NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 F 4.8253 8.1676 115.8659 57.1454 40.3260 177.1388 11 H 4.0991 5.2900 118.1215 54.2302 29.0228 170.4767 12 E 4.6006 9.5692 123.6902 57.7585 29.9796 177.0527 13 M 4.5375 7.0988 114.4568 55.0540 32.1411 176.5863 14 R 4.6217 7.7165 116.4941 55.3260 32.8792 175.2662 15 E 4.1508 8.0697 117.3651 54.7502 30.4058 174.5820 16 P 4.1515 0.0000 0.0000 61.9878 32.3031 174.8788 17 R 4.2564 6.9919 112.5181 55.6992 32.8662 173.5664 18 I 4.3036 8.5409 121.7028 60.5500 38.4911 175.1185 19 E 4.4923 8.5140 128.1120 54.5062 31.2493 171.8225 20 K 4.6534 8.7242 131.9816 55.9676 33.8768 175.3063 21 V 4.6354 7.6913 119.8792 59.8720 34.2374 173.8113 22 V 4.0834 8.1142 128.7187 62.4990 32.5880 174.9625 23 V 4.7214 8.5105 122.0071 59.0191 33.0888 173.8350 24 H 5.0204 8.5139 124.8767 54.4815 33.2103 172.5439 25 M 4.3573 8.5363 124.8349 52.7678 32.2971 176.4721 26 G 3.9441 7.7115 113.1107 46.5828 0.0000 170.3053 27 I 4.1208 7.4022 122.9816 60.6236 39.6578 177.1203 28 G 4.0559 7.6571 111.1674 45.4729 0.0000 172.7553 29 H 4.3143 7.6499 113.6210 55.7631 31.8695 173.4656 *35 A 4.2174 7.2990 122.9510 51.9928 19.1680 176.1014 36 N 4.2589 8.7882 111.6338 56.1221 36.7591 176.6077 37 A 4.1384 7.9586 122.6643 54.5840 18.3848 178.8560 38 E 3.8974 8.3785 118.1050 59.9682 29.3728 178.8629 39 D 4.4259 7.5176 119.0522 57.7503 40.8754 179.3426 40 I 3.8875 7.7274 112.4502 64.2627 37.1021 177.8875 41 L 4.0610 7.7826 121.0218 57.4422 41.3889 179.7773 42 G 3.6229 8.3937 105.8480 47.5340 0.0000 175.6525 43 E 4.0364 7.6932 119.8745 59.1236 29.9167 178.7444 44 I 3.9314 8.0029 117.4027 63.2122 37.9607 176.0305 45 T 4.5725 7.5292 106.5939 64.3113 70.3329 174.4439 46 G 3.9706 7.3387 108.7296 44.2414 0.0000 173.3278 47 Q 4.5720 7.7347 116.1007 54.2563 31.3061 174.0190 48 M 3.8381 8.5222 119.0843 55.6726 32.5160 174.7741 49 P 4.8669 0.0000 0.0000 61.6264 33.9012 174.9501 50 V 4.5290 8.2175 118.8298 61.2022 34.9736 175.3111 51 R 4.3908 8.6739 124.8936 56.8569 31.2111 176.8409 52 T 4.5066 8.7489 119.2514 61.3198 69.3757 173.9857 53 K 5.3645 8.6673 124.4587 55.8448 33.3563 175.3298 54 A 4.8910 8.6213 122.5882 50.2300 22.1646 175.7346 55 K 4.5032 8.3902 117.4194 55.5599 35.1034 174.9688 56 R 4.1673 8.4503 122.5956 56.3070 29.6411 176.0282 57 T 4.5021 8.2836 117.4874 62.5718 69.6013 174.5449 58 V 4.5658 8.9307 125.6363 60.4398 35.0175 176.2049 59 G 3.7815 8.8624 112.5334 48.6598 0.0000 174.9681 60 E 4.2575 8.1001 118.7287 58.3103 28.2314 176.1049 61 F 4.2146 7.7496 112.7745 60.3962 38.9432 174.9500 62 D 4.9413 7.8484 116.9887 51.9857 40.2952 175.6553 63 I 4.0887 7.5994 114.3276 61.5334 39.3747 177.4165 64 R 3.8220 7.9152 121.4019 56.2297 29.4363 174.7182 65 E 3.9348 8.1968 128.9657 58.3934 30.2427 176.1584 66 G 3.8719 7.9682 108.9671 46.5977 0.0000 171.9892 67 D 4.5460 8.2108 121.5185 51.7441 42.2857 173.5013 68 P 4.6010 0.0000 0.0000 62.4519 31.8649 176.1875 69 I 4.4885 9.0672 128.6450 59.7422 38.1503 175.1777 70 G 4.2538 7.6505 105.9900 43.1969 0.0000 172.7727 71 A 5.9400 8.3228 120.7443 49.0171 23.1425 174.9828 72 K 5.1200 8.3164 116.8985 54.2946 37.2544 175.3369 73 V 4.5555 7.9868 119.6907 61.7725 34.8935 173.4221 74 T 4.6443 8.5400 119.0063 60.2238 69.5455 173.5622 75 L 4.4278 8.1554 128.1968 53.9297 43.1053 176.3359 76 R 4.8151 8.3309 122.0445 54.4478 33.3702 176.8266 77 D 4.2875 8.8934 120.6732 55.5927 39.3398 176.2319 78 E 3.9671 9.0110 124.2599 61.0759 