NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 F 4.8314 8.1676 115.8764 57.2828 40.2868 176.5723 11 H 3.3585 5.5232 117.6844 56.8962 28.0751 173.2883 12 E 3.7849 7.9835 121.4745 59.0088 30.0782 179.7773 13 M 4.5346 7.1244 115.7393 55.5265 32.1244 177.5434 14 R 4.6429 7.6499 115.9933 56.0933 34.8683 175.6750 15 E 3.9483 8.0315 117.0964 55.2637 29.8412 174.9234 16 P 4.0829 0.0000 0.0000 62.1341 32.3578 175.0974 17 R 4.0805 7.0857 113.7027 55.7733 32.7894 173.7529 18 I 4.1873 8.5833 122.6214 61.2219 37.3202 175.2551 19 E 4.3758 8.9007 129.1775 58.2419 30.6167 176.5436 20 K 5.3337 7.4779 115.5075 56.6166 36.0299 174.9992 21 V 5.1973 8.1623 121.8319 60.3497 34.2110 174.0029 22 V 4.5324 8.0903 128.3065 61.7014 33.7964 175.0276 23 V 5.1348 8.6709 119.8851 58.7982 34.9922 174.2678 24 H 5.3272 8.6777 119.9354 54.0160 33.1710 172.3474 25 M 4.4556 8.4690 117.3410 53.5115 35.0541 175.3242 26 G 3.6881 8.3209 112.4623 46.8247 0.0000 172.2324 27 I 3.6023 8.5271 130.0892 60.4600 36.6259 175.7092 28 G 3.7626 8.4891 121.5561 45.4619 0.0000 172.8171 29 H 4.6142 7.4118 123.8472 55.6873 30.1327 175.1564 *35 A 4.2116 7.3632 122.8959 52.0325 19.4244 176.9467 36 N 4.5145 8.6802 116.2131 53.1654 37.7396 176.6713 37 A 4.2474 7.8639 124.0078 55.0415 18.5111 179.0959 38 E 3.8887 8.0234 116.6628 60.1874 29.7421 178.7122 39 D 4.4294 7.6762 119.2325 57.4677 40.8849 178.6541 40 I 3.6883 7.6848 112.4362 64.4892 37.5688 178.0012 41 L 4.2509 7.7689 120.4691 57.3742 41.3447 179.5712 42 G 3.5997 8.0057 105.7825 47.0675 0.0000 175.3543 43 E 3.9370 8.0554 120.7005 58.8555 29.7372 178.7640 44 I 3.8879 7.9955 117.5519 64.8105 38.0470 177.3922 45 T 4.4306 7.9008 109.2878 63.9337 69.0624 173.9913 46 G 3.3758 6.7292 111.9413 43.8522 0.0000 172.4649 47 Q 4.5472 7.8305 118.7416 54.6597 31.7465 173.7102 48 M 4.1033 8.3234 118.2128 54.9052 32.4178 174.9590 49 P 4.8705 0.0000 0.0000 61.9715 34.3263 174.7710 50 V 4.3846 8.1358 117.9620 61.0599 34.4052 175.1365 51 R 4.3526 8.8945 126.7315 57.3445 31.0684 176.1517 52 T 4.5155 9.1610 119.1432 61.9472 71.1874 174.2085 53 K 4.9921 8.9040 125.5986 54.5183 34.3905 174.9696 54 A 4.8670 8.0744 121.3244 50.4581 22.5131 175.3078 55 K 4.5945 8.2572 116.9548 55.5941 35.6615 173.5416 56 R 4.0332 8.6695 127.3612 55.9157 30.1528 176.5632 57 T 4.2569 8.2964 118.0588 63.1456 69.6522 174.3179 58 V 4.4741 7.9263 123.7394 60.5965 34.2490 176.8237 59 G 3.7998 8.9502 115.6156 48.5877 0.0000 173.9966 60 E 4.2153 8.1662 118.7577 58.8594 28.4873 176.6415 61 F 4.1979 7.4961 114.9769 60.7795 38.1771 174.2247 62 D 4.9927 8.0431 116.4239 53.5324 42.0695 177.7714 63 I 3.6566 8.2917 112.7877 63.3979 37.7263 176.1190 64 R 3.7677 8.0053 121.3587 56.0719 29.5569 174.8206 65 E 3.8426 8.2881 128.5185 58.4329 30.2922 175.7431 66 G 4.0390 7.7687 114.0239 46.3174 0.0000 171.8325 67 D 4.5434 8.5385 122.1238 51.3662 42.1186 173.7128 68 P 4.4536 0.0000 0.0000 63.7377 31.5644 176.0723 69 I 4.5042 9.4092 122.1998 59.9700 40.3149 174.8591 70 G 4.2831 7.4020 105.5373 46.3634 0.0000 171.2364 71 A 5.7586 7.9233 120.0545 51.9470 23.3591 175.0528 72 K 5.2425 8.2750 116.6971 57.2673 36.4996 175.0338 73 V 4.6199 7.9710 119.7488 61.8408 34.7785 172.9913 74 T 4.5845 8.5277 119.0246 60.5095 69.8064 173.9381 75 L 4.6649 8.5619 127.3390 53.2602 43.8402 176.1482 76 R 4.6683 7.9173 120.4895 55.6596 34.1279 176.7243 77 D 4.3184 8.6528 120.9218 54.8994 39.3141 174.4219 78 E 3.9246 9.0281 119.1674 61.4283 29.2949 178.9082 79 M 3.9188 8.2191 115.9371 58.5181 32.1984 