@text 
"CRYSTAL STRUCTURE OF ACTIVATED TOBACCO RUBISCO COMPLEXED WITH THE REACTION-INTERMEDIATE ANALOGUE 2-CARBOXY-ARABINITOL 1,5-BISPHOSPHATE"
H.A. Schreuder, S. Knight, P.M.G. Curmi, I. Andersson, D. Cascio, C.-I. Branden and D. Eisenberg

		Contents of file SCHREUDR.KIN:
Kin.1 - Calpha trace of one activated tobacco RuBisCO L4S4 unit
Kin.2 - Comparison of spinach & tobacco activated RuBisCO
Kin.3 - Comparison of spinach & tobacco RuBisCO hydrophobic pocket containing res. 309

	Kinemage 1 is a Calpha trace of one of the two L4S4 unit which make up the hexadecamer of activated tobacco RuBisCO.  The reaction-intermediate analogue, CABP, and the Mg2+ ion cofactor, are present in each of the four active sites.  The three classifications of disulfide bonds are shown:  between the dimer-related Cys247 residues, the Cys449-Cys459 pairs, and the Cys172-Cys192 pairs.  One can highlight the "true" crystallographic contact regions in a L2S2 unit; region I linking the hexadecamers around the 3-one axis and region 2 linking the stacked hexadecamers along the c-axis.  View2 is designed for stereoviewing these contact regions, with L3, S3, L4, and S4 undisplayed.

 	Kinemage 2 is an animation between Calpha traces of spinach & tobacco activated RuBisCO (L1S1 only), shown in the same perspective as figure 5 in the manuscript.   Highlighted are the beta-peptide (L1, aa 466-472), alpha-A (S1, aa 23-35), and alpha-B (S1, aa 80-93), which contain specific mutations from spinach to tobacco RuBisCO -- note that only the solvent exposed sides are mutated, while the buried sidechains are conserved (except for one).  This perspective allows for a good look at the barrel domain.  CABP, CO2, and Mg2+ can be displayed, revealing their central location in the barrel.

	Kinemage 3 is an animation between sidechains contained in the hydrophobic pocket occupied by residue 309 in spinach and tobacco RuBisCO (Ile-spinach; Met-tobacco).  One can observe the rotation of Phe117 and the subsequent rotations of Phe274 and Tyr269.  This is the same perspective presented in figure 6 in the manuscript.  View2 is ideal for stereoviewing.

	Coordinates from Brookhaven Data Bank file:  4RUB (tobacco, activated), 8RUB (spinach, activated)
@kinemage 1 
@caption 
Calpha trace of one L4S4 unit of activated tobacco RuBisCO.  Large subunits are displayed as either seagreen or greentint; small subunits are in skyblue.  CABP (pink) and Mg2+ (magenta) are displayed at each of the four active sites.  The 3 types of disulfide bonds are presented in yellow: dimer-related Cys247 residues, the Cys449-Cys459 pairs, and the Cys172-Cys192 pairs.  "True" crystallographic contact regions can be turned on and are designated by 'X' (red-region I, brown-region II) -- undisplay L3, S3, L4, and S4 first, then select view2 in stereo.
@thinline
@2zoom 0.60 
@2zslab 110 
@2center 77.029 -6.941 17.851 
@2matrix 
0.060759 0.998152 0.000000 -0.998152 0.060759 0.000000 0.000000 0.000000 1.000000 
@group {RuBisCO} 
@subgroup {L1} 
@vectorlist {Calphas} color=sea 
{ca ala a 9}P 47.821 37.399 20.672
{ca ala a 9}47.821 37.399 20.672
{ca ser a 10}46.07 40.622 19.58
{ca val a 11}44.942 41.063 15.936
{ca gly a 12}42.389 38.391 14.954
{ca phe a 13}43.547 34.966 13.82
{ca lys a 14}43.086 35.258 10.026
{ca ala a 15}43.74 31.881 8.342
{ca gly a 16}45.681 31.588 5.102
{ca val a 17}49.042 32.082 3.467
{ca lys a 18}50.828 35.525 3.503
{ca glu a 19}54.343 36.469 2.245
{ca tyr a 20}57.243 35.691 4.578
{ca lys a 21}58.16 39.29 3.916
{ca leu a 22}55.468 40.623 6.217
{ca thr a 23}57.135 39.286 9.401
{ca tyr a 24}60.655 38.179 8.676
{ca tyr a 25}61.892 41.19 6.68
{ca thr a 26}62.73 43.843 9.302
{ca pro a 27}65.412 46.233 8.029
{ca glu a 28}64.337 48.278 10.986
{ca tyr a 29}65.999 45.892 13.354
{ca gln a 30}68.809 46.715 15.669
{ca thr a 31}70.646 43.504 16.518
{ca lys a 32}71.085 42.657 20.183
{ca asp a 33}74.462 41.68 21.619
{ca thr a 34}73.03 38.225 22.387
{ca asp a 35}71.584 37.454 18.952
{ca ile a 36}73.207 34.747 16.764
{ca leu a 37}73.676 36.485 13.366
{ca ala a 38}74.17 34.676 10.049
{ca ala a 39}75.256 35.93 6.727
{ca phe a 40}73.613 33.651 4.073
{ca arg a 41}74.517 34.099 0.348
{ca val a 42}71.099 33.543 -1.294
{ca thr a 43}70.276 32.94 -4.998
{ca pro a 44}66.525 33.114 -5.541
{ca gln a 45}64.356 31.679 -8.083
{ca pro a 46}63.504 34.103 -10.875
{ca gly a 47}60.348 35.719 -9.524
{ca val a 48}61.448 35.825 -5.927
{ca pro a 49}62.231 39.213 -4.567
{ca pro a 50}65.347 38.928 -2.41
{ca glu a 51}63.491 40.31 0.571
{ca glu a 52}61.009 37.433 0.221
{ca ala a 53}63.804 34.795 -0.203
{ca gly a 54}65.599 36.313 2.78
{ca ala a 55}62.446 36.215 4.994
{ca ala a 56}61.66 32.606 3.955
{ca val a 57}65.192 31.806 5.03
{ca ala a 58}64.593 33.553 8.393
{ca ala a 59}61.051 32.196 9.09
{ca glu a 60}61.523 28.573 8.203
{ca ser a 61}64.63 28.829 10.375
{ca ser a 62}63.099 29.994 13.647
{ca thr a 63}59.404 30.244 14.244
{ca gly a 64}57.26 30.002 11.188
{ca thr a 65}55.626 27.842 8.575
{ca trp a 66}53.91 28.445 5.186
{ca thr a 67}50.339 29.437 6.317
{ca thr a 68}48.785 31.146 9.332
{ca val a 69}48.393 29.281 12.595
{ca trp a 70}46.512 30.716 15.509
{ca thr a 71}49.022 29.387 18.116
{ca asp a 72}51.408 32.28 17.403
{ca gly a 73}49.058 34.371 19.585
{ca leu a 74}49.77 32.103 22.505
{ca thr a 75}53.341 33.254 22.549
{ca ser a 76}54.863 36.497 21.087
{ca leu a 77}56.908 36.221 17.82
{ca asp a 78}58.519 39.556 18.405
{ca arg a 79}60.592 37.84 21.026
{ca tyr a 80}61.285 34.653 19.139
{ca lys a 81}61.08 35.245 15.336
{ca gly a 82}64.281 34.894 13.334
{ca arg a 83}64.678 38.111 11.311
{ca cys a 84}66.171 39.177 8.049
{ca tyr a 85}67.467 42.624 8.81
{ca arg a 86}69.277 43.216 5.546
{ca ile a 87}70.075 42.171 2.012
{ca glu a 88}73.075 43.208 -0.099
{ca arg a 89}73.818 42.572 -3.776
{ca val a 90}76.741 40.347 -4.527
{ca val a 91}78.654 42.773 -6.607
{ca gly a 92}79.132 41.275 -10.014
{ca glu a 93}77.002 38.256 -9.474
{ca lys a 94}74.149 36.484 -10.955
{ca asp a 95}71.124 37.437 -8.901
{ca gln a 96}72.995 36.481 -5.73
{ca tyr a 97}72.712 38.248 -2.412
{ca ile a 98}73.792 38.249 1.189
{ca ala a 99}70.692 37.973 3.361
{ca tyr a 100}71.66 38.745 6.977
{ca val a 101}69.535 37.063 9.64
{ca ala a 102}69.396 37.486 13.38
{ca tyr a 103}68.39 34.765 15.816
{ca pro a 104}67.515 35.569 19.431
{ca leu a 105}69.467 33.573 22.076
{ca asp a 106}66.302 32.035 23.616
{ca leu a 107}66.074 29.792 20.549
{ca phe a 108}69.167 27.6 21.045
{ca glu a 109}69.745 24.85 23.558
{ca glu a 110}72.86 25.557 25.552
{ca gly a 111}76.029 23.641 24.684
{ca ser a 112}74.564 22.064 21.611
{ca val a 113}76.074 22.734 18.163
{ca thr a 114}73.537 20.014 17.136
{ca asn a 115}70.631 22.255 18.022
{ca met a 116}72.25 25.427 16.519
{ca phe a 117}72.839 23.704 13.173
{ca thr a 118}69.363 22.039 13.3
{ca ser a 119}67.954 25.585 13.379
{ca ile a 120}70.138 27.631 11.038
{ca val a 121}70.539 24.934 8.395
{ca gly a 122}67.714 22.477 9.094
{ca asn a 123}65.323 23.03 6.24
{ca val a 124}65.906 26.293 4.335
{ca phe a 125}68.491 24.944 1.955
{ca gly a 126}65.799 22.929 0.111
{ca phe a 127}63.132 25.596 -0.354
{ca lys a 128}61.481 25.486 -3.788
{ca ala a 129}61.593 29.314 -3.888
{ca leu a 130}65.466 29.263 -3.739
{ca arg a 131}67.793 27.694 -6.22
{ca ala a 132}70.989 27.761 -4.208
{ca leu a 133}71.651 28.75 -0.503
{ca arg a 134}75.052 28.903 1.327
{ca leu a 135}75.942 29.908 4.953
{ca glu a 136}79.073 32.017 4.886
{ca asp a 137}79.479 33.033 8.508
{ca leu a 138}77.743 33.008 11.929
{ca arg a 139}78.405 35.437 14.756
{ca ile a 140}78.391 33.534 18.022
{ca pro a 141}77.597 35.836 20.972
{ca pro a 142}79.576 35.542 24.188
{ca ala a 143}76.405 34.598 26.011
{ca tyr a 144}76.244 31.474 23.857
{ca val a 145}79.984 30.98 23.685
{ca lys a 146}80.019 30.612 27.514
{ca thr a 147}77.727 27.726 27.316
{ca phe a 148}80.378 25.517 25.575
{ca gln a 149}83.303 23.545 26.996
{ca gly a 150}85.319 24.105 23.938
{ca pro a 151}88.503 22.219 23.51
{ca pro a 152}89.563 19.675 26.082
{ca his a 153}92.8 21.663 26.183
{ca gly a 154}93.831 24.227 23.502
{ca ile a 155}97.153 25.526 22.259
{ca gln a 156}98.727 26.541 25.51
{ca val a 157}98.107 23.459 27.718
{ca glu a 158}98.895 21.086 24.737
{ca arg a 159}102.389 22.714 24.313
{ca asp a 160}102.662 22.838 28.091
{ca lys a 161}101.898 19.103 28.394
{ca leu a 162}104.09 17.813 25.542
{ca asn a 163}106.772 20.385 26.523
{ca lys a 164}107.05 21.853 23.048
{ca tyr a 165}107.843 25.429 22.135
{ca gly a 166}109.008 27.611 19.238
{ca arg a 167}108.067 25.881 15.969
{ca pro a 168}105.373 23.971 14.216
{ca leu a 169}104.639 20.442 15.578
{ca leu a 170}105.475 17.732 13.008
{ca gly a 171}103.305 14.706 12.184
{ca cys a 172}102.691 11.922 9.613
{ca thr a 173}99.731 9.713 8.494
{ca ile a 174}100.929 6.097 8.156
{ca lys a 175}100.135 4.803 4.583
{ca pro a 176}98.79 2.729 2.914
{ca lys a 177}95.336 4.065 3.932
{ca leu a 178}93.768 0.69 4.707
{ca gly a 179}95.491 -2.728 4.696
{ca leu a 180}98.426 -2.768 7.087
{ca ser a 181}98.405 -5.181 10.073
{ca ala a 182}98.379 -4.05 13.7
{ca lys a 183}102.055 -4.977 13.943
{ca asn a 184}103.234 -3.318 10.803
{ca tyr a 185}101.319 -0.227 11.895
{ca gly a 186}103.461 -0.085 15.035
{ca arg a 187}106.757 -0.712 13.178
{ca ala a 188}105.952 2.09 10.747
{ca val a 189}105.063 4.31 13.756
{ca tyr a 190}108.231 3.726 15.776
{ca glu a 191}110.282 4.223 12.654
{ca cys a 192}108.585 7.538 11.767
{ca leu a 193}108.748 8.933 15.343
{ca arg a 194}112.466 7.96 16.128
{ca gly a 195}113.304 10.09 13.168
{ca gly a 196}112.043 13.276 14.713
{ca leu a 197}108.28 13.581 13.938
{ca asp a 198}106.27 14.56 17.081
{ca phe a 199}103.304 12.54 16.079
{ca thr a 200}102.127 9.829 13.746
{ca lys a 201}98.413 9.072 13.264
{ca asp a 202}95.71 6.72 12.07
{ca asp a 203}94.256 7.64 8.685
{ca glu a 204}90.762 8.964 9.341
{ca asn a 205}89.349 5.776 7.853
{ca val a 206}91.439 3.383 10.021
{ca asn a 207}88.856 2.38 12.694
{ca ser a 208}88.485 -1.371 13.327
{ca gln a 209}88.58 -3.739 10.333
{ca pro a 210}89.283 -7.28 9.397
{ca phe a 211}92.826 -6.466 8.334
{ca met a 212}93.528 -4.697 11.715
{ca arg a 213}91.456 -4.355 14.781
{ca trp a 214}91.303 -1.303 16.953
{ca arg a 215}92.566 -2.816 20.191
{ca asp a 216}95.532 -4.58 18.445
{ca arg a 217}96.481 -1.374 16.689
{ca phe a 218}96.34 0.557 19.921
{ca leu a 219}98.448 -1.957 21.826
{ca phe a 220}101.212 -2.016 19.273
{ca cys a 221}101.328 1.733 18.529
{ca ala a 222}101.736 2.236 22.326
{ca glu a 223}104.657 -0.154 22.358
{ca ala a 224}106.22 1.767 19.447
{ca leu a 225}105.634 5.301 20.667
{ca tyr a 226}107.009 4.342 23.947
{ca lys a 227}110.132 2.975 22.165
{ca ala a 228}110.697 6.137 20.074
{ca glu a 229}110.084 8.467 22.952
{ca ala a 230}112.751 6.756 25.057
{ca glu a 231}115.161 6.628 22.19
{ca thr a 232}114.893 10.289 21.248
{ca gly a 233}114.361 11.886 24.655
{ca glu a 234}111.363 13.864 23.249
{ca ile a 235}107.684 13.336 24.167
{ca lys a 236}106.041 11.46 21.27
{ca gly a 237}102.355 10.759 20.525
{ca his a 238}100.373 8.681 18.018
{ca tyr a 239}96.805 9.867 17.208
{ca leu a 240}94.624 6.814 17.985
{ca asn a 241}91.391 6.905 16.064
{ca ala a 242}88.393 6.593 18.409
{ca thr a 243}85.827 7.13 15.499
{ca ala a 244}83.371 4.245 15.835
{ca gly a 245}79.907 3.249 14.905
{ca thr a 246}78.112 3.902 18.303
{ca cys a 247}78.981 6.281 21.154
{ca glu a 248}79.432 3.261 23.335
{ca glu a 249}82.018 1.941 20.917
{ca met a 250}83.668 5.308 20.683
{ca ile a 251}83.981 5.791 24.427
{ca lys a 252}85.285 2.292 24.748
{ca arg a 253}88.309 2.894 22.551
{ca ala a 254}88.922 6.283 24.251
{ca val a 255}88.932 4.41 27.511
{ca phe a 256}91.746 2.005 26.432
{ca ala a 257}93.963 4.868 25.147
{ca arg a 258}93.505 6.135 28.736
{ca glu a 259}94.453 2.767 30.143
{ca leu a 260}97.727 2.758 28.061
{ca gly a 261}98.582 6.282 29.181
{ca val a 262}99.227 7.551 25.704
{ca pro a 263}98.6 11.306 25.241
{ca ile a 264}96.294 11.897 22.249
{ca val a 265}93.228 10.43 20.487
{ca met a 266}91.506 11.528 17.294
{ca his a 267}87.962 11.675 15.907
{ca asp a 268}86.427 12.394 12.484
{ca tyr a 269}83.922 14.941 13.758
{ca leu a 270}81.773 15.16 10.631
{ca thr a 271}81.238 11.464 9.837
{ca gly a 272}81.058 10.793 13.597
{ca gly a 273}78.697 13.708 14.316
{ca phe a 274}78.535 16.742 16.661
{ca thr a 275}76.546 14.703 19.194
{ca ala a 276}79.269 12.039 19.432
{ca asn a 277}82.108 14.601 19.168
{ca thr a 278}80.933 16.602 22.029
{ca ser a 279}80.688 13.46 24.187
{ca leu a 280}84.318 12.626 23.259
{ca ala a 281}85.598 16.131 24.024
{ca his a 282}83.979 15.849 27.428
{ca tyr a 283}85.584 12.472 28.09
{ca cys a 284}88.876 13.727 26.812
{ca arg a 285}88.621 16.775 29.083
{ca asp a 286}87.97 14.725 32.14
{ca asn a 287}90.665 12.155 31.388
{ca gly a 288}93.247 14.485 29.983
{ca leu a 289}93.717 13.176 26.478
{ca leu a 290}94.327 15.781 23.687
{ca leu a 291}91.817 15.368 20.797
{ca his a 292}92.756 15.648 17.091
{ca ile a 293}89.844 16.425 14.781
{ca his a 294}89.812 15.098 11.179
{ca arg a 295}87.272 16.93 9.066
{ca ala a 296}86.449 14.094 6.65
{ca met a 297}83.297 14.779 4.657
{ca his a 298}83.659 18.542 4.973
{ca ala a 299}84.366 19.158 1.299
{ca val a 300}80.954 17.628 0.489
{ca ile a 301}79.53 20.708 2.237
{ca asp a 302}82.067 23.398 1.777
{ca arg a 303}83.292 23.305 -1.816
{ca gln a 304}80.817 25.211 -4.084
{ca lys a 305}80.73 28.968 -3.693
{ca asn a 306}76.977 29.101 -4.227
{ca his a 307}75.544 26.295 -2.031
{ca gly a 308}76.473 24.832 1.293
{ca ile a 309}78.2 25.71 4.489
{ca his a 310}81.554 27.508 4.436
{ca phe a 311}84.394 25.824 6.388
{ca arg a 312}84.911 28.912 8.535
{ca val a 313}81.575 27.973 9.972
{ca leu a 314}82.43 24.258 10.276
{ca ala a 315}85.643 25.527 11.898
{ca lys a 316}83.712 27.628 14.439
{ca ala a 317}81.327 24.76 15.139
{ca leu a 318}84.241 22.57 16.21
{ca arg a 319}85.971 25.181 18.484
{ca met a 320}82.63 25.078 20.237
{ca ser a 321}82.074 21.327 20.207
{ca gly a 322}85.593 20.529 21.28
{ca gly a 323}88.881 19.7 19.619
{ca asp a 324}92.504 20.49 20.386
{ca his a 325}93.571 20.108 16.724
{ca ile a 326}91.515 20.7 13.524
{ca his a 327}92.803 20.343 9.936
{ca ser a 328}92.888 23.779 8.396
{ca gly a 329}94.192 23.074 4.862
{ca thr a 330}97.589 23.686 3.209
{ca val a 331}96.948 26.15 0.401
{ca val a 332}99.954 24.722 -1.423
{ca gly a 333}99.159 21.009 -1.698
{ca lys a 334}96.908 18.185 -2.903
{ca leu a 335}93.544 19.613 -1.808
{ca glu a 336}91.706 22.901 -2.48
{ca gly a 337}92.22 25.984 -0.293
{ca glu a 338}93.061 29.668 -0.779
{ca arg a 339}95.477 31.587 1.276
{ca asp a 340}93.411 34.575 2.425
{ca ile a 341}90.346 32.691 3.364
{ca thr a 342}92.539 30.27 5.108
{ca leu a 343}94.344 32.928 7.05
{ca gly a 344}90.933 34.081 7.886
{ca phe a 345}89.507 31.012 9.548
{ca val a 346}92.911 30.067 11.039
{ca asp a 347}92.458 33.249 13.125
{ca leu a 348}88.873 32.227 13.875
{ca leu a 349}90.437 28.915 15.173
{ca arg a 350}93.267 30.28 17.333
{ca asp a 351}92.628 33.987 18.458
{ca asp a 352}90.507 35.391 21.234
{ca phe a 353}88.898 38.207 19.222
{ca val a 354}88.767 38.484 15.534
{ca glu a 355}87.772 41.706 13.957
{ca gln a 356}85.501 41.5 10.914
{ca asp a 357}87.447 41.616 7.575
{ca arg a 358}85.494 40.937 4.437
{ca ser a 359}88.759 40.957 2.667
{ca arg a 360}89.36 37.609 4.295
{ca gly a 361}85.828 36.303 4.326
{ca ile a 362}85.121 37.232 7.933
{ca tyr a 363}81.666 38.736 7.905
{ca phe a 364}81.343 39.479 11.696
{ca thr a 365}83.637 40.304 14.628
{ca gln a 366}83.983 37.145 16.691
{ca asp a 367}84.688 37.419 20.423
{ca trp a 368}85.63 34.072 21.952
{ca val a 369}85.586 35.173 25.56
{ca ser a 370}88.582 33.052 26.359
{ca leu a 371}87.425 29.742 24.761
{ca pro a 372}90.825 28.005 24.18
{ca gly a 373}92.089 28.091 20.682
{ca val a 374}92.685 25.112 18.439
{ca leu a 375}95.946 24.226 16.675
{ca pro a 376}95.438 24.151 12.901
{ca val a 377}96.891 21.162 11.053
{ca ala a 378}98.351 21.435 7.59
{ca ser a 379}98.181 18.117 5.735
{ca gly a 380}97.963 16.439 2.355
{ca gly a 381}100.392 16.309 -0.489
{ca ile a 382}103.086 18.539 1.064
{ca his a 383}106.807 17.894 1.036
{ca val a 384}110.204 19.164 1.995
{ca trp a 385}110.04 21.868 -0.668
{ca his a 386}106.892 23.386 0.892
{ca met a 387}108.391 23.848 4.319
{ca pro a 388}109.183 27.548 4.185
{ca ala a 389}105.799 28.392 2.735
{ca leu a 390}103.799 26.511 5.387
{ca thr a 391}106.03 27.879 8.097