27.9126 178.2993 79 M 3.9790 8.2944 117.7594 58.5304 31.7724 178.6751 80 A 4.1976 8.0012 120.6151 55.1386 18.8258 179.1936 81 E 3.9551 8.1042 116.6108 59.6183 29.4997 179.1127 82 E 4.0729 8.4354 118.6826 58.7927 29.9440 178.8795 83 F 4.4997 7.5133 118.2747 60.6476 39.9553 177.5926 84 L 4.1644 8.3824 118.6707 57.6452 41.0418 179.3375 85 Q 4.3217 8.0899 115.5204 56.2331 28.3812 176.0315 86 T 4.5233 7.8674 110.4797 61.7221 74.9847 175.1233 87 A 3.9343 7.4777 124.8360 54.0376 18.2143 179.1675 88 L 3.5120 7.8113 115.4246 57.5188 41.7473 177.9565 89 P 4.1947 0.0000 0.0000 65.8066 31.3524 177.8335 90 L 4.2382 7.9433 114.2507 54.6023 41.9353 176.5371 91 A 4.7981 7.7026 122.1472 50.3999 21.5009 174.9066 92 E 4.4170 8.1129 116.9498 58.4030 31.7943 176.3907 93 L 3.6663 6.5421 116.9990 51.8576 43.9477 175.7504 94 A 4.5172 8.6242 122.8192 52.5671 21.1896 174.9166 95 T 3.1070 8.5444 110.8584 62.7677 69.6747 173.7044 96 S 3.8870 8.6821 120.3308 60.4184 63.0969 173.4782 97 Q 4.4580 8.0588 118.8772 55.9307 28.7632 174.8097 98 F 4.9994 7.8649 113.5637 54.7495 41.9400 174.9118 99 D 4.6652 9.4503 124.1853 54.3580 41.5846 176.1283 100 D 4.6602 8.5642 120.6761 55.6865 41.2263 177.4709 101 T 4.5193 7.7745 113.7062 63.0732 68.7462 174.6402 102 G 3.9537 8.3486 108.6339 46.5748 0.0000 172.9856 103 N 5.3314 7.6736 116.7157 51.2652 42.0250 173.0469 104 F 4.6461 7.3410 108.9640 56.3169 41.1848 172.9860 105 S 5.0172 8.8501 116.5811 56.3866 64.7877 172.7897 106 F 4.9528 8.7244 121.1859 55.7975 41.3939 173.0026 107 G 4.5336 8.9166 102.9673 44.4413 0.0000 172.5819 *128 L 4.0477 8.5095 121.6092 55.1868 43.5210 176.9604 129 D 5.2164 8.3027 125.0441 53.1312 44.2486 176.2832 130 V 4.3056 7.8490 120.5681 62.6865 34.2144 172.9973 131 T 4.6815 8.8213 125.8167 61.6885 71.6835 174.2827 132 V 4.2809 7.6077 124.0429 61.0466 34.3209 173.7584 133 N 4.7199 8.5592 127.7077 52.7385 40.0989 173.7183 134 L 5.3314 8.0989 125.5530 53.1755 44.6720 175.8683 135 V 4.2306 7.8067 120.1375 60.9440 34.7605 172.1661 136 R 4.4340 8.3901 117.9065 55.4723 31.0081 176.7674 137 P 3.9738 0.0000 0.0000 65.1720 32.0348 178.0322 138 G 4.1368 8.0696 104.3488 45.4539 0.0000 175.2317 139 Y 4.4193 7.7037 124.2341 60.1284 38.7856 176.4581 140 R 3.7585 8.2260 119.5186 59.4455 29.9615 178.0301 141 V 3.4824 7.4189 116.4165 65.9734 31.1595 177.5991 142 A 4.2700 7.7913 119.2830 52.7185 18.7078 177.8665 143 K 4.2509 7.4513 112.7506 56.0012 33.1228 176.3752 144 R 4.3182 7.7742 116.4941 55.3766 31.0592 176.2277 145 D 4.4960 8.5002 116.6147 56.6366 41.0916 177.5976 146 K 4.1087 7.8913 118.3911 57.0048 32.7895 176.8392 147 A 4.4391 8.7889 125.3069 52.6061 16.3002 177.1586 148 S 4.5759 7.1343 112.2886 60.8224 63.6969 173.6381 149 R 4.6617 8.5152 119.9682 54.8710 33.8082 174.0357 150 S 4.3223 8.5952 120.1976 58.0963 63.2718 173.7615 151 I 3.9606 8.3477 128.0397 60.3627 37.6261 174.3508 152 P 4.4420 0.0000 0.0000 62.7303 31.9319 177.3964 153 T 3.9218 8.5948 110.9474 64.8459 68.9020 176.7466 154 K 3.9710 8.0827 120.5814 59.5043 32.1575 177.2440 155 H 4.5635 7.8713 115.6094 56.7114 30.0003 175.3023 156 R 4.2099 7.3219 117.5798 56.4387 30.6723 175.3258 157 L 4.4581 8.1119 121.3594 54.1129 43.3921 176.3165 158 N 4.8747 8.3875 123.1690 51.3603 41.3233 174.4185 159 P 4.3174 0.0000 0.0000 66.0343 31.4582 178.6656 160 A 3.8690 7.9235 118.4893 55.4701 17.9731 179.2288 161 D 4.4035 8.2296 116.2883 57.1492 40.7675 179.1500 162 A 4.1189 8.0808 121.5650 