NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 43 A 4.2419 8.2649 123.5655 51.9521 18.8938 175.8196 44 Q 3.7688 8.0458 123.6643 56.6976 28.7376 176.5079 45 H 4.9281 8.9430 121.6817 54.2148 33.6659 173.0192 46 I 4.4192 8.2263 121.3290 60.9118 37.5459 175.7971 47 V 4.3589 8.4830 128.8411 60.3008 33.1307 173.2879 48 P 5.0748 0.0000 0.0000 62.6903 31.8830 175.2800 49 C 5.2822 8.9692 120.4687 58.2283 32.8395 173.6469 50 T 4.5861 8.8733 110.6953 60.5422 70.2087 176.1449 51 I 3.7095 8.8217 123.9263 64.5293 37.0904 178.8601 52 S 4.1066 8.3150 115.2774 61.6570 62.4046 176.7391 53 Q 3.9541 7.8778 120.5672 58.5606 28.8234 178.4059 54 L 4.0466 7.7162 119.4801 57.9408 41.5069 179.7132 55 L 4.0242 7.9902 117.5611 57.3750 41.5946 178.8395 56 S 4.5071 7.5995 112.0900 57.6849 63.3838 174.0762 57 A 4.4927 7.2825 125.5285 52.0896 18.8769 177.2888 58 T 4.3057 8.9276 113.8194 60.7826 70.8814 174.0311 59 L 4.5477 8.6144 128.2090 53.6124 41.8123 174.9352 60 V 4.1067 8.2904 126.1978 61.5595 33.1210 175.5242 61 D 4.5644 9.0923 128.8486 56.0474 37.7026 173.0562 62 E 3.7186 8.1463 111.0697 56.6016 28.7860 173.8243 63 V 4.4093 6.9943 114.7704 59.6253 35.2041 173.9940 64 F 5.0959 8.7558 123.5066 57.3736 40.4972 174.5655 65 R 5.1472 9.4289 122.0388 54.5107 34.2072 174.2778 66 I 4.4403 9.1433 125.2525 59.2381 38.8846 175.7108 67 G 3.6968 8.8464 118.8807 47.1257 0.0000 173.7841 68 N 4.5648 8.7976 121.1548 52.7687 38.0677 175.1108 69 V 3.8899 7.7683 121.2489 61.9921 31.7782 174.4710 70 E 4.7520 8.7071 129.1482 55.5727 30.3183 175.5489 71 I 4.7212 8.8305 119.4413 59.3162 40.1777 173.6834 72 S 4.5664 8.1571 116.0028 59.2409 64.8634 172.2188 73 Q 4.7885 7.8684 119.5198 55.5432 30.4519 174.5991 74 V 5.2338 9.0805 119.2454 59.8198 36.7301 174.3052 75 T 5.2779 8.5797 111.0477 59.9913 71.8904 173.0600 76 I 4.7311 8.5710 116.7262 59.0840 41.5301 174.0857 77 V 4.7895 7.9005 122.6551 61.4719 33.9370 174.6823 78 G 4.0488 8.5754 113.4172 46.0014 0.0000 171.4241 79 I 4.2957 7.9001 120.9371 59.6543 39.0557 175.9845 80 I 4.1349 8.3946 128.1984 61.8262 37.1500 176.8173 81 R 4.4503 9.1185 127.2432 57.9654 31.4252 176.6387 82 H 4.9490 7.9287 116.6224 54.7776 33.5715 172.2190 83 A 4.7472 8.2578 125.7079 50.1631 21.6618 175.1301 84 E 4.3570 8.5539 122.7012 54.1376 31.7733 175.7472 85 K 4.1909 8.4409 125.8643 56.2292 33.1853 175.9441 86 A 4.7231 8.7817 127.3226 49.6705 22.4734 175.3470 87 P 4.2574 0.0000 0.0000 65.7243 31.5207 177.8505 88 T 4.4174 7.8794 106.1167 62.9226 69.9077 173.7671 89 N 5.1314 7.9200 118.0972 51.4343 41.5155 173.3712 90 I 4.4856 8.6295 120.0408 59.3205 40.6535 174.8413 91 V 4.4727 7.8619 126.8032 61.4397 33.4689 173.8820 92 Y 5.1760 8.9718 126.2336 56.4233 40.8041 175.0216 93 K 4.9421 9.0700 123.1304 55.3415 33.8901 175.5030 94 I 4.8677 8.6908 126.6553 59.3730 40.4692 174.5348 95 D 5.0461 8.8019 125.6486 52.7411 43.6152 174.3759 96 D 4.6145 8.4613 129.2498 53.2100 41.7486 176.3781 97 M 4.4861 8.6121 120.3567 56.0233 32.4083 176.7034 98 T 4.1041 8.0754 109.3694 63.0420 69.5622 173.8477 99 A 4.3001 7.2696 122.2519 51.5503 21.8125 175.2582 100 A 4.1737 8.4613 120.0649 51.7203 18.9234 175.9196 101 P 4.5567 0.0000 0.0000 63.2176 32.2146 175.5323 102 M 4.6157 8.9224 123.2469 53.6753 34.9317 174.8098 103 D 4.8482 8.6056 125.3553 54.5061 42.5188 175.2901 104 V 4.6568 9.1834 123.3408 61.1852 34.6449 173.9008 105 R 4.6974 8.7914 129.4987 54.8838 31.9178 174.5468 106 Q 4.9274 9.1703 128.1245 54.0378 31.6963 174.0824 107 W 4.8658 9.0345 127.3386 56.2771 29.9334 176.5406 108 V 3.8794 8.2193 122.7726 60.5018 31.6856 175.3080 *115 S 4.2111 8.2642 114.1646 58.9638 64.1286 172.3532 116 E 4.4851 8.2752 122.8403 53.9478 30.8200 173.1241 117 N 4.1618 8.8312 124.8485 52.9495 36.6179 173.7279 118 T 4.7018 8.0101 118.1965 61.0025 68.3476 