178.3349 80 A 4.2564 8.3850 120.8466 54.8190 19.0664 179.3253 81 E 3.9601 8.1081 116.5070 59.7120 29.5613 179.1200 82 E 4.0779 8.2351 116.5286 58.2282 29.9431 178.1593 83 F 4.4996 7.8013 120.5046 60.1407 40.3684 177.3225 84 L 4.0914 8.0862 118.5868 57.9685 41.2424 179.2440 85 Q 3.9520 8.3056 117.5681 58.6742 28.6495 178.6428 86 T 4.3574 7.4961 107.8831 63.1486 70.7481 175.2229 87 A 3.8614 8.4043 124.7187 53.1263 17.9410 179.7082 88 L 3.6766 8.0782 118.5206 57.1162 42.5811 177.3766 89 P 4.3409 0.0000 0.0000 65.9961 31.2177 179.0814 90 L 4.2268 7.8371 111.8170 55.2284 40.9490 176.8574 91 A 4.7354 8.2927 120.9046 50.8226 22.2404 177.4634 92 E 4.4986 8.3296 121.0014 53.5603 28.6682 175.3068 93 L 3.8554 7.6537 119.1549 55.1432 42.8114 176.9657 94 A 5.7220 8.2120 123.8318 50.4092 22.1317 174.8563 95 T 4.1632 8.3716 110.7709 66.1129 69.2152 177.3602 96 S 4.3485 8.0338 113.5231 60.3278 62.3070 174.5443 97 Q 4.4907 8.2202 119.9037 56.2863 28.8485 174.6876 98 F 5.0119 8.1337 117.6428 55.4666 40.7289 175.3450 99 D 4.7185 10.1292 124.4637 53.9835 41.7069 175.8498 100 D 4.5816 8.5657 120.3098 57.1579 41.0877 178.3739 101 T 4.3508 8.4365 113.9084 63.5959 68.2606 175.1020 102 G 3.9670 7.8348 108.0613 46.2139 0.0000 173.3055 103 N 5.1677 7.6288 117.1914 51.5950 41.9516 173.3786 104 F 4.8155 7.8052 111.5395 56.3969 41.0747 173.1171 105 S 5.1160 7.9669 115.9117 56.8202 65.8636 172.6849 106 F 4.6742 8.3212 115.6447 57.0186 40.8720 172.1848 107 G 4.1592 9.0308 104.1832 44.4937 0.0000 172.8967 *128 L 4.0353 8.5380 122.7516 55.1354 43.7642 176.5119 129 D 5.0189 8.7902 125.6161 52.6952 44.2885 175.7182 130 V 4.5444 7.8033 120.0208 61.7279 34.8584 174.0506 131 T 4.7082 9.1483 124.6297 61.5149 72.2442 173.2637 132 V 4.4705 8.0135 124.7217 61.1137 34.2213 173.7038 133 N 4.8081 9.2290 128.1788 52.3164 40.0853 173.5776 134 L 5.3377 7.9835 125.9506 53.1446 44.5950 176.0246 135 V 4.2177 7.6296 119.6032 61.0176 34.9704 171.8114 136 R 4.4468 8.3611 118.1493 55.3489 31.0292 176.7400 137 P 3.9995 0.0000 0.0000 64.6150 31.5339 176.3934 138 G 4.2735 9.2915 109.8704 44.9308 0.0000 174.7386 139 Y 4.1691 8.2960 123.2251 60.0834 38.8320 176.6288 140 R 3.9988 8.2589 119.4746 59.4915 29.8620 178.2488 141 V 3.5706 7.6544 117.5672 65.1114 31.2387 176.7992 142 A 4.9930 7.7904 119.4890 51.2422 19.5475 177.2155 143 K 4.2155 7.4359 115.0197 56.3210 34.0105 176.8344 144 R 4.2107 7.6169 114.7835 56.0477 30.5296 175.1455 145 D 4.5896 8.3538 115.7816 56.4066 41.8135 177.3322 146 K 3.9397 7.8963 118.1121 57.6856 32.4731 177.1816 147 A 4.3326 8.7689 126.9205 52.5176 16.2704 176.6349 148 S 4.5346 7.1306 112.9501 60.6149 64.1172 173.5152 149 R 4.5676 8.5618 118.5677 55.2955 33.6041 174.0229 150 S 4.5606 8.5681 119.3676 57.8013 63.5771 173.6729 151 I 3.9545 8.1901 126.2943 60.2703 37.7025 174.5450 152 P 4.4074 0.0000 0.0000 62.7138 32.0874 177.2830 153 T 3.8948 8.7437 111.9804 65.0903 68.5430 176.1206 154 K 4.2330 8.0514 116.6416 57.4777 31.6536 176.4493 155 H 4.8262 8.2434 116.0055 55.4038 31.3208 173.3200 156 R 4.2678 8.1731 117.9112 56.3808 30.7431 175.3670 157 L 4.5564 8.0454 120.6705 54.1731 43.7615 175.3068 158 N 5.2002 8.1144 118.3262 50.0975 43.2061 174.0041 159 P 4.3790 0.0000 0.0000 66.2407 31.5176 178.3776 160 A 3.8777 8.0595 118.7548 55.4919 18.1299 178.9637 161 D 4.4168 8.2392 115.8326 57.1959 40.9895 179.3598 162 A 4.1188 8.1746 121.5328 55.0544 18.5770 179.3376 163 V 3.3331 7.9084 116.7335 66.6855 31.4790 177.2508 164 A 3.7298 8.4616 116.5233 55.3798 