NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 S 4.4670 8.3344 117.0993 58.5082 62.9101 172.4872 6 M 4.0423 8.3227 126.6151 55.9110 32.8881 171.9681 7 V 3.5499 8.5548 118.6665 63.8701 32.8544 174.3181 8 C 4.7223 8.8145 124.8151 58.7402 29.6942 173.5161 9 E 4.2768 8.6738 121.2497 56.3488 30.8237 175.6655 10 V 4.5651 7.9584 120.8623 60.7832 33.5582 174.8241 11 D 4.3296 8.6555 127.4989 54.6284 41.6488 175.6926 12 P 4.2783 0.0000 0.0000 65.6484 31.4082 178.4521 13 E 4.2124 8.2046 119.1148 58.6339 29.5832 178.4624 14 L 3.9652 7.8553 119.9951 58.3444 42.2378 178.7922 15 T 3.8477 8.2399 116.1855 66.6654 68.5090 176.3215 16 E 3.9924 8.2168 120.3518 59.3562 29.5041 179.5343 17 K 4.1050 7.9942 118.3715 59.6230 32.0324 179.4303 18 L 4.0266 8.1270 119.2360 57.8484 41.2644 179.8581 19 R 3.9460 7.9604 117.2937 59.0738 29.7998 178.6958 20 K 4.1655 8.2374 119.5987 59.4298 32.2933 178.6864 21 F 3.8991 8.3450 121.0940 61.1628 39.0165 176.9585 22 R 3.8246 7.4364 117.2561 58.5118 29.7602 177.2938 23 F 5.1150 7.2010 114.6691 56.7547 40.3579 175.2731 24 R 4.0240 7.6537 116.8297 56.5264 29.4914 176.6678 25 K 4.2320 8.3118 118.6664 56.8276 33.1279 177.0860 26 E 4.0130 7.9387 118.7180 56.7260 29.8377 176.7607 27 T 3.7415 8.0228 111.2185 62.2886 70.1272 175.1947 28 D 4.4917 7.9107 121.7415 54.6195 41.7839 177.0974 29 N 5.4405 9.1065 120.8343 53.3141 35.8057 174.0441 30 A 5.0049 8.0609 122.9065 51.8331 20.6180 177.1168 31 A 5.4940 9.2079 122.8238 50.2568 22.8386 175.1155 32 I 4.5879 8.8998 122.9115 59.7029 39.7956 174.6432 33 I 4.8859 8.8580 129.2312 59.9220 39.2371 174.9616 34 M 5.4358 9.5037 126.6198 53.4026 35.8084 174.7899 35 K 5.1822 9.0000 120.1620 55.1448 37.0572 174.9444 36 V 4.2302 8.3977 121.1753 62.1659 32.4854 174.9960 37 D 4.6348 9.3481 131.0487 53.4136 41.1654 177.6192 38 K 4.0437 8.7735 128.9093 57.6781 32.1841 175.3388 39 D 4.5593 8.2014 117.7500 57.5005 40.8883 177.8795 40 R 4.0147 8.6066 116.1131 56.7136 31.0069 176.2433 41 Q 3.3842 8.1317 116.7831 56.8533 26.4086 172.9482 42 M 5.1937 7.8037 115.9904 53.8360 36.5837 174.7831 43 V 4.3624 8.9636 126.9636 62.8562 32.9701 175.2218 44 V 4.8490 9.0963 120.2676 58.8302 36.2278 174.6647 45 L 4.0628 8.6278 124.1378 56.5684 41.8848 175.7322 46 E 4.5894 9.2692 127.5419 57.5018 30.6527 175.4458 47 E 4.6966 7.6680 115.3540 55.0837 32.9846 172.9102 48 E 5.0693 8.2424 120.8979 54.4915 33.1789 174.4232 49 F 4.9087 9.0745 124.6985 55.6834 41.5110 176.6469 50 Q 3.9736 9.1203 124.1974 59.1255 29.2136 175.3729 51 N 4.7762 7.8526 114.9963 53.0882 40.4514 173.4721 52 I 4.9820 8.9764 126.8589 59.1611 41.3942 174.9941 53 S 4.6480 9.6403 124.0523 57.3713 64.3298 173.4728 54 P 4.0855 0.0000 0.0000 65.5548 30.9541 178.6496 55 E 3.8297 8.0739 117.6348 59.3588 29.7938 178.3624 56 E 3.8327 8.2575 118.7664 59.3586 29.4829 179.2844 57 L 3.6361 7.9801 120.3703 57.8146 41.9195 178.5768 58 K 3.6639 7.8141 118.5958 60.1501 32.1166 178.2527 59 M 4.1289 7.8327 117.0920 58.3013 31.8375 178.3583 60 E 4.0664 7.7770 118.0282 58.2156 30.0710 177.9684 61 L 4.1042 7.0485 117.9661 53.5843 42.2813 175.2852 62 P 4.3532 0.0000 0.0000 62.8030 31.7861 176.6443 63 E 4.0518 8.6474 120.7197 58.8645 29.8928 177.8620 64 R 4.6250 7.7831 115.5047 55.4736 31.8420 174.2759 65 Q 4.5853 7.6343 115.2420 53.3820 32.6041 173.1633 66 P 4.4618 0.0000 0.0000 62.5597 32.5728 175.8138 67 R 4.7029 8.2424 118.9410 55.1042 35.2037 174.2101 68 F 5.3954 8.8226 