{ca glu a 392}105.35 31.323 6.584
{ca ile a 393}101.564 31.06 6.183
{ca phe a 394}100.981 29.25 9.521
{ca gly a 395}103.731 30.195 12.057
{ca asp a 396}104.71 28.204 15.12
{ca asp a 397}101.174 27.325 16.301
{ca ser a 398}100.402 24.681 13.699
{ca val a 399}100.99 20.922 13.141
{ca leu a 400}102.473 20.133 9.7
{ca gln a 401}101.851 16.551 8.541
{ca phe a 402}103.871 14.311 6.191
{ca gly a 403}102.105 11.167 5.054
{ca gly a 404}103.427 10.362 1.656
{ca gly a 405}106.145 12.874 2.46
{ca thr a 406}107.52 10.646 5.163
{ca leu a 407}106.808 7.064 4.029
{ca gly a 408}107.777 7.947 0.477
{ca his a 409}111.402 8.852 1.258
{ca pro a 410}113.956 6.693 -0.563
{ca trp a 411}115.584 5.525 2.703
{ca gly a 412}112.341 4.716 4.581
{ca asn a 413}110.598 6.367 7.602
{ca ala a 414}113.418 7.229 10.034
{ca pro a 415}115.418 9.211 7.435
{ca gly a 416}112.214 10.693 5.965
{ca ala a 417}111.332 11.893 9.446
{ca val a 418}114.82 13.386 9.919
{ca ala a 419}114.434 15.03 6.5
{ca asn a 420}111.309 16.971 7.528
{ca arg a 421}112.599 17.811 11.053
{ca val a 422}115.756 19.348 9.517
{ca ala a 423}113.854 21.137 6.753
{ca leu a 424}111.617 22.703 9.308
{ca glu a 425}114.278 23.562 11.903
{ca ala a 426}116.097 24.987 8.894
{ca cys a 427}113.251 27.319 8.037
{ca val a 428}112.669 28.258 11.657
{ca lys a 429}116.241 29.57 12.166
{ca ala a 430}116.269 31.264 8.78
{ca arg a 431}113.196 33.015 9.958
{ca asn a 432}114.699 33.88 13.349
{ca glu a 433}117.91 35.215 11.77
{ca gly a 434}115.62 37.56 9.829
{ca arg a 435}115.709 35.777 6.406
{ca asp a 436}112.454 36.029 4.44
{ca leu a 437}110.685 32.71 4.142
{ca ala a 438}108.616 34.06 1.258
{ca gln a 439}111.421 35.514 -0.934
{ca glu a 440}114.358 33.527 0.356
{ca gly a 441}112.363 30.328 0.795
{ca asn a 442}113.95 28.078 -1.752
{ca glu a 443}117.617 28.654 -0.992
{ca ile a 444}117.061 27.961 2.632
{ca ile a 445}115.908 24.43 2.209
{ca arg a 446}118.249 24.197 -0.794
{ca glu a 447}121.139 25.152 1.397
{ca ala a 448}120.133 22.576 4.011
{ca cys a 449}119.682 19.882 1.475
{ca lys a 450}123.443 20.453 1.009
{ca trp a 451}124.344 19.621 4.597
{ca ser a 452}121.899 16.826 5.372
{ca pro a 453}122.076 13.375 3.775
{ca glu a 454}118.544 12.461 4.616
{ca leu a 455}117.288 15.894 3.691
{ca ala a 456}119.156 15.665 0.432
{ca ala a 457}117.609 12.437 -0.589
{ca ala a 458}114.232 14.011 -0.089
{ca cys a 459}114.948 17.202 -2.052
{ca glu a 460}116.026 15.262 -5.09
{ca val a 461}112.837 13.151 -5.113
{ca trp a 462}110.178 15.783 -4.738
{ca lys a 463}112.029 18.618 -6.441
{ca glu a 464}109.703 19.039 -9.409
{ca ile a 465}106.3 18.588 -7.63
{ca val a 466}103.665 21.292 -7.086
{ca phe a 467}99.861 21.144 -7.182
{ca asn a 468}99.016 24.271 -9.123
{ca phe a 469}95.556 24.096 -10.576
{ca ala a 470}93.092 27.002 -10.726
{ca ala a 471}90.858 26.983 -7.625
{ca val a 472}87.141 26.713 -6.857
@subgroup {S1} 
@vectorlist {Calphas} color=sky 
{ca met s 1}P 121.064 4.721 1.961
{ca met s 1}121.064 4.721 1.961
{ca gln s 2}121.947 5.002 5.639
{ca val s 3}120.548 3.731 8.891
{ca trp s 4}119.709 6.627 11.175
{ca pro s 5}121.457 5.431 14.292
{ca pro s 6}119.474 4.117 17.167
{ca ile s 7}121.978 5.06 19.815
{ca asn s 8}123.59 8.331 20.817
{ca lys s 9}121.251 10.946 19.457
{ca lys s 10}119.162 12.189 22.298
{ca lys s 11}117.458 15.427 21.201
{ca tyr s 12}116.423 18.595 22.923
{ca glu s 13}113.445 19.827 21.034
{ca thr s 14}113.769 22.945 18.847
{ca leu s 15}116.941 23.441 16.887
{ca ser s 16}118.522 20.189 18.118
{ca tyr s 17}118.411 18.743 14.575
{ca leu s 18}120.705 21.421 13.072
{ca pro s 19}124.428 21.485 13.855
{ca asp s 20}125.748 22.771 17.174
{ca leu s 21}124.758 26.463 17.313
{ca ser s 22}127.699 28.813 17.282
{ca gln s 23}127.681 31.698 19.705
{ca glu s 24}126.802 33.975 16.877
{ca gln s 25}123.943 31.705 15.899
{ca leu s 26}122.899 31.344 19.503
{ca leu s 27}122.984 35.087 19.772
{ca ser s 28}120.632 35.54 16.843
{ca glu s 29}118.051 33.493 18.99
{ca val s 30}118.197 35.6 22.17
{ca glu s 31}118.138 38.394 19.646
{ca tyr s 32}114.781 37.249 18.14
{ca leu s 33}113.256 36.493 21.447
{ca leu s 34}113.917 40.094 22.374
{ca lys s 35}112.834 41.595 19.063
{ca asn s 36}109.498 40.01 20.051
{ca gly s 37}108.923 41.044 23.64
{ca trp s 38}109.471 37.667 25.234
{ca val s 39}110.985 37.788 28.695
{ca pro s 40}114.038 35.61 28.56
{ca cys s 41}114.448 33.111 31.369
{ca leu s 42}117.047 30.348 32.12
{ca glu s 43}116.535 26.807 33.628
{ca phe s 44}119.188 24.155 34.227
{ca glu s 45}118.988 20.48 35.215
{ca thr s 46}121.779 18.347 36.6
{ca glu s 47}120.049 15.005 36.904
{ca his s 48}117.152 14.043 34.652
{ca gly s 49}118.164 15.189 31.393
{ca phe s 50}115.005 13.588 29.857
{ca val s 51}111.344 12.974 30.728
{ca tyr s 52}110.471 9.907 32.686
{ca arg s 53}107.309 8.484 34.177
{ca glu s 54}108.051 7.386 37.749
{ca asn s 55}105.325 8.893 39.85
{ca asn s 56}102.398 8.294 37.474
{ca lys s 57}101.388 7.28 33.967
{ca ser s 58}97.964 8.869 33.482
{ca pro s 59}97.514 10.544 30.147
{ca gly s 60}99.685 13.594 30.013
{ca tyr s 61}101.709 12.975 33.116
{ca tyr s 62}105.472 12.694 32.564
{ca asp s 63}108.016 13.348 35.309
{ca gly s 64}111.033 15.411 34.179
{ca arg s 65}109.44 18.392 32.462
{ca tyr s 66}110.158 21.016 35.039
{ca trp s 67}113.775 22.133 35.317
{ca thr s 68}115.383 24.532 37.902
{ca met s 69}114.972 28.259 37.264
{ca trp s 70}118.292 30.046 36.971
{ca lys s 71}117.8 33.134 39.145
{ca leu s 72}114.596 34.914 37.818
{ca pro s 73}112.981 35.625 34.419
{ca met s 74}114.938 38.706 33.403
{ca phe s 75}112.028 41.038 32.946
{ca gly s 76}112.849 44.46 31.446
{ca cys s 77}116.336 43.353 30.14
{ca thr s 78}117.168 44.333 26.544
{ca asp s 79}120.75 43.358 26.335
{ca ala s 80}120.74 40.107 24.391
{ca thr s 81}124.414 39.916 25.524
{ca gln s 82}123.496 40.175 29.263
{ca val s 83}121.415 36.876 28.947
{ca leu s 84}124.178 35.159 27.036
{ca ala s 85}126.443 36.256 29.902
{ca glu s 86}124.231 34.353 32.285
{ca val s 87}124.493 31.156 30.339
{ca gly s 88}128.297 31.522 30.781
{ca glu s 89}127.779 32.291 34.394
{ca ala s 90}125.788 29.032 34.911
{ca lys s 91}128.069 26.534 33.172
{ca lys s 92}130.523 27.987 35.691
{ca ala s 93}128.933 26.455 38.787
{ca tyr s 94}126.88 23.82 36.93
{ca pro s 95}129.39 22.39 34.47
{ca gln s 96}127.368 19.22 34.442
{ca ala s 97}123.976 20.863 33.987
{ca trp s 98}122.004 21.071 30.849
{ca ile s 99}121.069 24.729 30.434
{ca arg s 100}118.249 26.022 28.328
{ca ile s 101}116.931 29.46 27.461
{ca ile s 102}113.155 30.028 27.18
{ca gly s 103}111.025 32.982 26.152
{ca phe s 104}107.784 34.001 27.898
{ca asp s 105}104.891 35.777 26.082
{ca asn s 106}103.028 37.001 29.276
{ca val s 107}99.895 37.927 27.349
{ca arg s 108}99.342 34.509 26.019
{ca gln s 109}101.166 32.851 28.8
{ca val s 110}102.996 30.378 26.496
{ca gln s 111}106.782 29.817 26.275
{ca cys s 112}107.258 31.216 22.767
{ca ile s 113}110.75 29.829 22.503
{ca ser s 114}113.105 27.392 24.072
{ca phe s 115}116.459 26.024 22.835
{ca ile s 116}119.277 24.315 24.64
{ca ala s 117}122.072 26.774 25.375
{ca tyr s 118}124.471 24.181 26.799
{ca lys s 119}124.605 20.379 27.113
{ca pro s 120}127.051 18.963 29.631
{ca glu s 121}129.895 16.772 28.468
{ca gly s 122}129.043 13.979 26.07
{ca tyr s 123}125.652 14.97 24.796
@subgroup {L2} 
@vectorlist {Calphas} color=sea
{ca ala b 9}P 47.856 -18.386 1.738
{ca ala b 9}47.856 -18.386 1.738
{ca ser b 10}46.167 -19.601 -1.489
{ca val b 11}44.946 -23.229 -1.91
{ca gly b 12}42.393 -24.133 0.797
{ca phe b 13}43.623 -25.314 4.182
{ca lys b 14}43.052 -29.038 3.914
{ca ala b 15}43.693 -30.804 7.255
{ca gly b 16}45.64 -34.091 7.571
{ca val b 17}49.057 -35.686 7.066
{ca lys b 18}50.858 -35.625 3.631
{ca glu b 19}54.342 -36.877 2.731
{ca tyr b 20}57.207 -34.472 3.455
{ca lys b 21}58.27 -35.202 -0.133
{ca leu b 22}55.512 -32.959 -1.396
{ca thr b 23}57.148 -29.709 -0.215
{ca tyr b 24}60.599 -30.526 1.006
{ca tyr b 25}61.877 -32.461 -2.014
{ca thr b 26}62.785 -29.881 -4.699
{ca pro b 27}65.443 -31.209 -7.097
{ca glu b 28}64.361 -28.256 -9.131
{ca tyr b 29}66.055 -25.783 -6.781
{ca gln b 30}68.821 -23.439 -7.607
{ca thr b 31}70.699 -22.62 -4.438
{ca lys b 32}71.086 -18.976 -3.52
{ca asp b 33}74.515 -17.596 -2.572
{ca thr b 34}73.098 -16.749 0.895
{ca asp b 35}71.728 -20.239 1.59
{ca ile b 36}73.179 -22.381 4.414
{ca leu b 37}73.823 -25.747 2.708
{ca ala b 38}74.121 -29.07 4.459
{ca ala b 39}75.39 -32.441 3.325
{ca phe b 40}73.613 -35.045 5.536
{ca arg b 41}74.526 -38.786 5.181
{ca val b 42}71.148 -40.496 5.532
{ca thr b 43}70.262 -44.171 6.06
{ca pro b 44}66.534 -44.691 5.934
{ca gln b 45}64.283 -47.155 7.465
{ca pro b 46}63.486 -50.029 5.138
{ca gly b 47}60.398 -48.698 3.421
{ca val b 48}61.55 -45.072 3.266
{ca pro b 49}62.27 -43.686 -0.162
{ca pro b 50}65.374 -41.558 0.209
{ca glu b 51}63.441 -38.627 -1.194
{ca glu b 52}61.057 -38.931 1.725
{ca ala b 53}63.769 -39.366 4.415
{ca gly b 54}65.584 -36.43 2.776
{ca ala b 55}62.413 -34.272 2.814
{ca ala b 56}61.662 -35.235 6.434
{ca val b 57}65.137 -34.094 7.4
{ca ala b 58}64.637 -30.795 5.546
{ca ala b 59}61.176 -30.09 6.914
{ca glu b 60}61.533 -30.899 10.574
{ca ser b 61}64.6 -28.77 10.28
{ca ser b 62}63.143 -25.549 9.034
{ca thr b 63}59.449 -25.019 8.795
{ca gly b 64}57.183 -27.979 9.087
{ca thr b 65}55.643 -30.637 11.237
{ca trp b 66}53.832 -33.915 10.657
{ca thr b 67}50.282 -32.799 9.743
{ca thr b 68}48.796 -29.798 7.915
{ca val b 69}48.481 -26.551 9.88
{ca trp b 70}46.551 -23.562 8.464
{ca thr b 71}49.03 -20.982 9.778
{ca asp b 72}51.324 -21.735 6.863
{ca gly b 73}48.993 -19.602 4.748
{ca leu b 74}49.742 -16.642 7.012
{ca thr b 75}53.362 -16.464 5.744
{ca ser b 76}54.902 -18.022 2.66
{ca leu b 77}56.94 -21.293 2.884
{ca asp b 78}58.589 -20.75 -0.477
{ca arg b 79}60.618 -18.125 1.328
{ca tyr b 80}61.361 -20.012 4.472
{ca lys b 81}61.127 -23.801 3.877
{ca gly b 82}64.306 -25.795 4.246
{ca arg b 83}64.725 -27.848 1.061
{ca cys b 84}66.189 -31.122 -0.041
{ca tyr b 85}67.451 -30.386 -3.563
{ca arg b 86}69.312 -33.666 -4.171
{ca ile b 87}70.041 -37.176 -3.019
{ca glu b 88}73.029 -39.236 -4.033
{ca arg b 89}73.771 -42.926 -3.294
{ca val b 90}76.726 -43.708 -1.107
{ca val b 91}78.683 -45.758 -3.587
{ca gly b 92}79.197 -49.125 -2.175
{ca glu b 93}76.986 -48.591 0.794
{ca lys b 94}74.19 -50.149 2.656
{ca asp b 95}71.158 -48.069 1.691
{ca gln b 96}73.014 -44.872 2.661
{ca tyr b 97}72.744 -41.585 0.944
{ca ile b 98}73.845 -38.059 0.773
{ca ala b 99}70.803 -35.858 1.153
{ca tyr b 100}71.691 -32.197 0.394
{ca val b 101}69.669 -29.511 2.102
{ca ala b 102}69.431 -25.729 1.572
{ca tyr b 103}68.325 -23.353 4.405
{ca pro b 104}67.563 -19.743 3.581
{ca leu b 105}69.501 -17.133 5.555
{ca asp b 106}66.282 -15.588 7.026
{ca leu b 107}66.107 -18.616 9.341
{ca phe b 108}69.157 -18.073 11.54
{ca glu b 109}69.816 -15.64 14.289
{ca glu b 110}72.932 -13.675 13.536
{ca gly b 111}76.042 -14.404 15.475
{ca ser b 112}74.485 -17.484 17.11
{ca val b 113}76.073 -20.941 16.418
{ca thr b 114}73.607 -22.06 19.147
{ca asn b 115}70.781 -21.039 16.877
{ca met b 116}72.314 -22.583 13.694
{ca phe b 117}72.787 -25.996 15.374
{ca thr b 118}69.383 -25.865 17.09
{ca ser b 119}67.849 -25.848 13.577
{ca ile b 120}70.06 -28.104 11.534
{ca val b 121}70.548 -30.778 14.227
{ca gly b 122}67.838 -30.086 16.828
{ca asn b 123}65.252 -32.85 16.098
{ca val b 124}65.934 -34.76 12.868
{ca phe b 125}68.491 -37.202 14.215
{ca gly b 126}65.747 -38.983 16.108
{ca phe b 127}63.04 -39.458 13.49
{ca lys b 128}61.435 -42.909 13.623
{ca ala b 129}61.606 -43.016 9.825
{ca leu b 130}65.462 -42.871 9.855
{ca arg b 131}67.744 -45.384 11.602
{ca ala b 132}70.882 -43.245 11.4
{ca leu b 133}71.709 -39.644 10.361
{ca arg b 134}75.041 -37.846 10.221
{ca leu b 135}75.959 -34.223 9.327
{ca glu b 136}79.002 -34.283 7.137
{ca asp b 137}79.416 -30.604 6.094
{ca leu b 138}77.775 -27.154 6.164
{ca arg b 139}78.381 -24.405 3.627
{ca ile b 140}78.315 -21.1 5.659
{ca pro b 141}77.67 -18.166 3.345
{ca pro b 142}79.607 -14.913 3.527
{ca ala b 143}76.422 -13.201 4.519
{ca tyr b 144}76.261 -15.231 7.742
{ca val b 145}79.946 -15.387 8.167
{ca lys b 146}80.162 -11.601 8.546
{ca thr b 147}77.764 -11.825 11.49
{ca phe b 148}80.383 -13.546 13.702
{ca gln b 149}83.223 -12.103 15.587
{ca gly b 150}85.204 -15.239 15.043
{ca pro b 151}88.478 -15.654 16.916
{ca pro b 152}89.581 -13.109 19.466
{ca his b 153}92.872 -12.946 17.523
{ca gly b 154}93.814 -15.665 14.961
{ca ile b 155}97.171 -16.887 13.663
{ca gln b 156}98.769 -13.664 12.557
{ca val b 157}98.011 -11.628 15.644
{ca glu b 158}98.956 -14.419 17.979
{ca arg b 159}102.263 -14.783 16.27
{ca asp b 160}102.79 -10.967 16.268
{ca lys b 161}101.966 -10.71 19.983
{ca leu b 162}104.112 -13.64 21.204
{ca asn b 163}106.842 -12.59 18.761
{ca lys b 164}107.187 -16.096 17.401
{ca tyr b 165}107.804 -16.994 13.782
{ca gly b 166}108.887 -19.932 11.662
{ca arg b 167}108.062 -23.239 13.213
{ca pro b 168}105.308 -24.888 15.128
{ca leu b 169}104.759 -23.57 18.648
{ca leu b 170}105.481 -26.264 21.304
{ca gly b 171}103.258 -26.976 24.346
{ca cys b 172}102.762 -29.492 27.244
{ca thr b 173}99.738 -30.567 29.415
{ca ile b 174}100.985 -30.992 32.991
{ca lys b 175}100.189 -34.546 34.276
{ca pro b 176}98.834 -36.244 36.364
{ca lys b 177}95.385 -35.158 35.017
{ca leu b 178}93.785 -34.486 38.451
{ca gly b 179}95.533 -34.524 41.854
{ca leu b 180}98.423 -32.096 41.811
{ca ser b 181}98.499 -29.151 44.309
{ca ala b 182}98.39 -25.499 43.206
{ca lys b 183}102.016 -25.199 44.222
{ca asn b 184}103.282 -28.338 42.417
{ca tyr b 185}101.38 -27.313 39.292
{ca gly b 186}103.506 -24.203 39.246
{ca arg b 187}106.728 -26.044 39.886
{ca ala b 188}105.895 -28.41 37.089
{ca val b 189}105.068 -25.391 34.876
{ca tyr b 190}108.264 -23.408 35.461
{ca glu b 191}110.28 -26.556 34.88
{ca cys b 192}108.611 -27.403 31.538
{ca leu b 193}108.708 -23.793 30.312
{ca arg b 194}112.405 -23.045 31.143
{ca gly b 195}113.36 -25.944 28.967
{ca gly b 196}112.021 -24.419 25.85
{ca leu b 197}108.368 -25.176 25.474
{ca asp b 198}106.351 -22.024 24.498
{ca phe b 199}103.293 -22.991 26.538
{ca thr b 200}102.196 -25.408 29.27
{ca lys b 201}98.505 -25.905 30.119
{ca asp b 202}95.787 -27.028 32.454
{ca asp b 203}94.331 -30.426 31.548
{ca glu b 204}90.828 -29.926 30.179
{ca asn b 205}89.219 -31.192 33.408
{ca val b 206}91.39 -29.012 35.65
{ca asn b 207}88.723 -26.416 36.69
{ca ser b 208}88.495 -25.821 40.426
{ca gln b 209}88.494 -28.754 42.877
{ca pro b 210}89.345 -29.854 46.384
{ca phe b 211}92.881 -30.8 45.589
{ca met b 212}93.538 -27.406 43.84
{ca arg b 213}91.453 -24.355 43.517
{ca trp b 214}91.376 -22.162 40.4
{ca arg b 215}92.623 -18.951 41.98
{ca asp b 216}95.537 -20.647 43.729
{ca arg b 217}96.495 -22.466 40.507
{ca phe b 218}96.269 -19.188 38.659
{ca leu b 219}98.409 -17.295 41.128
{ca phe b 220}101.268 -19.81 41.135
{ca cys b 221}101.316 -20.616 37.378
{ca ala b 222}101.615 -16.811 36.957
{ca glu b 223}104.646 -16.841 39.263
{ca ala b 224}106.189 -19.723 37.363
{ca leu b 225}105.68 -18.559 33.793
{ca tyr b 226}107.045 -15.185 34.722
{ca lys b 227}110.218 -16.947 36.11
{ca ala b 228}110.695 -19.128 33.084
{ca glu b 229}110.13 -16.175 30.722
{ca ala b 230}112.779 -14.115 32.425
{ca glu b 231}115.23 -16.946 32.442
{ca thr b 232}114.909 -17.897 28.799
{ca gly b 233}114.2 -14.404 27.328
{ca glu b 234}111.346 -15.859 25.292
{ca ile b 235}107.709 -14.911 25.828
{ca lys b 236}106.009 -17.822 27.681
{ca gly b 237}102.299 -18.602 28.27
{ca his b 238}100.398 -21.096 30.422
{ca tyr b 239}96.765 -21.866 29.281
{ca leu b 240}94.642 -21.221 32.472
{ca asn b 241}91.357 -23.096 32.341
{ca ala b 242}88.304 -20.742 32.551
{ca thr b 243}85.776 -23.55 31.964
{ca ala b 244}83.338 -23.35 34.816
{ca gly b 245}79.865 -24.261 35.827
{ca thr b 246}78.175 -20.872 35.189
{ca cys b 247}78.845 -18.023 32.865
{ca glu b 248}79.468 -15.816 35.914
{ca glu b 249}82.081 -18.104 37.228
{ca met b 250}83.583 -18.44 33.816
{ca ile b 251}84.022 -14.729 33.263
{ca lys b 252}85.196 -14.247 36.771
{ca arg b 253}88.216 -16.538 36.109
{ca ala b 254}88.835 -14.904 32.742
{ca val b 255}88.955 -11.62 34.647
{ca phe b 256}91.675 -12.71 37.16
{ca ala b 257}93.892 -13.93 34.309
{ca arg b 258}93.559 -10.408 32.913
{ca glu b 259}94.433 -9.067 36.412
{ca leu b 260}97.743 -11.025 36.32
{ca gly b 261}98.771 -9.859 32.813
