NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 D 4.6440 8.3644 119.5606 52.8345 41.0226 174.8527 7 T 3.8194 8.5715 120.6654 60.3289 67.8453 167.7698 8 V 4.5357 9.1166 129.9659 61.8384 34.1429 174.3268 9 T 4.7371 8.6707 123.9431 61.8345 71.5578 172.9574 10 I 5.1146 8.3565 126.2060 59.6231 39.0985 175.0304 11 K 4.8431 8.8482 124.6635 54.6666 36.3855 173.6968 12 P 3.8651 0.0000 0.0000 62.4654 31.8601 176.2486 13 I 3.8670 8.0031 124.0289 61.1184 38.7023 175.3322 14 R 4.6125 8.6461 125.7916 53.6570 33.5737 176.3135 15 A 3.9491 8.6498 122.3411 55.5919 18.2786 180.1021 16 E 3.9605 7.9530 112.0530 59.4583 29.9460 178.4023 17 H 4.4867 8.2337 116.4185 57.3269 28.6826 177.3395 18 V 3.7658 7.4482 121.2212 66.3014 31.3446 177.6675 19 E 3.9473 8.1594 117.2351 59.5537 29.4664 178.8453 20 S 4.1226 8.2289 112.5809 61.6983 62.2714 175.8765 21 F 4.2653 8.7046 123.4238 61.6771 39.0398 176.6061 22 H 3.6491 8.2975 117.7957 58.9926 29.5624 177.4412 23 R 3.7885 7.9180 119.5799 59.0276 29.9050 178.8022 24 A 4.0513 7.8981 120.5051 55.2324 18.4444 179.5155 25 L 3.4687 7.3751 118.8498 57.9824 42.0242 178.6902 26 D 4.2044 8.0587 117.9660 57.0489 40.9383 177.8835 27 A 3.9655 8.0458 120.5626 55.4356 18.2368 179.5389 28 V 4.1904 7.9334 117.8959 65.7962 31.5399 178.4259 29 S 3.9739 8.2882 115.0307 61.5009 62.4807 176.4250 30 R 4.2155 7.7258 118.2921 57.8834 28.8992 178.2504 31 E 4.0593 8.0487 118.3655 56.9319 29.2120 177.3957 32 R 4.0477 7.9365 116.6854 56.9891 28.2800 177.0120 33 K 4.2823 7.2305 117.1957 56.6124 34.5794 176.1274 34 Y 4.5473 7.7066 114.7417 59.0980 39.8928 176.0851 35 L 4.4394 7.6017 117.4223 53.7191 42.8393 176.8083 36 S 4.5224 8.5458 113.8854 58.9944 63.7710 174.0325 37 F 5.0217 7.5479 115.9372 55.3242 39.7303 175.4120 38 L 4.4238 8.3206 120.9113 54.8350 42.3053 176.0092 39 E 4.6461 7.5935 117.0242 54.7162 32.2850 174.5088 40 A 4.3451 8.4510 127.5067 51.3150 19.0432 176.0910 41 P 4.4375 0.0000 0.0000 61.2292 32.2841 175.5576 42 P 4.3499 0.0000 0.0000 62.9384 32.9044 176.7873 43 L 3.5891 8.4122 121.2455 58.8778 41.8418 179.4306 44 E 4.2151 8.1024 116.9237 58.6991 29.4784 178.9117 45 A 4.0087 7.8897 120.9084 55.1811 18.4738 179.9231 46 V 3.7169 7.8928 111.0646 64.4538 31.5482 178.6521 47 R 3.9111 8.5280 118.7428 59.3827 29.8706 178.2289 48 A 3.9954 8.0101 120.4581 55.3345 18.1777 179.4568 49 F 4.1729 7.8998 117.2634 61.4323 39.5555 177.2504 50 V 3.2788 8.0508 117.2847 65.6524 31.6521 177.5358 51 L 4.1101 8.1493 119.1819 57.8044 41.3892 179.8120 52 D 4.1458 7.8894 114.2378 55.1327 40.9971 177.7362 *54 I 3.9707 7.6899 120.1819 60.9704 39.0876 177.9611 55 E 3.9239 8.0151 118.3268 59.2461 29.2557 177.5711 56 N 4.6347 8.3837 114.5822 52.6763 38.5374 175.1767 57 D 4.6062 7.7345 115.3879 55.3476 40.2725 173.0735 58 H 4.3135 7.3928 114.8234 54.0385 29.3518 173.5805 59 P 4.4413 0.0000 0.0000 62.9669 32.4735 175.4099 60 Q 4.8678 8.2932 125.8557 55.3031 32.1353 172.8601 61 F 5.0776 9.6220 125.6508 55.6566 43.0951 174.7614 62 V 5.1029 8.9062 114.5951 59.5996 35.4288 174.3209 63 A 5.1120 9.1731 125.9735 50.5460 21.2897 175.8536 64 I 4.9595 9.0841 123.5231 59.3810 40.2438 174.6806 65 A 4.7785 8.7290 128.6349 50.3648 21.9058 175.7737 66 D 4.5248 9.7080 124.0199 55.5054 38.3991 175.4650 67 G 4.1056 8.0614 105.1257 46.2288 0.0000 173.3595 68 D 4.6520 7.7538 