NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8051 8.3393 109.7270 45.2799 0.0000 172.6688 2 I 3.9215 8.0715 114.0157 59.4618 38.7892 173.1762 3 S 4.6018 8.6075 116.2340 56.3407 67.5431 175.0333 4 Y 4.1944 8.5442 120.2260 58.6781 37.7657 176.6861 5 S 4.5593 9.1441 119.1169 58.3402 63.7195 174.1546 6 V 4.4486 7.2950 119.7878 60.9649 34.3570 174.6543 7 E 4.1657 8.6422 125.0443 56.1126 30.1087 176.2987 8 A 4.4668 8.0840 124.4676 50.1926 22.0583 175.1803 9 D 4.4917 8.6537 123.2047 52.8766 41.2231 174.7305 10 P 4.2923 0.0000 0.0000 66.0926 31.0434 177.3691 11 D 4.6535 8.7768 118.2031 56.5695 41.2125 176.6927 12 T 5.2629 8.1687 108.8818 60.2223 70.2819 173.5275 13 T 4.9978 8.0788 116.1015 62.6476 72.8944 173.0573 14 A 4.6855 8.6047 125.8706 50.0464 22.2250 175.3253 15 K 5.1312 8.1944 119.2552 54.8659 36.0832 175.0246 16 A 4.6492 8.6766 119.8645 52.1244 22.9207 175.3786 17 M 5.2207 8.5779 117.7210 54.0646 36.6239 174.2728 18 L 4.8111 8.5839 120.6438 53.0184 45.1158 175.7287 19 R 4.8897 8.3665 120.7441 55.0674 33.0131 175.7706 20 E 3.7130 9.5578 123.5943 57.2432 27.8810 175.8729 21 R 4.1132 8.7472 119.2832 56.3136 31.8962 177.8459 22 Q 4.9729 8.9236 123.1801 54.8131 28.4372 174.5011 23 M 4.6721 8.0408 119.8066 53.8595 34.5159 174.4760 24 S 4.0896 8.5699 114.1950 58.4383 63.0960 174.6918 25 F 4.4280 8.8844 129.7102 61.2724 39.0013 177.3759 26 K 3.5966 7.8156 117.8297 59.4901 31.8643 178.8757 27 H 4.1282 8.4242 116.9694 58.5191 28.5251 178.1057 28 S 4.1739 7.6641 117.3903 61.4835 62.6452 176.6426 29 K 3.7476 7.5729 120.8894 59.2494 31.6513 179.1706 30 A 3.8139 7.2746 119.4212 55.1449 18.3378 179.7063 31 I 3.4537 7.5395 117.8749 64.4725 37.2112 178.0923 32 A 3.9577 8.0094 121.7955 55.3531 17.9452 179.2714 33 R 3.7287 7.9433 116.1289 59.8999 30.2031 177.9860 34 E 3.9416 8.1178 117.5538 58.5082 29.9667 177.8288 35 I 3.9338 7.6711 111.5293 60.1781 38.3678 175.6851 36 K 4.1498 7.1540 122.4340 57.9904 32.4537 176.6762 37 G 3.9609 8.7585 114.4298 45.3665 0.0000 173.8947 38 K 4.3760 7.7010 119.2145 55.9782 33.2838 175.8065 39 T 4.7218 9.4585 117.4146 62.4396 70.4782 175.8441 40 A 4.0771 8.9092 128.9619 55.6495 18.4906 180.5368 41 G 3.6277 8.2964 103.8952 47.9725 0.0000 175.7102 42 E 4.0137 8.1089 120.1861 59.0063 29.4814 178.8971 43 A 4.0567 8.4976 121.2116 55.2855 18.4839 179.7415 44 V 3.5870 7.9021 116.4229 66.4661 31.7641 177.8492 45 D 4.4171 8.2405 118.4988 57.4725 40.4919 178.2142 46 Y 4.1079 8.5019 120.2919 60.9493 38.8511 178.3125 47 L 3.8038 8.4134 120.0732 57.7561 41.6251 179.4423 48 E 3.9704 8.3503 118.4108 59.0353 29.3912 179.0837 49 A 3.9741 7.7362 120.6423 54.6710 18.3128 179.9532 50 V 4.1159 7.2868 118.2902 65.9588 31.4530 178.2325 51 I 3.6771 7.5876 118.2086 64.5466 37.0147 177.8146 52 E 4.0854 8.0973 119.1611 57.2882 29.4377 177.6759 53 G 3.5498 8.0543 106.1979 45.4645 0.0000 173.6041 54 D 4.6234 8.3410 119.1949 54.1661 41.9224 176.3757 55 Q 4.4969 7.8311 120.5270 53.3597 31.3235 171.7688 56 P 4.3378 0.0000 0.0000 61.9298 33.1490 175.4890 57 V 4.3743 8.1667 123.0341 60.3212 32.8785 173.3949 58 P 4.8124 0.0000 0.0000 63.2077 31.8569 176.5453 59 F 4.8723 9.3946 124.9002 56.2198 38.1525 175.5073 60 K 3.5482 8.3587 123.1098 57.4564 32.7901 177.9139 61 Q 4.2281 7.9332 117.7021 57.7110 30.4321 175.9772 62 H 4.7481 7.5959 115.4442 54.4304 27.3412 174.3272 63 N 5.1462 7.8219 114.9799 52.0520 38.3489 175.2804 64 S 4.2258 8.1669 114.2471 60.2707 63.0074 174.8114 65 G 3.9239 8.9697 112.9069 45.2918 0.0000 173.3522 66 V 3.7926 7.8665 120.5931 62.3347 32.4647 175.9482 67 G 3.8797 8.4259 114.0228 46.1388 0.0000 172.6611 68 H 4.8891 8.6421 119.0374 55.6020 30.0556 174.9914 69 K 4.6404 8.9554 