NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4273 8.4345 117.0993 57.2343 64.0686 173.8698 3 R 3.9283 8.4168 118.3677 57.1679 29.5410 176.3585 4 K 4.2665 9.4501 122.8957 57.0764 33.6849 176.3947 5 N 5.0547 7.6497 113.9212 50.5532 41.5336 173.9867 6 I 3.7203 8.0763 119.6417 61.3907 38.5567 175.5606 7 S 4.5092 8.3752 122.0780 57.3580 63.1112 173.9944 8 L 4.3435 8.3991 126.4129 54.2439 42.6237 177.0430 9 T 4.7324 8.2146 115.3685 60.2294 72.7676 175.6643 10 E 4.0373 8.7246 121.4141 61.7008 29.6001 180.7861 11 S 4.4267 8.0103 114.3658 60.9972 63.1039 176.2536 12 L 4.0352 8.1549 124.4167 58.0106 41.8036 178.6177 13 E 4.0100 8.8147 118.9448 59.3918 29.2682 178.9711 14 E 4.0279 8.4153 119.4991 58.9741 29.6770 177.9974 15 Y 4.0058 8.0868 119.7755 60.8031 38.6517 178.0663 16 I 3.7154 8.2235 120.8620 64.4928 37.2735 178.0009 17 F 4.1596 8.6685 123.9186 62.1611 39.0648 177.9560 18 R 4.1410 8.3846 118.1817 60.0104 29.2037 178.5588 19 N 5.0428 7.3716 112.9962 53.3825 39.1489 174.9649 20 S 4.4140 7.5723 110.5131 59.3926 67.3693 174.8967 21 V 3.8207 7.2256 121.2194 62.2394 31.7454 176.4117 22 R 4.4478 8.7647 127.0381 54.3060 29.9883 173.9208 23 E 4.0816 7.8461 119.0272 54.5069 31.0134 175.0860 24 P 4.3056 0.0000 0.0000 62.6879 33.3367 176.8526 25 D 4.4546 8.7451 121.1449 57.8388 40.8745 179.0878 26 S 4.3708 8.3515 112.9063 61.7638 62.4620 176.2300 27 F 4.0720 8.6027 119.8523 60.3052 38.6909 177.2390 28 L 4.0692 8.2794 120.0398 58.1620 41.8846 178.7466 29 K 3.9232 8.6368 119.9659 59.6291 32.0499 178.3258 30 L 3.3028 7.8102 120.3450 57.9265 41.8746 179.1856 31 R 3.8192 7.7874 117.5439 59.0574 29.7733 179.0223 32 K 3.8940 8.0834 117.4076 59.5954 32.1863 178.5218 33 E 4.0987 8.3486 119.4717 59.8224 29.4297 179.0831 34 T 3.9765 8.4187 116.1357 66.2098 68.1686 176.9365 35 G 3.6673 7.8498 107.5821 47.9536 0.0000 175.0449 36 T 4.0599 7.4207 109.0539 63.9361 69.4534 175.1783 37 L 4.3024 7.6539 121.8196 54.1046 42.1452 177.6567 38 A 4.3231 8.6913 123.1954 53.8433 18.6705 177.7271 39 Q 4.3731 7.8917 115.0034 54.1918 32.2043 175.6816 *41 N 4.6587 8.7326 118.5485 53.2284 40.0579 175.5127 42 M 4.0585 8.3480 120.4171 56.9910 32.1092 176.5201 43 Q 4.7397 7.6851 116.0544 54.0354 30.9865 175.1479 44 I 4.1492 7.9800 112.6094 60.1414 39.0796 176.2722 45 S 4.3756 8.2409 116.6267 57.1777 65.2788 173.3271 46 P 4.5566 0.0000 0.0000 65.5078 30.8081 178.4084 47 E 3.9223 8.2276 117.8732 59.3735 29.4658 178.4079 48 E 4.1263 8.0653 119.2460 59.6166 29.6171 179.2000 49 G 3.7801 8.2432 105.3254 48.1016 0.0000 175.7070 50 Q 4.0535 8.2054 120.2813 58.2724 28.7006 178.4367 51 F 4.3263 8.4933 122.2135 61.4938 39.4761 177.2731 52 L 3.7852 8.2904 118.9829 57.3626 41.2597 178.9215 53 N 4.1133 8.0947 117.1155 56.7161 38.8547 176.7367 54 I 3.6372 7.7828 119.8812 64.1668 38.1247 177.8029 55 L 3.8854 7.7767 119.7370 57.9600 41.0938 179.7288 56 T 3.9394 7.6643 115.0517 66.4685 68.7367 176.6678 57 K 4.1124 7.8595 119.8304 59.5729 31.9422 179.2052 58 I 3.6891 7.7333 119.1913 64.7371 37.2013 178.4307 59 S 4.3058 8.0527 113.0289 59.1504 62.8871 175.2680 60 G 3.8274 7.7430 109.0995 45.6716 0.0000 173.5344 61 A 4.0702 7.6577 121.9287 52.7508 18.8087 178.2463 62 K 4.6024 9.4549 118.6875 55.6970 35.6595 176.0263 63 R 4.7458 8.0677 118.4018 54.3599 33.4893 174.2223 64 I 4.8582 8.9357 125.3860 59.3134 40.7220 174.8092 65 I 4.7052 7.8596 126.8435 59.4233 39.6755 173.9927 66 E 4.9379 8.9980 128.9795 54.8339 31.5927 174.6921 67 I 4.1963 9.0802 128.9513 62.9250 38.5813 175.6162 68 G 4.2107 9.2228 116.3760 46.8311 0.0000 171.3321 69 T 4.9974 8.9445 121.8717 62.0983 71.5179 175.6349 70 F 3.8851 8.8022 123.3926 60.0955 39.2558 175.9118 71 T 4.1266 7.1246 108.1237 61.4831 68.8215 175.8775 72 G 4.1571 8.3529 111.2531 45.6921 0.0000 174.9326 73 Y 3.6848 8.2160 121.4130 60.6336 38.6838 178.3416 74 S 4.0655 8.3322 114.8935 61.4183 62.8145 176.2121 75 S 4.4243 8.3705 117.4483 61.4507 62.5221 176.4305 76 L 4.0003 8.1667 122.4963 57.6090 40.8821 179.2638 77 C 4.2469 7.5252 116.9439 62.5516 28.0331 176.1362 78 F 4.3409 8.1755 119.4806 