119.6560 53.0429 41.9424 175.9933 69 V 4.1659 8.6263 123.4351 63.1270 31.4897 175.7802 70 I 4.3606 8.6159 120.8243 60.1354 38.8893 175.1184 71 G 4.5315 7.8853 108.9019 46.3487 0.0000 172.3134 72 W 5.8351 8.6057 116.8951 55.7415 31.6199 173.5614 73 C 5.1015 9.2914 120.8728 58.2839 34.9367 172.3831 74 D 5.4023 9.7132 124.5613 52.1535 43.2129 174.1545 75 I 5.0793 8.7543 121.1343 59.6044 39.9500 175.3690 76 R 4.3739 8.9375 125.6614 54.5553 30.8613 176.0630 77 R 4.2734 8.3505 125.0760 56.4949 30.3966 176.1862 78 Q 4.1240 8.7923 125.9843 56.7024 29.0028 176.6662 79 D 4.5130 8.8371 123.1131 57.0105 41.7177 177.8110 80 R 4.0617 7.8110 115.0082 55.7881 30.2417 177.2690 81 A 4.0348 8.7017 123.1603 55.6421 18.5327 179.5554 82 T 4.1314 7.8781 103.4233 63.2842 69.3197 174.9519 83 R 4.5964 8.1308 119.6555 55.5923 31.8224 176.8645 84 A 4.2577 7.6842 121.0144 54.8425 18.5293 178.0014 85 H 4.7161 8.4866 110.4083 56.4520 29.8407 174.2437 86 C 5.2022 8.3557 120.9776 57.7763 34.0530 172.6973 87 G 4.4656 9.1280 112.1407 44.7285 0.0000 171.3439 88 T 5.0718 8.7701 119.2031 61.5545 70.6343 173.5506 89 L 4.9034 8.7241 129.6135 54.3710 43.2583 175.7613 90 G 4.2992 8.9965 112.0885 44.4237 0.0000 171.5534 *92 G 3.1133 8.3856 107.1388 44.9166 0.0000 172.1496 93 I 4.9383 7.4304 119.8761 58.8412 41.3269 175.4399 94 L 4.2116 8.7788 124.7827 54.4593 42.3090 176.4896 95 P 4.1776 0.0000 0.0000 65.8572 31.3856 178.5758 96 A 3.9454 8.1140 118.7395 54.4243 18.3119 177.3205 97 Y 4.5288 7.9567 111.7785 57.7138 37.5171 176.2485 98 R 4.0773 7.6615 120.4647 56.5102 30.7600 175.7163 99 N 4.0973 8.6655 114.4115 54.9339 37.1346 174.3522 100 K 4.4901 7.7210 109.4992 55.4322 33.5601 177.5553 101 G 3.9647 8.3156 107.9395 45.4853 0.0000 175.7348 102 L 4.0895 7.8432 121.5510 57.9128 41.9054 178.7834 103 G 3.5228 7.9743 104.3366 47.6440 0.0000 174.9419 104 A 4.1714 7.8776 121.7304 54.9805 18.8420 179.5768 105 R 4.0447 7.8771 116.0446 59.1389 30.1653 179.8720 106 L 3.9494 8.0066 117.6357 55.8668 42.0340 178.7132 *108 R 4.2697 7.9311 117.6195 55.9020 32.2633 178.1952 109 R 3.6654 7.6391 116.2567 59.4127 29.8484 179.3674 110 T 3.6285 7.5556 115.4847 66.4164 68.4388 176.9968 111 L 4.2156 7.8302 120.5237 57.7600 41.7055 178.8432 112 D 4.1504 8.1018 117.8308 57.3336 41.1044 178.1946 113 A 4.0491 8.1037 121.0010 55.0745 18.4703 179.4729 114 A 3.9997 8.0479 119.4937 55.4534 18.4207 179.4014 115 H 3.5382 7.9737 116.7502 59.1839 29.6294 176.8725 116 E 3.8480 7.9285 119.8116 59.5684 29.4706 178.4688 117 F 4.2312 8.4097 119.5707 59.8424 39.4888 175.5537 118 G 4.2019 8.0181 104.7849 45.1482 0.0000 173.9384 119 L 4.4153 8.0630 119.7467 55.0562 42.5866 176.2285 120 H 4.8152 9.3875 122.1990 57.5131 31.8090 174.7598 121 R 4.7855 7.8748 118.3851 54.4248 33.1543 173.8681 122 I 5.0043 8.1812 127.6647 59.5306 39.4106 174.6611 123 E 5.2612 9.1276 124.8976 54.6902 32.9292 174.6359 124 L 4.7653 8.1121 118.8677 54.8345 43.8974 174.0077 125 S 5.2291 8.5444 116.0548 56.7785 65.8345 173.9248 126 V 4.6217 8.7740 122.8795 59.8452 35.0165 174.6431 127 H 4.8043 8.8924 120.0698 56.0391 29.1108 176.5795 128 A 4.0611 9.1198 126.6063 54.7247 18.3771 177.9823 129 D 4.7061 7.9872 112.9157 53.5495 40.5030 177.1071 130 N 4.6877 8.2780 121.6994 52.6358 37.3964 175.0482 131 A 4.0484 7.9147 124.3429 54.4203 18.9315 179.2155 