17.6556 179.3777 165 F 4.0529 7.1145 120.4731 60.5723 40.4317 177.5770 166 I 3.5432 7.6122 117.6698 64.2556 37.2773 177.3925 167 E 4.6752 8.8481 121.9133 58.7550 29.1589 179.4476 168 S 4.5874 8.3947 111.4397 57.7105 64.1086 175.0366 169 T 4.7687 8.0973 114.1918 62.7398 70.3781 173.5138 170 Y 3.3923 7.8272 121.4652 57.3905 35.5623 168.4665 171 D 4.3503 6.4724 117.0215 53.8362 43.4527 175.7579 172 V 4.8652 7.9633 117.4401 61.1459 35.8079 177.9790 173 E 4.6100 8.6636 128.5778 56.2484 28.5906 177.0387 174 V 3.6183 7.7890 117.9064 61.9796 31.8377 174.9628 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 10 F 8.17 4.83 0.00 3.35 3.40 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 0.00 0.00 0.00 0.00 11 H 5.52 3.36 0.00 3.05 2.41 0.00 5.49 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 7.98 3.78 0.00 1.52 1.82 0.00 0.00 0.00 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 13 M 7.12 4.53 0.00 1.88 2.07 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.61 0.00 14 R 7.65 4.64 0.00 1.98 1.91 0.00 3.42 0.00 0.00 3.40 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.76 0.00 15 E 8.03 3.95 0.00 2.06 1.94 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 2.47 2.22 0.00 16 P 0.00 4.08 0.00 0.84 1.65 0.00 3.61 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 17 R 7.09 4.08 0.00 1.87 1.81 0.00 2.73 0.00 0.00 3.11 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.36 0.00 18 I 8.58 4.19 1.96 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.87 1.01 0.00 0.00 19 E 8.90 4.38 0.00 1.87 1.84 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 2.27 2.26 0.00 20 K 7.48 5.33 0.00 1.77 1.81 0.00 1.62 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.34 1.19 7.81 21 V 8.16 5.20 1.96 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 0.92 0.00 0.00 0.94 0.00 0.00 22 V 8.09 4.53 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 0.83 0.00 0.00 0.84 0.00 0.00 23 V 8.67 5.13 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 0.50 0.00 0.00 0.70 0.00 0.00 24 H 8.68 5.33 0.00 3.22 3.25 0.00 5.40 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 M 8.47 4.46 0.00 1.86 1.89 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 26 G 8.32 3.69 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 0.00 0.00 0.00 27 I 8.53 3.60 1.89 0.00 0.00 0.82 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 0.68 0.68 0.00 0.00 28 G 8.49 3.76 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 0.00 0.00 0.00 29 H 7.41 4.61 0.00 3.13 3.34 0.00 5.76 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *35 A 7.36 4.21 1.27 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 0.00 0.00 0.00 36 N 8.68 4.51 0.00 2.92 3.07 0.00 0.00 5.85 7.46 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 37 A 7.86 4.25 1.31 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 38 E 8.02 3.89 0.00 1.95 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 2.33 2.36 0.00 39 D 7.68 4.43 0.00 2.97 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 40 I 7.68 3.69 1.88 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 1.80 0.94 0.91 0.00 0.00 41 L 7.77 4.25 0.00 1.84 1.74 0.93 0.75 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 42 G 8.01 3.60 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 0.00 0.00 0.00 43 E 8.06 3.94 0.00 1.97 2.05 0.00 0.00 0.00 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 2.55 0.00 44 I 8.00 3.89 1.99 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 