120.6444 56.3446 41.5654 175.1643 69 V 4.8056 8.3731 121.7102 61.2818 34.9302 174.3710 70 V 4.8592 8.2503 120.8702 59.9868 34.0926 174.3406 71 Y 5.6743 9.1389 125.0976 56.2505 42.8427 173.4266 72 S 5.0197 9.3779 121.9147 56.9853 64.1269 171.8424 73 Y 4.6839 8.4714 128.4844 55.2207 41.0871 174.4066 74 K 3.8449 8.8531 129.7870 56.5660 33.0536 175.6237 75 Y 4.0715 8.6842 130.4182 55.6496 40.3835 174.2543 76 V 4.4414 8.1114 127.3866 62.4285 32.4609 175.4533 77 H 4.8553 9.4626 126.1085 54.6297 29.9446 176.0989 78 D 4.4668 8.6659 121.5768 56.5435 39.0439 177.6133 79 D 4.6407 8.1558 116.0937 52.6123 39.6306 177.1271 80 G 3.9732 8.5374 109.9643 45.4801 0.0000 174.4539 81 R 4.0344 7.7805 120.0973 56.5980 31.3236 175.3951 82 V 4.9170 8.2309 124.1262 61.0645 34.1213 174.5438 83 S 4.6829 8.6680 121.1469 56.3358 66.7220 172.7047 84 Y 5.2515 8.2855 116.0621 54.6994 37.0399 173.7218 85 P 4.5835 0.0000 0.0000 62.8375 33.4403 176.8197 86 L 5.5972 8.4836 120.8654 53.5521 44.4652 175.3041 87 C 4.9541 9.0857 115.3966 56.9926 34.0143 172.1654 88 F 5.2056 8.9778 122.5170 56.6273 41.2297 174.2297 89 I 5.2799 8.7345 126.9294 59.6126 40.5602 174.3161 90 F 5.4123 9.6486 130.4008 56.8096 40.7504 174.6471 91 S 4.4801 8.9402 123.2946 57.7501 62.9693 172.7867 92 S 4.6837 8.2088 123.5334 55.1146 62.1071 169.9832 93 P 4.4363 0.0000 0.0000 61.5693 32.6131 176.2890 94 V 3.6534 8.0867 124.9152 64.5689 31.8314 175.6753 95 G 4.0572 8.9163 114.8617 45.6779 0.0000 173.8314 96 C 4.4571 7.6558 115.6385 57.5592 30.3894 174.9387 97 K 4.1460 8.3724 125.9614 56.1067 33.0985 177.3854 98 P 4.5260 0.0000 0.0000 66.2563 31.2140 179.4857 99 E 4.0122 8.1483 117.6148 60.6636 29.7575 180.7685 100 Q 4.2608 8.0793 120.2108 59.2010 29.1829 178.2701 101 Q 4.0709 8.2877 118.7960 59.4919 28.5768 178.0023 102 M 4.0552 8.3372 120.3874 58.6079 32.0572 177.8680 103 M 4.0548 7.9350 117.0285 58.8606 32.7152 177.5060 104 Y 4.1579 8.3249 116.5061 61.0387 37.9687 178.1082 105 A 4.2305 9.1584 122.7528 55.5432 18.2884 179.9727 106 G 3.6501 8.3562 102.3256 46.9813 0.0000 175.0111 107 S 4.5759 7.8876 115.8009 58.3224 63.5966 175.9508 108 K 3.3843 7.6778 123.6914 59.4908 31.8687 178.0213 109 N 4.1156 7.9176 116.6413 56.4357 38.8533 176.4923 110 R 3.7372 7.7403 119.6074 59.3948 30.1447 178.1159 111 L 3.7593 7.4918 119.9702 57.8413 41.9155 178.8879 112 V 2.8424 7.5482 118.5526 66.0871 31.1692 178.1203 113 Q 3.8835 7.7731 116.1490 59.0507 28.4994 178.8510 114 T 3.9673 7.7978 116.1038 66.6155 67.7251 176.5201 115 A 4.0616 8.3311 122.8150 52.7520 18.2183 177.5542 116 E 3.6040 8.1166 115.4528 57.4728 27.6585 174.2122 117 L 4.6535 7.1251 114.9202 53.4972 43.3037 177.2208 118 T 4.1299 8.3537 112.0341 62.5690 69.8184 175.0272 119 K 4.1552 7.7067 122.2582 55.0287 32.3015 174.7689 120 V 4.6094 7.8138 124.0664 60.9148 33.4395 174.3752 121 F 5.6038 9.5522 126.9451 55.8037 42.6009 173.9987 122 E 5.4692 9.3053 122.3156 54.4306 32.3137 174.6830 123 I 4.4830 8.5978 120.0771 59.2828 40.3211 176.0452 124 R 4.7580 8.4096 122.6027 55.6342 31.6506 175.6837 125 T 4.7400 7.2054 113.8458 60.4279 70.6610 174.4577 126 T 3.7984 8.3868 118.0163 64.1880 69.0668 175.8805 127 D 4.2878 7.9841 121.5418 57.4427 40.8968 177.5927 128 D 4.0804 7.5262 117.9383 56.5059 40.7665 176.7444 129 L 3.6532 6.9731 121.1057 53.8354 40.3770 176.0045 130 T 4.7149 7.6984 114.2138 58.3535 73.4347 174.1446 131 E 3.6586 8.6446 121.4507 59.5555 29.6003 178.7530 132 