60.6901 38.3834 177.6590 79 A 4.0689 8.1870 119.4280 54.8958 18.2569 179.1661 80 S 4.3791 7.8524 110.5802 60.0219 63.6339 175.7864 81 A 4.2268 7.4062 122.6275 53.2615 19.0379 177.9206 82 L 4.0335 7.3243 116.9433 54.2628 42.3523 175.3853 83 P 4.5918 0.0000 0.0000 61.9548 32.2131 177.0504 84 E 3.9376 8.6962 116.4310 58.9506 29.3817 177.3834 85 D 4.7329 8.0958 116.7495 52.9539 39.8568 175.9631 86 G 4.1602 7.9976 107.6295 45.6501 0.0000 173.8871 87 K 5.2171 9.4859 121.4366 54.4668 37.2059 175.1178 88 I 5.0307 8.7825 122.8001 59.1711 41.4607 173.6180 89 L 4.7664 8.6422 131.5672 53.6160 43.7760 174.6549 90 C 4.9655 9.0720 125.1299 58.9029 30.2803 172.5464 91 C 5.2319 9.0273 121.1465 58.1829 30.4152 172.5755 92 D 5.0902 8.6232 122.9626 52.9509 44.4655 176.3641 93 V 3.9381 8.6831 115.1319 62.2471 32.4319 176.1797 94 S 4.6561 8.7395 116.0200 56.1613 63.7507 174.2134 95 E 3.9477 8.7246 128.8410 59.0621 29.0495 178.0246 96 E 3.7192 7.8717 118.9539 59.1190 29.7899 178.8383 97 W 4.5212 7.9817 119.1358 60.0169 29.1726 178.5230 98 T 3.9823 7.9249 108.4771 63.7384 68.3513 176.3792 99 N 4.1926 8.1290 120.4612 56.2454 38.4036 177.3144 100 V 3.5392 7.3727 119.1414 65.7630 31.5744 177.6821 101 A 3.8985 7.4354 121.4413 54.5325 18.0841 179.6951 102 R 3.3091 7.3011 117.0013 58.7995 30.0034 178.2463 103 K 3.6465 7.6471 119.5367 60.1067 32.0664 178.2813 104 Y 3.9196 7.6383 116.5924 60.4626 37.7625 178.0209 105 W 4.4987 8.3767 120.5635 59.8790 29.1970 178.4715 106 K 4.0302 8.6724 119.8561 59.5100 31.4735 178.4338 107 E 3.9418 8.1714 118.5590 58.8682 29.5840 177.6165 108 N 4.8500 8.1905 113.7565 52.1396 39.2069 175.1469 109 G 3.9071 7.8883 108.4227 46.9209 0.0000 174.5077 110 L 4.5669 8.3381 118.6656 54.0106 42.8450 178.5343 111 E 3.9381 8.3475 119.7140 59.3486 29.6271 178.8234 112 N 4.1942 8.1790 114.8097 55.7154 37.4132 176.0239 113 K 4.2488 8.1896 117.1165 57.4164 32.6397 176.0182 114 I 4.8613 7.4260 120.3115 59.3712 38.9523 175.2078 115 F 4.8443 9.2674 124.8134 55.7041 42.5781 174.2103 116 L 5.2076 8.3982 121.6545 53.6210 45.2657 174.9952 117 K 4.2984 8.8652 126.6499 54.5316 34.9846 174.8985 118 L 4.5881 8.5518 127.2568 54.7224 43.2214 175.5318 119 G 3.6196 8.4482 107.6746 44.0492 0.0000 173.4093 120 S 4.1568 8.7681 114.0045 58.3975 63.1375 175.4772 121 A 4.1359 8.8299 131.4199 54.9223 18.2469 179.2225 122 L 4.0580 8.0757 117.6019 57.9591 41.6858 179.2332 123 E 3.9711 8.1647 117.9480 59.7518 29.6305 179.0049 124 T 3.9302 7.9390 115.7020 67.1079 68.6012 176.5709 125 L 4.2512 8.3299 120.5731 57.7162 41.6477 179.2790 126 Q 4.0376 8.2268 119.6777 59.1530 29.0072 178.5320 127 V 3.6783 8.3295 119.6370 66.0744 31.5498 177.7839 128 L 4.1020 8.1821 119.8529 58.1426 41.9191 179.0209 129 I 3.7611 8.0613 119.8252 64.5871 36.9388 177.9451 130 D 4.7363 8.0300 117.3408 54.9496 40.9218 177.0958 131 S 4.1684 7.6441 116.3199 58.9626 63.0349 174.6747 132 K 4.3727 8.6860 125.3540 58.2051 32.4488 177.1470 133 S 3.9989 7.3883 110.6861 55.4554 65.9593 173.4692 134 A 3.2120 7.2229 124.7664 51.3711 18.5608 176.1582 135 P 4.1338 0.0000 0.0000 61.9760 31.8253 177.3046 136 S 4.0160 8.6195 114.9323 61.4545 62.5084 176.1707 137 W 4.6707 7.4569 114.0885 56.7876 28.6199 176.0257 138 A 4.6111 7.7955 121.4368 51.4949 19.5058 175.7256 139 S 4.2542 7.5720 111.5305 59.8948 62.6949 173.7043 140 D 4.6408 9.0225 125.2060 54.5485 39.8149 172.9899 141 F 4.1111 7.6353 117.1557 57.0871 40.7277 175.5119 142 A 4.2606 8.1632 119.1405 52.1266 22.1287 175.6162 143 F 4.5859 8.3752 113.2505 57.1823 40.0614 174.4921 144 G 3.9567 9.4184 109.8492 43.9011 0.0000 171.7788 145 P 4.4060 0.0000 0.0000 63.4152 32.2068 175.9973 146 S 3.9638 8.8165 113.2281 59.4122 60.4664 173.1026 147 S 4.5290 8.5694 111.9517 57.4990 64.9022 174.2560 148 I 4.3266 7.4279 122.2584 59.7066 39.4762 175.7840 149 D 4.5836 8.7200 124.6877 56.5347 42.2119 176.5362 150 L 5.2381 7.5292 116.5922 54.4345 43.9947 174.8186 151 F 5.2455 9.3345 119.7949 55.8127 42.4267 174.4728 152 F 5.4331 8.8439 123.9813 56.5981 41.8921 173.7490 153 L 4.3735 8.6270 130.1961 53.2501 