1.92 0.81 1.07 0.00 0.00 45 T 7.90 4.43 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 1.08 0.00 0.00 46 G 6.73 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 0.00 0.00 0.00 47 Q 7.83 4.55 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.91 0.00 0.00 0.00 0.00 0.00 2.20 2.29 0.00 48 M 8.32 4.10 0.00 2.01 2.03 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.52 0.00 49 P 0.00 4.87 0.00 2.04 2.06 0.00 3.69 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.07 0.00 50 V 8.14 4.38 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.94 0.00 0.00 51 R 8.89 4.35 0.00 1.72 1.85 0.00 3.34 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 52 T 9.16 4.52 4.32 0.00 0.00 0.00 0.00 0.00 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 53 K 8.90 4.99 0.00 1.62 1.74 0.00 1.73 0.00 0.00 0.61 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.26 7.81 54 A 8.07 4.87 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 55 K 8.26 4.59 0.00 1.60 1.68 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.77 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.42 7.81 56 R 8.67 4.03 0.00 1.98 1.97 0.00 3.20 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 1.52 1.64 0.00 57 T 8.30 4.26 4.26 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 0.00 0.00 0.00 1.25 0.00 0.00 58 V 7.93 4.47 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 1.08 0.00 0.00 0.98 0.00 0.00 59 G 8.95 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 0.00 0.00 0.00 60 E 8.17 4.22 0.00 2.14 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 2.31 2.34 0.00 61 F 7.50 4.20 0.00 3.00 3.14 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 0.00 0.00 0.00 62 D 8.04 4.99 0.00 2.98 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 63 I 8.29 3.66 1.94 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.79 1.03 0.00 0.00 64 R 8.01 3.77 0.00 1.76 2.06 0.00 3.21 0.00 0.00 3.10 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.63 0.00 65 E 8.29 3.84 0.00 2.04 1.79 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 2.37 2.31 0.00 66 G 7.77 4.04 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 0.00 67 D 8.54 4.54 0.00 2.63 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 68 P 0.00 4.45 0.00 1.93 2.06 0.00 3.59 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 2.02 2.14 0.00 69 I 9.41 4.50 1.95 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 1.19 1.77 0.84 0.00 0.00 70 G 7.40 4.28 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 0.00 0.00 0.00 71 A 7.92 5.76 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 72 K 8.27 5.24 0.00 1.76 1.89 0.00 1.60 0.00 0.00 1.66 0.00 0.00 2.75 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.37 1.22 7.81 73 V 7.97 4.62 1.92 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 0.89 0.00 0.00 0.87 0.00 0.00 74 T 8.53 4.58 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 1.15 0.00 0.00 75 L 8.56 4.66 0.00 1.59 1.53 0.48 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 76 R 7.92 4.67 0.00 1.61 1.75 0.00 3.32 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.61 0.00 77 D 8.65 4.32 0.00 2.88 2.63 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 78 E 9.03 3.92 0.00 2.01 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 0.00 2.43 2.45 0.00 79 M 8.22 3.92 0.00 1.98 2.32 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.60 0.00 80 A 8.38 4.26 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.11 3.96 0.00 2.05 