A 3.9387 7.9780 120.0773 54.9215 18.4198 179.2511 133 W 3.9885 8.3252 126.7023 60.5613 30.7185 178.1485 134 L 3.3628 8.3034 119.2981 57.7798 40.9808 179.6425 135 Q 3.7158 7.8567 117.8020 58.7868 28.3570 178.4847 136 E 4.0387 7.7280 118.5540 59.5735 29.6098 179.4051 137 K 3.7902 7.2556 116.8485 58.3727 32.0327 178.6093 138 L 4.5978 8.0154 118.2467 55.7859 41.8910 178.4653 139 S 4.0913 7.7085 113.0135 60.0496 62.7971 174.0925 140 F 4.4507 7.6817 125.0546 57.5832 39.6179 174.5169 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 5 S 8.33 4.47 0.00 3.65 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 6 M 8.32 4.04 0.00 2.06 2.12 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 2.56 2.61 0.00 7 V 8.55 3.55 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 0.97 0.00 0.00 8 C 8.81 4.72 0.00 2.80 2.82 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 0.00 0.00 0.00 9 E 8.67 4.28 0.00 1.93 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 2.24 0.00 10 V 7.96 4.57 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 0.73 0.00 0.00 0.86 0.00 0.00 11 D 8.66 4.33 0.00 2.98 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 12 P 0.00 4.28 0.00 2.19 2.08 0.00 3.65 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.13 0.00 13 E 8.20 4.21 0.00 2.12 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 2.37 1.79 0.00 14 L 7.86 3.97 0.00 1.79 1.84 0.90 0.84 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 15 T 8.24 3.85 4.42 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 1.21 0.00 0.00 16 E 8.22 3.99 0.00 2.22 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 2.34 2.36 0.00 17 K 7.99 4.10 0.00 2.01 1.87 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.09 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.69 7.81 18 L 8.13 4.03 0.00 1.82 1.71 0.91 0.71 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 19 R 7.96 3.95 0.00 2.03 2.04 0.00 3.18 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 20 K 8.24 4.17 0.00 1.90 2.13 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.50 7.81 21 F 8.35 3.90 0.00 3.33 3.14 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 22 R 7.44 3.82 0.00 0.99 0.66 0.00 2.86 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.79 0.00 23 F 7.20 5.12 0.00 2.87 2.87 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 24 R 7.65 4.02 0.00 1.82 1.78 0.00 2.21 0.00 0.00 2.32 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.34 0.00 25 K 8.31 4.23 0.00 1.71 1.82 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.35 7.81 26 E 7.94 4.01 0.00 1.87 1.83 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 2.28 2.23 0.00 27 T 8.02 3.74 4.02 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 0.65 0.00 0.00 28 D 7.91 4.49 0.00 2.72 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 29 N 9.11 5.44 0.00 2.95 3.11 0.00 0.00 6.79 7.39 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 30 A 8.06 5.00 1.49 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 0.00 0.00 0.00 31 A 9.21 5.49 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 I 8.90 4.59 1.62 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.48 0.84 0.00 0.00 33 I 8.86 4.89 1.93 0.00 0.00 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 1.29 0.88 1.00 0.00 0.00 34 M 9.50 5.44 0.00 2.08 2.12 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.46 0.00 35 K 9.00 5.18 0.00 1.95 1.97 0.00 1.35 