174.8629 119 V 3.9149 8.1310 121.5719 61.0269 32.2961 176.2016 120 V 3.7513 8.5563 124.1564 62.0237 32.0509 174.4380 121 P 4.4330 0.0000 0.0000 61.6414 31.9311 174.3470 122 P 4.5667 0.0000 0.0000 64.2386 31.7583 176.1315 123 E 3.7533 9.0133 118.9845 57.3060 27.4783 174.1444 124 T 4.5767 7.1128 115.6984 62.1161 70.7768 173.6855 125 Y 4.4497 8.5606 124.1170 57.9513 39.3211 175.0443 126 V 4.8772 8.9482 116.9465 59.4026 36.4357 174.2040 127 K 4.8542 9.1283 124.4977 54.9453 34.2556 175.0859 128 V 4.7415 8.9176 127.2659 60.9395 34.3278 173.8271 129 A 4.9108 8.2143 129.4657 50.4362 21.5025 175.5870 130 G 4.3029 8.0933 108.9646 46.2752 0.0000 171.2827 131 H 5.6353 8.7861 116.4027 53.6865 32.3541 173.3439 132 L 4.3924 8.6773 125.1375 55.0624 42.6714 176.3340 133 R 5.2031 8.9037 124.5605 54.9064 33.8624 175.9554 134 S 4.3519 8.3366 116.2376 58.2968 63.3108 173.3085 135 F 4.4934 8.1336 118.3912 57.9601 38.3491 174.6415 136 Q 4.4907 8.2479 124.7746 55.1564 31.5636 176.6341 137 N 4.4935 8.6391 120.7340 53.0655 38.3522 174.2220 138 K 4.3984 7.4690 118.8531 54.4273 32.8401 175.7259 139 K 4.6329 8.4442 126.4491 56.4523 33.2291 176.2904 140 S 4.6937 8.9803 117.2697 57.6732 67.2132 172.5296 141 L 5.0992 8.4057 119.4819 53.1271 44.2229 176.3285 142 V 4.6212 8.7247 123.4783 61.5202 32.5978 174.3532 143 A 4.8304 8.7395 131.3061 51.3348 18.9401 176.9492 144 F 4.7346 8.3958 117.5037 57.9769 39.6016 176.3197 145 K 4.5981 7.3430 120.0859 54.3682 35.4177 175.0601 146 I 4.7192 8.4737 127.0372 59.8654 40.0244 174.3474 147 M 4.5423 8.8031 128.7173 52.6867 34.1341 173.3193 148 P 4.6991 0.0000 0.0000 62.9514 32.2600 176.1885 149 L 4.1907 8.9217 125.2869 54.8710 41.3901 177.1191 150 E 4.1922 8.9823 123.6233 57.2173 30.6458 175.8843 151 D 4.8232 7.7623 117.7621 52.1418 43.1121 176.1048 152 M 4.2706 8.5730 126.0259 57.2775 32.1405 178.0086 153 N 4.4285 8.6180 117.2871 56.0498 38.5754 176.9545 154 E 3.9985 8.1498 120.1420 59.1085 29.4274 178.9814 155 F 4.1852 7.9751 120.8275 61.6401 39.5782 177.3191 156 T 3.2773 7.7663 114.7508 66.8425 68.2046 176.6307 157 T 3.8388 7.9723 117.6105 66.7022 68.3303 176.2016 158 H 4.3394 8.2226 121.6402 58.6272 29.8170 177.2435 159 I 3.5683 7.2923 121.1692 64.5141 36.9957 178.2533 160 L 3.9424 7.6132 119.2526 57.9254 41.1512 179.6163 161 E 3.9084 8.3829 118.6444 59.1955 29.4102 179.2095 162 V 3.7826 7.9182 118.7014 66.3248 31.4566 178.2030 163 I 3.6812 7.4736 118.6656 64.3899 37.0054 178.0026 164 N 4.2399 8.1849 117.6330 56.5209 38.6869 176.6879 165 A 3.9205 8.3889 122.5014 55.7126 18.6025 179.4579 166 H 4.0476 8.3160 114.6424 58.8868 28.5461 177.8418 167 M 4.0228 8.3240 120.6490 58.6140 32.1075 178.6614 168 V 3.7102 7.8046 119.2691 64.6105 31.5208 178.3983 169 L 4.0010 8.2517 120.2796 57.4780 41.2454 179.5902 170 S 4.1932 7.8761 113.1634 61.0992 63.0108 176.4297 171 K 4.1233 7.6229 121.5069 59.1626 31.9627 178.8387 172 A 4.1399 8.0996 119.5580 54.0334 18.3269 177.6640 173 N 4.6220 7.5606 119.1967 53.3885 38.9975 174.7285 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 43 A 8.26 4.24 1.26 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 0.00 0.00 0.00 44 Q 8.05 3.77 0.00 2.14 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.68 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 45 H 8.94 4.93 0.00 3.11 3.22 0.00 5.69 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 I 8.23 4.42 1.92 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.57 0.96 0.00 0.00 47 V 8.48 4.36 2.09 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 0.85 0.00 0.00 1.00 0.00 0.00 48 P 0.00 5.07 0.00 1.95 1.99 0.00 3.33 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.79 0.00 49 C 8.97 5.28 0.00 2.83 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 50 T 8.87 4.59 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 