132 R 3.6844 7.9092 116.8709 59.4019 30.1706 178.4732 133 A 3.3347 7.7077 120.4477 54.9403 18.3768 179.3086 134 I 3.6223 7.5587 118.1036 64.7960 37.2546 178.3457 135 A 4.0207 8.0898 121.3977 55.0834 18.0797 179.4997 136 L 3.7918 7.6668 118.6956 58.4576 42.1853 178.7505 137 Y 4.3858 7.5811 117.0502 61.1637 37.9057 178.3675 138 E 4.0509 8.7296 119.8968 59.4161 29.4005 179.3633 139 K 3.9556 7.8276 118.0693 59.7798 32.3955 178.7406 140 I 4.0092 7.9025 118.7240 62.8533 36.9719 176.8602 141 G 4.2117 7.6294 107.4661 45.1194 0.0000 173.7835 142 F 4.2562 8.4734 118.3997 57.2152 39.4344 174.8113 143 A 4.6846 8.6256 125.1523 50.8018 20.3259 176.8883 144 H 4.4381 8.8240 118.5380 56.0838 29.1481 175.3913 145 E 4.5391 10.6216 120.4329 55.2854 31.5947 176.1031 146 G 4.2775 6.9657 106.3057 43.9660 0.0000 170.9485 147 R 4.9836 7.9468 119.6703 54.3091 32.6909 174.3307 148 A 4.5853 9.3930 129.6583 50.5250 20.4350 176.2278 149 R 4.4376 8.6068 122.1694 56.9314 31.1348 176.5754 150 D 4.3519 9.0133 122.8519 55.3448 38.9817 174.8177 151 A 4.2356 8.1275 121.4902 53.2958 19.3939 178.5740 152 V 4.4947 7.8521 115.8707 60.8195 34.2899 174.2240 153 S 5.1236 8.6190 119.9271 56.7569 65.0866 172.8860 154 I 4.3148 8.3271 128.0449 62.7757 38.8926 176.5219 155 D 4.5293 7.6338 118.6875 52.6660 39.8425 175.7315 156 G 3.8021 8.1860 111.0907 46.5183 0.0000 170.3408 157 H 4.7893 7.3320 116.2206 53.7918 30.6620 173.0935 158 Y 5.1166 8.1817 122.2716 57.8365 38.8641 174.9021 159 I 4.6327 8.9019 124.9231 59.2895 40.5269 175.1329 160 D 4.9687 8.7620 125.7992 54.5211 42.2505 175.0548 161 S 5.2106 8.9158 115.6445 56.5627 65.9396 172.4727 162 L 5.1841 9.3545 126.0296 53.2748 44.0713 175.9155 163 N 5.4900 9.4639 120.7306 51.1808 41.3188 173.8572 *165 A 4.7176 8.2007 120.7508 52.0773 20.6373 175.3298 166 I 4.3444 8.2624 119.4713 58.9029 41.2752 174.2655 167 I 4.5879 7.7339 128.2742 59.1952 39.4997 175.2080 168 F 4.3815 8.6422 127.2460 57.1102 39.5895 176.1162 169 G 3.7650 8.7426 111.3486 45.6771 0.0000 173.0964 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 6 D 8.36 4.64 0.00 2.71 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 0.00 0.00 0.00 0.00 7 T 8.57 3.82 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 8 V 9.12 4.54 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 0.84 0.00 0.00 0.97 0.00 0.00 9 T 8.67 4.74 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 10 I 8.36 5.11 1.91 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 1.44 0.59 1.03 0.00 0.00 11 K 8.85 4.84 0.00 1.82 1.89 0.00 1.32 0.00 0.00 1.69 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.39 7.81 12 P 0.00 3.87 0.00 1.74 1.55 0.00 3.64 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 1.94 1.83 0.00 13 I 8.00 3.87 1.61 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.64 0.69 0.00 0.00 14 R 8.65 4.61 0.00 1.71 1.68 0.00 3.17 0.00 0.00 3.31 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 15 A 8.65 3.95 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 16 E 7.95 3.96 0.00 2.03 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 1.95 2.10 0.00 17 H 8.23 4.49 0.00 3.28 3.38 0.00 5.64 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 18 V 7.45 3.77 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 1.08 0.00 0.00 1.02 0.00 0.00 19 E 8.16 3.95 0.00 2.12 