{ca val b 262}99.171 -13.403 31.507
{ca pro b 263}98.534 -13.946 27.801
{ca ile b 264}96.273 -16.963 27.271
{ca val b 265}93.265 -18.65 28.799
{ca met b 266}91.487 -21.836 27.612
{ca his b 267}87.979 -23.168 27.436
{ca asp b 268}86.397 -26.619 26.775
{ca tyr b 269}83.893 -25.333 24.224
{ca leu b 270}81.769 -28.463 23.976
{ca thr b 271}81.359 -29.22 27.67
{ca gly b 272}80.909 -25.578 28.405
{ca gly b 273}78.797 -24.92 25.333
{ca phe b 274}78.669 -22.506 22.422
{ca thr b 275}76.539 -19.955 24.407
{ca ala b 276}79.247 -19.71 27.114
{ca asn b 277}82.097 -19.997 24.551
{ca thr b 278}80.988 -17.11 22.434
{ca ser b 279}80.729 -15.032 25.654
{ca leu b 280}84.389 -15.881 26.444
{ca ala b 281}85.514 -15.118 22.936
{ca his b 282}83.995 -11.712 23.261
{ca tyr b 283}85.597 -11.238 26.545
{ca cys b 284}88.937 -12.275 25.305
{ca arg b 285}88.574 -10.084 22.339
{ca asp b 286}87.974 -6.978 24.404
{ca asn b 287}90.596 -7.808 26.947
{ca gly b 288}93.364 -9.136 24.803
{ca leu b 289}93.74 -12.734 26.015
{ca leu b 290}94.391 -15.533 23.463
{ca leu b 291}91.821 -18.353 23.866
{ca his b 292}92.784 -22.052 23.46
{ca ile b 293}89.765 -24.27 22.722
{ca his b 294}89.87 -27.874 24.092
{ca arg b 295}87.403 -30.158 22.202
{ca ala b 296}86.519 -32.45 25.091
{ca met b 297}83.338 -34.458 24.461
{ca his b 298}83.643 -34.168 20.664
{ca ala b 299}84.379 -37.917 20.079
{ca val b 300}80.97 -38.645 21.517
{ca ile b 301}79.489 -36.967 18.401
{ca asp b 302}82.081 -37.335 15.715
{ca arg b 303}83.328 -41. 15.75
{ca gln b 304}80.845 -43.343 13.918
{ca lys b 305}80.726 -42.863 10.132
{ca asn b 306}77.03 -43.387 10.104
{ca his b 307}75.522 -41.166 12.849
{ca gly b 308}76.537 -37.874 14.494
{ca ile b 309}78.213 -34.716 13.264
{ca his b 310}81.636 -34.878 11.595
{ca phe b 311}84.432 -32.892 13.276
{ca arg b 312}85.093 -30.6 10.239
{ca val b 313}81.609 -29.183 11.15
{ca leu b 314}82.475 -28.979 14.859
{ca ala b 315}85.64 -27.158 13.68
{ca lys b 316}83.672 -24.738 11.457
{ca ala b 317}81.349 -23.965 14.367
{ca leu b 318}84.297 -22.888 16.555
{ca arg b 319}85.97 -20.604 14.017
{ca met b 320}82.52 -18.959 14.067
{ca ser b 321}81.968 -18.898 17.834
{ca gly b 322}85.567 -18.019 18.661
{ca gly b 323}88.927 -19.498 19.519
{ca asp b 324}92.485 -18.701 18.63
{ca his b 325}93.646 -22.404 19.07
{ca ile b 326}91.547 -25.593 18.453
{ca his b 327}92.909 -29.211 18.839
{ca ser b 328}92.955 -30.791 15.403
{ca gly b 329}94.226 -34.271 16.087
{ca thr b 330}97.61 -35.967 15.502
{ca val b 331}96.925 -38.788 12.998
{ca val b 332}100.031 -40.541 14.401
{ca gly b 333}99.18 -40.762 18.152
{ca lys b 334}96.878 -42.087 20.913
{ca leu b 335}93.512 -40.905 19.495
{ca glu b 336}91.666 -41.542 16.238
{ca gly b 337}92.358 -39.428 13.15
{ca glu b 338}93.092 -39.99 9.466
{ca arg b 339}95.496 -37.879 7.539
{ca asp b 340}93.411 -36.752 4.578
{ca ile b 341}90.434 -35.823 6.527
{ca thr b 342}92.672 -34.07 8.966
{ca leu b 343}94.402 -32.089 6.196
{ca gly b 344}90.982 -31.204 4.927
{ca phe b 345}89.601 -29.542 8.052
{ca val b 346}92.97 -28.145 9.08
{ca asp b 347}92.597 -25.967 5.945
{ca leu b 348}88.967 -25.322 6.95
{ca leu b 349}90.468 -23.949 10.171
{ca arg b 350}93.28 -21.775 8.844
{ca asp b 351}92.661 -20.672 5.169
{ca asp b 352}90.534 -17.917 3.731
{ca phe b 353}89.086 -19.903 0.885
{ca val b 354}88.792 -23.637 0.711
{ca glu b 355}87.853 -25.156 -2.511
{ca gln b 356}85.591 -28.195 -2.386
{ca asp b 357}87.495 -31.555 -2.511
{ca arg b 358}85.53 -34.768 -1.968
{ca ser b 359}88.853 -36.53 -1.826
{ca arg b 360}89.478 -34.916 1.586
{ca gly b 361}85.867 -34.817 2.903
{ca ile b 362}85.14 -31.236 1.934
{ca tyr b 363}81.687 -31.286 0.45
{ca phe b 364}81.444 -27.515 -0.306
{ca thr b 365}83.753 -24.59 -1.233
{ca gln b 366}84.001 -22.482 1.971
{ca asp b 367}84.749 -18.764 1.729
{ca trp b 368}85.677 -17.156 5.121
{ca val b 369}85.595 -13.577 3.934
{ca ser b 370}88.564 -12.832 6.057
{ca leu b 371}87.443 -14.318 9.381
{ca pro b 372}90.869 -14.944 11.114
{ca gly b 373}92.242 -18.478 11.069
{ca val b 374}92.635 -20.736 14.023
{ca leu b 375}95.893 -22.491 14.938
{ca pro b 376}95.345 -26.282 14.959
{ca val b 377}96.814 -28.198 17.973
{ca ala b 378}98.356 -31.665 17.644
{ca ser b 379}98.343 -33.398 21.005
{ca gly b 380}98.036 -36.788 22.752
{ca gly b 381}100.37 -39.702 22.961
{ca ile b 382}103.027 -38.055 20.652
{ca his b 383}106.841 -38.136 21.217
{ca val b 384}110.2 -37.153 19.936
{ca trp b 385}110.066 -39.774 17.287
{ca his b 386}106.893 -38.207 15.765
{ca met b 387}108.402 -34.812 15.25
{ca pro b 388}109.214 -34.925 11.606
{ca ala b 389}105.801 -36.374 10.672
{ca leu b 390}103.86 -33.775 12.706
{ca thr b 391}106.06 -31.055 11.367
{ca glu b 392}105.281 -32.459 7.875
{ca ile b 393}101.602 -32.929 8.096
{ca phe b 394}101.032 -29.651 9.963
{ca gly b 395}103.618 -27.058 8.973
{ca asp b 396}104.763 -24.151 11.087
{ca asp b 397}101.215 -22.875 11.824
{ca ser b 398}100.444 -25.458 14.431
{ca val b 399}101.013 -26.06 18.19
{ca leu b 400}102.449 -29.554 19.008
{ca gln b 401}101.9 -30.699 22.579
{ca phe b 402}103.838 -33.071 24.807
{ca gly b 403}102.216 -34.07 28.026
{ca gly b 404}103.489 -37.511 28.817
{ca gly b 405}106.125 -36.7 26.233
{ca thr b 406}107.646 -33.987 28.503
{ca leu b 407}106.885 -35.05 32.117
{ca gly b 408}107.722 -38.618 31.091
{ca his b 409}111.414 -37.94 30.208
{ca pro b 410}113.949 -39.721 32.441
{ca trp b 411}115.548 -36.469 33.67
{ca gly b 412}112.335 -34.521 34.518
{ca asn b 413}110.69 -31.564 32.862
{ca ala b 414}113.423 -29.098 31.817
{ca pro b 415}115.437 -31.758 29.911
{ca gly b 416}112.235 -33.205 28.355
{ca ala b 417}111.391 -29.659 27.257
{ca val b 418}114.846 -29.255 25.682
{ca ala b 419}114.405 -32.645 24.079
{ca asn b 420}111.35 -31.652 22.177
{ca arg b 421}112.685 -28.156 21.306
{ca val b 422}115.8 -29.631 19.716
{ca ala b 423}113.878 -32.358 17.962
{ca leu b 424}111.622 -29.708 16.455
{ca glu b 425}114.309 -27.213 15.588
{ca ala b 426}116.159 -30.16 14.066
{ca cys b 427}113.22 -31.124 11.907
{ca val b 428}112.764 -27.462 10.951
{ca lys b 429}116.316 -27.006 9.634
{ca ala b 430}116.372 -30.313 7.805
{ca arg b 431}113.197 -29.172 6.115
{ca asn b 432}114.701 -25.767 5.39
{ca glu b 433}117.9 -27.332 3.962
{ca gly b 434}115.705 -29.286 1.623
{ca arg b 435}115.691 -32.741 3.358
{ca asp b 436}112.41 -34.727 3.11
{ca leu b 437}110.791 -35.011 6.469
{ca ala b 438}108.668 -37.947 5.125
{ca gln b 439}111.404 -39.998 3.548
{ca glu b 440}114.399 -38.774 5.604
{ca gly b 441}112.408 -38.367 8.772
{ca asn b 442}113.948 -40.927 10.993
{ca glu b 443}117.609 -40.169 10.427
{ca ile b 444}117.049 -36.591 11.19
{ca ile b 445}115.91 -36.972 14.756
{ca arg b 446}118.183 -39.954 15.015
{ca glu b 447}121.112 -37.811 14.008
{ca ala b 448}120.105 -35.201 16.563
{ca cys b 449}119.773 -37.701 19.257
{ca lys b 450}123.477 -38.122 18.686
{ca trp b 451}124.382 -34.523 19.476
{ca ser b 452}121.869 -33.797 22.263
{ca pro b 453}122.129 -35.469 25.731
{ca glu b 454}118.596 -34.446 26.623
{ca leu b 455}117.367 -35.418 23.185
{ca ala b 456}119.175 -38.766 23.417
{ca ala b 457}117.76 -39.723 26.721
{ca ala b 458}114.307 -39.267 25.163
{ca cys b 459}114.954 -41.156 21.949
{ca glu b 460}116.024 -44.243 23.827
{ca val b 461}112.913 -44.223 25.99
{ca trp b 462}110.273 -43.848 23.34
{ca lys b 463}112.026 -45.57 20.435
{ca glu b 464}109.695 -48.522 20.084
{ca ile b 465}106.284 -46.819 20.559
{ca val b 466}103.695 -46.258 17.836
{ca phe b 467}99.888 -46.384 17.999
{ca asn b 468}99.084 -48.283 14.86
{ca phe b 469}95.585 -49.696 15.012
{ca ala b 470}93.009 -49.919 12.172
{ca ala b 471}90.88 -46.75 12.168
{ca val b 472}87.127 -46. 12.443
@subgroup {S2} 
@vectorlist {Calphas} color=sky 
{ca met t 1}P 121.076 -37.174 34.446
{ca met t 1}121.076 -37.174 34.446
{ca gln t 2}121.904 -33.488 34.143
{ca val t 3}120.576 -30.215 35.403
{ca trp t 4}119.687 -27.936 32.551
{ca pro t 5}121.463 -24.795 33.703
{ca pro t 6}119.423 -21.931 35.032
{ca ile t 7}121.974 -19.313 34.086
{ca asn t 8}123.6 -18.328 30.839
{ca lys t 9}121.174 -19.776 28.299
{ca lys t 10}119.145 -16.875 26.911
{ca lys t 11}117.514 -17.911 23.681
{ca tyr t 12}116.51 -16.214 20.525
{ca glu t 13}113.483 -18.143 19.291
{ca thr t 14}113.793 -20.259 16.2
{ca leu t 15}116.968 -22.184 15.686
{ca ser t 16}118.597 -21.036 18.948
{ca tyr t 17}118.444 -24.555 20.418
{ca leu t 18}120.699 -26.069 17.73
{ca pro t 19}124.488 -25.29 17.633
{ca asp t 20}125.619 -21.863 16.325
{ca leu t 21}124.772 -21.728 12.694
{ca ser t 22}127.75 -21.783 10.402
{ca gln t 23}127.617 -19.345 7.511
{ca glu t 24}126.808 -22.277 5.177
{ca gln t 25}123.992 -23.169 7.47
{ca leu t 26}122.827 -19.638 7.756
{ca leu t 27}123.003 -19.35 4.014
{ca ser t 28}120.608 -22.208 3.522
{ca glu t 29}118.123 -20.153 5.681
{ca val t 30}118.159 -17.005 3.58
{ca glu t 31}117.971 -19.272 0.507
{ca tyr t 32}114.804 -21.039 1.942
{ca leu t 33}113.24 -17.709 2.631
{ca leu t 34}113.898 -16.695 -0.924
{ca lys t 35}112.803 -20.031 -2.42
{ca asn t 36}109.48 -19.123 -0.902
{ca gly t 37}109.036 -15.517 -1.9
{ca trp t 38}109.489 -13.909 1.443
{ca val t 39}110.99 -10.414 1.37
{ca pro t 40}114.048 -10.658 3.603
{ca cys t 41}114.447 -7.811 6.152
{ca leu t 42}117.063 -6.952 8.771
{ca glu t 43}116.553 -5.598 12.333
{ca phe t 44}119.197 -4.973 15.017
{ca glu t 45}119.053 -3.862 18.644
{ca thr t 46}121.828 -2.585 20.789
{ca glu t 47}120.068 -2.184 24.116
{ca his t 48}117.236 -4.464 25.05
{ca gly t 49}118.182 -7.821 24.015
{ca phe t 50}115.027 -9.259 25.602
{ca val t 51}111.337 -8.417 26.131
{ca tyr t 52}110.402 -6.405 29.163
{ca arg t 53}107.263 -4.88 30.572
{ca glu t 54}108.056 -1.361 31.728
{ca asn t 55}105.316 0.736 30.246
{ca asn t 56}102.351 -1.663 30.836
{ca lys t 57}101.351 -5.106 31.959
{ca ser t 58}97.928 -5.606 30.336
{ca pro t 59}97.533 -8.965 28.531
{ca gly t 60}99.64 -9.157 25.379
{ca tyr t 61}101.709 -6.078 26.117
{ca tyr t 62}105.377 -6.552 26.337
{ca asp t 63}107.952 -3.803 25.765
{ca gly t 64}111.016 -4.928 23.741
{ca arg t 65}109.473 -6.707 20.706
{ca tyr t 66}110.128 -3.991 18.194
{ca trp t 67}113.722 -3.724 17.011
{ca thr t 68}115.378 -1.162 14.603
{ca met t 69}115.002 -1.813 10.901
{ca trp t 70}118.358 -2.143 9.158
{ca lys t 71}117.758 0.001 5.993
{ca leu t 72}114.527 -1.268 4.279
{ca pro t 73}113.072 -4.734 3.519
{ca met t 74}114.996 -5.713 0.383
{ca phe t 75}111.979 -6.211 -1.853
{ca gly t 76}112.911 -7.62 -5.321
{ca cys t 77}116.371 -8.926 -4.226
{ca thr t 78}117.2 -12.498 -5.194
{ca asp t 79}120.733 -12.744 -4.15
{ca ala t 80}120.815 -14.728 -0.964
{ca thr t 81}124.399 -13.562 -0.826
{ca gln t 82}123.427 -9.885 -1.002
{ca val t 83}121.432 -10.268 2.244
{ca leu t 84}124.296 -12.04 3.944
{ca ala t 85}126.515 -9.143 2.944
{ca glu t 86}124.15 -6.847 4.831
{ca val t 87}124.569 -8.901 7.95
{ca gly t 88}128.335 -8.407 7.631
{ca glu t 89}127.77 -4.765 6.84
{ca ala t 90}125.76 -4.222 10.089
{ca lys t 91}128.076 -5.965 12.583
{ca lys t 92}130.491 -3.414 11.104
{ca ala t 93}128.916 -0.328 12.739
{ca tyr t 94}126.92 -2.195 15.41
{ca pro t 95}129.369 -4.706 16.722
{ca gln t 96}127.341 -4.733 19.913
{ca ala t 97}123.99 -5.097 18.136
{ca trp t 98}121.969 -8.299 18.112
{ca ile t 99}121.12 -8.709 14.357
{ca arg t 100}118.282 -10.799 13.083
{ca ile t 101}116.934 -11.725 9.65
{ca ile t 102}113.139 -11.967 9.048
{ca gly t 103}110.945 -12.894 6.102
{ca phe t 104}107.754 -11.211 5.095
{ca asp t 105}104.835 -13.02 3.47
{ca asn t 106}103.073 -9.854 2.096
{ca val t 107}99.926 -11.781 1.206
{ca arg t 108}99.268 -13.124 4.644
{ca gln t 109}101.234 -10.369 6.242
{ca val t 110}102.999 -12.673 8.744
{ca gln t 111}106.802 -12.811 9.29
{ca cys t 112}107.261 -16.293 7.859
{ca ile t 113}110.735 -16.554 9.284
{ca ser t 114}113.175 -15.024 11.752
{ca phe t 115}116.477 -16.357 13.118
{ca ile t 116}119.276 -14.464 14.8
{ca ala t 117}122.06 -13.716 12.354
{ca tyr t 118}124.439 -12.37 14.973
{ca lys t 119}124.652 -12.076 18.761
{ca pro t 120}127.092 -9.546 20.14
{ca glu t 121}129.894 -10.607 22.353
{ca gly t 122}128.988 -13.006 25.141
{ca tyr t 123}125.611 -14.317 24.141
@subgroup {L3} 
@vectorlist {Calphas} color=greentint 
{ca ala c 9}P 106.172 -41.122 45.932
{ca ala c 9}106.172 -41.122 45.932
{ca ser c 10}107.879 -44.418 46.862
{ca val c 11}109.019 -46.874 44.159
{ca gly c 12}111.537 -45.258 41.823
{ca phe c 13}110.405 -43.168 38.887
{ca lys c 14}110.852 -45.579 35.968
{ca ala c 15}110.331 -43.846 32.641
{ca gly c 16}108.379 -45.52 29.821
{ca val c 17}105. -46.876 28.759
{ca lys c 18}103.118 -49.542 30.874
{ca glu c 19}99.66 -51.057 30.271
{ca tyr c 20}96.819 -49.157 31.837
{ca lys c 21}95.756 -52.419 33.416
{ca leu c 22}98.519 -52.18 35.989
{ca thr c 23}96.878 -49.248 37.831
{ca tyr c 24}93.406 -48.806 36.542
{ca tyr c 25}92.03 -52.371 36.674
{ca thr c 26}91.139 -52.979 40.349
{ca pro c 27}88.528 -55.699 40.724
{ca glu c 28}89.629 -55.695 44.296
{ca tyr c 29}87.928 -52.34 44.771
{ca gln c 30}85.187 -51.695 47.212
{ca thr c 31}83.193 -48.666 46.118
{ca lys c 32}82.825 -45.756 48.548
{ca asp c 33}79.559 -44.041 49.185
{ca thr c 34}80.938 -40.797 47.751
{ca asp c 35}82.272 -42.3 44.5
{ca ile c 36}80.736 -41.309 41.149
{ca leu c 37}80.267 -44.647 39.339
{ca ala c 38}79.848 -45.089 35.664
{ca ala c 39}78.702 -48.048 33.659
{ca phe c 40}80.416 -47.756 30.212
{ca arg c 41}79.496 -50.141 27.365
{ca val c 42}82.9 -50.792 25.714
{ca thr c 43}83.735 -52.533 22.407
{ca pro c 44}87.472 -53.011 22.125
{ca gln c 45}89.645 -53.261 19.18
{ca pro c 46}90.473 -56.875 18.277
{ca gly c 47}93.66 -57.329 20.315
{ca val c 48}92.537 -55.374 23.38
{ca pro c 49}91.775 -57.398 26.444
{ca pro c 50}88.7 -55.784 27.965
{ca glu c 51}90.509 -55.182 31.244
{ca glu c 52}93.006 -53.108 29.284
{ca ala c 53}90.246 -51.261 27.395
{ca gly c 54}88.54 -50.786 30.742
{ca ala c 55}91.663 -49.453 32.441
{ca ala c 56}92.343 -47.044 29.486
{ca val c 57}88.842 -45.689 29.867
{ca ala c 58}89.47 -45.26 33.631
{ca ala c 59}92.952 -43.792 33.335
{ca glu c 60}92.433 -41.28 30.594
{ca ser c 61}89.376 -40.169 32.484
{ca ser c 62}90.94 -39.293 35.804
{ca thr c 63}94.58 -39.125 36.498
{ca gly c 64}96.657 -40.76 33.822
{ca thr c 65}98.342 -40.463 30.475
{ca trp c 66}100.186 -42.834 28.094
{ca thr c 67}103.705 -42.981 29.569
{ca thr c 68}105.124 -42.683 33.08
{ca val c 69}105.486 -39.214 34.526
{ca trp c 70}107.431 -38.616 37.816
{ca thr c 71}105.009 -36.02 39.172
{ca asp c 72}102.701 -38.939 40.194
{ca gly c 73}104.998 -39.424 43.17
{ca leu c 74}104.237 -35.827 44.295
{ca thr c 75}100.661 -36.769 45.087
{ca ser c 76}99.032 -40.201 45.751
{ca leu c 77}97.083 -41.841 42.886
{ca asp c 78}95.434 -44.282 45.285
{ca arg c 79}93.402 -41.269 46.397
{ca tyr c 80}92.774 -39.873 43.039
{ca lys c 81}92.902 -42.537 40.301
{ca gly c 82}89.691 -43.371 38.501
{ca arg c 83}89.276 -47.151 38.681
{ca cys c 84}87.808 -49.937 36.65
{ca tyr c 85}86.6 -52.375 39.318
{ca arg c 86}84.705 -54.816 36.978
{ca ile c 87}83.899 -55.836 33.422
{ca glu c 88}80.961 -58.001 32.394
{ca arg c 89}80.192 -59.681 29.025
{ca val c 90}77.32 -58.258 27.034
{ca val c 91}75.314 -61.347 26.764
{ca gly c 92}74.82 -62.159 23.188
{ca glu c 93}76.983 -59.471 21.879
{ca lys c 94}79.861 -58.872 19.614
{ca asp c 95}82.877 -58.374 21.867
{ca gln c 96}80.946 -55.795 23.885
{ca tyr c 97}81.285 -55.33 27.607
{ca ile c 98}80.156 -53.269 30.551
{ca ala c 99}83.333 -51.751 32.163
{ca tyr c 100}82.343 -50.265 35.559
{ca val c 101}84.351 -47.228 36.712
{ca ala c 102}84.585 -45.493 40.01
{ca tyr c 103}85.636 -41.827 40.339
{ca pro c 104}86.431 -40.378 43.776
{ca leu c 105}84.629 -37.248 44.888
{ca asp c 106}87.779 -35.219 45.133
{ca leu c 107}87.921 -35.083 41.328
{ca phe c 108}84.832 -33.017 40.567
{ca glu c 109}84.199 -29.318 40.93
{ca glu c 110}81.049 -28.861 42.943
{ca gly c 111}77.928 -27.508 41.184
{ca ser c 112}79.432 -28.163 37.732
{ca val c 113}77.895 -30.671 35.301
{ca thr c 114}80.428 -29.055 32.892
{ca asn c 115}83.268 -30.296 35.048
{ca met c 116}81.818 -33.835 35.614
{ca phe c 117}81.17 -34.393 31.865
{ca thr c 118}84.671 -33.005 30.998
{ca ser c 119}86.115 -35.855 33.023
{ca ile c 120}83.918 -38.843 32.32
{ca val c 121}83.432 -38.11 28.634
{ca gly c 122}86.207 -35.766 27.762
{ca asn c 123}88.658 -37.922 25.81
{ca val c 124}88.159 -41.752 26.041
{ca phe c 125}85.512 -41.887 23.353
{ca gly c 126}88.26 -41.366 20.804