43.1569 176.9989 154 D 4.6285 8.3787 129.9225 52.6054 40.6245 175.5199 155 A 4.6814 7.9386 123.6660 51.5329 19.2586 178.0665 156 D 4.5293 8.7247 117.2723 53.8435 40.2143 177.7524 157 K 2.8753 8.4508 124.8365 58.8140 31.7160 178.6497 158 E 4.1646 7.9154 115.6692 58.0877 29.9509 177.4888 159 N 4.6943 7.9477 116.5607 53.0018 39.2390 175.7854 160 Y 4.3946 7.9461 120.5936 61.0184 37.8190 177.1249 161 P 4.6164 0.0000 0.0000 65.5743 31.5306 177.5541 162 N 4.5588 8.2098 116.0510 55.7283 38.9422 176.6475 163 Y 4.3335 7.6761 117.9894 61.0750 37.9682 177.0664 164 Y 4.2859 8.2000 120.5983 60.6962 38.8328 176.6225 165 P 4.0102 0.0000 0.0000 65.9135 31.1712 178.2861 166 L 3.9299 7.7699 117.9941 57.5309 41.6099 178.9339 167 I 2.6541 7.9018 120.1250 64.3883 36.7645 178.4431 168 L 3.7860 7.3617 117.9508 57.4387 41.5423 179.2363 169 K 4.0059 7.9806 118.5158 59.6698 32.0056 179.2367 170 L 4.0918 7.9526 118.8480 56.4173 41.9596 177.4192 171 L 4.7105 7.9227 119.2800 54.8714 42.7490 177.6345 172 K 4.2036 9.0891 122.7525 55.4200 33.5551 174.7984 173 P 4.3460 0.0000 0.0000 64.5857 31.1912 176.9065 174 G 3.9481 9.6060 114.0809 44.9305 0.0000 173.9331 175 G 3.8998 8.1305 107.4604 46.0415 0.0000 172.4125 176 L 5.2351 8.7710 122.5201 52.9542 45.0169 174.8031 177 L 4.8977 9.3859 129.2580 54.0357 44.0048 174.9497 178 I 5.1352 9.0548 127.3836 59.7574 39.6457 174.2953 179 A 4.9183 8.9406 129.7863 50.0678 20.9768 175.3619 180 D 4.8504 8.9537 123.2820 53.8755 42.5196 175.1411 181 N 4.7015 8.7716 116.0925 54.7412 35.9393 176.6662 182 V 3.7452 7.8912 110.9598 62.8821 32.3077 177.4631 183 L 4.3927 8.4019 119.3239 53.6987 43.4075 175.7891 184 W 4.4653 8.5562 127.7263 57.9617 29.1144 173.5146 185 D 4.0249 10.6100 111.7245 55.0807 40.3612 173.9869 186 G 4.1020 8.4515 108.4390 44.9604 0.0000 176.5097 187 S 4.0900 7.7684 114.0824 60.9820 62.9917 177.1631 188 V 3.7355 7.8717 113.6868 64.1902 31.5536 177.2726 189 A 3.9864 8.1709 122.3660 54.3832 18.6026 176.7144 190 D 4.6183 7.6850 115.6149 53.0767 40.2879 176.6178 191 L 4.3182 8.3522 126.0081 55.8165 41.7078 178.3960 192 S 4.2304 8.7803 113.8880 59.6279 63.3826 173.7722 193 H 4.7575 7.9643 119.5604 54.9723 28.6538 174.8620 194 Q 4.7186 8.3694 125.2095 55.3402 30.0107 175.8388 195 E 4.1856 8.3189 117.5376 55.5246 30.3599 176.4909 196 P 4.2926 0.0000 0.0000 66.2543 30.8874 178.4156 197 S 3.9373 8.0904 114.2863 61.0851 63.2203 175.9135 198 T 3.9180 8.1024 119.4154 66.1014 68.3458 176.4616 199 V 3.6904 8.2896 120.2628 65.9243 31.5075 178.3521 200 G 3.5540 7.9318 105.4466 47.7489 0.0000 175.8405 201 I 3.6305 7.6322 122.1599 64.0659 37.2080 178.4449 202 R 3.9416 8.0145 118.9858 59.4281 29.9943 178.9162 203 K 3.9344 8.1972 119.0727 59.3770 32.1458 178.4097 204 F 4.0350 8.5297 120.9835 61.6140 39.3037 176.8418 205 N 4.1863 8.6084 116.0473 56.0794 38.2478 177.0054 206 E 4.0065 7.9636 120.2654 58.9255 29.6369 178.4780 207 L 3.8616 7.4738 117.8898 57.6940 41.9140 179.4268 208 V 3.3263 7.0914 118.0147 65.9626 31.1881 177.4370 209 Y 4.1018 7.4079 117.9081 60.5468 38.7833 176.9826 210 N 4.5718 7.9959 114.1060 52.4544 38.8797 174.4701 211 D 4.5671 7.3870 122.2540 53.3724 41.3675 176.6988 212 S 4.4024 8.5122 120.9350 59.4112 63.9206 174.8278 213 L 4.2842 8.1746 121.4325 56.4682 42.3061 176.7930 214 V 5.0518 7.5018 110.6614 59.5178 35.4721 174.5871 215 D 5.2100 8.8541 121.7631 52.5639 43.6308 175.9158 216 V 4.9437 8.3879 120.9627 59.9655 34.6253 174.9373 217 S 4.5282 9.1772 117.8508 56.5625 65.1407 172.7689 218 L 4.7616 8.7079 130.9118 54.1195 42.2919 175.5276 219 V 4.2666 9.0347 128.5001 60.1307 32.9595 175.0403 220 P 4.7214 0.0000 0.0000 62.5166 31.1294 175.8641 221 I 4.2175 7.4368 118.0253 61.3136 40.8487 174.4825 222 A 3.6298 7.9776 129.0269 54.0517 17.3901 177.1716 223 D 4.7304 8.8526 116.5677 56.4289 41.5885 174.4356 224 G 4.3114 8.8616 108.4547 45.2595 0.0000 173.3577 225 V 4.9859 8.8966 122.8510 61.3160 35.0454 174.1402 226 S 5.1524 9.0696 124.7936 57.6782 64.6704 173.3966 227 L 4.9729 9.2402 126.1304 53.7196 42.8347 175.8716 228 V 4.7276 9.0612 126.1259 61.1702 