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 2.45 2.45 0.00 82 E 8.24 4.08 0.00 2.04 2.05 0.00 0.00 0.00 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 2.44 0.00 83 F 7.80 4.50 0.00 3.28 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 8.09 4.09 0.00 1.92 1.79 1.04 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 85 Q 8.31 3.95 0.00 1.89 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.78 0.00 0.00 0.00 0.00 0.00 2.28 2.52 0.00 86 T 7.50 4.36 4.09 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 1.13 0.00 0.00 87 A 8.40 3.86 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 88 L 8.08 3.68 0.00 1.75 1.71 0.96 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.34 0.00 2.27 2.12 0.00 3.71 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.13 0.00 90 L 7.84 4.23 0.00 1.79 1.74 0.91 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 91 A 8.29 4.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.33 4.50 0.00 1.95 1.90 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 2.21 2.29 0.00 93 L 7.65 3.86 0.00 1.59 1.66 0.82 0.57 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 94 A 8.21 5.72 1.27 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 0.00 0.00 0.00 95 T 8.37 4.16 4.23 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 0.00 0.00 0.00 1.16 0.00 0.00 96 S 8.03 4.35 0.00 4.03 4.04 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 97 Q 8.22 4.49 0.00 2.40 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.92 0.00 0.00 0.00 0.00 0.00 2.55 2.50 0.00 98 F 8.13 5.01 0.00 3.10 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 D 10.13 4.72 0.00 2.65 2.79 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 0.00 100 D 8.57 4.58 0.00 2.87 2.73 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 0.00 101 T 8.44 4.35 4.34 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 1.23 0.00 0.00 102 G 7.83 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 N 7.63 5.17 0.00 2.68 2.85 0.00 0.00 6.60 8.13 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 0.00 104 F 7.81 4.82 0.00 2.82 1.91 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 0.00 105 S 7.97 5.12 0.00 3.94 3.70 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 0.00 106 F 8.32 4.67 0.00 3.18 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 0.00 107 G 9.03 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 *128 L 8.54 4.04 0.00 1.75 1.59 0.94 1.13 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 0.00 129 D 8.79 5.02 0.00 2.74 2.43 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 0.00 0.00 0.00 0.00 130 V 7.80 4.54 0.87 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 0.94 0.00 0.00 0.89 0.00 0.00 131 T 9.15 4.71 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 1.08 0.00 0.00 132 V 8.01 4.47 1.35 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 1.04 0.00 0.00 0.60 0.00 0.00 133 N 9.23 4.81 0.00 2.71 2.66 0.00 0.00 6.57 6.70 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 0.00 134 L 7.98 5.34 0.00 1.67 1.51 1.23 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 135 V 7.63 4.22 1.55 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 0.25 0.00 0.00 0.78 0.00 0.00 136 R 8.36 4.45 0.00 1.81 2.16 0.00 2.92 0.00 0.00 3.05 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.43 0.00 137 P 0.00 4.00 0.00 2.09 2.10 0.00 3.57 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.09 0.00 138 G 9.29 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 