120.9460 54.4407 34.6598 177.6551 70 S 4.1235 9.0694 120.0909 61.3567 62.9774 175.6854 71 K 4.1386 7.9008 117.9950 57.5239 32.2034 177.0773 72 V 3.7691 7.5587 120.1889 62.4176 31.3768 174.3686 73 D 4.7481 8.7710 126.6899 53.6904 42.5574 176.6621 74 G 3.8729 10.1871 113.6843 45.4806 0.0000 171.9289 75 W 4.9705 7.3626 128.6510 56.7247 34.3282 173.0182 76 D 4.3795 6.7516 115.8420 54.3717 40.6107 175.6214 77 A 4.7136 7.1439 122.3458 51.1501 19.7297 176.4448 78 G 4.0433 7.9259 106.7986 45.6972 0.0000 172.4145 79 R 4.0473 7.3434 118.3569 54.4347 34.9159 174.2246 80 Y 4.6357 7.8323 113.5492 56.1791 37.8826 175.5428 81 P 4.6193 0.0000 0.0000 62.5768 29.8506 177.2011 82 E 4.0092 8.5131 121.8558 58.9696 29.8876 178.8626 83 K 3.9128 8.1096 119.8843 59.3527 32.4443 178.3186 84 A 4.1952 8.1379 120.4050 55.5242 18.3114 179.5699 85 S 4.1635 8.1898 113.5452 61.7818 62.9549 177.1456 86 K 4.0941 8.4451 121.2424 59.3056 31.7952 179.3262 87 A 4.1049 8.1863 121.2300 55.0040 18.2400 179.6919 88 F 3.9336 8.5716 116.5746 60.4217 38.9013 177.9681 89 L 4.1696 8.0886 118.9749 57.7450 41.3847 179.2180 90 D 4.3554 8.0409 118.8600 57.1917 40.7375 178.4570 91 L 3.8958 7.8633 120.7916 58.3056 41.9961 179.1414 92 L 4.0504 8.4473 119.2945 57.5862 41.3963 179.0214 93 E 3.9314 8.6386 119.9443 59.0276 29.4771 178.5409 94 N 4.2633 8.2061 116.9238 56.5008 39.1419 176.6281 95 A 3.9516 8.0586 122.1785 55.4566 18.5648 179.7503 96 V 3.7776 8.1891 116.9325 66.0650 31.4926 178.5507 97 G 3.6163 7.8803 105.5486 47.7916 0.0000 175.5484 98 N 4.4031 8.6921 119.3249 55.8654 38.6714 177.1853 99 A 4.0719 8.4782 122.6020 55.5627 18.3870 179.5199 100 D 4.6795 8.2289 118.5672 57.1808 40.7656 177.9959 101 H 4.4356 8.2761 116.1080 57.6433 29.9095 175.8664 102 Q 4.5388 7.7297 117.0759 56.1408 29.6759 176.1135 103 G 3.8038 8.3569 109.5781 45.0578 0.0000 174.0573 104 F 4.4108 7.8827 118.5718 56.9306 39.6915 174.3766 105 D 4.8762 8.5423 121.5572 52.4212 39.7216 176.4999 106 G 3.9308 8.6318 114.0354 48.8919 0.0000 173.3058 107 E 3.8593 8.4361 118.8169 58.8223 29.6733 179.2492 108 A 4.2396 7.5246 117.5072 53.7041 18.9764 177.5249 109 M 4.4451 8.0047 116.6588 55.4590 33.4403 175.8292 110 T 4.6582 8.6700 118.8031 63.0254 70.7768 174.7920 111 I 4.1383 8.7665 127.4207 60.5435 36.0674 176.4611 112 K 4.0163 8.8720 128.5777 59.1181 32.9563 176.3705 113 H 5.1518 8.0529 118.5575 54.6120 33.6716 172.5094 114 V 5.4027 8.2816 123.1476 61.2408 34.1392 173.0744 115 A 4.7163 8.5795 125.0160 50.6527 22.5419 174.4207 116 A 5.3362 8.6100 122.5363 50.8104 21.7436 176.1274 117 H 4.9022 9.2358 117.1678 53.8325 33.2605 172.7478 118 K 3.9716 7.7932 124.8718 56.1268 31.8100 176.4872 119 V 3.8696 9.0965 128.1751 62.7192 32.3563 176.1584 120 G 3.9451 6.6355 106.4146 45.9854 0.0000 170.2602 121 E 5.0664 7.8732 117.9066 54.4370 33.4108 175.7140 122 Q 4.1936 9.3512 126.4099 55.5445 29.7879 175.0582 123 Q 4.7951 8.7348 126.6099 56.0750 29.5598 176.0686 124 G 4.9636 10.8095 109.8991 43.4693 0.0000 171.1324 125 R 5.1834 8.6220 120.0187 54.0953 33.3803 174.2437 126 K 4.2775 9.1946 127.6058 53.6574 34.4392 173.4061 127 P 4.5534 0.0000 0.0000 63.2814 31.9669 175.7346 128 R 4.7782 8.8280 121.4795 53.7242 33.8276 175.0680 129 A 4.1129 8.3304 122.1062 53.7350 18.9196 177.4098 130 M 3.6168 8.9215 116.7168 56.2837 28.8776 177.6075 131 G 3.9156 8.3726 104.0536 46.3861 0.0000 173.8517 132 R 4.7887 7.5037 118.3141 54.0043 33.4056 174.1151 133 A 5.3684 8.5939 125.1444 50.2854 22.5558 174.9153 134 S 4.8221 8.6417 112.5046 56.2406 67.2846 173.2608 135 A 4.5613 8.5977 121.7447 52.2269 19.0269 178.1881 136 W 5.0989 9.0692 129.7930 56.4653 31.6406 173.2334 137 N 5.3301 8.0145 120.3407 51.6252 