{ca phe c 127}90.898 -43.776 21.921
{ca lys c 128}92.48 -45.671 18.997
{ca ala c 129}92.453 -48.891 21.125
{ca leu c 130}88.589 -48.769 21.342
{ca arg c 131}86.31 -48.864 18.363
{ca ala c 132}83.169 -47.739 20.138
{ca leu c 133}82.311 -46.531 23.688
{ca arg c 134}78.986 -45.435 25.236
{ca leu c 135}77.996 -44.234 28.683
{ca glu c 136}74.919 -46.004 29.896
{ca asp c 137}74.679 -44.727 33.422
{ca leu c 138}76.233 -42.756 36.254
{ca arg c 139}75.626 -42.949 39.955
{ca ile c 140}75.726 -39.403 41.428
{ca pro c 141}76.354 -39.745 45.211
{ca pro c 142}74.399 -37.6 47.639
{ca ala c 143}77.583 -35.823 48.591
{ca tyr c 144}77.749 -34.443 45.016
{ca val c 145}74.013 -34.109 44.566
{ca lys c 146}73.811 -31.653 47.518
{ca thr c 147}76.192 -29.348 45.666
{ca phe c 148}73.591 -28.579 42.931
{ca gln c 149}70.671 -26.242 43.043
{ca gly c 150}68.708 -28.47 40.772
{ca pro c 151}65.429 -27.214 39.352
{ca pro c 152}64.476 -23.651 39.918
{ca his c 153}61.17 -25.145 41.158
{ca gly c 154}60.093 -28.737 40.541
{ca ile c 155}56.754 -30.522 40.104
{ca gln c 156}55.199 -29.575 43.456
{ca val c 157}55.889 -25.809 43.424
{ca glu c 158}55.102 -25.626 39.658
{ca arg c 159}51.64 -27.119 40.339
{ca asp c 160}51.268 -25.065 43.511
{ca lys c 161}52.042 -21.911 41.481
{ca leu c 162}49.898 -22.417 38.393
{ca asn c 163}47.163 -23.902 40.724
{ca lys c 164}47.019 -27.101 38.695
{ca tyr c 165}46.178 -30.528 40.002
{ca gly c 166}45.138 -34.091 39.033
{ca arg c 167}45.969 -34.71 35.396
{ca pro c 168}48.696 -34.018 32.803
{ca leu c 169}49.237 -30.324 31.908
{ca leu c 170}48.552 -29.765 28.161
{ca gly c 171}50.645 -27.746 25.75
{ca cys c 172}51.246 -26.812 22.072
{ca thr c 173}54.28 -25.701 19.963
{ca ile c 174}53.082 -23.018 17.498
{ca lys c 175}53.876 -24.029 13.831
{ca pro c 176}55.185 -23.334 11.254
{ca lys c 177}58.609 -23.817 12.986
{ca leu c 178}60.184 -20.539 11.583
{ca gly c 179}58.57 -17.8 9.35
{ca leu c 180}55.554 -16.503 11.417
{ca ser c 181}55.481 -12.693 12.374
{ca ala c 182}55.592 -11.529 15.986
{ca lys c 183}51.981 -10.563 15.614
{ca asn c 184}50.719 -13.807 14.133
{ca tyr c 185}52.566 -15.71 16.839
{ca gly c 186}50.519 -13.935 19.425
{ca arg c 187}47.319 -14.517 17.499
{ca ala c 188}48.03 -18.183 17.208
{ca val c 189}48.933 -18.225 20.936
{ca tyr c 190}45.741 -16.638 22.324
{ca glu c 191}43.725 -18.86 19.997
{ca cys c 192}45.453 -22.054 21.291
{ca leu c 193}45.224 -20.912 24.885
{ca arg c 194}41.529 -19.844 25.017
{ca gly c 195}40.576 -23.346 23.769
{ca gly c 196}41.844 -24.936 27.067
{ca leu c 197}45.613 -25.729 26.586
{ca asp c 198}47.628 -24.629 29.702
{ca phe c 199}50.702 -23.63 27.67
{ca thr c 200}51.817 -22.692 24.167
{ca lys c 201}55.474 -22.413 23.32
{ca asp c 202}58.319 -21.306 21.086
{ca asp c 203}59.761 -23.972 18.758
{ca glu c 204}63.214 -24.674 20.078
{ca asn c 205}64.76 -22.905 17.065
{ca val c 206}62.594 -19.782 17.565
{ca asn c 207}65.194 -17.299 19.067
{ca ser c 208}65.446 -13.869 17.329
{ca gln c 209}65.541 -13.853 13.508
{ca pro c 210}64.764 -11.425 10.652
{ca phe c 211}61.198 -12.666 10.354
{ca met c 212}60.459 -12.085 14.086
{ca arg c 213}62.63 -10.662 16.8
{ca trp c 214}62.624 -11.92 20.328
{ca arg c 215}61.476 -8.676 21.976
{ca asp c 216}58.518 -8.349 19.616
{ca arg c 217}57.365 -11.937 20.127
{ca phe c 218}57.682 -11.583 23.877
{ca leu c 219}55.536 -8.474 23.945
{ca phe c 220}52.79 -9.928 21.794
{ca cys c 221}52.742 -13.362 23.377
{ca ala c 222}52.335 -11.516 26.668
{ca glu c 223}49.287 -9.713 25.352
{ca ala c 224}47.763 -12.925 24.15
{ca leu c 225}48.281 -15.196 27.188
{ca tyr c 226}46.954 -12.407 29.351
{ca lys c 227}43.817 -12.333 27.044
{ca ala c 228}43.342 -16.053 27.146
{ca glu c 229}43.821 -16.304 30.9
{ca ala c 230}41.246 -13.6 31.525
{ca glu c 231}38.819 -15.227 29.191
{ca thr c 232}39.271 -18.745 30.614
{ca gly c 233}39.739 -17.876 34.259
{ca glu c 234}42.6 -20.426 34.204
{ca ile c 235}46.258 -19.446 34.718
{ca lys c 236}48.017 -19.673 31.342
{ca gly c 237}51.697 -19.367 30.309
{ca his c 238}53.584 -19.415 26.973
{ca tyr c 239}57.177 -20.814 26.948
{ca leu c 240}59.337 -17.76 25.937
{ca asn c 241}62.587 -19.032 24.353
{ca ala c 242}65.67 -17.432 25.988
{ca thr c 243}68.242 -19.544 24.118
{ca ala c 244}70.647 -17.13 22.578
{ca gly c 245}74.153 -16.87 21.361
{ca thr c 246}75.896 -15.426 24.437
{ca cys c 247}75.029 -15.635 28.172
{ca glu c 248}74.575 -11.861 28.167
{ca glu c 249}71.942 -12.07 25.466
{ca met c 250}70.34 -15.028 27.105
{ca ile c 251}69.928 -13.437 30.526
{ca lys c 252}68.795 -10.283 28.873
{ca arg c 253}65.746 -11.983 27.458
{ca ala c 254}65.211 -13.814 30.712
{ca val c 255}65.074 -10.378 32.177
{ca phe c 256}62.365 -9.137 29.771
{ca ala c 257}60.022 -12.059 30.565
{ca arg c 258}60.481 -11.15 34.256
{ca glu c 259}59.542 -7.508 33.391
{ca leu c 260}56.333 -8.833 31.651
{ca gly c 261}55.289 -10.875 34.757
{ca val c 262}54.884 -13.974 32.584
{ca pro c 263}55.447 -17.268 34.392
{ca ile c 264}57.828 -19.51 32.348
{ca val c 265}60.71 -19.325 29.958
{ca met c 266}62.509 -22.055 28.09
{ca his c 267}66.015 -23.002 27.016
{ca asp c 268}67.502 -25.598 24.619
{ca tyr c 269}69.992 -26.875 27.209
{ca leu c 270}72.284 -28.876 24.868
{ca thr c 271}72.804 -26.439 21.993
{ca gly c 272}73.157 -23.578 24.61
{ca gly c 273}75.224 -25.653 26.941
{ca phe c 274}75.478 -26.672 30.521
{ca thr c 275}77.436 -23.509 31.457
{ca ala c 276}74.736 -21.287 30.105
{ca asn c 277}71.981 -23.585 31.384
{ca thr c 278}73.011 -23.482 34.952
{ca ser c 279}73.275 -19.66 34.763
{ca leu c 280}69.664 -19.653 33.582
{ca ala c 281}68.481 -22.011 36.232
{ca his c 282}69.999 -19.75 38.846
{ca tyr c 283}68.453 -16.682 37.287
{ca cys c 284}65.117 -18.468 37.198
{ca arg c 285}65.362 -19.611 40.733
{ca asp c 286}66.008 -16.092 42.094
{ca asn c 287}63.451 -14.446 39.905
{ca gly c 288}60.619 -16.904 40.058
{ca leu c 289}60.25 -18.073 36.449
{ca leu c 290}59.698 -21.789 35.61
{ca leu c 291}62.14 -23.138 33.068
{ca his c 292}61.198 -25.749 30.392
{ca ile c 293}64.232 -27.48 28.85
{ca his c 294}64.025 -28.638 25.163
{ca arg c 295}66.588 -31.351 24.342
{ca ala c 296}67.479 -30.329 20.892
{ca met c 297}70.653 -32.04 19.653
{ca his c 298}70.365 -34.997 22.085
{ca ala c 299}69.597 -37.607 19.493
{ca val c 300}73.027 -36.756 18.081
{ca ile c 301}74.394 -38.34 21.188
{ca asp c 302}71.906 -40.846 22.412
{ca arg c 303}70.612 -42.896 19.424
{ca gln c 304}73.105 -45.632 18.542
{ca lys c 305}73.296 -48.523 21.086
{ca asn c 306}76.994 -48.917 20.745
{ca his c 307}78.422 -45.337 20.892
{ca gly c 308}77.433 -42.162 22.792
{ca ile c 309}75.686 -41.143 25.882
{ca his c 310}72.355 -42.642 26.896
{ca phe c 311}69.596 -40.081 27.472
{ca arg c 312}69.112 -41.376 31.059
{ca val c 313}72.446 -39.69 31.662
{ca leu c 314}71.592 -36.461 29.743
{ca ala c 315}68.322 -36.475 31.842
{ca lys c 316}70.278 -36.95 35.099
{ca ala c 317}72.624 -34.109 33.983
{ca leu c 318}69.687 -31.748 33.618
{ca arg c 319}68.063 -32.487 36.971
{ca met c 320}71.456 -31.411 38.327
{ca ser c 321}71.932 -28.287 36.209
{ca gly c 322}68.326 -27.073 36.532
{ca gly c 323}65.108 -27.451 34.626
{ca asp c 324}61.462 -27.547 35.735
{ca his c 325}60.309 -29.468 32.581
{ca ile c 326}62.483 -31.742 30.305
{ca his c 327}61.226 -33.458 27.176
{ca ser c 328}61.126 -37.228 27.959
{ca gly c 329}59.849 -38.662 24.65
{ca thr c 330}56.367 -40.116 23.667
{ca val c 331}56.997 -43.785 22.85
{ca val c 332}53.98 -43.617 20.558
{ca gly c 333}54.762 -40.712 18.248
{ca lys c 334}57.097 -39.322 15.513
{ca leu c 335}60.457 -39.875 17.171
{ca glu c 336}62.326 -42.834 18.612
{ca gly c 337}61.76 -44.177 22.163
{ca glu c 338}60.891 -47.441 23.883
{ca arg c 339}58.486 -47.743 26.729
{ca asp c 340}60.544 -49.449 29.39
{ca ile c 341}63.638 -47.389 29.065
{ca thr c 342}61.411 -44.368 29.076
{ca leu c 343}59.697 -45.58 32.256
{ca gly c 344}63.109 -45.995 33.648
{ca phe c 345}64.445 -42.411 33.131
{ca val c 346}61.083 -40.766 33.734
{ca asp c 347}61.417 -42.093 37.342
{ca leu c 348}65.053 -40.852 37.321
{ca leu c 349}63.634 -37.393 36.516
{ca arg c 350}60.767 -37.241 39.026
{ca asp c 351}61.514 -39.735 41.943
{ca asp c 352}63.34 -39.243 45.205
{ca phe c 353}64.872 -42.665 45.238
{ca val c 354}65.185 -45.001 42.322
{ca glu c 355}66.212 -48.528 42.955
{ca gln c 356}68.454 -50.156 40.365
{ca asp c 357}66.474 -52.22 37.665
{ca arg c 358}68.508 -53.546 34.793
{ca ser c 359}65.209 -54.487 33.302
{ca arg c 360}64.57 -50.798 32.692
{ca gly c 361}68.181 -49.793 31.937
{ca ile c 362}68.86 -48.329 35.364
{ca tyr c 363}72.316 -49.718 36.322
{ca phe c 364}72.581 -48.042 39.744
{ca thr c 365}70.35 -47.031 42.655
{ca gln c 366}70.008 -43.284 42.478
{ca asp c 367}69.213 -41.337 45.698
{ca trp c 368}68.371 -37.659 44.93
{ca val c 369}68.413 -36.577 48.573
{ca ser c 370}65.44 -34.38 47.99
{ca leu c 371}66.536 -32.648 44.785
{ca pro c 372}63.148 -31.461 43.339
{ca gly c 373}61.919 -33.521 40.47
{ca val c 374}61.362 -32.457 36.884
{ca leu c 375}58.027 -32.788 34.939
{ca pro c 376}58.577 -34.911 31.807
{ca val c 377}57.104 -33.579 28.55
{ca ala c 378}55.536 -35.71 25.885
{ca ser c 379}55.798 -34.2 22.448
{ca gly c 380}56.06 -34.626 18.687
{ca gly c 381}53.689 -36.359 16.301
{ca ile c 382}50.957 -37.084 18.985
{ca his c 383}47.175 -36.721 18.591
{ca val c 384}43.734 -37.235 20.1
{ca trp c 385}43.966 -40.991 19.546
{ca his c 386}47.169 -41.281 21.679
{ca met c 387}45.646 -39.604 24.681
{ca pro c 388}44.81 -42.718 26.692
{ca ala c 389}48.237 -44.313 26.114
{ca leu c 390}50.203 -41.173 27.089
{ca thr c 391}47.946 -40.688 30.037
{ca glu c 392}48.642 -44.357 30.702
{ca ile c 393}52.376 -44.364 30.346
{ca phe c 394}52.982 -40.946 31.976
{ca gly c 395}50.458 -40.276 34.808
{ca asp c 396}49.235 -36.9 35.896
{ca asp c 397}52.767 -35.476 36.4
{ca ser c 398}53.547 -34.922 32.791
{ca val c 399}53.113 -32.166 30.131
{ca leu c 400}51.654 -33.484 26.825
{ca gln c 401}52.109 -31.333 23.807
{ca phe c 402}50.122 -30.767 20.629
{ca gly c 403}51.931 -28.826 17.942
{ca gly c 404}50.512 -30.239 14.703
{ca gly c 405}47.851 -31.947 16.751
{ca thr c 406}46.522 -28.429 17.61
{ca leu c 407}47.154 -26.107 14.649
{ca gly c 408}46.305 -29.114 12.441
{ca his c 409}42.592 -29.285 13.496
{ca pro c 410}40.023 -28.576 10.743
{ca trp c 411}38.439 -25.696 12.583
{ca gly c 412}41.68 -24.006 13.719
{ca asn c 413}43.455 -23.643 17.107
{ca ala c 414}40.644 -22.954 19.736
{ca pro c 415}38.582 -25.893 18.691
{ca gly c 416}41.779 -27.985 18.426
{ca ala c 417}42.592 -26.957 21.95
{ca val c 418}39.152 -27.943 23.203
{ca ala c 419}39.493 -31.252 21.374
{ca asn c 420}42.665 -32.271 23.273
{ca arg c 421}41.294 -30.917 26.563
{ca val c 422}38.134 -33.084 26.387
{ca ala c 423}40.137 -36.019 25.084
{ca leu c 424}42.406 -35.821 28.09
{ca glu c 425}39.724 -34.992 30.716
{ca ala c 426}37.833 -37.853 29.101
{ca cys c 427}40.773 -40.196 29.665
{ca val c 428}41.198 -38.888 33.16
{ca lys c 429}37.701 -39.709 34.381
{ca ala c 430}37.656 -43.14 32.742
{ca arg c 431}40.802 -43.773 34.607
{ca asn c 432}39.3 -42.491 37.803
{ca glu c 433}36.047 -44.507 37.274
{ca gly c 434}38.384 -47.49 37.111
{ca arg c 435}38.309 -48.09 33.313
{ca asp c 436}41.531 -49.467 31.794
{ca leu c 437}43.209 -46.854 29.635
{ca ala c 438}45.278 -49.663 28.039
{ca gln c 439}42.583 -52.23 27.279
{ca glu c 440}39.629 -49.804 27.154
{ca gly c 441}41.594 -46.966 25.592
{ca asn c 442}40.003 -46.669 22.198
{ca glu c 443}36.337 -46.702 23.129
{ca ile c 444}36.94 -44.011 25.694
{ca ile c 445}38.073 -41.384 23.237
{ca arg c 446}35.803 -42.929 20.621
{ca glu c 447}32.898 -42.421 23.007
{ca ala c 448}33.764 -38.846 23.683
{ca cys c 449}34.324 -37.995 20.033
{ca lys c 450}30.57 -38.81 19.996
{ca trp c 451}29.629 -36.123 22.502
{ca ser c 452}32.203 -33.442 21.401
{ca pro c 453}31.92 -31.545 18.101
{ca glu c 454}35.449 -30.231 18.325
{ca leu c 455}36.639 -33.555 19.64
{ca ala c 456}34.886 -35.416 16.775
{ca ala c 457}36.312 -33.212 13.997
{ca ala c 458}39.61 -34.281 15.454
{ca cys c 459}39.051 -38.004 15.649
{ca glu c 460}37.981 -38.074 12.015
{ca val c 461}41.146 -36.413 10.71
{ca trp c 462}43.799 -38.32 12.642
{ca lys c 463}42.03 -41.703 13.013
{ca glu c 464}44.299 -43.81 10.764
{ca ile c 465}47.672 -42.323 11.954
{ca val c 466}50.377 -44.175 13.869
{ca phe c 467}54.188 -44.147 13.755
{ca asn c 468}54.978 -47.802 14.031
{ca phe c 469}58.446 -48.473 12.751
{ca ala c 470}60.944 -50.947 14.238
{ca ala c 471}63.117 -49.128 16.814
{ca val c 472}66.847 -48.462 17.307
@subgroup {S3} 
@vectorlist {Calphas} color=sky
{ca met u 1}P 33.057 -25.527 11.703
{ca met u 1}33.057 -25.527 11.703
{ca gln u 2}32.05 -23.621 14.861
{ca val u 3}33.351 -20.628 16.661
{ca trp u 4}34.28 -21.632 20.187
{ca pro u 5}32.493 -18.868 22.087
{ca pro u 6}34.605 -16.165 23.583
{ca ile u 7}32.108 -15.372 26.36
{ca asn u 8}30.478 -17.403 29.182
{ca lys u 9}32.793 -20.335 29.364
{ca lys u 10}34.838 -19.754 32.542
{ca lys u 11}36.614 -22.949 33.558
{ca tyr u 12}37.541 -24.568 36.795
{ca glu u 13}40.532 -26.706 35.929
{ca thr u 14}40.281 -30.477 36.01
{ca leu u 15}37.104 -31.976 34.63
{ca ser u 16}35.42 -28.618 33.815
{ca tyr u 17}35.492 -29.509 30.125
{ca leu u 18}33.27 -32.61 30.315
{ca pro u 19}29.508 -32.165 31.012
{ca asp u 20}28.36 -31.358 34.551
{ca leu u 21}29.223 -34.234 36.846
{ca ser u 22}26.229 -36.107 38.139
{ca gln u 23}26.318 -37.014 41.804
{ca glu u 24}27.205 -40.539 40.78
{ca gln u 25}30.027 -39.199 38.704
{ca leu u 26}31.064 -36.912 41.485
{ca leu u 27}30.976 -39.871 43.808
{ca ser u 28}33.438 -41.796 41.652
{ca glu u 29}35.898 -39.006 42.248
{ca val u 30}35.738 -38.833 46.031
{ca glu u 31}35.919 -42.572 45.66
{ca tyr u 32}39.193 -42.463 43.643
{ca leu u 33}40.639 -39.969 45.95
{ca leu u 34}40.115 -42.316 48.845
{ca lys u 35}41.166 -45.369 46.926
{ca asn u 36}44.529 -43.672 46.87
{ca gly u 37}45.165 -42.448 50.421
{ca trp u 38}44.574 -38.743 49.725
{ca val u 39}43.079 -36.714 52.585
{ca pro u 40}39.979 -35.086 51.182
{ca cys u 41}39.579 -31.421 51.941
{ca leu u 42}37.018 -28.73 51.048
{ca glu u 43}37.416 -25.061 50.241
{ca phe u 44}34.807 -22.544 49.128
{ca glu u 45}35.097 -18.965 47.873
{ca thr u 46}32.323 -16.457 47.728
{ca glu u 47}34.027 -13.47 46.141
{ca his u 48}36.84 -13.995 43.668
{ca gly u 49}35.713 -16.789 41.538
{ca phe u 50}38.964 -16.352 39.504
{ca val u 51}42.638 -15.467 39.856
{ca tyr u 52}43.604 -11.858 39.743
{ca arg u 53}46.687 -9.821 40.129
{ca glu u 54}45.895 -6.798 42.265
{ca asn u 55}48.675 -6.779 44.898
{ca asn u 56}51.634 -7.743 42.631
{ca lys u 57}52.575 -8.867 39.108
{ca ser u 58}56.045 -10.38 39.614
{ca pro u 59}56.445 -13.786 37.893
{ca gly u 60}54.386 -16.469 39.598
{ca tyr u 61}52.305 -14.083 41.76
{ca tyr u 62}48.585 -14.217 41.23
{ca asp u 63}46.053 -13.024 43.83
{ca gly u 64}42.932 -15.253 43.946
{ca arg u 65}44.58 -18.808 44.392
{ca tyr u 66}43.893 -19.423 48.085
{ca trp u 67}40.209 -20.132 48.93
{ca thr u 68}38.675 -20.701 52.459
{ca met u 69}39.072 -24.085 54.059
{ca trp u 70}35.69 -25.623 54.866
{ca lys u 71}36.243 -27.013 58.422
{ca leu u 72}39.417 -29.179 58.397
{ca pro u 73}40.949 -31.665 55.947
{ca met u 74}38.985 -34.814 57.029
{ca phe u 75}41.964 -36.93 58.016
{ca gly u 76}41.155 -40.579 58.75
{ca cys u 77}37.725 -40.423 56.987
{ca thr u 78}36.854 -43.344 54.708
{ca asp u 79}33.296 -42.568 53.979
{ca ala u 80}33.217 -41.21 50.483
{ca thr u 81}29.638 -40.437 51.37
{ca gln u 82}30.511 -38.353 54.417
{ca val u 83}32.577 -35.849 52.309
{ca leu u 84}29.76 -35.656 49.859
{ca ala u 85}27.609 -34.788 52.768
{ca glu u 86}29.841 -31.879 53.577
{ca val u 87}29.45 -30.592 50.089
{ca gly u 88}25.642 -30.479 50.633
{ca glu u 89}26.298 -29.055 54.041
{ca ala u 90}28.246 -26.107 52.592
{ca lys u 91}25.905 -25.101 49.727
{ca lys u 92}23.539 -24.857 52.667
{ca ala u 93}25.066 -21.714 54.221
{ca tyr u 94}27.12 -20.616 51.17
{ca pro u 95}24.648 -20.944 48.354
{ca gln u 96}26.635 -18.296 46.54
{ca ala u 97}29.993 -20.046 47.116
{ca trp u 98}32.07 -21.875 44.541
{ca ile u 99}32.883 -25.137 46.428
{ca arg u 100}35.743 -27.452 45.472
{ca ile u 101}37.053 -30.776 46.588
{ca ile u 102}40.835 -31.494 46.847
{ca gly u 103}43.031 -34.412 47.851
{ca phe u 104}46.236 -34.215 49.803
{ca asp u 105}49.099 -36.626 49.215
{ca asn u 106}50.88 -35.907 52.65
{ca val u 107}54.029 -37.727 51.521
{ca arg u 108}54.676 -35.614 48.538