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 2.41 2.43 0.00 20 S 8.23 4.12 0.00 3.95 4.08 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 0.00 0.00 0.00 21 F 8.70 4.27 0.00 3.09 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 22 H 8.30 3.65 0.00 3.23 3.43 0.00 5.84 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 R 7.92 3.79 0.00 2.08 1.96 0.00 3.20 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.91 0.00 24 A 7.90 4.05 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 0.00 0.00 25 L 7.38 3.47 0.00 0.47 1.17 1.02 0.37 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 26 D 8.06 4.20 0.00 2.71 2.64 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 27 A 8.05 3.97 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 28 V 7.93 4.19 2.49 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 1.44 0.00 0.00 1.23 0.00 0.00 29 S 8.29 3.97 0.00 3.86 3.86 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 30 R 7.73 4.22 0.00 1.88 1.98 0.00 3.16 0.00 0.00 3.49 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.80 0.00 31 E 8.05 4.06 0.00 2.27 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 0.00 2.38 2.59 0.00 32 R 7.94 4.05 0.00 1.86 1.93 0.00 3.07 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 33 K 7.23 4.28 0.00 0.81 1.47 0.00 1.35 0.00 0.00 1.53 0.00 0.00 2.60 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.21 0.54 7.81 34 Y 7.71 4.55 0.00 2.90 2.89 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 35 L 7.60 4.44 0.00 1.36 0.97 0.89 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 36 S 8.55 4.52 0.00 4.09 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 37 F 7.55 5.02 0.00 3.35 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 38 L 8.32 4.42 0.00 1.66 1.72 0.92 0.79 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 39 E 7.59 4.65 0.00 1.91 1.81 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 2.20 2.29 0.00 40 A 8.45 4.35 1.13 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 0.00 0.00 0.00 0.00 0.00 0.00 41 P 0.00 4.44 0.00 1.93 1.87 0.00 3.52 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 42 P 0.00 4.35 0.00 2.23 2.17 0.00 3.69 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 2.05 2.02 0.00 43 L 8.41 3.59 0.00 1.46 1.63 0.88 0.77 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 44 E 8.10 4.22 0.00 2.07 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 0.00 2.38 2.42 0.00 45 A 7.89 4.01 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 46 V 7.89 3.72 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 0.78 0.00 0.00 0.98 0.00 0.00 47 R 8.53 3.91 0.00 1.84 2.08 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 48 A 8.01 4.00 1.45 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 0.00 0.00 0.00 0.00 0.00 0.00 49 F 7.90 4.17 0.00 2.99 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 50 V 8.05 3.28 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 0.73 0.00 0.00 0.98 0.00 0.00 51 L 8.15 4.11 0.00 1.84 1.67 0.88 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 52 D 7.89 4.15 0.00 2.91 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 7.69 3.97 1.92 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.75 0.84 0.00 0.00 55 E 8.02 3.92 0.00 2.01 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 