51 I 8.82 3.71 2.05 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 1.56 0.68 0.89 0.00 0.00 52 S 8.31 4.11 0.00 4.02 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 0.00 53 Q 7.88 3.95 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.98 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 54 L 7.72 4.05 0.00 1.80 1.60 0.87 0.35 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 55 L 7.99 4.02 0.00 1.57 1.72 0.90 0.91 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 56 S 7.60 4.51 0.00 4.03 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 57 A 7.28 4.49 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 58 T 8.93 4.31 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 59 L 8.61 4.55 0.00 1.45 1.53 -0.20 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 60 V 8.29 4.11 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 0.93 0.00 0.00 0.93 0.00 0.00 61 D 9.09 4.56 0.00 2.84 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 62 E 8.15 3.72 0.00 2.02 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 0.00 2.22 2.36 0.00 63 V 6.99 4.41 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 0.71 0.00 0.00 0.99 0.00 0.00 64 F 8.76 5.10 0.00 3.39 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 65 R 9.43 5.15 0.00 1.72 2.01 0.00 3.10 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 66 I 9.14 4.44 1.94 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 1.19 0.75 0.92 0.00 0.00 67 G 8.85 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 0.00 0.00 0.00 68 N 8.80 4.56 0.00 2.86 2.95 0.00 0.00 5.80 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 69 V 7.77 3.89 2.25 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 0.84 0.00 0.00 0.96 0.00 0.00 70 E 8.71 4.75 0.00 2.00 1.87 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 2.35 2.45 0.00 71 I 8.83 4.72 1.92 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 1.27 0.98 0.96 0.00 0.00 72 S 8.16 4.57 0.00 3.96 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 73 Q 7.87 4.79 0.00 2.22 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.50 0.00 0.00 0.00 0.00 0.00 2.48 2.27 0.00 74 V 9.08 5.23 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 0.70 0.00 0.00 0.91 0.00 0.00 75 T 8.58 5.28 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 1.21 0.00 0.00 76 I 8.57 4.73 1.86 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 1.06 0.89 0.93 0.00 0.00 77 V 7.90 4.79 2.09 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 1.17 0.00 0.00 0.76 0.00 0.00 78 G 8.58 4.05 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 0.00 0.00 0.00 79 I 7.90 4.30 1.55 0.00 0.00 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 -0.30 0.01 0.68 0.00 0.00 80 I 8.39 4.13 1.80 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 1.20 0.57 1.06 0.00 0.00 81 R 9.12 4.45 0.00 1.73 1.96 0.00 3.30 0.00 0.00 3.07 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.66 0.00 82 H 7.93 4.95 0.00 3.13 3.08 0.00 5.61 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 8.26 4.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 E 8.55 4.36 0.00 1.82 1.78 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 2.15 2.14 0.00 85 K 8.44 4.19 0.00 1.67 1.63 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.36 1.36 7.81 86 A 8.78 4.72 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 87 P 0.00 4.26 0.00 2.07 2.18 0.00 3.67 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 88 T 7.88 4.42 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 89 N 7.92 5.13 0.00 2.10 2.32 0.00 0.00 6.62 7.60 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 90 I 8.63 4.49 1.61 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 0.95 0.88 0.02 0.00 0.00 91 V 7.86 4.47 