41.3229 174.6190 138 S 4.7242 8.4612 115.8257 56.1091 66.0963 172.5801 139 P 4.7450 0.0000 0.0000 62.6128 32.8504 175.1031 140 Q 5.0322 9.0768 122.0638 54.1589 31.4847 174.7498 141 V 4.8157 9.2972 124.6641 61.1685 34.6372 173.9905 142 D 5.3852 8.7993 126.2961 52.8027 44.5205 175.5701 143 V 4.9685 8.3115 119.7938 60.6147 35.1372 172.8147 144 E 5.1238 8.9769 122.3162 54.7330 32.8505 174.5997 145 L 5.2350 8.7733 122.5647 53.8361 46.3112 174.6535 146 I 4.9273 9.2517 126.6782 59.6396 40.4400 174.5780 147 L 5.0148 9.1238 127.8975 53.7381 43.6694 175.5976 148 E 5.0684 9.0294 122.4307 54.1670 33.7874 174.4424 149 E 4.3258 8.5997 125.1838 55.5990 30.8945 175.6584 150 P 4.3964 0.0000 0.0000 63.1185 31.4035 176.2135 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 1 G 8.34 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 0.00 0.00 0.00 2 I 8.07 3.92 1.65 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 1.33 0.54 0.72 0.00 0.00 3 S 8.61 4.60 0.00 3.79 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 4 Y 8.54 4.19 0.00 2.97 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 5 S 9.14 4.56 0.00 3.99 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 6 V 7.30 4.45 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 0.81 0.00 0.00 0.59 0.00 0.00 7 E 8.64 4.17 0.00 1.98 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 0.00 2.31 2.30 0.00 8 A 8.08 4.47 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 9 D 8.65 4.49 0.00 2.68 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 10 P 0.00 4.29 0.00 2.23 2.19 0.00 3.81 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 11 D 8.78 4.65 0.00 2.84 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 12 T 8.17 5.26 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 1.36 0.00 0.00 13 T 8.08 5.00 4.40 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 1.08 0.00 0.00 14 A 8.60 4.69 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.19 5.13 0.00 1.45 1.55 0.00 1.25 0.00 0.00 0.61 0.00 0.00 2.31 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.82 1.10 7.81 16 A 8.68 4.65 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 17 M 8.58 5.22 0.00 1.74 1.87 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.44 0.00 18 L 8.58 4.81 0.00 1.44 1.43 0.66 0.62 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 19 R 8.37 4.89 0.00 1.61 1.76 0.00 3.44 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.52 0.00 20 E 9.56 3.71 0.00 1.96 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 2.22 0.00 21 R 8.75 4.11 0.00 1.62 1.85 0.00 3.27 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.72 0.00 22 Q 8.92 4.97 0.00 1.94 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.73 0.00 0.00 0.00 0.00 0.00 2.32 2.19 0.00 23 M 8.04 4.67 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.57 0.00 24 S 8.57 4.09 0.00 3.64 3.63 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 25 F 8.88 4.43 0.00 3.02 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 26 K 7.82 3.60 0.00 1.58 1.51 0.00 1.55 0.00 0.00 1.50 0.00 0.00 2.61 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.91 1.32 7.81 27 H 8.42 4.13 0.00 3.26 3.31 0.00 5.64 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 S 7.66 4.17 0.00 4.05 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 29 K 7.57 3.75 0.00 1.52 1.61 0.00 1.37 0.00 0.00 1.36 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.75 0.77 7.81 30 A 7.27 3.81 1.16 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 31 I 7.54 3.45 1.22 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.86 -0.05 0.00 0.00 32 A 8.01 3.96 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 0.00 0.00 0.00 