0.00 2.31 2.29 0.00 56 N 8.38 4.63 0.00 2.55 2.70 0.00 0.00 6.67 7.94 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 57 D 7.73 4.61 0.00 2.89 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 58 H 7.39 4.31 0.00 3.10 3.25 0.00 5.74 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 P 0.00 4.44 0.00 2.23 2.24 0.00 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0.00 0.00 136 L 7.67 3.79 0.00 1.58 1.37 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 137 Y 7.58 4.39 0.00 3.05 2.67 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 0.00 138 E 8.73 4.05 0.00 2.00 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 2.42 2.55 0.00 139 K 7.83 3.96 0.00 1.88 2.04 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.49 7.81 140 I 7.90 4.01 2.20 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 1.84 1.10 1.09 0.00 0.00 141 G 7.63 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 0.00 142 F 8.47 4.26 0.00 3.06 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 0.00 143 A 8.63 4.68 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 0.00 144 H 8.82 4.44 0.00 3.09 3.27 0.00 5.64 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 E 10.62 4.54 0.00 2.02 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 2.23 2.37 0.00 146 G 6.97 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 0.00 147 R 7.95 4.98 0.00 1.80 1.79 0.00 3.23 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 148 A 9.39 4.59 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 0.00 149 R 8.61 4.44 0.00 1.66 1.84 0.00 3.52 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 150 D 9.01 4.35 0.00 2.54 2.15 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 0.00 151 A 8.13 4.24 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 0.00 152 V 7.85 4.49 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 0.86 0.00 0.00 0.96 0.00 0.00 153 S 8.62 5.12 0.00 3.98 3.71 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 0.00 0.00 0.00 0.00 154 I 8.33 4.31 1.83 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 1.33 0.72 0.90 0.00 0.00 155 D 7.63 4.53 0.00 2.73 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 0.00 156 G 8.19 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 0.00 157 H 7.33 4.79 0.00 3.15 3.11 0.00 5.61 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 Y 8.18 5.12 0.00 2.91 2.94 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 0.00 159 I 8.90 4.63 1.79 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 1.19 1.14 0.87 0.00 0.00 160 D 8.76 4.97 0.00 2.70 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 0.00 161 S 8.92 5.21 0.00 3.91 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 0.00 162 L 9.35 5.18 0.00 1.65 1.63 1.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 163 N 9.46 5.49 0.00 2.61 2.74 0.00 0.00 6.73 7.93 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 *165 A 8.20 4.72 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 I 8.26 4.34 0.56 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 1.02 -0.02 0.00 0.00 167 I 7.73 4.59 1.70 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.58 0.66 0.00 0.00 168 F 8.64 4.38 0.00 2.77 2.55 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 0.00 169 G 8.74 3.77 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.