55.0834 18.5656 179.3622 163 V 3.1994 7.6649 116.6107 66.1865 31.4290 177.7408 164 A 3.9943 7.8153 120.0397 55.2961 17.9869 179.0606 165 F 4.1689 7.6449 116.5599 61.7456 39.6660 177.2664 166 I 3.5258 7.8257 118.9636 64.3320 36.8081 177.7193 167 E 4.5004 8.4385 120.5825 58.6863 29.3501 178.4722 168 S 4.4929 7.8568 111.0959 57.9014 64.3805 175.0767 169 T 4.7465 7.8974 112.7102 62.5335 70.6370 173.3345 170 Y 3.4043 7.6837 116.6977 57.3496 34.8595 168.5488 171 D 4.4174 6.7078 116.9053 53.9495 43.5463 175.6173 172 V 4.7298 7.8146 117.0466 61.1165 35.6388 177.8124 173 E 4.3164 8.8142 120.7609 56.4618 28.6269 177.3656 174 V 3.9769 7.7961 116.4907 63.6836 31.7403 175.1052 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 3.38 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 11 H 5.29 4.10 0.00 3.15 2.47 0.00 5.62 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 12 E 9.57 4.60 0.00 1.66 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 2.07 2.17 0.00 13 M 7.10 4.54 0.00 2.10 2.03 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 2.52 2.55 0.00 14 R 7.72 4.62 0.00 1.81 1.99 0.00 3.48 0.00 0.00 3.40 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 15 E 8.07 4.15 0.00 2.17 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 2.35 2.30 0.00 16 P 0.00 4.15 0.00 0.78 1.43 0.00 3.67 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 2.00 1.97 0.00 17 R 6.99 4.26 0.00 1.61 1.83 0.00 2.74 0.00 0.00 3.13 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.45 0.00 18 I 8.54 4.30 1.99 0.00 0.00 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 1.45 0.92 0.98 0.00 0.00 19 E 8.51 4.49 0.00 1.90 1.75 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 2.23 2.25 0.00 20 K 8.72 4.65 0.00 2.11 2.01 0.00 1.64 0.00 0.00 1.71 0.00 0.00 3.08 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.32 7.81 21 V 7.69 4.64 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 1.42 0.00 0.00 0.98 0.00 0.00 22 V 8.11 4.08 1.97 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 0.83 0.00 0.00 0.85 0.00 0.00 23 V 8.51 4.72 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 0.47 0.00 0.00 0.69 0.00 0.00 24 H 8.51 5.02 0.00 3.17 3.02 0.00 5.62 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 M 8.54 4.36 0.00 1.81 1.90 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.39 0.00 26 G 7.71 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 0.00 0.00 0.00 27 I 7.40 4.12 1.78 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.77 0.73 0.00 0.00 28 G 7.66 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 29 H 7.65 4.31 0.00 3.13 3.32 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 7.30 4.22 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 36 N 8.79 4.26 0.00 2.92 3.11 0.00 0.00 5.88 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 7.96 4.14 1.32 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 0.00 0.00 38 E 8.38 3.90 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 2.49 0.00 39 D 7.52 4.43 0.00 2.80 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 40 I 7.73 3.89 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 1.82 0.94 0.92 0.00 0.00 41 L 7.78 4.06 0.00 1.85 1.72 0.94 0.92 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 8.39 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 43 E 7.69 4.04 0.00 2.06 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 0.00 2.34 2.51 0.00 44 I 8.00 3.93 1.97 