33.7757 174.1580 229 R 4.9681 8.7994 129.6018 54.2132 32.3387 174.8943 230 K 4.4372 8.9881 128.8616 56.3142 32.9602 176.5183 231 R 4.4311 8.6131 127.3499 55.9452 30.7342 176.9730 232 L 4.2404 8.4653 121.3591 55.1256 42.5083 176.4405 233 E 4.3912 8.6551 122.5790 55.9987 31.7684 176.8142 *234 H 4.3887 8.6083 115.7169 55.2125 27.8683 175.2346 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 S 8.43 4.43 0.00 3.65 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 R 8.42 3.93 0.00 1.90 1.77 0.00 3.22 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.28 0.00 4 K 9.45 4.27 0.00 1.74 1.90 0.00 1.67 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.46 7.81 5 N 7.65 5.05 0.00 2.67 2.70 0.00 0.00 6.84 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 I 8.08 3.72 1.87 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.73 0.91 0.00 0.00 7 S 8.38 4.51 0.00 3.89 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 L 8.40 4.34 0.00 1.63 1.60 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 9 T 8.21 4.73 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 10 E 8.72 4.04 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 1.96 0.00 11 S 8.01 4.43 0.00 4.06 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 L 8.15 4.04 0.00 1.77 1.86 0.82 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.81 4.01 0.00 2.18 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.54 0.00 14 E 8.42 4.03 0.00 2.24 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.43 0.00 15 Y 8.09 4.01 0.00 3.28 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 I 8.22 3.72 2.14 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.35 0.96 0.00 0.00 17 F 8.67 4.16 0.00 3.32 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 R 8.38 4.14 0.00 1.93 1.83 0.00 3.27 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 19 N 7.37 5.04 0.00 2.39 2.60 0.00 0.00 6.73 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 S 7.57 4.41 0.00 3.91 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 7.23 3.82 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.76 0.00 0.00 22 R 8.76 4.45 0.00 1.65 1.72 0.00 3.13 0.00 0.00 3.08 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.41 0.00 23 E 7.85 4.08 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.49 0.00 24 P 0.00 4.31 0.00 1.90 1.80 0.00 3.03 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.79 0.00 25 D 8.75 4.45 0.00 2.75 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 S 8.35 4.37 0.00 4.08 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 F 8.60 4.07 0.00 3.27 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.28 4.07 0.00 2.02 1.97 0.99 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 29 K 8.64 3.92 0.00 2.07 2.26 0.00 1.79 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.73 1.59 7.81 30 L 7.81 3.30 0.00 0.29 1.45 0.47 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 31 R 7.79 3.82 0.00 2.10 1.88 0.00 2.94 0.00 0.00 2.50 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.91 0.00 32 K 8.08 3.89 0.00 1.91 1.90 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.66 7.81 33 E 8.35 4.10 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 34 T 8.42 3.98 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 35 G 7.85 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.42 4.06 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 37 L 7.65 4.30 0.00 1.67 1.79 0.47 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 38 A 8.69 4.32 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Q 7.89 4.37 0.00 1.91 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.56 0.00 0.00 0.00 0.00 0.00 2.22 2.31 0.00 *41 N 8.73 4.66 0.00 2.67 2.82 0.00 0.00 7.10 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 M 8.35 4.06 0.00 1.11 1.26 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.23 0.00 43 Q 7.69 4.74 0.00 2.27 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.05 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 44 I 7.98 4.15 2.12 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.59 