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 0.89 0.00 0.00 0.76 0.00 0.00 92 Y 8.97 5.18 0.00 2.91 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 93 K 9.07 4.94 0.00 1.73 1.75 0.00 1.59 0.00 0.00 1.63 0.00 0.00 2.81 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.55 1.44 7.81 94 I 8.69 4.87 1.83 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 1.00 0.70 0.82 0.00 0.00 95 D 8.80 5.05 0.00 2.70 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 D 8.46 4.61 0.00 2.91 3.01 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 0.00 0.00 0.00 97 M 8.61 4.49 0.00 2.05 2.18 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.54 0.00 98 T 8.08 4.10 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 1.23 0.00 0.00 99 A 7.27 4.30 1.22 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 0.00 0.00 100 A 8.46 4.17 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 0.00 101 P 0.00 4.56 0.00 1.93 1.98 0.00 3.64 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 2.01 2.06 0.00 102 M 8.92 4.62 0.00 2.02 1.87 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.47 0.00 103 D 8.61 4.85 0.00 2.63 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 0.00 104 V 9.18 4.66 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 0.96 0.00 0.00 0.96 0.00 0.00 105 R 8.79 4.70 0.00 1.71 1.40 0.00 2.21 0.00 0.00 2.26 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 1.15 0.00 106 Q 9.17 4.93 0.00 2.16 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.74 0.00 0.00 0.00 0.00 0.00 2.32 2.58 0.00 107 W 9.03 4.87 0.00 3.45 3.01 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 0.00 0.00 0.00 108 V 8.22 3.88 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 0.82 0.00 0.00 1.05 0.00 0.00 *115 S 8.26 4.21 0.00 3.92 3.89 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 0.00 116 E 8.28 4.49 0.00 1.95 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 2.30 2.22 0.00 117 N 8.83 4.16 0.00 2.88 2.96 0.00 0.00 6.17 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 T 8.01 4.70 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 1.23 0.00 0.00 119 V 8.13 3.91 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 0.64 0.00 0.00 0.93 0.00 0.00 120 V 8.56 3.75 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 0.66 0.00 0.00 0.83 0.00 0.00 121 P 0.00 4.43 0.00 2.21 1.95 0.00 3.66 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.11 0.00 122 P 0.00 4.57 0.00 2.03 1.99 0.00 3.77 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 2.03 2.13 0.00 123 E 9.01 3.75 0.00 2.06 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 2.20 2.39 0.00 124 T 7.11 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 1.19 0.00 0.00 125 Y 8.56 4.45 0.00 2.89 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 0.00 126 V 8.95 4.88 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 0.60 0.00 0.00 0.81 0.00 0.00 127 K 9.13 4.85 0.00 1.76 1.62 0.00 1.59 0.00 0.00 1.57 0.00 0.00 2.81 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.30 1.42 7.81 128 V 8.92 4.74 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 0.79 0.00 0.00 0.81 0.00 0.00 129 A 8.21 4.91 0.79 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 0.00 130 G 8.09 4.30 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 0.00 131 H 8.79 5.64 0.00 3.21 3.33 0.00 5.62 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 L 8.68 4.39 0.00 1.48 1.35 0.70 -0.02 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 0.00 133 R 8.90 5.20 0.00 2.08 2.48 0.00 3.34 0.00 0.00 3.32 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.77 0.00 134 S 8.34 4.35 0.00 4.06 3.52 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 0.00 0.00 0.00 0.00 135 F 8.13 4.49 0.00 3.14 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 0.00 