0.00 0.00 33 R 7.94 3.73 0.00 1.78 2.14 0.00 3.10 0.00 0.00 2.97 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 34 E 8.12 3.94 0.00 1.92 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 2.19 1.84 0.00 35 I 7.67 3.93 1.86 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 1.69 0.63 0.92 0.00 0.00 36 K 7.15 4.15 0.00 1.74 1.71 0.00 1.79 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.43 1.39 7.81 37 G 8.76 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 0.00 0.00 0.00 38 K 7.70 4.38 0.00 1.98 1.72 0.00 1.41 0.00 0.00 1.51 0.00 0.00 2.71 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.36 1.35 7.81 39 T 9.46 4.72 4.43 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 1.35 0.00 0.00 40 A 8.91 4.08 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 41 G 8.30 3.63 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 0.00 42 E 8.11 4.01 0.00 2.14 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 2.41 2.39 0.00 43 A 8.50 4.06 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 0.00 0.00 0.00 0.00 0.00 44 V 7.90 3.59 2.26 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 1.06 0.00 0.00 1.01 0.00 0.00 45 D 8.24 4.42 0.00 2.94 2.76 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 46 Y 8.50 4.11 0.00 3.10 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 47 L 8.41 3.80 0.00 1.76 1.73 1.06 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.35 3.97 0.00 2.03 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 2.34 2.67 0.00 49 A 7.74 3.97 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 50 V 7.29 4.12 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 1.28 0.00 0.00 0.35 0.00 0.00 51 I 7.59 3.68 2.01 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 1.42 0.84 0.91 0.00 0.00 52 E 8.10 4.09 0.00 2.05 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 0.00 2.32 2.39 0.00 53 G 8.05 3.55 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 0.00 0.00 0.00 54 D 8.34 4.62 0.00 2.62 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 55 Q 7.83 4.50 0.00 2.03 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 7.03 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 56 P 0.00 4.34 0.00 1.81 1.66 0.00 3.84 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 1.92 1.92 0.00 57 V 8.17 4.37 2.22 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 1.42 0.00 0.00 0.95 0.00 0.00 58 P 0.00 4.81 0.00 1.95 2.05 0.00 3.75 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.18 0.00 59 F 9.39 4.87 0.00 2.84 3.03 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 0.00 0.00 0.00 60 K 8.36 3.55 0.00 1.27 0.84 0.00 1.31 0.00 0.00 1.19 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.96 7.81 61 Q 7.93 4.23 0.00 1.78 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.38 0.00 0.00 0.00 0.00 0.00 1.68 2.16 0.00 62 H 7.60 4.75 0.00 2.97 3.15 0.00 5.70 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 N 7.82 5.15 0.00 3.04 3.53 0.00 0.00 5.85 7.64 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 64 S 8.17 4.23 0.00 4.04 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 65 G 8.97 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 66 V 7.87 3.79 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 0.73 0.00 0.00 1.12 0.00 0.00 67 G 8.43 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 0.00 0.00 0.00 68 H 8.64 4.89 0.00 2.98 3.14 0.00 5.66 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 8.96 4.64 0.00 1.53 1.63 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.39 1.26 7.81 70 S 9.07 4.12 0.00 3.98 4.01 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 71 K 7.90 4.14 0.00 1.80 1.94 0.00 1.85 