1.20 0.00 0.00 45 S 8.24 4.38 0.00 4.26 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 P 0.00 4.56 0.00 2.43 2.68 0.00 3.88 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.12 0.00 47 E 8.23 3.92 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 48 E 8.07 4.13 0.00 2.09 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.57 0.00 49 G 8.24 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.21 4.05 0.00 2.32 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.64 0.00 51 F 8.49 4.33 0.00 3.14 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.29 3.79 0.00 1.33 0.89 0.17 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 53 N 8.09 4.11 0.00 2.83 2.92 0.00 0.00 6.82 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 I 7.78 3.64 2.05 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.45 0.94 0.00 0.00 55 L 7.78 3.89 0.00 1.72 1.59 0.24 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 56 T 7.66 3.94 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 57 K 7.86 4.11 0.00 1.92 1.84 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.60 1.71 7.81 58 I 7.73 3.69 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.51 0.91 0.00 0.00 59 S 8.05 4.31 0.00 4.04 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 G 7.74 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 A 7.66 4.07 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 K 9.45 4.60 0.00 1.68 1.73 0.00 1.57 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.31 1.52 7.81 63 R 8.07 4.75 0.00 1.36 1.15 0.00 2.21 0.00 0.00 2.96 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.10 0.00 64 I 8.94 4.86 1.73 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.58 0.34 0.00 0.00 65 I 7.86 4.71 0.67 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.95 0.92 0.00 0.00 66 E 9.00 4.94 0.00 2.06 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.59 0.00 67 I 9.08 4.20 1.56 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.69 0.34 0.00 0.00 68 G 9.22 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 T 8.94 5.00 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 70 F 8.80 3.89 0.00 2.91 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 T 7.12 4.13 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.27 0.00 0.00 72 G 8.35 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 Y 8.22 3.68 0.00 2.96 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 S 8.33 4.07 0.00 3.84 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 S 8.37 4.42 0.00 4.32 4.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 L 8.17 4.00 0.00 1.36 0.80 0.12 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 77 C 7.53 4.25 0.00 2.63 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 F 8.18 4.34 0.00 3.28 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 A 8.19 4.07 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 7.85 4.38 0.00 4.06 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 7.41 4.23 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 L 7.32 4.03 0.00 1.95 1.66 1.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 83 P 0.00 4.59 0.00 2.39 2.20 0.00 3.71 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.95 0.00 84 E 8.70 3.94 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 85 D 8.10 4.73 0.00 2.80 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 G 8.00 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 K 9.49 5.22 0.00 1.81 2.05 0.00 1.72 0.00 0.00 2.03 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.68 1.51 7.81 88 I 8.78 5.03 1.85 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.28 0.82 0.00 0.00 89 L 8.64 4.77 0.00 0.35 0.76 0.95 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 90 C 9.07 4.97 0.00 3.05 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 C 9.03 5.23 0.00 2.93 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 D 8.62 5.09 0.00 2.74 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 V 8.68 3.94 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 1.03 0.00 0.00 94 S 8.74 4.66 