NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 K 4.2124 8.3144 120.1273 55.8711 33.8951 174.5191 9 E 4.0379 8.3550 119.8038 56.9487 30.6546 174.6255 10 R 5.3618 8.3984 121.2021 54.0310 34.8717 173.8631 11 T 4.7149 8.3292 115.6378 60.2666 71.8260 171.7679 12 F 4.9460 8.5891 127.7477 56.5677 41.3052 174.7488 13 L 4.5840 7.3421 124.2900 52.5087 45.0350 175.5662 14 A 4.4654 7.8569 122.9476 49.8826 22.4834 175.1060 15 V 4.2136 8.5301 123.6479 60.5832 33.0536 176.5947 16 K 4.6379 8.9149 125.7550 55.0600 33.3423 176.6784 17 P 4.5015 0.0000 0.0000 65.0578 30.9362 178.8163 18 D 4.5913 8.3438 118.1567 56.3256 39.6160 178.7078 19 G 3.5838 8.1048 106.7409 47.5062 0.0000 175.6905 20 V 3.5743 7.8176 120.6743 65.7113 31.3679 178.0362 21 A 4.0635 7.9480 119.2290 54.7686 18.2960 178.8638 22 R 4.2767 7.7012 113.6660 55.4961 30.9590 176.2605 23 G 3.7114 7.8135 106.0802 47.6010 0.0000 174.9434 24 L 4.3727 7.5328 116.3754 53.9616 42.4887 178.1624 25 V 3.6308 7.5288 119.9317 66.1533 31.6466 178.1106 26 G 3.6111 7.9798 105.0135 47.5409 0.0000 174.8456 27 E 3.9363 8.1639 121.1954 59.3113 29.0628 179.0551 28 I 3.7312 7.5844 119.0863 64.4679 37.2956 178.2733 29 I 4.0395 7.9111 120.4615 64.6870 36.9940 178.3127 30 A 4.2308 8.2817 121.4222 55.2281 17.9381 179.8265 31 R 3.7607 7.5524 115.5441 59.6248 30.0266 178.5780 32 Y 4.1459 7.4812 115.2787 60.8000 37.9238 177.8263 33 E 4.1426 8.4324 119.5783 59.5743 29.3965 179.6705 34 K 4.0290 7.9800 117.2133 58.9464 32.1211 178.9638 35 K 3.9230 7.4183 118.8721 57.4047 32.1349 177.5576 36 G 3.9272 7.4236 105.5254 44.9727 0.0000 173.8200 37 F 4.8430 7.4788 117.7390 57.3498 39.8816 174.5161 38 V 4.5694 8.5576 123.3682 61.0413 33.9202 174.4219 39 L 3.7903 8.5930 130.0330 54.8987 42.3173 176.4151 40 V 4.2538 8.3412 119.1901 61.1213 33.5611 175.6895 41 G 3.9303 7.2001 106.3006 44.8607 0.0000 172.7067 42 L 4.8733 8.4128 121.8470 54.0281 44.9154 173.8319 43 K 4.7404 9.0906 124.9956 55.6367 36.4511 174.5798 44 Q 5.0465 8.5692 123.3284 55.1424 30.3324 174.4702 45 L 4.5333 8.6988 124.5595 54.7916 44.4702 174.4971 46 V 4.3107 8.2030 120.9173 60.8454 31.8311 173.9899 47 P 4.2406 0.0000 0.0000 62.8257 32.1188 176.6817 48 T 4.1910 7.9872 118.1453 62.7122 69.7828 175.7166 49 K 3.7973 8.8585 125.1464 59.8504 32.2206 178.8446 50 D 4.4588 7.9140 116.6053 55.2142 40.2652 178.2203 51 L 3.6379 7.8373 121.6722 57.8888 42.0711 178.2579 52 A 3.8705 7.7396 120.7064 55.3826 18.1042 179.5233 53 E 4.1940 8.0460 115.6994 59.6736 29.5795 179.5384 54 S 4.2821 7.6987 114.3045 61.7458 62.9638 175.7638 55 H 4.2651 8.1547 120.1182 58.6315 30.1136 176.3891 56 Y 5.0575 8.1747 118.3327 57.7773 38.8062 178.0420 57 A 4.1991 8.0893 125.2156 55.1951 19.0078 179.8520 58 E 4.2297 8.2400 111.0099 58.1008 30.1010 176.8429 59 H 4.9419 8.0539 116.6348 55.5371 29.3754 175.9960 60 K 2.6222 7.6617 119.5070 58.5166 32.3716 177.5550 61 E 4.3092 7.9079 117.5125 56.2639 29.7441 175.6890 62 R 4.7664 7.4506 118.2173 53.6859 32.7385 174.7254 63 P 4.5061 0.0000 0.0000 65.8821 31.5875 177.9162 64 F 4.6934 8.5792 112.0874 56.8787 37.9733 176.8501 65 F 3.8381 8.1026 124.0053 61.9755 39.1556 177.4761 66 G 3.5672 8.2358 104.7361 47.3049 0.0000 175.7361 67 G 3.5422 7.8792 107.5303 47.8182 0.0000 175.2949 68 L 3.8845 7.0219 122.0703 57.4853 41.3548 180.1498 69 V 3.5857 6.9264 116.4594 65.9233 31.2586 177.5116 70 S 4.2231 7.9834 112.9202 61.4413 62.2000 176.0776 71 F 4.3201 8.3984 123.1210 61.3896 39.1204 176.8503 72 I 3.7168 7.8702 116.0195 62.7536 37.8565 176.5166 73 T 4.4214 7.1731 107.5698 62.0356 69.4284 175.1061 74 S 4.2453 7.7677 116.1501 59.5955 63.5584 173.4827 75 G 3.9408 7.0884 108.4664 44.0648 0.0000 170.8843 76 P 4.6038 0.0000 0.0000 62.8686 32.5874 175.6004 77 V 4.5860 8.8245 121.8492 61.2455 34.9530 174.3305 78 V 4.9095 8.2631 119.3821 59.7109 33.8597 175.0699 79 A 4.7890 8.7764 127.3442 49.8357 22.5909 175.4170 *81 V 4.4422 7.9036 117.1480 61.7878 33.0778 174.6146 82 F 5.2548 8.4874 120.9043 55.6211 42.8833 173.6268 83 E 4.9782 9.2104 121.9413 54.2246 