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.45 7.81 72 V 7.56 3.77 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 0.92 0.00 0.00 0.94 0.00 0.00 73 D 8.77 4.75 0.00 2.80 2.52 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 74 G 10.19 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 75 W 7.36 4.97 0.00 3.48 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 76 D 6.75 4.38 0.00 1.99 2.29 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 77 A 7.14 4.71 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 0.00 0.00 0.00 0.00 0.00 78 G 7.93 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 79 R 7.34 4.05 0.00 0.67 1.45 0.00 3.07 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.12 0.00 80 Y 7.83 4.64 0.00 2.84 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 81 P 0.00 4.62 0.00 2.19 1.95 0.00 3.59 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 2.34 2.27 0.00 82 E 8.51 4.01 0.00 2.22 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 2.40 2.41 0.00 83 K 8.11 3.91 0.00 1.90 1.92 0.00 1.77 0.00 0.00 1.87 0.00 0.00 3.18 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.57 1.56 7.81 84 A 8.14 4.20 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 85 S 8.19 4.16 0.00 4.15 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 86 K 8.45 4.09 0.00 2.02 1.90 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.72 7.81 87 A 8.19 4.10 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 88 F 8.57 3.93 0.00 3.33 3.20 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 89 L 8.09 4.17 0.00 1.95 1.77 0.96 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.04 4.36 0.00 3.01 2.71 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 91 L 7.86 3.90 0.00 1.70 1.80 0.81 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 92 L 8.45 4.05 0.00 1.76 1.75 1.09 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 93 E 8.64 3.93 0.00 2.12 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 2.32 2.33 0.00 94 N 8.21 4.26 0.00 2.99 2.97 0.00 0.00 7.04 8.44 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 95 A 8.06 3.95 1.37 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 0.00 0.00 96 V 8.19 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 1.07 0.00 0.00 0.96 0.00 0.00 97 G 7.88 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 98 N 8.69 4.40 0.00 2.92 2.91 0.00 0.00 6.91 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 99 A 8.48 4.07 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 0.00 100 D 8.23 4.68 0.00 2.92 2.78 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 0.00 101 H 8.28 4.44 0.00 3.23 3.53 0.00 5.90 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Q 7.73 4.54 0.00 2.69 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.13 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 103 G 8.36 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 0.00 104 F 7.88 4.41 0.00 3.19 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 0.00 105 D 8.54 4.88 0.00 2.80 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 0.00 106 G 8.63 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 0.00 107 E 8.44 3.86 0.00 2.06 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 2.44 2.37 0.00 108 A 7.52 4.24 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 0.00 109 M 8.00 4.45 0.00 1.92 2.16 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 2.59 2.53 0.00 110 T 8.67 4.66 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 0.00 111 I 8.77 4.14 1.93 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.01 0.93 0.00 0.00 112 K 8.87 4.02 0.00 1.77 1.99 0.00 1.86 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.39 