0.00 3.90 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 E 8.72 3.95 0.00 2.03 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 96 E 7.87 3.72 0.00 1.71 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.08 0.00 97 W 7.98 4.52 0.00 3.46 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 T 7.92 3.98 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 99 N 8.13 4.19 0.00 2.97 2.84 0.00 0.00 6.47 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 V 7.37 3.54 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 1.08 0.00 0.00 101 A 7.44 3.90 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 R 7.30 3.31 0.00 1.56 1.74 0.00 3.14 0.00 0.00 3.31 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.92 0.00 103 K 7.65 3.65 0.00 1.75 1.92 0.00 1.54 0.00 0.00 1.42 0.00 0.00 2.41 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.85 1.26 7.81 104 Y 7.64 3.92 0.00 3.04 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 W 8.38 4.50 0.00 3.54 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 K 8.67 4.03 0.00 1.92 1.98 0.00 1.62 0.00 0.00 1.56 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.60 7.81 107 E 8.17 3.94 0.00 2.09 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.26 0.00 108 N 8.19 4.85 0.00 3.00 2.97 0.00 0.00 7.03 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 G 7.89 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 L 8.34 4.57 0.00 1.68 1.64 1.01 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 111 E 8.35 3.94 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.47 0.00 112 N 8.18 4.19 0.00 2.78 2.94 0.00 0.00 6.05 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 K 8.19 4.25 0.00 1.96 1.90 0.00 1.75 0.00 0.00 1.85 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.41 7.81 114 I 7.43 4.86 1.22 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.32 -0.41 0.00 0.00 115 F 9.27 4.84 0.00 2.52 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 L 8.40 5.21 0.00 1.77 1.60 1.17 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 117 K 8.87 4.30 0.00 1.00 1.04 0.00 0.89 0.00 0.00 0.61 0.00 0.00 2.54 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.30 0.79 7.81 118 L 8.55 4.59 0.00 1.51 1.54 0.91 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 119 G 8.45 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 S 8.77 4.16 0.00 3.92 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 A 8.83 4.14 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 L 8.08 4.06 0.00 1.71 1.71 0.78 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.16 3.97 0.00 2.23 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 124 T 7.94 3.93 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 125 L 8.33 4.25 0.00 1.85 1.89 1.13 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 126 Q 8.23 4.04 0.00 2.37 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.58 0.00 127 V 8.33 3.68 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 1.16 0.00 0.00 128 L 8.18 4.10 0.00 2.31 1.95 1.02 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 129 I 8.06 3.76 2.08 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.12 0.94 0.00 0.00 130 D 8.03 4.74 0.00 2.73 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 S 7.64 4.17 0.00 4.05 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 K 8.69 4.37 0.00 1.75 1.90 0.00 1.71 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.45 7.81 133 S 7.39 4.00 0.00 3.65 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 A 7.22 3.21 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 P 0.00 4.13 0.00 0.66 1.67 0.00 3.25 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.95 0.00 136 S 8.62 4.02 0.00 4.07 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 W 7.46 4.67 0.00 3.62 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 A 7.80 4.61 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 S 7.57 4.25 0.00 3.82 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 D 9.02 4.64 0.00 3.03 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 F 7.64 4.11 0.00 