{ca gln u 109}52.786 -32.686 49.882
{ca val u 110}50.935 -32.136 46.536
{ca gln u 111}47.211 -31.726 45.992
{ca cys u 112}46.814 -34.912 44.04
{ca ile u 113}43.331 -33.89 42.901
{ca ser u 114}40.899 -31.036 42.754
{ca phe u 115}37.486 -30.752 40.973
{ca ile u 116}34.744 -28.209 41.544
{ca ala u 117}31.88 -29.785 43.51
{ca tyr u 118}29.547 -26.825 43.094
{ca lys u 119}29.417 -23.561 41.18
{ca pro u 120}26.938 -20.975 42.409
{ca glu u 121}24.105 -19.9 40.219
{ca gly u 122}24.992 -18.884 36.703
{ca tyr u 123}28.346 -20.493 36.187
@subgroup {L4} 
@vectorlist {Calphas} color=greentint 
{ca ala d 9}P 106.241 -6.821 -1.963
{ca ala d 9}106.241 -6.821 -1.963
{ca ser d 10}107.873 -7.725 -5.301
{ca val d 11}109.033 -5.027 -7.745
{ca gly d 12}111.555 -2.715 -6.111
{ca phe d 13}110.425 0.187 -3.997
{ca lys d 14}110.953 3.144 -6.443
{ca ala d 15}110.388 6.502 -4.672
{ca gly d 16}108.369 9.281 -6.333
{ca val d 17}105.021 10.307 -7.773
{ca lys d 18}103.139 8.273 -10.418
{ca glu d 19}99.659 8.897 -11.906
{ca tyr d 20}96.787 7.304 -9.999
{ca lys d 21}95.758 5.729 -13.29
{ca leu d 22}98.501 3.167 -13.045
{ca thr d 23}96.913 1.382 -10.071
{ca tyr d 24}93.375 2.501 -9.666
{ca tyr d 25}92.04 2.504 -13.219
{ca thr d 26}91.16 -1.164 -13.766
{ca pro d 27}88.589 -1.57 -16.554
{ca glu d 28}89.639 -5.157 -16.488
{ca tyr d 29}87.947 -5.674 -13.166
{ca gln d 30}85.224 -8.059 -12.478
{ca thr d 31}83.261 -6.988 -9.479
{ca lys d 32}82.847 -9.39 -6.587
{ca asp d 33}79.443 -9.916 -4.998
{ca thr d 34}80.986 -8.648 -1.736
{ca asp d 35}82.294 -5.43 -3.17
{ca ile d 36}80.794 -2.03 -2.169
{ca leu d 37}80.271 -0.278 -5.517
{ca ala d 38}79.888 3.453 -5.999
{ca ala d 39}78.682 5.558 -8.871
{ca phe d 40}80.435 8.968 -8.557
{ca arg d 41}79.49 11.785 -11.063
{ca val d 42}82.901 13.371 -11.651
{ca thr d 43}83.794 16.676 -13.341
{ca pro d 44}87.485 17.035 -13.709
{ca gln d 45}89.703 19.917 -14.088
{ca pro d 46}90.606 20.873 -17.632
{ca gly d 47}93.75 18.852 -18.226
{ca val d 48}92.482 15.81 -16.255
{ca pro d 49}91.754 12.645 -18.196
{ca pro d 50}88.668 11.133 -16.691
{ca glu d 51}90.523 7.934 -16.015
{ca glu d 52}92.972 9.882 -13.899
{ca ala d 53}90.246 11.819 -12.074
{ca gly d 54}88.452 8.441 -11.648
{ca ala d 55}91.713 6.725 -10.36
{ca ala d 56}92.342 9.58 -7.837
{ca val d 57}88.794 9.214 -6.52
{ca ala d 58}89.393 5.469 -6.029
{ca ala d 59}92.907 5.741 -4.646
{ca glu d 60}92.45 8.465 -2.094
{ca ser d 61}89.347 6.671 -1.03
{ca ser d 62}91.023 3.388 -0.177
{ca thr d 63}94.597 2.587 0.006
{ca gly d 64}96.651 5.296 -1.64
{ca thr d 65}98.341 8.677 -1.388
{ca trp d 66}100.111 11.094 -3.717
{ca thr d 67}103.651 9.589 -3.815
{ca thr d 68}105.146 6.083 -3.634
{ca val d 69}105.5 4.542 -0.166
{ca trp d 70}107.497 1.385 0.464
{ca thr d 71}105.019 0.008 3.005
{ca asp d 72}102.699 -1.07 0.213
{ca gly d 73}104.963 -4.025 -0.159
{ca leu d 74}104.118 -5.116 3.365
{ca thr d 75}100.634 -6.054 2.4
{ca ser d 76}99.067 -6.544 -0.991
{ca leu d 77}97.114 -3.777 -2.684
{ca asp d 78}95.538 -6.152 -5.085
{ca arg d 79}93.396 -7.264 -2.164
{ca tyr d 80}92.78 -3.887 -0.688
{ca lys d 81}92.911 -1.199 -3.373
{ca gly d 82}89.622 0.56 -4.224
{ca arg d 83}89.245 0.463 -8.002
{ca cys d 84}87.895 2.49 -10.829
{ca tyr d 85}86.608 -0.138 -13.191
{ca arg d 86}84.744 2.183 -15.577
{ca ile d 87}83.968 5.677 -16.718
{ca glu d 88}80.916 6.768 -18.812
{ca arg d 89}80.24 10.17 -20.418
{ca val d 90}77.275 12.036 -19.025
{ca val d 91}75.296 12.355 -22.219
{ca gly d 92}74.863 15.935 -23.047
{ca glu d 93}76.965 17.292 -20.324
{ca lys d 94}79.852 19.542 -19.67
{ca asp d 95}82.87 17.328 -19.266
{ca gln d 96}80.998 15.324 -16.618
{ca tyr d 97}81.217 11.565 -16.165
{ca ile d 98}80.156 8.599 -14.103
{ca ala d 99}83.285 6.95 -12.628
{ca tyr d 100}82.387 3.558 -11.07
{ca val d 101}84.42 2.477 -8.098
{ca ala d 102}84.52 -0.902 -6.297
{ca tyr d 103}85.603 -1.257 -2.692
{ca pro d 104}86.491 -4.667 -1.231
{ca leu d 105}84.585 -5.685 1.855
{ca asp d 106}87.685 -5.966 4.017
{ca leu d 107}87.923 -2.16 4.093
{ca phe d 108}84.822 -1.382 6.153
{ca glu d 109}84.138 -1.679 9.791
{ca glu d 110}81.044 -3.836 10.395
{ca gly d 111}77.943 -2.123 11.668
{ca ser d 112}79.364 1.391 10.947
{ca val d 113}77.903 3.896 8.471
{ca thr d 114}80.424 6.352 9.974
{ca asn d 115}83.287 4.161 8.79
{ca met d 116}81.75 3.62 5.313
{ca phe d 117}81.243 7.403 4.911
{ca thr d 118}84.686 8.261 6.177
{ca ser d 119}86.171 6.126 3.352
{ca ile d 120}83.993 6.766 0.35
{ca val d 121}83.456 10.478 0.984
{ca gly d 122}86.27 11.367 3.337
{ca asn d 123}88.666 13.407 1.252
{ca val d 124}88.181 13.058 -2.517
{ca phe d 125}85.48 15.783 -2.825
{ca gly d 126}88.23 18.427 -2.244
{ca phe d 127}90.868 17.225 -4.642
{ca lys d 128}92.482 20.131 -6.514
{ca ala d 129}92.388 17.946 -9.702
{ca leu d 130}88.546 17.8 -9.576
{ca arg d 131}86.255 20.861 -9.675
{ca ala d 132}83.1 19.097 -8.546
{ca leu d 133}82.281 15.522 -7.317
{ca arg d 134}78.967 13.993 -6.319
{ca leu d 135}78.128 10.449 -5.076
{ca glu d 136}74.924 9.221 -6.804
{ca asp d 137}74.6 5.658 -5.478
{ca leu d 138}76.311 2.863 -3.592
{ca arg d 139}75.689 -0.859 -3.909
{ca ile d 140}75.616 -2.334 -0.341
{ca pro d 141}76.336 -6.055 -0.532
{ca pro d 142}74.399 -8.55 1.549
{ca ala d 143}77.625 -9.456 3.273
{ca tyr d 144}77.695 -5.869 4.563
{ca val d 145}73.992 -5.429 5.065
{ca lys d 146}73.871 -8.397 7.54
{ca thr d 147}76.184 -6.526 9.828
{ca phe d 148}73.641 -3.768 10.587
{ca gln d 149}70.714 -3.865 12.883
{ca gly d 150}68.786 -1.524 10.641
{ca pro d 151}65.43 -0.178 11.93
{ca pro d 152}64.453 -0.725 15.469
{ca his d 153}61.184 -2.059 13.976
{ca gly d 154}60.213 -1.343 10.314
{ca ile d 155}56.847 -1.115 8.606
{ca gln d 156}55.132 -4.3 9.615
{ca val d 157}55.973 -4.205 13.31
{ca glu d 158}55.052 -0.532 13.497
{ca arg d 159}51.697 -1.242 11.986
{ca asp d 160}51.374 -4.318 14.121
{ca lys d 161}52.048 -2.338 17.292
{ca leu d 162}49.851 0.694 16.755
{ca asn d 163}47.293 -1.687 15.215
{ca lys d 164}46.94 0.367 12.081
{ca tyr d 165}46.222 -0.888 8.561
{ca gly d 166}45.075 0.196 5.094
{ca arg d 167}45.946 3.852 4.458
{ca pro d 168}48.632 6.382 5.094
{ca leu d 169}49.335 7.208 8.809
{ca leu d 170}48.534 10.897 9.487
{ca gly d 171}50.631 13.43 11.388
{ca cys d 172}51.226 17.111 12.253
{ca thr d 173}54.241 19.182 13.405
{ca ile d 174}53.085 21.561 16.137
{ca lys d 175}53.89 25.256 15.124
{ca pro d 176}55.186 27.865 15.762
{ca lys d 177}58.683 26.214 15.333
{ca leu d 178}60.186 27.601 18.595
{ca gly d 179}58.463 29.735 21.306
{ca leu d 180}55.511 27.675 22.646
{ca ser d 181}55.417 26.635 26.38
{ca ala d 182}55.655 23.132 27.781
{ca lys d 183}51.902 23.378 28.476
{ca asn d 184}50.699 25.03 25.271
{ca tyr d 185}52.57 22.315 23.467
{ca gly d 186}50.51 19.719 25.274
{ca arg d 187}47.304 21.588 24.617
{ca ala d 188}48.071 21.887 20.981
{ca val d 189}48.97 18.105 20.894
{ca tyr d 190}45.746 16.829 22.449
{ca glu d 191}43.79 19.171 20.29
{ca cys d 192}45.379 17.849 17.07
{ca leu d 193}45.219 14.257 18.179
{ca arg d 194}41.517 14.021 19.319
{ca gly d 195}40.637 15.316 15.821
{ca gly d 196}41.922 12.094 14.212
{ca leu d 197}45.677 12.525 13.455
{ca asp d 198}47.747 9.423 14.437
{ca phe d 199}50.718 11.428 15.639
{ca thr d 200}51.842 14.909 16.471
{ca lys d 201}55.53 15.788 16.784
{ca asp d 202}58.269 18.075 17.879
{ca asp d 203}59.69 20.297 15.206
{ca glu d 204}63.175 19.072 14.469
{ca asn d 205}64.693 22.044 16.397
{ca val d 206}62.561 21.652 19.465
{ca asn d 207}65.189 20.081 21.817
{ca ser d 208}65.461 21.809 25.242
{ca gln d 209}65.527 25.636 25.375
{ca pro d 210}64.774 28.46 27.822
{ca phe d 211}61.243 28.741 26.507
{ca met d 212}60.398 24.981 26.951
{ca arg d 213}62.548 22.299 28.593
{ca trp d 214}62.522 18.805 27.158
{ca arg d 215}61.433 17.163 30.409
{ca asp d 216}58.489 19.58 30.777
{ca arg d 217}57.368 19.099 27.153
{ca phe d 218}57.692 15.323 27.48
{ca leu d 219}55.562 15.175 30.643
{ca phe d 220}52.742 17.258 29.251
{ca cys d 221}52.638 15.816 25.735
{ca ala d 222}52.307 12.44 27.536
{ca glu d 223}49.349 13.734 29.459
{ca ala d 224}47.799 14.981 26.245
{ca leu d 225}48.351 12.034 24.015
{ca tyr d 226}46.978 9.844 26.742
{ca lys d 227}43.867 12.073 26.857
{ca ala d 228}43.432 12.037 23.072
{ca glu d 229}43.823 8.217 22.891
{ca ala d 230}41.249 7.521 25.531
{ca glu d 231}38.838 9.902 23.884
{ca thr d 232}39.095 8.565 20.409
{ca gly d 233}39.767 4.874 21.222
{ca glu d 234}42.658 4.862 18.627
{ca ile d 235}46.302 4.429 19.622
{ca lys d 236}48.013 7.804 19.419
{ca gly d 237}51.707 8.833 19.667
{ca his d 238}53.596 12.109 19.785
{ca tyr d 239}57.232 12.059 18.388
{ca leu d 240}59.34 13.304 21.353
{ca asn d 241}62.648 14.79 20.046
{ca ala d 242}65.693 13.177 21.794
{ca thr d 243}68.198 15.033 19.603
{ca ala d 244}70.711 16.41 22.058
{ca gly d 245}74.22 17.775 22.296
{ca thr d 246}75.882 14.742 23.861
{ca cys d 247}75.116 10.977 23.598
{ca glu d 248}74.548 10.873 27.349
{ca glu d 249}71.943 13.658 27.003
{ca met d 250}70.388 11.927 24.067
{ca ile d 251}69.995 8.566 25.81
{ca lys d 252}68.792 10.24 28.945
{ca arg d 253}65.712 11.672 27.165
{ca ala d 254}65.019 8.395 25.316
{ca val d 255}65.083 6.876 28.757
{ca phe d 256}62.251 9.187 30.057
{ca ala d 257}60.053 8.539 27.031
{ca arg d 258}60.47 4.856 28.014
{ca glu d 259}59.495 5.728 31.617
{ca leu d 260}56.295 7.366 30.372
{ca gly d 261}55.172 4.316 28.261
{ca val d 262}54.913 6.531 25.145
{ca pro d 263}55.506 4.823 21.846
{ca ile d 264}57.817 6.89 19.611
{ca val d 265}60.769 9.243 19.858
{ca met d 266}62.54 11.145 17.092
{ca his d 267}66.058 12.116 16.159
{ca asp d 268}67.672 14.497 13.649
{ca tyr d 269}70.077 11.964 12.172
{ca leu d 270}72.281 14.302 10.191
{ca thr d 271}72.734 17.103 12.798
{ca gly d 272}72.959 14.436 15.485
{ca gly d 273}75.219 12.203 13.452
{ca phe d 274}75.501 8.628 12.479
{ca thr d 275}77.467 7.671 15.59
{ca ala d 276}74.739 9.042 17.829
{ca asn d 277}71.866 7.75 15.662
{ca thr d 278}73.2 4.232 15.65
{ca ser d 279}73.242 4.363 19.391
{ca leu d 280}69.635 5.528 19.583
{ca ala d 281}68.486 2.892 17.095
{ca his d 282}70.028 0.277 19.356
{ca tyr d 283}68.474 1.848 22.464
{ca cys d 284}65.066 1.853 20.729
{ca arg d 285}65.312 -1.676 19.624
{ca asp d 286}65.998 -2.91 23.146
{ca asn d 287}63.419 -0.726 24.658
{ca gly d 288}60.696 -0.939 22.134
{ca leu d 289}60.243 2.667 21.042
{ca leu d 290}59.609 3.483 17.313
{ca leu d 291}62.127 6.088 16.168
{ca his d 292}61.313 8.821 13.659
{ca ile d 293}64.223 10.162 11.648
{ca his d 294}64.193 13.871 10.621
{ca arg d 295}66.619 14.75 7.813
{ca ala d 296}67.579 18.301 8.873
{ca met d 297}70.742 19.577 7.094
{ca his d 298}70.304 17.192 4.216
{ca ala d 299}69.661 19.657 1.415
{ca val d 300}72.975 21.195 2.361
{ca ile d 301}74.343 17.991 0.788
{ca asp d 302}71.82 16.777 -1.619
{ca arg d 303}70.618 19.695 -3.744
{ca gln d 304}73.162 20.568 -6.577
{ca lys d 305}73.227 17.943 -9.348
{ca asn d 306}76.97 18.399 -9.722
{ca his d 307}78.498 18.237 -6.214
{ca gly d 308}77.561 16.356 -3.027
{ca ile d 309}75.761 13.218 -1.966
{ca his d 310}72.375 12.234 -3.475
{ca phe d 311}69.525 11.602 -0.998
{ca arg d 312}68.965 8.065 -2.244
{ca val d 313}72.415 7.4 -0.6
{ca leu d 314}71.56 9.392 2.528
{ca ala d 315}68.4 7.243 2.628
{ca lys d 316}70.209 3.927 2.244
{ca ala d 317}72.639 4.967 5.023
{ca leu d 318}69.679 5.428 7.412
{ca arg d 319}68.026 2.084 6.65
{ca met d 320}71.432 0.842 7.659
{ca ser d 321}72.098 2.812 10.842
{ca gly d 322}68.497 2.723 12.115
{ca gly d 323}65.077 4.324 11.79
{ca asp d 324}61.43 3.296 11.625
{ca his d 325}60.387 6.408 9.593
{ca ile d 326}62.439 8.763 7.318
{ca his d 327}61.181 11.897 5.635
{ca ser d 328}61.116 11.148 1.92
{ca gly d 329}59.844 14.477 0.406
{ca thr d 330}56.411 15.485 -1.036
{ca val d 331}56.965 16.296 -4.75
{ca val d 332}53.971 18.578 -4.525
{ca gly d 333}54.808 20.925 -1.564
{ca lys d 334}57.104 23.615 -0.055
{ca leu d 335}60.538 21.967 -0.624
{ca glu d 336}62.352 20.549 -3.68
{ca gly d 337}61.844 17.03 -5.056
{ca glu d 338}60.988 15.236 -8.24
{ca arg d 339}58.526 12.374 -8.535
{ca asp d 340}60.532 9.749 -10.382
{ca ile d 341}63.596 10.118 -8.264
{ca thr d 342}61.481 10.124 -5.122
{ca leu d 343}59.703 6.967 -6.269
{ca gly d 344}63.084 5.42 -6.795
{ca phe d 345}64.403 6.016 -3.335
{ca val d 346}61.117 5.283 -1.649
{ca asp d 347}61.428 1.709 -2.934
{ca leu d 348}65.04 1.776 -1.713
{ca leu d 349}63.532 2.634 1.697
{ca arg d 350}60.749 0.05 1.838
{ca asp d 351}61.466 -2.909 -0.469
{ca asp d 352}63.38 -6.077 -0.062
{ca phe d 353}65.056 -6.019 -3.448
{ca val d 354}65.128 -3.207 -5.896
{ca glu d 355}66.172 -3.746 -9.394
{ca gln d 356}68.487 -1.229 -11.026
{ca asp d 357}66.542 1.465 -12.959
{ca arg d 358}68.486 4.346 -14.386
{ca ser d 359}65.181 5.859 -15.369
{ca arg d 360}64.557 6.48 -11.698
{ca gly d 361}68.186 7.215 -10.8
{ca ile d 362}68.828 3.755 -9.24
{ca tyr d 363}72.28 2.853 -10.59
{ca phe d 364}72.567 -0.544 -8.827
{ca thr d 365}70.349 -3.434 -7.879
{ca gln d 366}70.029 -3.294 -4.094
{ca asp d 367}69.315 -6.499 -2.195
{ca trp d 368}68.384 -5.845 1.46
{ca val d 369}68.419 -9.465 2.665
{ca ser d 370}65.431 -8.813 4.786
{ca leu d 371}66.529 -5.67 6.595
{ca pro d 372}63.256 -4.037 7.709
{ca gly d 373}61.855 -1.319 5.545
{ca val d 374}61.28 2.176 6.657
{ca leu d 375}58.035 4.135 6.355
{ca pro d 376}58.609 7.277 4.217
{ca val d 377}57.206 10.544 5.543
{ca ala d 378}55.645 13.208 3.259
{ca ser d 379}55.866 16.614 4.969
{ca gly d 380}56.036 20.335 4.409
{ca gly d 381}53.659 22.846 2.814
{ca ile d 382}50.92 20.238 1.908
{ca his d 383}47.167 20.592 2.416
{ca val d 384}43.8 18.967 1.936
{ca trp d 385}43.841 19.533 -1.814
{ca his d 386}47.014 17.41 -2.152
{ca met d 387}45.582 14.474 -0.473
{ca pro d 388}44.793 12.351 -3.505
{ca ala d 389}48.182 13.018 -5.093
{ca leu d 390}50.178 12.018 -1.956
{ca thr d 391}47.887 9.107 -1.566
{ca glu d 392}48.668 8.3 -5.189
{ca ile d 393}52.396 8.776 -5.291
{ca phe d 394}53.022 7.142 -1.909
{ca gly d 395}50.436 4.401 -1.118
{ca asp d 396}49.223 3.296 2.257
{ca asp d 397}52.802 2.719 3.568
{ca ser d 398}53.519 6.32 4.216
{ca val d 399}53.043 8.988 6.958
{ca leu d 400}51.493 12.298 5.698
{ca gln d 401}52.097 15.328 7.814
{ca phe d 402}50.055 18.438 8.405
{ca gly d 403}51.865 21.234 10.255
{ca gly d 404}50.639 24.524 8.886
{ca gly d 405}47.864 22.483 7.299
{ca thr d 406}46.44 21.455 10.725
{ca leu d 407}47.138 24.477 13.026
{ca gly d 408}46.293 26.614 10.021
{ca his d 409}42.529 25.621 9.755
{ca pro d 410}40.048 28.37 10.563
{ca trp d 411}38.404 26.537 13.43
{ca gly d 412}41.591 25.355 15.244
{ca asn d 413}43.379 21.987 15.587
{ca ala d 414}40.58 19.39 16.341
{ca pro d 415}38.647 20.497 13.268
{ca gly d 416}41.882 20.85 11.2
{ca ala d 417}42.636 17.249 12.123
{ca val d 418}39.139 15.989 11.201
{ca ala d 419}39.405 17.802 7.83
{ca asn d 420}42.64 15.808 6.941
{ca arg d 421}41.474 12.526 8.345
{ca val d 422}38.32 12.787 6.135
{ca ala d 423}40.257 14.046 3.113
{ca leu d 424}42.418 10.963 3.283
{ca glu d 425}39.726 8.345 4.127
{ca ala d 426}37.855 9.949 1.252
{ca cys d 427}40.757 9.455 -1.14
{ca val d 428}41.303 6.004 0.233
{ca lys d 429}37.733 4.859 -0.571
{ca ala d 430}37.762 6.513 -4.009
{ca arg d 431}40.834 4.513 -4.668
{ca asn d 432}39.311 1.29 -3.377
{ca glu d 433}36.036 1.742 -5.343
{ca gly d 434}38.309 2. -8.353
{ca arg d 435}38.361 5.797 -8.856
{ca asp d 436}41.615 7.282 -10.281
{ca leu d 437}43.281 9.556 -7.724
{ca ala d 438}45.409 11.019 -10.553
{ca gln d 439}42.611 11.904 -13.068
{ca glu d 440}39.587 12.012 -10.743
{ca gly d 441}41.552 13.533 -7.887
{ca asn d 442}40.021 16.934 -7.633
{ca glu d 443}36.42 15.964 -7.602
{ca ile d 444}36.902 13.466 -4.838
{ca ile d 445}38.088 15.855 -2.148
{ca arg d 446}35.81 18.452 -3.786
{ca glu d 447}32.92 16.109 -3.274
{ca ala d 448}33.822 15.377 0.367
{ca cys d 449}34.354 19.082 1.07
{ca lys d 450}30.6 19.244 0.392
{ca trp d 451}29.642 16.702 3.1
{ca ser d 452}32.161 17.754 5.771
{ca pro d 453}31.839 21.099 7.54
{ca glu d 454}35.4 20.805 8.838
{ca leu d 455}36.646 19.467 5.538
{ca ala d 456}34.873 22.372 3.75
{ca ala d 457}36.318 25.144 5.919
{ca ala d 458}39.721 23.719 4.913
{ca cys d 459}39.071 23.491 1.157
{ca glu d 460}37.995 27.084 0.986
{ca val d 461}41.104 28.265 2.71
{ca trp d 462}43.797 26.494 0.752
{ca lys d 463}41.999 26.143 -2.56
{ca glu d 464}44.287 28.375 -4.637