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.87 1.09 0.00 0.00 45 T 7.53 4.57 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 0.76 0.00 0.00 46 G 7.34 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 47 Q 7.73 4.57 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.59 6.76 0.00 0.00 0.00 0.00 0.00 2.17 2.33 0.00 48 M 8.52 3.84 0.00 2.00 2.07 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 2.61 2.59 0.00 49 P 0.00 4.87 0.00 1.90 1.97 0.00 3.60 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 2.03 2.04 0.00 50 V 8.22 4.53 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 0.76 0.00 0.00 0.91 0.00 0.00 51 R 8.67 4.39 0.00 1.72 1.83 0.00 3.35 0.00 0.00 3.21 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 52 T 8.75 4.51 4.36 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 1.21 0.00 0.00 53 K 8.67 5.36 0.00 1.63 1.74 0.00 1.72 0.00 0.00 2.35 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.28 7.81 54 A 8.62 4.89 1.23 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 0.00 0.00 0.00 55 K 8.39 4.50 0.00 1.71 1.69 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.40 7.81 56 R 8.45 4.17 0.00 1.99 2.00 0.00 3.20 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 57 T 8.28 4.50 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 1.24 0.00 0.00 58 V 8.93 4.57 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 1.00 0.00 0.00 0.94 0.00 0.00 59 G 8.86 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 60 E 8.10 4.26 0.00 2.14 2.08 0.00 0.00 0.00 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 7.75 4.21 0.00 3.02 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 62 D 7.85 4.94 0.00 2.92 2.54 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 0.00 63 I 7.60 4.09 1.93 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.82 1.06 0.00 0.00 64 R 7.92 3.82 0.00 1.75 2.09 0.00 3.19 0.00 0.00 3.10 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.61 0.00 65 E 8.20 3.93 0.00 1.97 1.80 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 2.29 2.30 0.00 66 G 7.97 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 0.00 0.00 0.00 67 D 8.21 4.55 0.00 2.64 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 68 P 0.00 4.60 0.00 1.94 2.05 0.00 3.59 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 69 I 9.07 4.49 1.96 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 1.14 0.83 0.98 0.00 0.00 70 G 7.65 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 0.00 0.00 0.00 0.00 71 A 8.32 5.94 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 8.32 5.12 0.00 1.75 1.87 0.00 1.59 0.00 0.00 1.66 0.00 0.00 2.77 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.34 1.20 7.81 73 V 7.99 4.56 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 0.87 0.00 0.00 0.85 0.00 0.00 74 T 8.54 4.64 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 1.16 0.00 0.00 75 L 8.16 4.43 0.00 1.45 1.55 0.36 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 76 R 8.33 4.82 0.00 1.64 1.80 0.00 3.33 0.00 0.00 3.23 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 77 D 8.89 4.29 0.00 2.88 2.24 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 78 E 9.01 3.97 0.00 2.02 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 2.42 2.43 0.00 79 M 8.29 3.98 0.00 2.01 2.29 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 2.70 2.59 0.00 80 A 8.00 4.20 1.42 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 0.00 