1.51 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.16 4.26 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 F 8.38 4.59 0.00 3.05 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 G 9.42 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 P 0.00 4.41 0.00 2.16 2.05 0.00 3.86 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.97 0.00 146 S 8.82 3.96 0.00 3.95 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 S 8.57 4.53 0.00 3.68 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 I 7.43 4.33 1.96 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.01 0.53 0.00 0.00 149 D 8.72 4.58 0.00 2.67 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 L 7.53 5.24 0.00 1.99 1.70 0.82 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 151 F 9.33 5.25 0.00 3.00 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 F 8.84 5.43 0.00 2.99 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 L 8.63 4.37 0.00 1.42 1.07 0.22 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 154 D 8.38 4.63 0.00 1.73 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 A 7.94 4.68 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 D 8.72 4.53 0.00 2.86 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 K 8.45 2.88 0.00 1.10 0.79 0.00 0.61 0.00 0.00 1.27 0.00 0.00 2.73 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.79 0.21 7.81 158 E 7.92 4.16 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 159 N 7.95 4.69 0.00 2.87 2.27 0.00 0.00 6.80 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 Y 7.95 4.39 0.00 2.93 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 P 0.00 4.62 0.00 2.29 2.29 0.00 3.84 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 162 N 8.21 4.56 0.00 2.56 2.75 0.00 0.00 7.01 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 Y 7.68 4.33 0.00 3.12 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 Y 8.20 4.29 0.00 3.36 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 P 0.00 4.01 0.00 2.27 2.30 0.00 3.89 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.12 0.00 166 L 7.77 3.93 0.00 1.88 1.80 1.01 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 167 I 7.90 2.65 1.67 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 0.49 0.17 0.00 0.00 168 L 7.36 3.79 0.00 1.27 1.48 0.39 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 169 K 7.98 4.01 0.00 2.00 1.86 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.62 7.81 170 L 7.95 4.09 0.00 2.01 2.01 1.19 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 171 L 7.92 4.71 0.00 1.63 1.63 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 172 K 9.09 4.20 0.00 1.67 1.69 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.73 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.50 1.52 7.81 173 P 0.00 4.35 0.00 1.91 1.99 0.00 3.62 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.08 0.00 174 G 9.61 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 G 8.13 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 L 8.77 5.24 0.00 1.79 1.54 1.06 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 177 L 9.39 4.90 0.00 1.82 1.77 0.95 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 178 I 9.05 5.14 2.35 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.72 1.28 0.00 0.00 179 A 8.94 4.92 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 D 8.95 4.85 0.00 2.47 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 N 8.77 4.70 0.00 3.01 3.12 0.00 0.00 6.86 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 V 7.89 3.75 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 1.11 0.00 0.00 183 L 8.40 4.39 0.00 1.94 1.75 0.96 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 184 W 8.56 4.47 0.00 3.12 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 D 10.61 4.02 0.00 2.33 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 G 8.45 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 S 7.77 4.09 0.00 3.80 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 V 7.87 3.74 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 1.07 0.00 0.00 189 A 8.17 3.99 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 D 7.69 4.62 0.00 2.85 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 L 8.35 4.32 0.00 1.68 1.71 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 192 S 8.78 4.23 0.00 3.88 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 H 7.96 4.76 0.00 3.53 3.50 0.00 5.59 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 Q 8.37 4.72 0.00 2.