{ca ile d 465}47.665 27.195 -3.201
{ca val d 466}50.369 25.367 -5.111
{ca phe d 467}54.165 25.393 -5.017
{ca asn d 468}54.899 25.158 -8.679
{ca phe d 469}58.428 26.379 -9.358
{ca ala d 470}60.94 24.897 -11.85
{ca ala d 471}63.091 22.31 -9.975
{ca val d 472}66.821 21.859 -9.354
@subgroup {S4} 
@vectorlist {Calphas} color=sky
{ca met v 1}P 33.013 27.483 13.663
{ca met v 1}33.013 27.483 13.663
{ca gln v 2}32.074 24.366 15.598
{ca val v 3}33.38 22.465 18.508
{ca trp v 4}34.318 18.924 17.493
{ca pro v 5}32.562 17.06 20.272
{ca pro v 6}34.571 15.523 23.064
{ca ile v 7}32.043 12.816 23.733
{ca asn v 8}30.456 9.955 21.728
{ca lys v 9}32.799 9.691 18.748
{ca lys v 10}34.857 6.569 19.47
{ca lys v 11}36.647 5.509 16.299
{ca tyr v 12}37.582 2.338 14.561
{ca glu v 13}40.526 3.183 12.455
{ca thr v 14}40.222 3.075 8.668
{ca leu v 15}37.052 4.429 7.124
{ca ser v 16}35.508 5.36 10.516
{ca tyr v 17}35.586 9.072 9.629
{ca leu v 18}33.307 8.775 6.606
{ca pro v 19}29.537 8.128 7.032
{ca asp v 20}28.333 4.6 7.864
{ca leu v 21}29.241 2.321 5.009
{ca ser v 22}26.318 1.022 2.985
{ca gln v 23}26.332 -2.68 2.171
{ca glu v 24}27.233 -1.65 -1.399
{ca gln v 25}30.07 0.432 -0.133
{ca leu v 26}31.143 -2.306 2.212
{ca leu v 27}30.987 -4.647 -0.747
{ca ser v 28}33.441 -2.488 -2.638
{ca glu v 29}35.882 -3.112 0.188
{ca val v 30}35.752 -6.916 0.297
{ca glu v 31}35.924 -6.512 -3.447
{ca tyr v 32}39.247 -4.544 -3.337
{ca leu v 33}40.778 -6.845 -0.835
{ca leu v 34}40.047 -9.652 -3.165
{ca lys v 35}41.162 -7.842 -6.244
{ca asn v 36}44.526 -7.719 -4.55
{ca gly v 37}45.106 -11.271 -3.263
{ca trp v 38}44.532 -10.653 0.371
{ca val v 39}42.995 -13.553 2.28
{ca pro v 40}39.963 -12.003 4.037
{ca cys v 41}39.518 -12.84 7.751
{ca leu v 42}37.042 -11.908 10.451
{ca glu v 43}37.455 -11.124 14.163
{ca phe v 44}34.829 -9.968 16.614
{ca glu v 45}35.011 -8.739 20.178
{ca thr v 46}32.231 -8.603 22.675
{ca glu v 47}33.977 -6.994 25.653
{ca his v 48}36.841 -4.56 25.05
{ca gly v 49}35.805 -2.419 22.276
{ca phe v 50}38.984 -0.417 22.71
{ca val v 51}42.622 -0.753 23.676
{ca tyr v 52}43.511 -0.531 27.347
{ca arg v 53}46.678 -0.979 29.33
{ca glu v 54}45.889 -3.064 32.33
{ca asn v 55}48.655 -5.709 32.289
{ca asn v 56}51.592 -3.493 31.265
{ca lys v 57}52.639 -0.029 30.323
{ca ser v 58}56.054 -0.603 28.711
{ca pro v 59}56.388 1.228 25.412
{ca gly v 60}54.388 -0.493 22.766
{ca tyr v 61}52.342 -2.617 25.054
{ca tyr v 62}48.601 -2.108 25.001
{ca asp v 63}45.97 -4.629 26.119
{ca gly v 64}42.91 -5.018 23.816
{ca arg v 65}44.476 -5.181 20.269
{ca tyr v 66}43.915 -8.895 19.725
{ca trp v 67}40.276 -9.827 18.884
{ca thr v 68}38.615 -13.291 18.442
{ca met v 69}39.054 -14.96 15.075
{ca trp v 70}35.669 -15.671 13.447
{ca lys v 71}36.243 -19.213 12.192
{ca leu v 72}39.467 -19.195 10.095
{ca pro v 73}41.017 -16.937 7.449
{ca met v 74}39.067 -17.861 4.27
{ca phe v 75}42.049 -18.889 2.193
{ca gly v 76}41.1 -19.702 -1.438
{ca cys v 77}37.699 -17.894 -1.284
{ca thr v 78}36.843 -15.59 -4.227
{ca asp v 79}33.292 -14.813 -3.503
{ca ala v 80}33.17 -11.318 -2.113
{ca thr v 81}29.6 -12.26 -1.308
{ca gln v 82}30.607 -15.257 0.726
{ca val v 83}32.61 -13.154 3.253
{ca leu v 84}29.762 -10.693 3.463
{ca ala v 85}27.649 -13.671 4.288
{ca glu v 86}29.852 -14.382 7.224
{ca val v 87}29.471 -10.904 8.622
{ca gly v 88}25.674 -11.525 8.672
{ca glu v 89}26.328 -14.919 10.093
{ca ala v 90}28.265 -13.464 13.021
{ca lys v 91}25.958 -10.571 14.009
{ca lys v 92}23.536 -13.464 14.306
{ca ala v 93}25.13 -15.129 17.466
{ca tyr v 94}27.146 -12.035 18.515
{ca pro v 95}24.655 -9.225 18.121
{ca gln v 96}26.64 -7.392 20.763
{ca ala v 97}29.894 -8.089 19.073
{ca trp v 98}31.971 -5.482 17.225
{ca ile v 99}32.927 -7.267 14.002
{ca arg v 100}35.69 -6.408 11.676
{ca ile v 101}37.062 -7.522 8.364
{ca ile v 102}40.816 -7.701 7.627
{ca gly v 103}43.066 -8.63 4.704
{ca phe v 104}46.307 -10.612 4.999
{ca asp v 105}49.119 -10.051 2.486
{ca asn v 106}50.896 -13.512 3.306
{ca val v 107}54.112 -12.499 1.424
{ca arg v 108}54.713 -9.402 3.501
{ca gln v 109}52.898 -10.727 6.433
{ca val v 110}51.035 -7.401 6.998
{ca gln v 111}47.251 -6.875 7.413
{ca cys v 112}46.874 -4.886 4.223
{ca ile v 113}43.326 -3.809 5.222
{ca ser v 114}40.857 -3.623 8.02
{ca phe v 115}37.512 -1.868 8.363
{ca ile v 116}34.705 -2.397 10.884
{ca ala v 117}31.894 -4.413 9.35
{ca tyr v 118}29.571 -3.989 12.295
{ca lys v 119}29.378 -2.049 15.584
{ca pro v 120}26.91 -3.311 18.143
{ca glu v 121}24.095 -1.086 19.215
{ca gly v 122}24.953 2.485 20.19
{ca tyr v 123}28.341 2.92 18.586
@group {contacts} off
@labellist {region I} color=red
{X}{ ca  gln a 30}P 68.809 46.715 15.669
{X}{ ca  asp a 33}P 74.462 41.68 21.619
{X}{ ca  arg a 86}P 69.277 43.216 5.546
{X}{ ca  arg a 89}P 73.818 42.572 -3.776
{X}{ ca  gln a 439}P 111.421 35.514 -0.934
{X}{ ca  asn a 442}P 113.95 28.078 -1.752
{X}{ ca  arg a 446}P 118.249 24.197 -0.794
{X}{ ca  lys a 450}P 123.443 20.453 1.009
{X}{ ca  trp a 451}P 124.344 19.621 4.597
{X}{ ca  ser a 452}P 121.899 16.826 5.372
{X}{ ca  glu s 43}P 116.535 26.807 33.628
{X}{ ca  ala s 85}P 126.443 36.256 29.902
{X}{ ca  gln b 30}P 68.821 -23.439 -7.607
{X}{ ca  asp b 33}P 74.515 -17.596 -2.572
{X}{ ca  arg b 86}P 69.312 -33.666 -4.171
{X}{ ca  arg b 89}P 73.771 -42.926 -3.294
{X}{ ca  gln b 439}P 111.404 -39.998 3.548
{X}{ ca  asn b 442}P 113.948 -40.927 10.993
{X}{ ca  arg b 446}P 118.183 -39.954 15.015
{X}{ ca  lys b 450}P 123.477 -38.122 18.686
{X}{ ca  trp b 451}P 124.382 -34.523 19.476
{X}{ ca  ser b 452}P 121.869 -33.797 22.263
{X}{ ca  glu t 43}P 116.553 -5.598 12.333
{X}{ ca  ala t 85}P 126.515 -9.143 2.944
@labellist {region II} color=brown
{X}{ ca  gln s 25}P 123.943 31.705 15.899
{X}{ ca  leu s 27}P 122.984 35.087 19.772
{X}{ ca  val s 30}P 118.197 35.6 22.17
{X}{ ca  glu s 86}P 124.231 34.353 32.285
{X}{ ca  glu s 89}P 127.779 32.291 34.394
{X}{ ca  gln t 25}P 123.992 -23.169 7.47
{X}{ ca  leu t 27}P 123.003 -19.35 4.014
{X}{ ca  val t 30}P 118.159 -17.005 3.58
{X}{ ca  glu t 86}P 124.15 -6.847 4.831
{X}{ ca  glu t 89}P 127.77 -4.765 6.84
@group {SS} dominant
@subgroup {subunit 1}
@vectorlist {SS} color= yellow 
{ca cys a 449}P 119.682 19.882 1.475
{cb cys a 449}119.121 19.886 0.092
{sg cys a 449}117.6 20.66 -0.052
{sg cys a 459}116.631 18.531 -0.419
{cb cys a 459}116.203 17.982 -1.941
{ca cys a 459}114.948 17.202 -2.052
{ca cys a 172} P 102.691 11.922 9.613
{cb cys a 172} 104.084 11.198 9.68
{sg cys a 172} 104.082 9.636 8.933
{sg cys a 192} 106.397 7.188 10.136
{cb cys a 192} 107.187 7.971 11.479
{ca cys a 192} 108.585 7.538 11.767
@subgroup {subunit 2}
@vectorlist {SS} color=yellow
{ca cys b 449}P 119.773 -37.701 19.257
{cb cys b 449}119.181 -39.05 19.27
{sg cys b 449}117.612 -39.129 18.5
{sg cys b 459}116.842 -39.669 20.52
{cb cys b 459}116.252 -41.124 21.17
{ca cys b 459}114.954 -41.156 21.949
{ca cys b 172} P 102.762 -29.492 27.244
{cb cys b 172} 104.037 -29.458 28.016
{sg cys b 172} 104.171 -30.168 29.622
{sg cys b 192} 106.654 -29.153 31.835
{cb cys b 192} 107.277 -27.758 31.01
{ca cys b 192} 108.611 -27.403 31.538
@subgroup {subunit 3}
@vectorlist {SS} color= yellow 
{ca cys c 449}P 34.324 -37.995 20.033
{cb cys c 449}34.972 -38.642 18.872
{sg cys c 449}36.603 -39.404 19.147
{sg cys c 459}37.307 -38.086 17.792
{cb cys c 459}37.841 -38.631 16.239
{ca cys c 459}39.051 -38.004 15.649
{ca cys c 172} P 51.246 -26.812 22.072
{cb cys c 172} 49.908 -26.127 21.684
{sg cys c 172} 49.725 -25.222 20.143
{sg cys c 192} 47.249 -22.766 19.617
{cb cys c 192} 46.842 -22.7 21.336
{ca cys c 192} 45.453 -22.054 21.291
@subgroup {subunit 4}
@vectorlist {SS} color= yellow 
{ca cys d 449}P 34.354 19.082 1.07
{cb cys d 449}34.9 20.182 0.262
{sg cys d 449}36.55 19.977 -0.553
{sg cys d 459}37.416 21.238 0.957
{cb cys d 459}37.778 22.94 0.501
{ca cys d 459}39.071 23.491 1.157
{ca cys d 172} P 51.226 17.111 12.253
{cb cys d 172} 49.859 17.417 12.929
{sg cys d 172} 49.613 18.764 13.955
{sg cys d 192} 47.469 19.576 16.487
{cb cys d 192} 46.779 17.889 16.465
{ca cys d 192} 45.379 17.849 17.07
@vectorlist {dimer-related} color=yellow
{ca cys a 247} P 78.981 6.281 21.154
{cb cys a 247} 78.057 7.137 22.041
{sg cys a 247} 77.09 8.276 21.026
{sg cys d 247} 77.226 10.077 21.936
{cb cys d 247} 76.029 9.861 23.265
{ca cys d 247} 75.116 10.977 23.598
{ca cys b 247} P 78.845 -18.023 32.865
{cb cys b 247} 77.89 -17.392 31.989
{sg cys b 247} 76.945 -18.189 30.778
{sg cys c 247} 77.007 -17.338 29.241
{cb cys c 247} 75.904 -15.932 29.327
{ca cys c 247} 75.029 -15.635 28.172
@group {het grps} dominant
@vectorlist {CABP} color= pink 
{c1 cap a 490}P 97.252 13.085 4.185
{c1 cap a 490}97.252 13.085 4.185
{c1 cap a 490}P 97.252 13.085 4.185
{c2 cap a 490}95.886 12.741 4.62
{c2 cap a 490}P 95.886 12.741 4.62
{c3 cap a 490}95.323 14.22 4.577
{c3 cap a 490}P 95.323 14.22 4.577
{c4 cap a 490}94.154 14.512 5.429
{c2 cap a 490}P 95.886 12.741 4.62
{c2b cap a 490}95.12 11.739 3.73
{c1 cap a 490}P 97.252 13.085 4.185
{o1 cap a 490}98.009 12.061 3.747
{c2 cap a 490}P 95.886 12.741 4.62
{o2 cap a 490}95.885 11.769 5.534
{c3 cap a 490}P 95.323 14.22 4.577
{o3 cap a 490}95.839 15.464 4.921
{c4 cap a 490}P 94.154 14.512 5.429
{o4 cap a 490}93.803 13.25 5.933
{c5 cap a 490}P 93.511 15.125 4.27
{o5 cap a 490}92.668 16.089 4.663
{c2b cap a 490}P 95.12 11.739 3.73
{o1b cap a 490}95.191 11.891 2.491
{c2b cap a 490}P 95.12 11.739 3.73
{o2b cap a 490}94.455 10.871 4.26
{o1 cap a 490}P 98.009 12.061 3.747
{pa cap a 490}99.208 12.589 2.939
{o5 cap a 490}P 92.668 16.089 4.663
{pc cap a 490}92.663 17.582 5.082
{pa cap a 490}P 99.208 12.589 2.939
{o1a cap a 490}98.611 12.977 1.683
{pa cap a 490}P 99.208 12.589 2.939
{o2a cap a 490}100.095 11.27 2.562
{pa cap a 490}P 99.208 12.589 2.939
{o3a cap a 490}100.03 13.37 3.837
{pc cap a 490}P 92.663 17.582 5.082
{o1c cap a 490}92.532 18.589 3.765
{pc cap a 490}P 92.663 17.582 5.082
{o2c cap a 490}91.386 17.641 5.808
{pc cap a 490}P 92.663 17.582 5.082
{o3c cap a 490}93.936 18.034 5.645
{c4 cap a 490}P 94.154 14.512 5.429
{c5 cap a 490}93.511 15.125 4.27
{c1 cap b 490}P 97.216 -34.945 26.141
{c1 cap b 490}97.216 -34.945 26.141
{c1 cap b 490}P 97.216 -34.945 26.141
{c2 cap b 490}95.84 -34.611 26.39
{c2 cap b 490}P 95.84 -34.611 26.39
{c3 cap b 490}95.238 -34.779 24.992
{c3 cap b 490}P 95.238 -34.779 24.992
{c4 cap b 490}94.112 -33.842 24.692
{c2 cap b 490}P 95.84 -34.611 26.39
{c2b cap b 490}95.09 -35.448 27.405
{c1 cap b 490}P 97.216 -34.945 26.141
{o1 cap b 490}97.979 -35.406 27.232
{c2 cap b 490}P 95.84 -34.611 26.39
{o2 cap b 490}95.796 -33.594 27.237
{c3 cap b 490}P 95.238 -34.779 24.992
{o3 cap b 490}95.656 -34.437 23.747
{c4 cap b 490}P 94.112 -33.842 24.692
{o4 cap b 490}93.888 -33.443 26.01
{c5 cap b 490}P 93.489 -34.896 23.99
{o5 cap b 490}92.711 -34.564 23.
{c2b cap b 490}P 95.09 -35.448 27.405
{o1b cap b 490}94.879 -36.616 27.192
{c2b cap b 490}P 95.09 -35.448 27.405
{o2b cap b 490}94.641 -34.931 28.432
{o1 cap b 490}P 97.979 -35.406 27.232
{pa cap b 490}99.229 -36.18 26.569
{o5 cap b 490}P 92.711 -34.564 23.
{pc cap b 490}92.711 -34.141 21.501
{pa cap b 490}P 99.229 -36.18 26.569
{o1a cap b 490}98.553 -37.39 26.021
{pa cap b 490}P 99.229 -36.18 26.569
{o2a cap b 490}99.995 -36.747 27.91
{pa cap b 490}P 99.229 -36.18 26.569
{o3a cap b 490}100.028 -35.235 25.777
{pc cap b 490}P 92.711 -34.141 21.501
{o1c cap b 490}92.297 -35.381 20.526
{pc cap b 490}P 92.711 -34.141 21.501
{o2c cap b 490}91.53 -33.289 21.314
{pc cap b 490}P 92.711 -34.141 21.501
{o3c cap b 490}94.087 -33.738 21.127
{c4 cap b 490}P 94.112 -33.842 24.692
{c5 cap b 490}93.489 -34.896 23.99
{c1 cap c 490}P 56.807 -31.037 18.147
{c1 cap c 490}56.807 -31.037 18.147
{c1 cap c 490}P 56.807 -31.037 18.147
{c2 cap c 490}58.227 -30.574 18.314
{c2 cap c 490}P 58.227 -30.574 18.314
{c3 cap c 490}58.781 -31.786 19.098
{c3 cap c 490}P 58.781 -31.786 19.098
{c4 cap c 490}59.878 -31.491 20.044
{c2 cap c 490}P 58.227 -30.574 18.314
{c2b cap c 490}58.947 -30.178 17.049
{c1 cap c 490}P 56.807 -31.037 18.147
{o1 cap c 490}55.972 -30.314 17.294
{c2 cap c 490}P 58.227 -30.574 18.314
{o2 cap c 490}58.246 -29.227 18.54
{c3 cap c 490}P 58.781 -31.786 19.098
{o3 cap c 490}58.375 -32.449 20.32
{c5 cap c 490}P 60.49 -32.653 19.374
{o5 cap c 490}61.183 -33.305 20.317
{c2b cap c 490}P 58.947 -30.178 17.049
{o1b cap c 490}58.95 -31.03 16.144
{c2b cap c 490}P 58.947 -30.178 17.049
{o2b cap c 490}59.486 -29.107 16.839
{o1 cap c 490}P 55.972 -30.314 17.294
{pa cap c 490}54.693 -31.194 16.952
{o5 cap c 490}P 61.183 -33.305 20.317
{pc cap c 490}61.144 -34.221 21.578
{pa cap c 490}P 54.693 -31.194 16.952
{o1a cap c 490}55.501 -32.358 16.319
{pa cap c 490}P 54.693 -31.194 16.952
{o2a cap c 490}53.96 -30.4 15.774
{pa cap c 490}P 54.693 -31.194 16.952
{o3a cap c 490}53.99 -31.434 18.193
{pc cap c 490}P 61.144 -34.221 21.578
{o1c cap c 490}61.562 -35.734 21.119
{pc cap c 490}P 61.144 -34.221 21.578
{o2c cap c 490}62.497 -34.017 22.412
{pc cap c 490}P 61.144 -34.221 21.578
{o3c cap c 490}59.987 -33.993 22.371
{c4 cap c 490}P 59.878 -31.491 20.044
{c5 cap c 490}60.49 -32.653 19.374
{c4 cap c 490}P 59.878 -31.491 20.044
{o4 cap c 490}60.047 -30.162 19.667
{c1 cap d 490}P 56.732 20.834 8.195
{c1 cap d 490}56.732 20.834 8.195
{c1 cap d 490}P 56.732 20.834 8.195
{c2 cap d 490}58.138 20.729 8.643
{c2 cap d 490}P 58.138 20.729 8.643
{c3 cap d 490}58.751 20.021 7.419
{c3 cap d 490}P 58.751 20.021 7.419
{c4 cap d 490}59.902 19.078 7.751
{c2 cap d 490}P 58.138 20.729 8.643
{c2b cap d 490}58.904 22.024 8.905
{c1 cap d 490}P 56.732 20.834 8.195
{o1 cap d 490}55.927 21.838 8.884
{c2 cap d 490}P 58.138 20.729 8.643
{o2 cap d 490}58.132 20.392 9.957
{c3 cap d 490}P 58.751 20.021 7.419
{o3 cap d 490}58.36 19.029 6.514
{c4 cap d 490}P 59.902 19.078 7.751
{o4 cap d 490}60.09 19.441 9.112
{c5 cap d 490}P 60.578 19.689 6.57
{o5 cap d 490}61.258 18.689 5.997
{c2b cap d 490}P 58.904 22.024 8.905
{o1b cap d 490}59.073 22.925 8.068
{c2b cap d 490}P 58.904 22.024 8.905
{o2b cap d 490}59.392 22.205 10.019
{o1 cap d 490}P 55.927 21.838 8.884
{pa cap d 490}54.726 22.264 7.898
{o5 cap d 490}P 61.258 18.689 5.997
{pc cap d 490}61.243 17.451 5.046
{pa cap d 490}P 54.726 22.264 7.898
{o1a cap d 490}55.365 23.032 6.755
{pa cap d 490}P 54.726 22.264 7.898
{o2a cap d 490}53.823 23.348 8.723
{pa cap d 490}P 54.726 22.264 7.898
{o3a cap d 490}54.082 20.891 7.688
{pc cap d 490}P 61.243 17.451 5.046
{o1c cap d 490}61.597 18.011 3.526
{pc cap d 490}P 61.243 17.451 5.046
{o2c cap d 490}62.656 16.804 5.301
{pc cap d 490}P 61.243 17.451 5.046
{o3c cap d 490}60.019 16.666 5.198
{c4 cap d 490}P 59.902 19.078 7.751
{c5 cap d 490}60.578 19.689 6.57
@vectorlist {Mg} color=magenta
{Mg a 491}P 93.767 11.169 6.297
{Mg a 491}93.767 11.169 6.297
{Mg a 491}P U 92.767 11.169 6.297
{Mg a 491}U 94.767 11.169 6.297
{Mg a 491}P U 93.767 10.169 6.297
{Mg a 491}U 93.767 12.169 6.297
{Mg a 491}P U 93.767 11.169 5.297
{Mg a 491}U 93.767 11.169 7.297
{Mg b 491}P 93.877 -32.958 28.005
{Mg b 491}93.877 -32.958 28.005
{Mg b 491}P U 92.877 -32.958 28.005
{Mg b 491}U 94.877 -32.958 28.005
{Mg b 491}P U 93.877 -33.958 28.005
{Mg b 491}U 93.877 -31.958 28.005
{Mg b 491}P U 93.877 -32.958 27.005
{Mg b 491}U 93.877 -32.958 29.005
{Mg c 491}P 59.955 -28.143 19.089
{Mg c 491}59.955 -28.143 19.089
{Mg c 491}P U 58.955 -28.143 19.089
{Mg c 491}U 60.955 -28.143 19.089
{Mg c 491}P U 59.955 -29.143 19.089
{Mg c 491}U 59.955 -27.143 19.089
{Mg c 491}P U 59.955 -28.143 18.089
{Mg c 491}U 59.955 -28.143 20.089
{Mg d 491}P 60.302 19.927 11.087
{Mg d 491}60.302 19.927 11.087
{Mg d 491}P U 59.302 19.927 11.087
{Mg d 491}U 61.302 19.927 11.087
{Mg d 491}P U 60.302 18.927 11.087
{Mg d 491}U 60.302 20.927 11.087
{Mg d 491}P U 60.302 19.927 10.087
{Mg d 491}U 60.302 19.927 12.087
@kinemage 2
@caption 
Animation comparing L1S1 for tobacco & spinach activated RuBisCO, with the large subunit in greentint and the small subunit in skyblue.  Note that mutated amino acids occur on the solvent exposed sides of the beta-peptide (red), the alpha-A helix (brown), and the alpha-B helix (green).  CABP (pink), activator CO2 (orange), and Mg2+ (magenta) can be turned on to show their central location in the barrel.  Stereoviewing is recommended while animating (click the 'animate' button).