32.6936 175.2393 84 G 4.4974 8.1754 112.4279 45.9098 0.0000 171.8740 85 K 4.1210 9.1433 122.0567 57.5056 32.4255 176.4990 86 G 4.1251 9.0336 115.3246 46.4372 0.0000 175.6677 87 V 3.0436 7.4192 122.4043 63.9876 31.2017 177.7199 88 V 3.4592 7.7585 118.4322 65.9618 31.4942 177.9715 89 A 4.1291 7.8891 120.0725 54.9908 18.1065 179.2946 90 S 4.1054 7.9026 110.5036 61.6861 62.6337 176.0386 91 A 4.4293 7.9495 122.0326 55.3247 18.3653 179.5399 92 R 4.1610 7.7719 115.4467 58.9451 29.8463 179.1334 93 L 4.0397 7.4445 116.3114 55.7784 42.1685 177.6767 *95 I 4.2283 7.8003 119.8289 61.3439 39.5146 173.4403 96 G 4.0882 7.6346 104.2046 44.2845 0.0000 172.5986 97 V 4.4889 7.6814 115.0043 59.3167 34.7501 175.9592 98 T 3.9340 8.6757 117.4045 66.8313 68.4083 174.5448 99 N 4.6125 8.0247 121.7168 51.9567 39.2426 173.4881 100 P 4.3248 0.0000 0.0000 65.5735 31.7078 178.7755 101 L 3.9602 8.2213 116.7050 57.0065 41.5517 177.5433 102 A 4.5732 7.5593 118.7774 51.9171 20.0285 177.2187 103 S 4.2882 7.5626 111.6152 58.0114 63.7603 173.9793 104 A 4.3506 8.2261 125.8740 50.4859 19.4777 175.4281 105 P 4.3776 0.0000 0.0000 64.0145 31.7963 176.0311 106 G 4.0589 8.8108 112.0602 45.9757 0.0000 175.1188 107 S 4.4927 8.0471 114.6426 57.3413 65.5619 175.3050 108 I 3.7716 8.1402 123.7655 65.0127 37.0124 179.0815 109 R 4.1703 8.2509 118.8943 59.1298 29.6352 179.3987 110 G 3.5756 7.8373 104.5452 47.6036 0.0000 174.9268 111 D 4.2923 7.7128 119.8951 55.5893 41.1709 177.3767 112 F 4.9411 7.9706 115.7770 57.2555 41.3354 175.8141 113 G 4.2835 8.0153 108.8305 44.0505 0.0000 173.7782 114 V 4.4369 8.1544 116.5392 60.5313 33.5324 175.1605 115 D 4.8547 7.7618 119.2986 51.8604 44.1511 176.0169 116 V 3.6003 8.6940 125.7035 66.0955 31.5894 177.4744 117 G 3.6511 7.9647 106.1951 47.2369 0.0000 173.3600 118 R 4.7125 7.6164 118.0392 55.0573 30.2161 175.0157 119 N 4.8744 8.0067 109.2958 52.8325 38.6804 176.4540 120 I 3.8404 9.2126 125.0455 62.0807 36.2680 173.1804 121 I 5.2136 6.4943 114.9235 59.6642 40.3495 173.4257 *123 G 3.7834 8.3061 107.6934 45.1120 0.0000 172.7577 124 S 4.3957 8.2730 115.8786 58.9361 63.1294 174.7393 125 D 4.7293 8.5644 122.4753 53.6535 40.1596 176.1566 126 S 4.5581 7.2622 114.1706 56.7521 66.8012 175.7270 127 V 3.6463 8.1640 120.9446 65.9458 31.3100 177.8096 128 E 3.9668 8.0981 118.0640 59.3673 29.4271 178.9663 129 S 4.1178 8.1517 114.9706 61.7099 62.9092 176.5639 130 A 4.0730 8.0009 123.1199 55.5404 17.9939 179.4784 131 N 4.3281 8.1168 114.5466 56.3063 38.4380 177.5235 132 R 3.8482 7.9230 119.7885 59.5731 30.3491 178.2420 133 E 3.9377 8.5758 118.5911 59.5324 29.5723 179.6546 134 I 3.9208 8.2383 119.7474 64.5533 37.0621 178.4928 135 A 4.1450 7.6693 119.6618 54.6454 18.1619 179.0858 136 L 4.0314 7.4388 118.7500 57.7786 42.3553 178.4404 137 W 4.3957 8.0914 116.9252 56.6161 29.3497 176.4221 138 F 4.9633 7.8200 116.7174 55.0325 41.2489 175.0367 139 K 4.1450 8.9366 125.9223 55.8959 32.2955 176.6577 140 P 4.3698 0.0000 0.0000 65.2269 31.4179 177.9452 141 E 4.2916 8.0734 114.1881 57.6411 30.0643 177.1834 142 E 4.2585 8.2177 118.4431 57.4644 29.9855 176.3717 143 L 4.8197 7.0909 117.8655 52.2995 43.6888 176.4148 144 L 4.1212 8.0314 123.2033 55.2366 42.2654 177.1270 145 T 4.1371 8.5817 113.3367 63.0954 69.8056 174.7724 146 E 4.3457 7.9668 122.1236 54.1971 29.9609 174.9919 147 V 4.1797 8.2062 123.9656 60.7710 32.9809 175.0905 148 K 4.4697 8.5579 126.4464 54.1146 33.3456 173.7009 149 P 4.7892 0.0000 0.0000 61.0932 33.0600 174.8981 150 N 3.9213 8.2519 116.5353 52.4642 39.2190 173.5100 151 P 4.5700 0.0000 0.0000 64.6345 31.8655 176.5103 152 N 4.6752 7.8987 114.8990 53.8641 38.6082 175.3218 153 L 4.2540 7.4569 117.7182 55.4226 43.1232 176.4414 154 Y 4.9002 7.5798 113.7994 55.9606 40.7622 175.3722 155 E 4.2826 8.8314 119.1224 56.5737 30.0315 175.9426 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 8 K 8.31 4.21 0.00 1.74 1.84 0.00 1.57 0.00 0.00 1.52 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.21 1.16 7.81 9 E 8.36 4.04 0.00 2.12 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 