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.94 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 195 E 8.32 4.19 0.00 2.19 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.42 0.00 196 P 0.00 4.29 0.00 2.42 2.33 0.00 3.72 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.05 0.00 197 S 8.09 3.94 0.00 3.78 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 T 8.10 3.92 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 199 V 8.29 3.69 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.01 0.00 0.00 200 G 7.93 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 I 7.63 3.63 1.76 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 -0.02 0.88 0.00 0.00 202 R 8.01 3.94 0.00 2.03 2.01 0.00 3.15 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.85 0.00 203 K 8.20 3.93 0.00 2.00 2.05 0.00 1.54 0.00 0.00 1.59 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.53 7.81 204 F 8.53 4.04 0.00 3.33 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 N 8.61 4.19 0.00 2.97 2.88 0.00 0.00 6.77 8.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 E 7.96 4.01 0.00 2.22 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 207 L 7.47 3.86 0.00 1.35 1.32 0.97 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 208 V 7.09 3.33 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 -0.32 0.00 0.00 209 Y 7.41 4.10 0.00 2.94 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 N 8.00 4.57 0.00 2.71 2.79 0.00 0.00 7.01 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 D 7.39 4.57 0.00 2.97 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 S 8.51 4.40 0.00 3.98 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 L 8.17 4.28 0.00 1.75 1.73 0.90 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 214 V 7.50 5.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 1.03 0.00 0.00 215 D 8.85 5.21 0.00 2.61 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 V 8.39 4.94 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 1.00 0.00 0.00 217 S 9.18 4.53 0.00 3.94 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 L 8.71 4.76 0.00 1.76 1.65 0.97 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 219 V 9.03 4.27 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 1.20 0.00 0.00 220 P 0.00 4.72 0.00 2.22 2.12 0.00 3.80 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.07 0.00 221 I 7.44 4.22 1.56 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.53 0.62 0.00 0.00 222 A 7.98 3.63 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 D 8.85 4.73 0.00 2.84 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 G 8.86 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 V 8.90 4.99 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 1.23 0.00 0.00 226 S 9.07 5.15 0.00 4.08 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 L 9.24 4.97 0.00 1.68 1.72 1.07 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 228 V 9.06 4.73 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.04 0.00 0.00 229 R 8.80 4.97 0.00 1.95 1.79 0.00 3.17 0.00 0.00 3.11 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00 230 K 8.99 4.44 0.00 1.86 1.69 0.00 1.63 0.00 0.00 1.79 0.00 0.00 2.80 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.42 1.39 7.81 231 R 8.61 4.43 0.00 1.80 1.84 0.00 3.32 0.00 0.00 3.32 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 232 L 8.47 4.24 0.00 1.52 1.59 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 233 E 8.66 4.39 0.00 1.92 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.26 0.00 *234 H 8.61 4.39 0.00 3.00 2.92 0.00 7.23 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.