0.00 0.00 1.61 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.41 7.81 36 V 8.40 4.23 1.65 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 0.63 0.00 0.00 0.10 0.00 0.00 37 D 9.35 4.63 0.00 2.71 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 8.77 4.04 0.00 1.81 1.72 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.36 1.04 7.81 39 D 8.20 4.56 0.00 2.78 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 R 8.61 4.01 0.00 1.86 1.97 0.00 3.31 0.00 0.00 3.43 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 41 Q 8.13 3.38 0.00 2.19 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.88 0.00 0.00 0.00 0.00 0.00 2.52 2.26 0.00 42 M 7.80 5.19 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.50 0.00 43 V 8.96 4.36 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 1.01 0.00 0.00 0.92 0.00 0.00 44 V 9.10 4.85 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 0.69 0.00 0.00 0.95 0.00 0.00 45 L 8.63 4.06 0.00 1.62 1.58 0.95 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 46 E 9.27 4.59 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 2.25 2.25 0.00 47 E 7.67 4.70 0.00 1.59 1.83 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 2.27 2.29 0.00 48 E 8.24 5.07 0.00 1.88 1.71 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 2.20 2.48 0.00 49 F 9.07 4.91 0.00 3.07 2.97 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 50 Q 9.12 3.97 0.00 2.07 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.85 0.00 0.00 0.00 0.00 0.00 2.40 2.58 0.00 51 N 7.85 4.78 0.00 2.80 2.76 0.00 0.00 6.64 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 52 I 8.98 4.98 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 1.10 0.92 1.03 0.00 0.00 53 S 9.64 4.65 0.00 3.96 4.03 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 54 P 0.00 4.09 0.00 2.15 2.12 0.00 3.71 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.25 0.00 55 E 8.07 3.83 0.00 2.00 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 0.00 2.33 2.35 0.00 56 E 8.26 3.83 0.00 2.17 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 2.26 2.28 0.00 57 L 7.98 3.64 0.00 1.41 1.52 0.76 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 58 K 7.81 3.66 0.00 1.84 1.99 0.00 1.79 0.00 0.00 1.61 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.59 7.81 59 M 7.83 4.13 0.00 1.96 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 2.78 2.52 0.00 60 E 7.78 4.07 0.00 2.01 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 2.29 1.90 0.00 61 L 7.05 4.10 0.00 1.53 1.50 0.80 1.30 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 62 P 0.00 4.35 0.00 2.09 2.01 0.00 3.69 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.94 0.00 63 E 8.65 4.05 0.00 1.92 1.98 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 2.23 2.26 0.00 64 R 7.78 4.63 0.00 1.75 1.78 0.00 3.02 0.00 0.00 3.29 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 65 Q 7.63 4.59 0.00 1.88 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.19 7.05 0.00 0.00 0.00 0.00 0.00 2.44 2.28 0.00 66 P 0.00 4.46 0.00 0.49 1.52 0.00 3.14 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.79 0.00 67 R 8.24 4.70 0.00 1.61 1.74 0.00 3.45 0.00 0.00 3.20 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.71 0.00 68 F 8.82 5.40 0.00 3.01 2.62 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 69 V 8.37 4.81 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 0.79 0.00 0.00 0.91 