2.35 2.39 0.00 10 R 8.40 5.36 0.00 1.64 1.70 0.00 3.22 0.00 0.00 3.50 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.58 0.00 11 T 8.33 4.71 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 1.04 0.00 0.00 12 F 8.59 4.95 0.00 3.21 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 13 L 7.34 4.58 0.00 1.28 1.19 0.78 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 14 A 7.86 4.47 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 15 V 8.53 4.21 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 0.74 0.00 0.00 0.92 0.00 0.00 16 K 8.91 4.64 0.00 2.08 1.92 0.00 1.95 0.00 0.00 1.89 0.00 0.00 2.98 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.54 1.52 7.81 17 P 0.00 4.50 0.00 1.68 1.90 0.00 3.47 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 1.72 1.81 0.00 18 D 8.34 4.59 0.00 3.00 3.24 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 19 G 8.10 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.82 3.57 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 0.99 0.00 0.00 0.96 0.00 0.00 21 A 7.95 4.06 1.40 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 0.00 0.00 22 R 7.70 4.28 0.00 1.81 1.95 0.00 3.27 0.00 0.00 3.26 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.87 0.00 23 G 7.81 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 0.00 0.00 0.00 24 L 7.53 4.37 0.00 1.83 1.48 0.53 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 25 V 7.53 3.63 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 1.06 0.00 0.00 0.92 0.00 0.00 26 G 7.98 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.16 3.94 0.00 2.01 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 2.19 2.50 0.00 28 I 7.58 3.73 2.14 0.00 0.00 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 1.58 0.99 1.10 0.00 0.00 29 I 7.91 4.04 1.97 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 1.65 1.12 1.12 0.00 0.00 30 A 8.28 4.23 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 31 R 7.55 3.76 0.00 1.70 1.59 0.00 3.37 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 32 Y 7.48 4.15 0.00 2.66 1.89 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 33 E 8.43 4.14 0.00 2.24 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 2.54 2.76 0.00 34 K 7.98 4.03 0.00 1.88 1.80 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.57 7.81 35 K 7.42 3.92 0.00 1.62 1.70 0.00 1.40 0.00 0.00 1.53 0.00 0.00 3.06 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.96 0.61 7.81 36 G 7.42 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 0.00 0.00 0.00 37 F 7.48 4.84 0.00 3.04 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 38 V 8.56 4.57 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 1.05 0.00 0.00 1.07 0.00 0.00 39 L 8.59 3.79 0.00 1.44 1.42 0.05 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 40 V 8.34 4.25 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 0.81 0.00 0.00 0.76 0.00 0.00 41 G 7.20 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 0.00 0.00 0.00 42 L 8.41 4.87 0.00 1.50 1.49 0.89 0.52 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 43 K 9.09 4.74 0.00 1.85 1.90 0.00 1.31 0.00 0.00 0.88 0.00 0.00 2.53 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.24 1.33 7.81 44 Q 8.57 5.05 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.76 0.00 0.00 0.00 0.00 0.00 2.28 2.43 0.00 45 L 8.70 4.53 0.00 1.72 1.70 0.89 0.68 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 46 V 8.20 4.31 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 0.82 0.00 0.00 0.91 0.00 0.00 47 P 0.00 4.24 0.00 2.03 1.78 0.00 3.79 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 48 T 7.99 4.19 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 1.14 0.00 0.00 49 K 8.86 3.80 0.00 1.74 1.86 0.00 1.65 0.00 0.00 1.84 0.00 0.00 2.92 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.51 1.39 7.81 50 D 7.91 4.46 0.00 2.86 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 51 L 7.84 3.64 0.00 1.45 1.54 -0.18 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 