136 Q 8.25 4.49 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.32 5.72 0.00 0.00 0.00 0.00 0.00 2.52 2.39 0.00 137 N 8.64 4.49 0.00 2.84 3.04 0.00 0.00 6.92 7.53 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 0.00 138 K 7.47 4.40 0.00 1.68 1.74 0.00 1.80 0.00 0.00 1.72 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.39 7.81 139 K 8.44 4.63 0.00 1.63 1.63 0.00 1.77 0.00 0.00 1.83 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.17 1.32 7.81 140 S 8.98 4.69 0.00 3.98 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 0.00 141 L 8.41 5.10 0.00 1.61 1.59 0.88 0.97 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 0.00 142 V 8.72 4.62 2.30 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 1.32 0.00 0.00 1.15 0.00 0.00 143 A 8.74 4.83 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 0.00 0.00 0.00 0.00 0.00 144 F 8.40 4.73 0.00 3.12 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 0.00 145 K 7.34 4.60 0.00 1.77 1.50 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.83 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.39 1.50 7.81 146 I 8.47 4.72 1.79 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 1.09 0.73 0.57 0.00 0.00 147 M 8.80 4.54 0.00 2.02 1.89 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.47 0.00 148 P 0.00 4.70 0.00 1.96 1.96 0.00 3.70 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 149 L 8.92 4.19 0.00 1.65 1.62 0.98 1.01 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 0.00 150 E 8.98 4.19 0.00 1.95 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 2.27 2.23 0.00 151 D 7.76 4.82 0.00 2.75 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 0.00 152 M 8.57 4.27 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.46 0.00 153 N 8.62 4.43 0.00 2.86 2.87 0.00 0.00 6.86 7.25 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 0.00 154 E 8.15 4.00 0.00 2.19 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 2.37 0.00 155 F 7.98 4.19 0.00 2.89 3.06 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 0.00 156 T 7.77 3.28 4.33 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 1.10 0.00 0.00 157 T 7.97 3.84 4.37 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 1.19 0.00 0.00 158 H 8.22 4.34 0.00 3.30 3.40 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 I 7.29 3.57 1.80 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.82 0.80 0.00 0.00 160 L 7.61 3.94 0.00 1.81 1.67 0.87 0.77 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 0.00 161 E 8.38 3.91 0.00 2.07 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 0.00 2.30 2.41 0.00 162 V 7.92 3.78 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 0.97 0.00 0.00 0.82 0.00 0.00 163 I 7.47 3.68 1.84 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 1.37 0.49 0.89 0.00 0.00 164 N 8.18 4.24 0.00 2.94 2.78 0.00 0.00 7.17 7.60 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 0.00 165 A 8.39 3.92 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 0.00 166 H 8.32 4.05 0.00 3.27 3.37 0.00 5.63 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 M 8.32 4.02 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.54 0.00 168 V 7.80 3.71 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 0.82 0.00 0.00 0.92 0.00 0.00 169 L 8.25 4.00 0.00 1.73 1.74 0.86 0.91 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 0.00 170 S 7.88 4.19 0.00 4.27 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 0.00 171 K 7.62 4.12 0.00 1.87 1.91 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.58 7.81 172 A 8.10 4.14 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 0.00 173 N 7.56 4.62 0.00 2.91 2.74 0.00 0.00 6.81 7.23 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 * Residues marked with a * may have inaccurate shift predictions.