0.00 0.00 70 V 8.25 4.86 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 0.62 0.00 0.00 0.09 0.00 0.00 71 Y 9.14 5.67 0.00 3.07 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 72 S 9.38 5.02 0.00 3.74 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 73 Y 8.47 4.68 0.00 2.83 2.79 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 74 K 8.85 3.84 0.00 1.83 1.52 0.00 1.91 0.00 0.00 1.59 0.00 0.00 2.76 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.11 0.79 7.81 75 Y 8.68 4.07 0.00 2.74 2.58 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 76 V 8.11 4.44 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 0.85 0.00 0.00 77 H 9.46 4.86 0.00 3.34 3.16 0.00 5.71 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 D 8.67 4.47 0.00 2.78 2.88 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 79 D 8.16 4.64 0.00 2.79 2.79 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 80 G 8.54 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 81 R 7.78 4.03 0.00 1.93 1.64 0.00 2.92 0.00 0.00 2.91 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.51 0.00 82 V 8.23 4.92 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 0.40 0.00 0.00 0.90 0.00 0.00 83 S 8.67 4.68 0.00 3.83 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 84 Y 8.29 5.25 0.00 2.75 2.82 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 0.00 0.00 0.00 85 P 0.00 4.58 0.00 2.27 2.28 0.00 4.00 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 2.32 2.26 0.00 86 L 8.48 5.60 0.00 1.62 1.83 0.83 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 87 C 9.09 4.95 0.00 2.88 3.12 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 0.00 0.00 0.00 0.00 88 F 8.98 5.21 0.00 3.18 2.87 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 89 I 8.73 5.28 1.98 0.00 0.00 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 1.72 1.00 1.10 0.00 0.00 90 F 9.65 5.41 0.00 3.44 3.22 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 91 S 8.94 4.48 0.00 3.85 3.59 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.21 4.68 0.00 2.72 3.10 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 93 P 0.00 4.44 0.00 1.97 1.90 0.00 3.39 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.90 0.00 94 V 8.09 3.65 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 0.69 0.00 0.00 0.90 0.00 0.00 95 G 8.92 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 96 C 7.66 4.46 0.00 3.01 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 97 K 8.37 4.15 0.00 1.78 1.73 0.00 1.80 0.00 0.00 1.87 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.07 7.81 98 P 0.00 4.53 0.00 2.27 2.35 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 2.08 2.04 0.00 99 E 8.15 4.01 0.00 2.00 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 2.31 1.93 0.00 100 Q 8.08 4.26 0.00 2.20 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.88 0.00 0.00 0.00 0.00 0.00 2.40 2.61 0.00 101 Q 8.29 4.07 0.00 2.35 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.63 0.00 102 M 8.34 4.06 0.00 2.30 2.24 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 2.65 2.60 0.00 103 M 7.93 4.05 0.00 2.25 2.13 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.49 0.00 104 Y 8.32 4.16 0.00 3.44 3.08 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 0.00 105 A 9.16 4.23 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 0.00 106 G 8.36 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 