52 A 7.74 3.87 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 53 E 8.05 4.19 0.00 2.03 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 0.00 2.72 2.39 0.00 54 S 7.70 4.28 0.00 3.81 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 0.00 55 H 8.15 4.27 0.00 3.07 3.32 0.00 5.92 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 Y 8.17 5.06 0.00 3.27 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 57 A 8.09 4.20 1.39 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 0.00 0.00 58 E 8.24 4.23 0.00 2.05 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 2.08 2.16 0.00 59 H 8.05 4.94 0.00 3.37 3.25 0.00 5.62 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 7.66 2.62 0.00 0.79 1.13 0.00 1.37 0.00 0.00 1.49 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.21 1.14 7.81 61 E 7.91 4.31 0.00 1.92 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 2.22 2.31 0.00 62 R 7.45 4.77 0.00 2.17 2.09 0.00 3.32 0.00 0.00 3.52 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.89 0.00 63 P 0.00 4.51 0.00 2.32 2.37 0.00 3.96 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.02 0.00 64 F 8.58 4.69 0.00 3.23 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 65 F 8.10 3.84 0.00 3.27 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 66 G 8.24 3.57 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 0.00 0.00 0.00 67 G 7.88 3.54 0.00 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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 P 0.00 4.60 0.00 2.22 2.18 0.00 3.60 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 1.95 0.00 77 V 8.82 4.59 2.20 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 0.94 0.00 0.00 0.96 0.00 0.00 78 V 8.26 4.91 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 0.66 0.00 0.00 0.91 0.00 0.00 79 A 8.78 4.79 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 *81 V 7.90 4.44 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 0.66 0.00 0.00 0.76 0.00 0.00 82 F 8.49 5.25 0.00 2.64 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 83 E 9.21 4.98 0.00 1.98 1.77 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 2.24 2.41 0.00 84 G 8.18 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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1.78 1.93 0.94 1.37 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 *95 I 7.80 4.23 2.08 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.97 0.98 0.00 0.00 96 G 7.63 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 0.00 0.00 0.00 0.00 97 V 7.68 4.49 2.10 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 0.76 0.00 0.00 0.94 0.00 0.00 98 T 8.68 3.93 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 99 N 8.02 4.61 0.00 2.80 2.71 0.00 0.00 7.14 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 0.00 100 P 0.00 4.32 0.00 2.32 2.22 0.00 3.67 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.15 0.00 101 L 8.22 3.96 0.00 1.80 1.74 0.97 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 102 A 7.56 4.57 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 0.00 103 S 7.56 4.29 0.00 4.08 3.81 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 0.00 104 A 8.23 4.35 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 0.00 105 P 0.00 4.38 0.00 2.00 1.96 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 2.06 0.00 106 G 8.81 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 0.00 107 S 8.05 4.49 0.00 4.18 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 0.00 108 I 8.14 3.77 1.95 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 1.70 0.78 1.08 0.00 0.00 109 R 8.25 4.17 0.00 1.91 2.03 0.00 3.22 0.00 0.00 3.36 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.84 0.00 110 G 7.84 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 D 7.71 4.29 0.00 2.13 1.54 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 0.00 112 F 7.97 4.94 0.00 3.20 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 0.00 113 G 8.02 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 