7.81 113 H 8.05 5.15 0.00 3.20 3.11 0.00 5.74 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.28 5.40 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 0.57 0.00 0.00 1.14 0.00 0.00 115 A 8.58 4.72 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 0.00 116 A 8.61 5.34 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 0.00 117 H 9.24 4.90 0.00 3.03 3.12 0.00 5.81 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.79 3.97 0.00 0.79 1.02 0.00 1.42 0.00 0.00 1.39 0.00 0.00 2.57 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.12 1.06 7.81 119 V 9.10 3.87 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 0.72 0.00 0.00 0.95 0.00 0.00 120 G 6.64 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 0.00 121 E 7.87 5.07 0.00 1.77 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 2.14 2.22 0.00 122 Q 9.35 4.19 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 7.00 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 123 Q 8.73 4.80 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.51 0.00 124 G 10.81 4.96 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 0.00 0.00 0.00 125 R 8.62 5.18 0.00 1.79 1.78 0.00 3.28 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 126 K 9.19 4.28 0.00 1.14 1.57 0.00 1.11 0.00 0.00 1.09 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.57 1.11 7.81 127 P 0.00 4.55 0.00 1.88 1.92 0.00 3.49 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 1.95 2.07 0.00 128 R 8.83 4.78 0.00 1.72 1.81 0.00 3.32 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.70 0.00 129 A 8.33 4.11 1.25 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 0.00 130 M 8.92 3.62 0.00 2.20 2.23 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 2.48 2.47 0.00 131 G 8.37 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 132 R 7.50 4.79 0.00 1.80 1.73 0.00 3.04 0.00 0.00 3.18 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 133 A 8.59 5.37 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 0.00 134 S 8.64 4.82 0.00 3.95 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 0.00 135 A 8.60 4.56 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 0.00 136 W 9.07 5.10 0.00 3.41 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 0.00 137 N 8.01 5.33 0.00 2.59 2.79 0.00 0.00 7.03 7.57 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 0.00 138 S 8.46 4.72 0.00 3.73 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 0.00 139 P 0.00 4.75 0.00 2.28 1.94 0.00 3.50 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 2.08 2.07 0.00 140 Q 9.08 5.03 0.00 1.91 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.75 0.00 0.00 0.00 0.00 0.00 2.23 2.22 0.00 141 V 9.30 4.82 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 1.13 0.00 0.00 1.12 0.00 0.00 142 D 8.80 5.39 0.00 2.63 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 0.00 143 V 8.31 4.97 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 0.41 0.00 0.00 0.78 0.00 0.00 144 E 8.98 5.12 0.00 2.09 1.76 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 2.19 2.26 0.00 145 L 8.77 5.23 0.00 1.78 1.52 1.06 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 146 I 9.25 4.93 1.93 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 1.25 0.94 0.86 0.00 0.00 147 L 9.12 5.01 0.00 1.40 1.45 0.88 0.65 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 0.00 148 E 9.03 5.07 0.00 1.91 1.67 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 2.17 2.38 0.00 149 E 8.60 4.33 0.00 2.06 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 0.00 2.58 2.41 0.00 150 P 0.00 4.40 0.00 2.05 1.99 0.00 3.74 0.00 0.00 3.71 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