0.00 0.00 81 E 8.10 3.96 0.00 2.16 1.99 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 2.45 2.63 0.00 82 E 8.44 4.07 0.00 2.01 2.08 0.00 0.00 0.00 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 2.55 0.00 83 F 7.51 4.50 0.00 3.22 3.27 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 84 L 8.38 4.16 0.00 1.92 1.80 1.09 1.43 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 8.09 4.32 0.00 1.91 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.70 0.00 0.00 0.00 0.00 0.00 2.21 2.52 0.00 86 T 7.87 4.52 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 1.14 0.00 0.00 87 A 7.48 3.93 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 88 L 7.81 3.51 0.00 1.70 1.69 0.96 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.19 0.00 2.10 2.12 0.00 3.68 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.18 0.00 90 L 7.94 4.24 0.00 1.75 1.73 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 91 A 7.70 4.80 0.75 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 0.00 0.00 92 E 8.11 4.42 0.00 1.93 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 2.19 2.28 0.00 93 L 6.54 3.67 0.00 1.74 1.80 1.00 0.77 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 94 A 8.62 4.52 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 95 T 8.54 3.11 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 1.09 0.00 0.00 96 S 8.68 3.89 0.00 4.23 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 97 Q 8.06 4.46 0.00 2.15 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 98 F 7.86 5.00 0.00 3.04 3.02 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 99 D 9.45 4.67 0.00 2.65 2.84 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 0.00 100 D 8.56 4.66 0.00 2.73 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 7.77 4.52 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 1.22 0.00 0.00 102 G 8.35 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 0.00 103 N 7.67 5.33 0.00 2.78 2.80 0.00 0.00 6.59 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 7.34 4.65 0.00 2.63 1.56 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 0.00 105 S 8.85 5.02 0.00 3.72 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 0.00 106 F 8.72 4.95 0.00 3.16 3.19 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 0.00 107 G 8.92 4.53 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 0.00 0.00 0.00 *128 L 8.51 4.05 0.00 1.76 1.60 0.95 1.15 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 0.00 129 D 8.30 5.22 0.00 2.68 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 0.00 130 V 7.85 4.31 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 0.00 0.00 0.82 0.00 0.00 0.97 0.00 0.00 131 T 8.82 4.68 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 1.04 0.00 0.00 132 V 7.61 4.28 1.14 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 1.07 0.00 0.00 0.74 0.00 0.00 133 N 8.56 4.72 0.00 2.77 2.91 0.00 0.00 6.59 7.81 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 0.00 134 L 8.10 5.33 0.00 1.73 1.51 1.36 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 135 V 7.81 4.23 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 0.53 0.00 0.00 136 R 8.39 4.43 0.00 1.82 1.98 0.00 2.99 0.00 0.00 3.10 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.39 0.00 137 P 0.00 3.97 0.00 2.10 2.11 0.00 3.63 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 138 G 8.07 4.14 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 0.00 