0.00 114 V 8.15 4.44 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 0.77 0.00 0.00 0.94 0.00 0.00 115 D 7.76 4.85 0.00 2.71 2.46 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 0.00 116 V 8.69 3.60 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 0.84 0.00 0.00 0.92 0.00 0.00 117 G 7.96 3.65 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 0.00 118 R 7.62 4.71 0.00 1.76 1.96 0.00 3.24 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.61 0.00 119 N 8.01 4.87 0.00 2.87 3.07 0.00 0.00 6.46 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 0.00 120 I 9.21 3.84 1.96 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 1.24 0.50 0.95 0.00 0.00 121 I 6.49 5.21 1.93 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.87 1.00 0.00 0.00 *123 G 8.31 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 0.00 124 S 8.27 4.40 0.00 3.97 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 0.00 125 D 8.56 4.73 0.00 2.81 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 0.00 126 S 7.26 4.56 0.00 4.03 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 0.00 127 V 8.16 3.65 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 1.06 0.00 0.00 0.94 0.00 0.00 128 E 8.10 3.97 0.00 2.11 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 2.41 2.46 0.00 129 S 8.15 4.12 0.00 4.07 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 0.00 130 A 8.00 4.07 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 0.00 0.00 0.00 0.00 0.00 131 N 8.12 4.33 0.00 2.93 2.89 0.00 0.00 6.70 7.26 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 0.00 132 R 7.92 3.85 0.00 2.03 2.09 0.00 3.10 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 133 E 8.58 3.94 0.00 2.20 1.48 0.00 0.00 0.00 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 2.32 0.00 134 I 8.24 3.92 1.98 0.00 0.00 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 1.60 1.36 0.96 0.00 0.00 135 A 7.67 4.14 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 0.00 136 L 7.44 4.03 0.00 1.82 1.74 0.80 0.84 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 0.00 137 W 8.09 4.40 0.00 3.26 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 0.00 138 F 7.82 4.96 0.00 3.31 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 0.00 139 K 8.94 4.15 0.00 1.97 1.90 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.44 7.81 140 P 0.00 4.37 0.00 2.19 2.13 0.00 3.62 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 141 E 8.07 4.29 0.00 2.09 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 2.30 2.29 0.00 142 E 8.22 4.26 0.00 2.46 2.34 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 2.46 2.36 0.00 143 L 7.09 4.82 0.00 1.61 1.45 0.88 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 144 L 8.03 4.12 0.00 1.58 1.56 0.88 0.64 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 0.00 145 T 8.58 4.14 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 1.20 0.00 0.00 146 E 7.97 4.35 0.00 2.09 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 2.20 2.27 0.00 147 V 8.21 4.18 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 0.89 0.00 0.00 0.94 0.00 0.00 148 K 8.56 4.47 0.00 1.75 1.74 0.00 1.80 0.00 0.00 1.77 0.00 0.00 3.08 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.39 7.81 149 P 0.00 4.79 0.00 2.35 2.20 0.00 3.87 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 2.14 2.09 0.00 150 N 8.25 3.92 0.00 2.75 2.69 0.00 0.00 6.73 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 0.00 151 P 0.00 4.57 0.00 2.24 2.19 0.00 3.82 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 1.99 2.00 0.00 152 N 7.90 4.68 0.00 2.90 2.85 0.00 0.00 6.85 7.73 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 0.00 153 L 7.46 4.25 0.00 1.65 0.92 0.85 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 7.58 4.90 0.00 2.98 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 0.00 155 E 8.83 4.28 0.00 2.10 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 2.26 2.32 0.00 * Residues marked with a * may have inaccurate shift predictions.