@onewidth
@zoom 1.00
@zslab 160 
@center 92.500 29.079 15.860 
@matrix 
0.481378 0.777488 -0.404705 0.515378 -0.624540 -0.586801 -0.708986 0.073897 -0.701342
@2zoom 1.90 
@2zslab 110 
@2center 94.192 23.074 4.862 
@2matrix 
0.434041 0.758667 -0.485831 0.447845 -0.649627 -0.614345 -0.781693 0.049074 -0.621732 @3zoom 1.06 
@3zslab 110 
@3center 92.500 29.079 15.860 
@3matrix 
0.182730 0.826580 0.532329 0.625564 -0.515453 0.585643 0.758474 0.225991 -0.611268 
@group {Tobacco} animate
@subgroup {lrg sub} dominant
@vectorlist {lrg sub} color=greentint
{ca ala a 9}P 47.821 37.399 20.672
{ca ser a 10}46.07 40.622 19.58
{ca val a 11}44.942 41.063 15.936
{ca gly a 12}42.389 38.391 14.954
{ca phe a 13}43.547 34.966 13.82
{ca lys a 14}43.086 35.258 10.026
{ca ala a 15}43.74 31.881 8.342
{ca gly a 16}45.681 31.588 5.102
{ca val a 17}49.042 32.082 3.467
{ca lys a 18}50.828 35.525 3.503
{ca glu a 19}54.343 36.469 2.245
{ca tyr a 20}57.243 35.691 4.578
{ca lys a 21}58.16 39.29 3.916
{ca leu a 22}55.468 40.623 6.217
{ca thr a 23}57.135 39.286 9.401
{ca tyr a 24}60.655 38.179 8.676
{ca tyr a 25}61.892 41.19 6.68
{ca thr a 26}62.73 43.843 9.302
{ca pro a 27}65.412 46.233 8.029
{ca glu a 28}64.337 48.278 10.986
{ca tyr a 29}65.999 45.892 13.354
{ca gln a 30}68.809 46.715 15.669
{ca thr a 31}70.646 43.504 16.518
{ca lys a 32}71.085 42.657 20.183
{ca asp a 33}74.462 41.68 21.619
{ca thr a 34}73.03 38.225 22.387
{ca asp a 35}71.584 37.454 18.952
{ca ile a 36}73.207 34.747 16.764
{ca leu a 37}73.676 36.485 13.366
{ca ala a 38}74.17 34.676 10.049
{ca ala a 39}75.256 35.93 6.727
{ca phe a 40}73.613 33.651 4.073
{ca arg a 41}74.517 34.099 0.348
{ca val a 42}71.099 33.543 -1.294
{ca thr a 43}70.276 32.94 -4.998
{ca pro a 44}66.525 33.114 -5.541
{ca gln a 45}64.356 31.679 -8.083
{ca pro a 46}63.504 34.103 -10.875
{ca gly a 47}60.348 35.719 -9.524
{ca val a 48}61.448 35.825 -5.927
{ca pro a 49}62.231 39.213 -4.567
{ca pro a 50}65.347 38.928 -2.41
{ca glu a 51}63.491 40.31 0.571
{ca glu a 52}61.009 37.433 0.221
{ca ala a 53}63.804 34.795 -0.203
{ca gly a 54}65.599 36.313 2.78
{ca ala a 55}62.446 36.215 4.994
{ca ala a 56}61.66 32.606 3.955
{ca val a 57}65.192 31.806 5.03
{ca ala a 58}64.593 33.553 8.393
{ca ala a 59}61.051 32.196 9.09
{ca glu a 60}61.523 28.573 8.203
{ca ser a 61}64.63 28.829 10.375
{ca ser a 62}63.099 29.994 13.647
{ca thr a 63}59.404 30.244 14.244
{ca gly a 64}57.26 30.002 11.188
{ca thr a 65}55.626 27.842 8.575
{ca trp a 66}53.91 28.445 5.186
{ca thr a 67}50.339 29.437 6.317
{ca thr a 68}48.785 31.146 9.332
{ca val a 69}48.393 29.281 12.595
{ca trp a 70}46.512 30.716 15.509
{ca thr a 71}49.022 29.387 18.116
{ca asp a 72}51.408 32.28 17.403
{ca gly a 73}49.058 34.371 19.585
{ca leu a 74}49.77 32.103 22.505
{ca thr a 75}53.341 33.254 22.549
{ca ser a 76}54.863 36.497 21.087
{ca leu a 77}56.908 36.221 17.82
{ca asp a 78}58.519 39.556 18.405
{ca arg a 79}60.592 37.84 21.026
{ca tyr a 80}61.285 34.653 19.139
{ca lys a 81}61.08 35.245 15.336
{ca gly a 82}64.281 34.894 13.334
{ca arg a 83}64.678 38.111 11.311
{ca cys a 84}66.171 39.177 8.049
{ca tyr a 85}67.467 42.624 8.81
{ca arg a 86}69.277 43.216 5.546
{ca ile a 87}70.075 42.171 2.012
{ca glu a 88}73.075 43.208 -0.099
{ca arg a 89}73.818 42.572 -3.776
{ca val a 90}76.741 40.347 -4.527
{ca val a 91}78.654 42.773 -6.607
{ca gly a 92}79.132 41.275 -10.014
{ca glu a 93}77.002 38.256 -9.474
{ca lys a 94}74.149 36.484 -10.955
{ca asp a 95}71.124 37.437 -8.901
{ca gln a 96}72.995 36.481 -5.73
{ca tyr a 97}72.712 38.248 -2.412
{ca ile a 98}73.792 38.249 1.189
{ca ala a 99}70.692 37.973 3.361
{ca tyr a 100}71.66 38.745 6.977
{ca val a 101}69.535 37.063 9.64
{ca ala a 102}69.396 37.486 13.38
{ca tyr a 103}68.39 34.765 15.816
{ca pro a 104}67.515 35.569 19.431
{ca leu a 105}69.467 33.573 22.076
{ca asp a 106}66.302 32.035 23.616
{ca leu a 107}66.074 29.792 20.549
{ca phe a 108}69.167 27.6 21.045
{ca glu a 109}69.745 24.85 23.558
{ca glu a 110}72.86 25.557 25.552
{ca gly a 111}76.029 23.641 24.684
{ca ser a 112}74.564 22.064 21.611
{ca val a 113}76.074 22.734 18.163
{ca thr a 114}73.537 20.014 17.136
{ca asn a 115}70.631 22.255 18.022
{ca met a 116}72.25 25.427 16.519
{ca phe a 117}72.839 23.704 13.173
{ca thr a 118}69.363 22.039 13.3
{ca ser a 119}67.954 25.585 13.379
{ca ile a 120}70.138 27.631 11.038
{ca val a 121}70.539 24.934 8.395
{ca gly a 122}67.714 22.477 9.094
{ca asn a 123}65.323 23.03 6.24
{ca val a 124}65.906 26.293 4.335
{ca phe a 125}68.491 24.944 1.955
{ca gly a 126}65.799 22.929 0.111
{ca phe a 127}63.132 25.596 -0.354
{ca lys a 128}61.481 25.486 -3.788
{ca ala a 129}61.593 29.314 -3.888
{ca leu a 130}65.466 29.263 -3.739
{ca arg a 131}67.793 27.694 -6.22
{ca ala a 132}70.989 27.761 -4.208
{ca leu a 133}71.651 28.75 -0.503
{ca arg a 134}75.052 28.903 1.327
{ca leu a 135}75.942 29.908 4.953
{ca glu a 136}79.073 32.017 4.886
{ca asp a 137}79.479 33.033 8.508
{ca leu a 138}77.743 33.008 11.929
{ca arg a 139}78.405 35.437 14.756
{ca ile a 140}78.391 33.534 18.022
{ca pro a 141}77.597 35.836 20.972
{ca pro a 142}79.576 35.542 24.188
{ca ala a 143}76.405 34.598 26.011
{ca tyr a 144}76.244 31.474 23.857
{ca val a 145}79.984 30.98 23.685
{ca lys a 146}80.019 30.612 27.514
{ca thr a 147}77.727 27.726 27.316
{ca phe a 148}80.378 25.517 25.575
{ca gln a 149}83.303 23.545 26.996
{ca gly a 150}85.319 24.105 23.938
{ca pro a 151}88.503 22.219 23.51
{ca pro a 152}89.563 19.675 26.082
{ca his a 153}92.8 21.663 26.183
{ca gly a 154}93.831 24.227 23.502
{ca ile a 155}97.153 25.526 22.259
{ca gln a 156}98.727 26.541 25.51
{ca val a 157}98.107 23.459 27.718
{ca glu a 158}98.895 21.086 24.737
{ca arg a 159}102.389 22.714 24.313
{ca asp a 160}102.662 22.838 28.091
{ca lys a 161}101.898 19.103 28.394
{ca leu a 162}104.09 17.813 25.542
{ca asn a 163}106.772 20.385 26.523
{ca lys a 164}107.05 21.853 23.048
{ca tyr a 165}107.843 25.429 22.135
{ca gly a 166}109.008 27.611 19.238
{ca arg a 167}108.067 25.881 15.969
{ca pro a 168}105.373 23.971 14.216
{ca leu a 169}104.639 20.442 15.578
{ca leu a 170}105.475 17.732 13.008
{ca gly a 171}103.305 14.706 12.184
{ca cys a 172}102.691 11.922 9.613
{ca thr a 173}99.731 9.713 8.494
{ca ile a 174}100.929 6.097 8.156
{ca lys a 175}100.135 4.803 4.583
{ca pro a 176}98.79 2.729 2.914
{ca lys a 177}95.336 4.065 3.932
{ca leu a 178}93.768 0.69 4.707
{ca gly a 179}95.491 -2.728 4.696
{ca leu a 180}98.426 -2.768 7.087
{ca ser a 181}98.405 -5.181 10.073
{ca ala a 182}98.379 -4.05 13.7
{ca lys a 183}102.055 -4.977 13.943
{ca asn a 184}103.234 -3.318 10.803
{ca tyr a 185}101.319 -0.227 11.895
{ca gly a 186}103.461 -0.085 15.035
{ca arg a 187}106.757 -0.712 13.178
{ca ala a 188}105.952 2.09 10.747
{ca val a 189}105.063 4.31 13.756
{ca tyr a 190}108.231 3.726 15.776
{ca glu a 191}110.282 4.223 12.654
{ca cys a 192}108.585 7.538 11.767
{ca leu a 193}108.748 8.933 15.343
{ca arg a 194}112.466 7.96 16.128
{ca gly a 195}113.304 10.09 13.168
{ca gly a 196}112.043 13.276 14.713
{ca leu a 197}108.28 13.581 13.938
{ca asp a 198}106.27 14.56 17.081
{ca phe a 199}103.304 12.54 16.079
{ca thr a 200}102.127 9.829 13.746
{ca lys a 201}98.413 9.072 13.264
{ca asp a 202}95.71 6.72 12.07
{ca asp a 203}94.256 7.64 8.685
{ca glu a 204}90.762 8.964 9.341
{ca asn a 205}89.349 5.776 7.853
{ca val a 206}91.439 3.383 10.021
{ca asn a 207}88.856 2.38 12.694
{ca ser a 208}88.485 -1.371 13.327
{ca gln a 209}88.58 -3.739 10.333
{ca pro a 210}89.283 -7.28 9.397
{ca phe a 211}92.826 -6.466 8.334
{ca met a 212}93.528 -4.697 11.715
{ca arg a 213}91.456 -4.355 14.781
{ca trp a 214}91.303 -1.303 16.953
{ca arg a 215}92.566 -2.816 20.191
{ca asp a 216}95.532 -4.58 18.445
{ca arg a 217}96.481 -1.374 16.689
{ca phe a 218}96.34 0.557 19.921
{ca leu a 219}98.448 -1.957 21.826
{ca phe a 220}101.212 -2.016 19.273
{ca cys a 221}101.328 1.733 18.529
{ca ala a 222}101.736 2.236 22.326
{ca glu a 223}104.657 -0.154 22.358
{ca ala a 224}106.22 1.767 19.447
{ca leu a 225}105.634 5.301 20.667
{ca tyr a 226}107.009 4.342 23.947
{ca lys a 227}110.132 2.975 22.165
{ca ala a 228}110.697 6.137 20.074
{ca glu a 229}110.084 8.467 22.952
{ca ala a 230}112.751 6.756 25.057
{ca glu a 231}115.161 6.628 22.19
{ca thr a 232}114.893 10.289 21.248
{ca gly a 233}114.361 11.886 24.655
{ca glu a 234}111.363 13.864 23.249
{ca ile a 235}107.684 13.336 24.167
{ca lys a 236}106.041 11.46 21.27
{ca gly a 237}102.355 10.759 20.525
{ca his a 238}100.373 8.681 18.018
{ca tyr a 239}96.805 9.867 17.208
{ca leu a 240}94.624 6.814 17.985
{ca asn a 241}91.391 6.905 16.064
{ca ala a 242}88.393 6.593 18.409
{ca thr a 243}85.827 7.13 15.499
{ca ala a 244}83.371 4.245 15.835
{ca gly a 245}79.907 3.249 14.905
{ca thr a 246}78.112 3.902 18.303
{ca cys a 247}78.981 6.281 21.154
{ca glu a 248}79.432 3.261 23.335
{ca glu a 249}82.018 1.941 20.917
{ca met a 250}83.668 5.308 20.683
{ca ile a 251}83.981 5.791 24.427
{ca lys a 252}85.285 2.292 24.748
{ca arg a 253}88.309 2.894 22.551
{ca ala a 254}88.922 6.283 24.251
{ca val a 255}88.932 4.41 27.511
{ca phe a 256}91.746 2.005 26.432
{ca ala a 257}93.963 4.868 25.147
{ca arg a 258}93.505 6.135 28.736
{ca glu a 259}94.453 2.767 30.143
{ca leu a 260}97.727 2.758 28.061
{ca gly a 261}98.582 6.282 29.181
{ca val a 262}99.227 7.551 25.704
{ca pro a 263}98.6 11.306 25.241
{ca ile a 264}96.294 11.897 22.249
{ca val a 265}93.228 10.43 20.487
{ca met a 266}91.506 11.528 17.294
{ca his a 267}87.962 11.675 15.907
{ca asp a 268}86.427 12.394 12.484
{ca tyr a 269}83.922 14.941 13.758
{ca leu a 270}81.773 15.16 10.631
{ca thr a 271}81.238 11.464 9.837
{ca gly a 272}81.058 10.793 13.597
{ca gly a 273}78.697 13.708 14.316
{ca phe a 274}78.535 16.742 16.661
{ca thr a 275}76.546 14.703 19.194
{ca ala a 276}79.269 12.039 19.432
{ca asn a 277}82.108 14.601 19.168
{ca thr a 278}80.933 16.602 22.029
{ca ser a 279}80.688 13.46 24.187
{ca leu a 280}84.318 12.626 23.259
{ca ala a 281}85.598 16.131 24.024
{ca his a 282}83.979 15.849 27.428
{ca tyr a 283}85.584 12.472 28.09
{ca cys a 284}88.876 13.727 26.812
{ca arg a 285}88.621 16.775 29.083
{ca asp a 286}87.97 14.725 32.14
{ca asn a 287}90.665 12.155 31.388
{ca gly a 288}93.247 14.485 29.983
{ca leu a 289}93.717 13.176 26.478
{ca leu a 290}94.327 15.781 23.687
{ca leu a 291}91.817 15.368 20.797
{ca his a 292}92.756 15.648 17.091
{ca ile a 293}89.844 16.425 14.781
{ca his a 294}89.812 15.098 11.179
{ca arg a 295}87.272 16.93 9.066
{ca ala a 296}86.449 14.094 6.65
{ca met a 297}83.297 14.779 4.657
{ca his a 298}83.659 18.542 4.973
{ca ala a 299}84.366 19.158 1.299
{ca val a 300}80.954 17.628 0.489
{ca ile a 301}79.53 20.708 2.237
{ca asp a 302}82.067 23.398 1.777
{ca arg a 303}83.292 23.305 -1.816
{ca gln a 304}80.817 25.211 -4.084
{ca lys a 305}80.73 28.968 -3.693
{ca asn a 306}76.977 29.101 -4.227
{ca his a 307}75.544 26.295 -2.031
{ca gly a 308}76.473 24.832 1.293
{ca ile a 309}78.2 25.71 4.489
{ca his a 310}81.554 27.508 4.436
{ca phe a 311}84.394 25.824 6.388
{ca arg a 312}84.911 28.912 8.535
{ca val a 313}81.575 27.973 9.972
{ca leu a 314}82.43 24.258 10.276
{ca ala a 315}85.643 25.527 11.898
{ca lys a 316}83.712 27.628 14.439
{ca ala a 317}81.327 24.76 15.139
{ca leu a 318}84.241 22.57 16.21
{ca arg a 319}85.971 25.181 18.484
{ca met a 320}82.63 25.078 20.237
{ca ser a 321}82.074 21.327 20.207
{ca gly a 322}85.593 20.529 21.28
{ca gly a 323}88.881 19.7 19.619
{ca asp a 324}92.504 20.49 20.386
{ca his a 325}93.571 20.108 16.724
{ca ile a 326}91.515 20.7 13.524
{ca his a 327}92.803 20.343 9.936
{ca ser a 328}92.888 23.779 8.396
{ca gly a 329}94.192 23.074 4.862
{ca thr a 330}97.589 23.686 3.209
{ca val a 331}96.948 26.15 0.401
{ca val a 332}99.954 24.722 -1.423
{ca gly a 333}99.159 21.009 -1.698
{ca lys a 334}96.908 18.185 -2.903
{ca leu a 335}93.544 19.613 -1.808
{ca glu a 336}91.706 22.901 -2.48
{ca gly a 337}92.22 25.984 -0.293
{ca glu a 338}93.061 29.668 -0.779
{ca arg a 339}95.477 31.587 1.276
{ca asp a 340}93.411 34.575 2.425
{ca ile a 341}90.346 32.691 3.364
{ca thr a 342}92.539 30.27 5.108
{ca leu a 343}94.344 32.928 7.05
{ca gly a 344}90.933 34.081 7.886
{ca phe a 345}89.507 31.012 9.548
{ca val a 346}92.911 30.067 11.039
{ca asp a 347}92.458 33.249 13.125
{ca leu a 348}88.873 32.227 13.875
{ca leu a 349}90.437 28.915 15.173
{ca arg a 350}93.267 30.28 17.333
{ca asp a 351}92.628 33.987 18.458
{ca asp a 352}90.507 35.391 21.234
{ca phe a 353}88.898 38.207 19.222
{ca val a 354}88.767 38.484 15.534
{ca glu a 355}87.772 41.706 13.957
{ca gln a 356}85.501 41.5 10.914
{ca asp a 357}87.447 41.616 7.575
{ca arg a 358}85.494 40.937 4.437
{ca ser a 359}88.759 40.957 2.667
{ca arg a 360}89.36 37.609 4.295
{ca gly a 361}85.828 36.303 4.326
{ca ile a 362}85.121 37.232 7.933
{ca tyr a 363}81.666 38.736 7.905
{ca phe a 364}81.343 39.479 11.696
{ca thr a 365}83.637 40.304 14.628
{ca gln a 366}83.983 37.145 16.691
{ca asp a 367}84.688 37.419 20.423
{ca trp a 368}85.63 34.072 21.952
{ca val a 369}85.586 35.173 25.56
{ca ser a 370}88.582 33.052 26.359
{ca leu a 371}87.425 29.742 24.761
{ca pro a 372}90.825 28.005 24.18
{ca gly a 373}92.089 28.091 20.682
{ca val a 374}92.685 25.112 18.439
{ca leu a 375}95.946 24.226 16.675
{ca pro a 376}95.438 24.151 12.901
{ca val a 377}96.891 21.162 11.053
{ca ala a 378}98.351 21.435 7.59
{ca ser a 379}98.181 18.117 5.735
{ca gly a 380}97.963 16.439 2.355
{ca gly a 381}100.392 16.309 -0.489
{ca ile a 382}103.086 18.539 1.064
{ca his a 383}106.807 17.894 1.036
{ca val a 384}110.204 19.164 1.995
{ca trp a 385}110.04 21.868 -0.668
{ca his a 386}106.892 23.386 0.892
{ca met a 387}108.391 23.848 4.319
{ca pro a 388}109.183 27.548 4.185
{ca ala a 389}105.799 28.392 2.735
{ca leu a 390}103.799 26.511 5.387
{ca thr a 391}106.03 27.879 8.097
{ca glu a 392}105.35 31.323 6.584
{ca ile a 393}101.564 31.06 6.183
{ca phe a 394}100.981 29.25 9.521
{ca gly a 395}103.731 30.195 12.057
{ca asp a 396}104.71 28.204 15.12
{ca asp a 397}101.174 27.325 16.301
{ca ser a 398}100.402 24.681 13.699
{ca val a 399}100.99 20.922 13.141
{ca leu a 400}102.473 20.133 9.7
{ca gln a 401}101.851 16.551 8.541
{ca phe a 402}103.871 14.311 6.191
{ca gly a 403}102.105 11.167 5.054
{ca gly a 404}103.427 10.362 1.656
{ca gly a 405}106.145 12.874 2.46
{ca thr a 406}107.52 10.646 5.163
{ca leu a 407}106.808 7.064 4.029
{ca gly a 408}107.777 7.947 0.477
{ca his a 409}111.402 8.852 1.258
{ca pro a 410}113.956 6.693 -0.563
{ca trp a 411}115.584 5.525 2.703
{ca gly a 412}112.341 4.716 4.581
{ca asn a 413}110.598 6.367 7.602
{ca ala a 414}113.418 7.229 10.034
{ca pro a 415}115.418 9.211 7.435
{ca gly a 416}112.214 10.693 5.965
{ca ala a 417}111.332 11.893 9.446
{ca val a 418}114.82 13.386 9.919
{ca ala a 419}114.434 15.03 6.5
{ca asn a 420}111.309 16.971 7.528
{ca arg a 421}112.599 17.811 11.053
{ca val a 422}115.756 19.348 9.517
{ca ala a 423}113.854 21.137 6.753
{ca leu a 424}111.617 22.703 9.308
{ca glu a 425}114.278 23.562 11.903
{ca ala a 426}116.097 24.987 8.894
{ca cys a 427}113.251 27.319 8.037
{ca val a 428}112.669 28.258 11.657
{ca lys a 429}116.241 29.57 12.166
{ca ala a 430}116.269 31.264 8.78
{ca arg a 431}113.196 33.015 9.958
{ca asn a 432}114.699 33.88 13.349
{ca glu a 433}117.91 35.215 11.77
{ca gly a 434}115.62 37.56 9.829
{ca arg a 435}115.709 35.777 6.406
{ca asp a 436}112.454 36.029 4.44
{ca leu a 437}110.685 32.71 4.142
{ca ala a 438}108.616 34.06 1.258
{ca gln a 439}111.421 35.514 -0.934
{ca glu a 440}114.358 33.527 0.356
{ca gly a 441}112.363 30.328 0.795
{ca asn a 442}113.95 28.078 -1.752
{ca glu a 443}117.617 28.654 -0.992
{ca ile a 444}117.061 27.961 2.632
{ca ile a 445}115.908 24.43 2.209
{ca arg a 446}118.249 24.197 -0.794
{ca glu a 447}121.139 25.152 1.397
{ca ala a 448}120.133 22.576 4.011
{ca cys a 449}119.682 19.882 1.475
{ca lys a 450}123.443 20.453 1.009
{ca trp a 451}124.344 19.621 4.597
{ca ser a 452}121.899 16.826 5.372
{ca pro a 453}122.076 13.375 3.775
{ca glu a 454}118.544 12.461 4.616
{ca leu a 455}117.288 15.894 3.691
{ca ala a 456}119.156 15.665 0.432
{ca ala a 457}117.609 12.437 -0.589
{ca ala a 458}114.232 14.011 -0.089
{ca cys a 459}114.948 17.202 -2.052
{ca glu a 460}116.026 15.262 -5.09
{ca val a 461}112.837 13.151 -5.113
{ca trp a 462}110.178 15.783 -4.738
{ca lys a 463}112.029 18.618 -6.441
{ca glu a 464}109.703 19.039 -9.409
{ca ile a 465}106.3 18.588 -7.63
{ca val a 466}103.665 21.292 -7.086
{ca phe a 467}99.861 21.144 -7.182
{ca asn a 468}99.016 24.271 -9.123
{ca phe a 469}95.556 24.096 -10.576
{ca ala a 470}93.092 27.002 -10.726
{ca ala a 471}90.858 26.983 -7.625
{ca val a 472}87.141 26.713 -6.857
@subgroup {sm sub} dominant
@vectorlist {sm sub} color=skyblue 
{ca met s 1}P 121.064 4.721 1.961
{ca met s 1}121.064 4.721 1.961
{ca gln s 2}121.947 5.002 5.639
{ca val s 3}120.548 3.731 8.891
{ca trp s 4}119.709 6.627 11.175
{ca pro s 5}121.457 5.431 14.292
{ca pro s 6}119.474 4.117 17.167
{ca ile s 7}121.978 5.06 19.815
{ca asn s 8}123.59 8.331 20.817
{ca lys s 9}121.251 10.946 19.457
{ca lys s 10}119.162 12.189 22.298