0.00 0.00 139 Y 7.70 4.42 0.00 3.16 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 8.23 3.76 0.00 1.92 1.94 0.00 3.26 0.00 0.00 3.26 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 141 V 7.42 3.48 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.97 0.00 0.00 142 A 7.79 4.27 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 K 7.45 4.25 0.00 1.57 1.73 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.80 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.63 1.16 7.81 144 R 7.77 4.32 0.00 1.88 1.93 0.00 3.03 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 1.88 1.55 0.00 145 D 8.50 4.50 0.00 2.67 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 7.89 4.11 0.00 1.80 1.71 0.00 1.80 0.00 0.00 1.81 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.42 7.81 147 A 8.79 4.44 1.30 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 0.00 0.00 148 S 7.13 4.58 0.00 3.79 3.98 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 0.00 149 R 8.52 4.66 0.00 1.91 1.73 0.00 3.13 0.00 0.00 3.09 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 150 S 8.60 4.32 0.00 3.92 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 0.00 151 I 8.35 3.96 2.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.21 1.04 0.00 0.00 152 P 0.00 4.44 0.00 2.22 2.01 0.00 3.67 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 153 T 8.59 3.92 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 1.23 0.00 0.00 154 K 8.08 3.97 0.00 1.79 1.94 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.51 7.81 155 H 7.87 4.56 0.00 3.05 3.37 0.00 5.94 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 R 7.32 4.21 0.00 2.00 1.86 0.00 3.41 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.74 0.00 157 L 8.11 4.46 0.00 1.51 1.72 0.89 0.92 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 0.00 158 N 8.39 4.87 0.00 3.12 2.72 0.00 0.00 6.65 7.83 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 0.00 159 P 0.00 4.32 0.00 2.16 2.21 0.00 3.62 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.48 0.00 160 A 7.92 3.87 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.23 4.40 0.00 2.82 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 8.08 4.12 1.63 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 0.00 0.00 163 V 7.66 3.20 1.99 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 0.75 0.00 0.00 0.29 0.00 0.00 164 A 7.82 3.99 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 0.00 165 F 7.64 4.17 0.00 3.04 3.37 0.00 0.00 0.00 0.00 0.00 0.00 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 7.83 3.53 1.85 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.87 0.89 0.00 0.00 167 E 8.44 4.50 0.00 1.91 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 2.27 2.14 0.00 168 S 7.86 4.49 0.00 3.88 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 0.00 169 T 7.90 4.75 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 1.23 0.00 0.00 170 Y 7.68 3.40 0.00 3.01 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 6.71 4.42 0.00 2.91 2.85 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 0.00 172 V 7.81 4.73 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 0.84 0.00 0.00 0.89 0.00 0.00 173 E 8.81 4.32 0.00 1.98 1.43 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 2.40 2.20 0.00 174 V 7.80 3.98 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 1.02 0.00 0.00 0.88 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.