0.00 107 S 7.89 4.58 0.00 3.93 3.82 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 0.00 0.00 0.00 108 K 7.68 3.38 0.00 1.52 1.79 0.00 1.80 0.00 0.00 1.49 0.00 0.00 2.86 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.21 1.36 7.81 109 N 7.92 4.12 0.00 2.79 2.71 0.00 0.00 6.75 7.65 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 0.00 110 R 7.74 3.74 0.00 1.83 1.94 0.00 3.29 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 111 L 7.49 3.76 0.00 1.42 1.28 0.83 0.47 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 0.00 112 V 7.55 2.84 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 0.76 0.00 0.00 -0.26 0.00 0.00 113 Q 7.77 3.88 0.00 2.17 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.73 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 114 T 7.80 3.97 4.31 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 1.18 0.00 0.00 115 A 8.33 4.06 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 0.00 116 E 8.12 3.60 0.00 2.04 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 2.22 2.46 0.00 117 L 7.13 4.65 0.00 1.66 1.62 1.13 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 118 T 8.35 4.13 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 1.21 0.00 0.00 119 K 7.71 4.16 0.00 1.71 1.43 0.00 1.89 0.00 0.00 1.98 0.00 0.00 2.85 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.56 1.46 7.81 120 V 7.81 4.61 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 0.84 0.00 0.00 0.78 0.00 0.00 121 F 9.55 5.60 0.00 3.36 3.18 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 0.00 0.00 0.00 122 E 9.31 5.47 0.00 2.23 1.98 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 2.16 2.50 0.00 123 I 8.60 4.48 1.64 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.33 0.26 0.00 0.00 124 R 8.41 4.76 0.00 1.70 1.89 0.00 3.39 0.00 0.00 3.20 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.40 0.00 125 T 7.21 4.74 4.13 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 1.12 0.00 0.00 126 T 8.39 3.80 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 1.10 0.00 0.00 127 D 7.98 4.29 0.00 2.54 2.68 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 0.00 0.00 0.00 0.00 128 D 7.53 4.08 0.00 2.28 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 0.00 0.00 0.00 129 L 6.97 3.65 0.00 1.20 1.51 1.02 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 130 T 7.70 4.71 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 1.19 0.00 0.00 131 E 8.64 3.66 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 2.33 2.25 0.00 132 A 7.98 3.94 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 0.00 133 W 8.33 3.99 0.00 3.31 3.40 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 0.00 134 L 8.30 3.36 0.00 1.53 1.28 0.70 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 135 Q 7.86 3.72 0.00 1.91 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.78 0.00 0.00 0.00 0.00 0.00 1.42 2.20 0.00 136 E 7.73 4.04 0.00 1.94 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 0.00 2.34 2.47 0.00 137 K 7.26 3.79 0.00 0.79 0.74 0.00 1.09 0.00 0.00 1.31 0.00 0.00 2.75 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.38 0.21 7.81 138 L 8.02 4.60 0.00 1.95 1.93 1.11 1.30 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 0.00 139 S 7.71 4.09 0.00 3.87 3.56 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 0.00 140 F 7.68 4.45 0.00 3.13 2.87 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