{ca lys s 11}117.458 15.427 21.201
{ca tyr s 12}116.423 18.595 22.923
{ca glu s 13}113.445 19.827 21.034
{ca thr s 14}113.769 22.945 18.847
{ca leu s 15}116.941 23.441 16.887
{ca ser s 16}118.522 20.189 18.118
{ca tyr s 17}118.411 18.743 14.575
{ca leu s 18}120.705 21.421 13.072
{ca pro s 19}124.428 21.485 13.855
{ca asp s 20}125.748 22.771 17.174
{ca leu s 21}124.758 26.463 17.313
{ca ser s 22}127.699 28.813 17.282
{ca gln s 23}127.681 31.698 19.705
{ca glu s 24}126.802 33.975 16.877
{ca gln s 25}123.943 31.705 15.899
{ca leu s 26}122.899 31.344 19.503
{ca leu s 27}122.984 35.087 19.772
{ca ser s 28}120.632 35.54 16.843
{ca glu s 29}118.051 33.493 18.99
{ca val s 30}118.197 35.6 22.17
{ca glu s 31}118.138 38.394 19.646
{ca tyr s 32}114.781 37.249 18.14
{ca leu s 33}113.256 36.493 21.447
{ca leu s 34}113.917 40.094 22.374
{ca lys s 35}112.834 41.595 19.063
{ca asn s 36}109.498 40.01 20.051
{ca gly s 37}108.923 41.044 23.64
{ca trp s 38}109.471 37.667 25.234
{ca val s 39}110.985 37.788 28.695
{ca pro s 40}114.038 35.61 28.56
{ca cys s 41}114.448 33.111 31.369
{ca leu s 42}117.047 30.348 32.12
{ca glu s 43}116.535 26.807 33.628
{ca phe s 44}119.188 24.155 34.227
{ca glu s 45}118.988 20.48 35.215
{ca thr s 46}121.779 18.347 36.6
{ca glu s 47}120.049 15.005 36.904
{ca his s 48}117.152 14.043 34.652
{ca gly s 49}118.164 15.189 31.393
{ca phe s 50}115.005 13.588 29.857
{ca val s 51}111.344 12.974 30.728
{ca tyr s 52}110.471 9.907 32.686
{ca arg s 53}107.309 8.484 34.177
{ca glu s 54}108.051 7.386 37.749
{ca asn s 55}105.325 8.893 39.85
{ca asn s 56}102.398 8.294 37.474
{ca lys s 57}101.388 7.28 33.967
{ca ser s 58}97.964 8.869 33.482
{ca pro s 59}97.514 10.544 30.147
{ca gly s 60}99.685 13.594 30.013
{ca tyr s 61}101.709 12.975 33.116
{ca tyr s 62}105.472 12.694 32.564
{ca asp s 63}108.016 13.348 35.309
{ca gly s 64}111.033 15.411 34.179
{ca arg s 65}109.44 18.392 32.462
{ca tyr s 66}110.158 21.016 35.039
{ca trp s 67}113.775 22.133 35.317
{ca thr s 68}115.383 24.532 37.902
{ca met s 69}114.972 28.259 37.264
{ca trp s 70}118.292 30.046 36.971
{ca lys s 71}117.8 33.134 39.145
{ca leu s 72}114.596 34.914 37.818
{ca pro s 73}112.981 35.625 34.419
{ca met s 74}114.938 38.706 33.403
{ca phe s 75}112.028 41.038 32.946
{ca gly s 76}112.849 44.46 31.446
{ca cys s 77}116.336 43.353 30.14
{ca thr s 78}117.168 44.333 26.544
{ca asp s 79}120.75 43.358 26.335
{ca ala s 80}120.74 40.107 24.391
{ca thr s 81}124.414 39.916 25.524
{ca gln s 82}123.496 40.175 29.263
{ca val s 83}121.415 36.876 28.947
{ca leu s 84}124.178 35.159 27.036
{ca ala s 85}126.443 36.256 29.902
{ca glu s 86}124.231 34.353 32.285
{ca val s 87}124.493 31.156 30.339
{ca gly s 88}128.297 31.522 30.781
{ca glu s 89}127.779 32.291 34.394
{ca ala s 90}125.788 29.032 34.911
{ca lys s 91}128.069 26.534 33.172
{ca lys s 92}130.523 27.987 35.691
{ca ala s 93}128.933 26.455 38.787
{ca tyr s 94}126.88 23.82 36.93
{ca pro s 95}129.39 22.39 34.47
{ca gln s 96}127.368 19.22 34.442
{ca ala s 97}123.976 20.863 33.987
{ca trp s 98}122.004 21.071 30.849
{ca ile s 99}121.069 24.729 30.434
{ca arg s 100}118.249 26.022 28.328
{ca ile s 101}116.931 29.46 27.461
{ca ile s 102}113.155 30.028 27.18
{ca gly s 103}111.025 32.982 26.152
{ca phe s 104}107.784 34.001 27.898
{ca asp s 105}104.891 35.777 26.082
{ca asn s 106}103.028 37.001 29.276
{ca val s 107}99.895 37.927 27.349
{ca arg s 108}99.342 34.509 26.019
{ca gln s 109}101.166 32.851 28.8
{ca val s 110}102.996 30.378 26.496
{ca gln s 111}106.782 29.817 26.275
{ca cys s 112}107.258 31.216 22.767
{ca ile s 113}110.75 29.829 22.503
{ca ser s 114}113.105 27.392 24.072
{ca phe s 115}116.459 26.024 22.835
{ca ile s 116}119.277 24.315 24.64
{ca ala s 117}122.072 26.774 25.375
{ca tyr s 118}124.471 24.181 26.799
{ca lys s 119}124.605 20.379 27.113
{ca pro s 120}127.051 18.963 29.631
{ca glu s 121}129.895 16.772 28.468
{ca gly s 122}129.043 13.979 26.07
{ca tyr s 123}125.652 14.97 24.796
@subgroup {het groups} off
@vectorlist {Mg} color=magenta
{Mg a 491}P 93.767 11.169 6.297
{Mg a 491}93.767 11.169 6.297
{Mg a 491}P U 92.767 11.169 6.297
{Mg a 491}U 94.767 11.169 6.297
{Mg a 491}P U 93.767 10.169 6.297
{Mg a 491}U 93.767 12.169 6.297
{Mg a 491}P U 93.767 11.169 5.297
{Mg a 491}U 93.767 11.169 7.297
@vectorlist {CO2} color=orange
{cz cbx a 201}P 94.795 11.806 8.892
{cz cbx a 201}94.795 11.806 8.892
{cz cbx a 201}P 94.795 11.806 8.892
{oz1 cbx a 201}94.798 12.752 7.998
{cz cbx a 201}P 94.795 11.806 8.892
{oz2 cbx a 201}94.569 10.782 8.393
@vectorlist {CABP} color=pink 
{c1 cap a 490}P 97.252 13.085 4.185
{c1 cap a 490}97.252 13.085 4.185
{c1 cap a 490}P 97.252 13.085 4.185
{c2 cap a 490}95.886 12.741 4.62
{c2 cap a 490}P 95.886 12.741 4.62
{c3 cap a 490}95.323 14.22 4.577
{c3 cap a 490}P 95.323 14.22 4.577
{c4 cap a 490}94.154 14.512 5.429
{c2 cap a 490}P 95.886 12.741 4.62
{c2b cap a 490}95.12 11.739 3.73
{c1 cap a 490}P 97.252 13.085 4.185
{o1 cap a 490}98.009 12.061 3.747
{c2 cap a 490}P 95.886 12.741 4.62
{o2 cap a 490}95.885 11.769 5.534
{c3 cap a 490}P 95.323 14.22 4.577
{o3 cap a 490}95.839 15.464 4.921
{c4 cap a 490}P 94.154 14.512 5.429
{o4 cap a 490}93.803 13.25 5.933
{c5 cap a 490}P 93.511 15.125 4.27
{o5 cap a 490}92.668 16.089 4.663
{c2b cap a 490}P 95.12 11.739 3.73
{o1b cap a 490}95.191 11.891 2.491
{c2b cap a 490}P 95.12 11.739 3.73
{o2b cap a 490}94.455 10.871 4.26
{o1 cap a 490}P 98.009 12.061 3.747
{pa cap a 490}99.208 12.589 2.939
{o5 cap a 490}P 92.668 16.089 4.663
{pc cap a 490}92.663 17.582 5.082
{pa cap a 490}P 99.208 12.589 2.939
{o1a cap a 490}98.611 12.977 1.683
{pa cap a 490}P 99.208 12.589 2.939
{o2a cap a 490}100.095 11.27 2.562
{pa cap a 490}P 99.208 12.589 2.939
{o3a cap a 490}100.03 13.37 3.837
{pc cap a 490}P 92.663 17.582 5.082
{o1c cap a 490}92.532 18.589 3.765
{pc cap a 490}P 92.663 17.582 5.082
{o2c cap a 490}91.386 17.641 5.808
{pc cap a 490}P 92.663 17.582 5.082
{o3c cap a 490}93.936 18.034 5.645
{c4 cap a 490}P 94.154 14.512 5.429
{c5 cap a 490}93.511 15.125 4.27
@subgroup {mutations} nobutton
@vectorlist {beta-peptide} nobutton color=red master= {mutations}
{ca val a 466}P 103.665 21.292 -7.086
{ca phe a 467}99.861 21.144 -7.182
{ca asn a 468}99.016 24.271 -9.123
{ca phe a 469}95.556 24.096 -10.576
{ca ala a 470}93.092 27.002 -10.726
{ca ala a 471}90.858 26.983 -7.625
{ca val a 472}87.141 26.713 -6.857
@vectorlist {alpha-A} nobutton color=brown master= {mutations}
{ca gln s 23}P 127.681 31.698 19.705
{ca glu s 24}126.802 33.975 16.877
{ca gln s 25}123.943 31.705 15.899
{ca leu s 26}122.899 31.344 19.503
{ca leu s 27}122.984 35.087 19.772
{ca ser s 28}120.632 35.54 16.843
{ca glu s 29}118.051 33.493 18.99
{ca val s 30}118.197 35.6 22.17
{ca glu s 31}118.138 38.394 19.646
{ca tyr s 32}114.781 37.249 18.14
{ca leu s 33}113.256 36.493 21.447
{ca leu s 34}113.917 40.094 22.374
{ca lys s 35}112.834 41.595 19.063
@vectorlist {alpha-B} nobutton color=green master= {mutations}
{ca ala s 80}P 120.74 40.107 24.391
{ca thr s 81}124.414 39.916 25.524
{ca gln s 82}123.496 40.175 29.263
{ca val s 83}121.415 36.876 28.947
{ca leu s 84}124.178 35.159 27.036
{ca ala s 85}126.443 36.256 29.902
{ca glu s 86}124.231 34.353 32.285
{ca val s 87}124.493 31.156 30.339
{ca gly s 88}128.297 31.522 30.781
{ca glu s 89}127.779 32.291 34.394
{ca ala s 90}125.788 29.032 34.911
{ca lys s 91}128.069 26.534 33.172
{ca lys s 92}130.523 27.987 35.691
{ca ala s 93}128.933 26.455 38.787
@group {Spinach} animate
@subgroup {lrg sub} dominant
@vectorlist {lrg sub} color=greentint 
{ca ala l 9}P 47.909 44.457 22.54
{ca ala l 9}47.909 44.457 22.54
{ca ser l 10}46.969 42.05 19.659
{ca val l 11}44.868 41.187 16.577
{ca glu l 12}42.565 38.395 15.225
{ca phe l 13}43.39 35.072 13.623
{ca lys l 14}42.58 35.248 9.868
{ca ala l 15}43.35 31.864 8.338
{ca gly l 16}45.349 31.91 5.007
{ca val l 17}48.863 32.32 3.598
{ca lys l 18}50.397 35.757 3.979
{ca asp l 19}53.978 36.642 2.554
{ca tyr l 20}56.901 35.842 4.796
{ca lys l 21}58.267 39.359 4.358
{ca leu l 22}55.319 40.906 6.188
{ca thr l 23}56.706 39.46 9.512
{ca tyr l 24}60.261 38.375 8.799
{ca tyr l 25}61.758 41.129 6.655
{ca thr l 26}62.871 43.658 9.202
{ca pro l 27}65.39 46.193 7.693
{ca glu l 28}64.952 48.703 10.528
{ca tyr l 29}66.222 46.17 13.153
{ca glu l 30}69.163 46.58 15.349
{ca thr l 31}71.003 43.555 16.439
{ca leu l 32}71.266 42.603 20.096
{ca asp l 33}74.634 41.452 21.387
{ca thr l 34}72.82 38.342 22.463
{ca asp l 35}71.769 37.349 18.908
{ca ile l 36}73.205 34.662 16.654
{ca leu l 37}73.692 36.453 13.299
{ca ala l 38}73.843 34.497 10.032
{ca ala l 39}75.293 35.724 6.652
{ca phe l 40}73.527 33.59 3.915
{ca arg l 41}74.458 33.782 0.22
{ca val l 42}70.981 33.393 -1.356
{ca ser l 43}70.096 32.677 -4.897
{ca pro l 44}66.338 33.157 -5.479
{ca gln l 45}64.299 31.407 -8.153
{ca pro l 46}63.247 33.846 -11.025
{ca gly l 47}60.094 35.722 -9.789
{ca val l 48}60.975 35.654 -6.074
{ca pro l 49}62.043 39.046 -4.589
{ca pro l 50}65.278 39.134 -2.445
{ca glu l 51}63.151 40.411 0.461
{ca glu l 52}60.774 37.495 0.195
{ca ala l 53}63.577 34.977 -0.272
{ca gly l 54}65.56 36.361 2.681
{ca ala l 55}62.397 36.394 4.825
{ca ala l 56}61.596 32.82 3.857
{ca val l 57}64.937 31.612 5.252
{ca ala l 58}64.493 33.66 8.451
{ca ala l 59}60.937 32.303 8.991
{ca glu l 60}61.524 28.718 8.372
{ca ser l 61}64.698 28.545 10.552
{ca ser l 62}63.009 29.965 13.588
{ca thr l 63}59.236 30.195 14.036
{ca gly l 64}57.255 30.281 10.797
{ca thr l 65}55.64 27.737 8.416
{ca trp l 66}53.814 28.18 5.006
{ca thr l 67}50.34 29.376 6.329
{ca thr l 68}49.027 31.315 9.333
{ca val l 69}48.553 29.221 12.425
{ca trp l 70}46.398 30.508 15.295
{ca thr l 71}48.913 29.394 18.016
{ca asp l 72}51.205 32.319 17.328
{ca gly l 73}48.914 34.55 19.43
{ca leu l 74}49.628 32.293 22.463
{ca thr l 75}53.273 33.647 22.487
{ca asn l 76}54.988 36.955 21.847
{ca leu l 77}56.39 36.17 18.438
{ca asp l 78}58.228 39.455 18.066
{ca arg l 79}60.584 38.197 20.675
{ca tyr l 80}61.132 34.876 19.127
{ca lys l 81}61.21 35.427 15.401
{ca gly l 82}64.281 35.185 13.244
{ca arg l 83}64.694 38.372 11.264
{ca cys l 84}66.107 39.245 7.869
{ca tyr l 85}67.397 42.68 8.739
{ca his l 86}69.839 43.322 5.779
{ca ile l 87}70.218 42.3 2.084
{ca glu l 88}73.327 43.166 -0.087
{ca pro l 89}73.64 42.358 -3.927
{ca val l 90}76.665 40.105 -4.664
{ca ala l 91}78.961 41.8 -7.204
{ca gly l 92}79.489 39.952 -10.385
{ca glu l 93}76.727 37.366 -9.728
{ca glu l 94}73.314 37.58 -11.451
{ca asn l 95}70.524 37.192 -8.909
{ca gln l 96}72.556 36.423 -5.841
{ca tyr l 97}72.343 38.361 -2.499
{ca ile l 98}73.93 38.306 1.049
{ca cys l 99}70.965 38.198 3.455
{ca tyr l 100}71.759 38.786 7.151
{ca val l 101}69.461 36.988 9.613
{ca ala l 102}69.304 37.58 13.414
{ca tyr l 103}68.178 34.703 15.688
{ca pro l 104}67.398 35.445 19.362
{ca leu l 105}69.406 33.656 22.144
{ca asp l 106}66.249 31.952 23.498
{ca leu l 107}65.993 29.892 20.376
{ca phe l 108}69.072 27.79 21.182
{ca glu l 109}69.742 24.881 23.541
{ca glu l 110}72.769 25.734 25.628
{ca gly l 111}75.805 23.734 24.697
{ca ser l 112}74.415 22.009 21.574
{ca val l 113}75.972 22.645 18.191
{ca thr l 114}73.494 19.992 16.909
{ca asn l 115}70.584 22.271 17.941
{ca met l 116}72.177 25.489 16.539
{ca phe l 117}72.569 23.77 13.118
{ca thr l 118}69.12 22.128 13.279
{ca ser l 119}67.564 25.645 13.393
{ca ile l 120}69.847 27.656 11.031
{ca val l 121}70.563 24.961 8.412
{ca gly l 122}67.735 22.357 9.042
{ca asn l 123}65.093 22.777 6.259
{ca val l 124}65.708 26.082 4.413
{ca phe l 125}68.226 24.94 1.719
{ca gly l 126}65.575 22.655 0.104
{ca phe l 127}63.01 25.358 -0.442
{ca lys l 128}61.523 25.265 -3.939
{ca ala l 129}61.686 29.091 -4.059
{ca leu l 130}65.548 29.129 -3.971
{ca arg l 131}67.928 27.877 -6.65
{ca ala l 132}70.831 27.677 -4.151
{ca leu l 133}71.71 28.727 -0.558
{ca arg l 134}75.007 28.824 1.336
{ca leu l 135}75.706 29.785 4.959
{ca glu l 136}78.781 31.973 4.883
{ca asp l 137}79.305 32.951 8.514
{ca leu l 138}77.726 32.999 11.978
{ca arg l 139}78.256 35.628 14.769
{ca ile l 140}78.048 33.555 17.941
{ca pro l 141}77.316 35.857 20.903
{ca val l 142}79.543 35.643 23.935
{ca ala l 143}76.625 34.538 26.185
{ca tyr l 144}76.132 31.535 23.924
{ca val l 145}79.911 30.719 23.65
{ca lys l 146}80.02 30.445 27.552
{ca thr l 147}77.508 27.594 27.316
{ca phe l 148}80.133 25.361 25.604
{ca gln l 149}83.257 23.716 27.048
{ca gly l 150}85.371 24.434 23.903
{ca pro l 151}88.743 22.637 23.349
{ca pro l 152}89.522 20.075 26.139
{ca his l 153}93.014 21.738 26.404
{ca gly l 154}93.851 24.265 23.569
{ca ile l 155}97.193 25.505 22.315
{ca gln l 156}98.894 26.673 25.583
{ca val l 157}98.057 23.595 27.697
{ca glu l 158}98.97 21.313 24.848
{ca arg l 159}102.492 22.826 24.416
{ca asp l 160}102.877 22.66 28.178
{ca lys l 161}101.878 18.979 28.539
{ca leu l 162}104.139 17.94 25.663
{ca asn l 163}106.889 20.424 26.51
{ca lys l 164}107.183 21.615 22.932
{ca tyr l 165}107.794 25.356 22.248
{ca gly l 166}109.127 27.465 19.411
{ca arg l 167}108.314 25.664 16.041
{ca pro l 168}105.395 24.073 14.209
{ca leu l 169}104.641 20.505 15.457
{ca leu l 170}105.39 17.667 12.957
{ca gly l 171}103.085 14.799 12.132
{ca cys l 172}102.584 11.986 9.589
{ca thr l 173}99.669 9.779 8.425
{ca ile l 174}100.665 6.077 8.09
{ca lys l 175}100.265 4.566 4.552
{ca pro l 176}98.778 2.603 2.633
{ca lys l 177}95.448 4.085 4.046
{ca leu l 178}93.969 0.672 4.696
{ca gly l 179}95.432 -2.842 4.331
{ca leu l 180}98.336 -2.869 6.884
{ca ser l 181}98.335 -5.127 9.91
{ca ala l 182}98.672 -3.969 13.528
{ca lys l 183}102.388 -5.047 13.938
{ca asn l 184}103.269 -3.402 10.693
{ca tyr l 185}101.288 -0.326 11.658
{ca gly l 186}103.346 -0.115 14.876
{ca arg l 187}106.679 -0.772 12.967
{ca ala l 188}105.942 2.112 10.62
{ca val l 189}105.113 4.497 13.514
{ca tyr l 190}108.242 3.678 15.568
{ca glu l 191}110.406 4.333 12.475
{ca cys l 192}108.697 7.671 11.747
{ca leu l 193}108.754 8.856 15.352
{ca arg l 194}112.445 7.961 15.998
{ca gly l 195}113.613 10.211 13.093
{ca gly l 196}112.217 13.516 14.494
{ca leu l 197}108.436 13.611 14.034
{ca asp l 198}106.351 14.567 17.098
{ca phe l 199}103.386 12.529 16.02
{ca thr l 200}102.075 9.959 13.653
{ca lys l 201}98.402 9.07 13.052
{ca asp l 202}95.742 6.609 12.069
{ca asp l 203}94.221 7.449 8.774
{ca glu l 204}90.759 8.859 9.188
{ca asn l 205}89.174 5.647 7.905
{ca val l 206}91.324 3.331 10.053
{ca asn l 207}88.861 2.31 12.669
{ca ser l 208}88.476 -1.503 13.298
{ca gln l 209}88.196 -3.853 10.32
{ca pro l 210}89.219 -7.376 9.066
{ca phe l 211}92.93 -6.577 8.384
{ca met l 212}93.527 -4.709 11.633
{ca arg l 213}91.173 -4.439 14.597
{ca trp l 214}91.523 -1.408 16.851
{ca arg l 215}92.753 -2.846 20.176
{ca asp l 216}95.63 -4.689 18.487
{ca arg l 217}96.622 -1.448 16.755
{ca phe l 218}96.311 0.589 19.979
{ca leu l 219}98.53 -1.989 21.769
{ca phe l 220}101.316 -2.122 19.111
{ca cys l 221}101.313 1.639 18.518
{ca ala l 222}101.711 2.358 22.271
{ca glu l 223}104.68 -0.083 22.239
{ca ala l 224}106.231 1.745 19.234
{ca leu l 225}105.733 5.325 20.518
{ca tyr l 226}107.297 4.587 23.894
{ca lys l 227}110.369 3.044 22.182
{ca ala l 228}110.757 6.082 19.875
{ca gln l 229}110.352 8.41 22.896
{ca ala l 230}112.906 6.475 24.982
{ca glu l 231}115.314 6.529 22.041
{ca thr l 232}115.108 10.262 21.462
{ca gly l 233}114.339 11.96 24.785
{ca glu l 234}111.47 13.899 23.079
{ca ile l 235}107.762 13.248 23.972
{ca lys l 236}105.891 11.397 21.232
{ca gly l 237}102.255 10.821 20.353
{ca his l 238}100.291 8.739 17.856
{ca tyr l 239}96.594 9.844 17.17
{ca leu l 240}94.62 6.713 17.988
{ca asn l 241}91.339 6.911 16.227
{ca ala l 242}88.241 6.608 18.43
{ca thr l 243}85.718 7.019 15.522
{ca ala l 244}83.208 4.14 15.684
{ca gly l 245}79.578 3.304 14.783
{ca thr l 246}78.065 3.874 18.237
{ca cys l 247}78.817 6.164 21.191
{ca glu l 248}79.535 3.013 23.124
{ca asp l 249}82.208 1.777 20.793
{ca met l 250}83.811 5.195 20.602
{ca met l 251}84.034 5.365 24.381
{ca lys l 252}85.509 1.837 24.605
{ca arg l 253}88.366 2.943 22.359
{ca ala l 254}89. 6.16 24.339
{ca val l 255}88.989 4.267 27.611
{ca phe l 256}91.71 1.815 26.424
{ca ala l 257}93.892 4.695 25.245
{ca arg l 258}93.433 6.306 28.694
{ca glu l 259}94.527 2.881 30.135
{ca leu l 260}97.72 2.825 28.01
{ca gly l 261}98.734 6.33 29.299
{ca val l 262}99.215 7.711 25.793
{ca pro l 263}98.589 11.507 25.158
{ca ile l 264}96.268 11.971 22.142
{ca val l 265}93.275 10.301 20.535
{ca met l 266}91.57 11.318 17.274
{ca his l 267}87.97 11.657 16.047
{ca asp l 268}86.229 12.394 12.734
{ca tyr l 269}83.669 14.916 14.018
{ca leu l 270}81.554 15.206 10.853
{ca thr l 271}81.076 11.426 9.952
{ca gly l 272}80.941 10.593 13.614
{ca gly l 273}78.743 13.625 14.282
{ca phe l 274}78.52 16.482 16.654
{ca thr l 275}76.618 14.828 19.575
{ca ala l 276}79.122 11.882 19.671
{ca asn l 277}81.911 14.401 19.228
{ca thr l 278}80.77 16.51 22.204
{ca thr l 279}80.628 13.394 24.369
{ca leu l 280}84.271 12.501 23.432
{ca ser l 281}85.353 16.142 23.974
{ca his l 282}84.076 16.053 27.536
{ca tyr l 283}85.669 12.717 28.192
{ca cys l 284}89.0