0.00 0.00 0.00 0.00 139 Y 8.30 4.17 0.00 2.98 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 0.00 140 R 8.26 4.00 0.00 1.94 1.95 0.00 3.24 0.00 0.00 3.27 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 141 V 7.65 3.57 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 0.99 0.00 0.00 1.01 0.00 0.00 142 A 7.79 4.99 0.99 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 0.00 0.00 143 K 7.44 4.22 0.00 1.64 1.79 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.87 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.81 1.34 7.81 144 R 7.62 4.21 0.00 1.91 1.96 0.00 3.14 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.56 0.00 145 D 8.35 4.59 0.00 2.66 2.73 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 0.00 146 K 7.90 3.94 0.00 1.80 1.73 0.00 1.80 0.00 0.00 1.81 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.42 7.81 147 A 8.77 4.33 1.28 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 0.00 0.00 148 S 7.13 4.53 0.00 3.90 3.99 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 0.00 149 R 8.56 4.57 0.00 1.84 1.72 0.00 3.07 0.00 0.00 3.08 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 150 S 8.57 4.56 0.00 3.90 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 0.00 151 I 8.19 3.95 1.98 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 1.43 1.16 1.05 0.00 0.00 152 P 0.00 4.41 0.00 2.21 2.00 0.00 3.65 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 153 T 8.74 3.89 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 1.24 0.00 0.00 154 K 8.05 4.23 0.00 1.79 1.92 0.00 1.60 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.51 7.81 155 H 8.24 4.83 0.00 3.05 3.39 0.00 5.94 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 R 8.17 4.27 0.00 2.00 1.90 0.00 3.43 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.75 0.00 157 L 8.05 4.56 0.00 1.54 1.83 0.89 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 158 N 8.11 5.20 0.00 2.91 2.68 0.00 0.00 6.82 8.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 P 0.00 4.38 0.00 2.15 2.16 0.00 3.64 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.43 0.00 160 A 8.06 3.88 1.28 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 0.00 0.00 161 D 8.24 4.42 0.00 2.80 2.79 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 0.00 162 A 8.17 4.12 1.79 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 0.00 0.00 163 V 7.91 3.33 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 0.83 0.00 0.00 0.26 0.00 0.00 164 A 8.46 3.73 1.35 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 0.00 0.00 0.00 165 F 7.11 4.05 0.00 3.13 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 I 7.61 3.54 2.01 0.00 0.00 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 1.64 1.07 0.90 0.00 0.00 167 E 8.85 4.68 0.00 1.98 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.16 0.00 168 S 8.39 4.59 0.00 3.84 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 T 8.10 4.77 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 1.14 0.00 0.00 170 Y 7.83 3.39 0.00 2.97 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 0.00 171 D 6.47 4.35 0.00 2.89 2.83 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 0.00 172 V 7.96 4.87 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.90 0.00 0.00 173 E 8.66 4.61 0.00 1.96 1.46 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 2.34 2.22 0.00 174 V 7.79 3.62 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.85 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.