NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9381 8.3549 109.7387 45.5034 0.0000 173.0381 2 S 4.5571 8.4400 122.3385 55.3289 64.3101 172.1834 3 M 4.8365 8.3449 120.3114 54.7810 34.6196 173.3322 4 T 4.4518 8.4312 111.7540 62.0323 67.8867 172.6552 5 V 3.4301 7.9245 117.2098 60.2571 31.2679 172.7339 6 R 4.6854 8.5298 121.2891 54.7013 30.7724 174.3357 7 Y 4.9460 8.4107 121.3294 55.3304 40.6249 175.2207 8 Q 4.3296 9.2469 119.8566 54.1975 33.0516 174.0714 9 I 4.9203 8.3053 124.2136 59.7535 38.9573 174.7481 10 E 4.7260 8.9864 124.4998 54.1865 33.3916 174.7169 11 Q 3.9035 8.0640 121.2346 54.7371 29.9106 175.2953 12 L 3.9124 8.3920 128.2676 57.5851 41.9290 176.3263 13 G 4.0272 7.5859 110.3718 44.5378 0.0000 173.1830 14 D 4.8433 8.4509 119.3501 53.7510 42.0896 178.4338 15 S 4.7487 7.6574 113.1978 56.2939 63.1931 172.9037 16 A 3.6954 7.8050 120.1645 51.3899 23.2789 175.6033 17 M 4.9988 8.8174 118.9779 53.8476 35.8811 173.9387 18 M 5.2669 8.6852 124.7409 53.7711 35.7465 173.9240 19 I 5.0078 9.0111 127.0287 59.5266 40.3729 174.4961 20 R 5.0185 8.8031 124.2624 54.8421 31.5645 175.7257 21 F 5.0930 9.3413 122.4372 57.2177 41.8639 174.6214 22 G 4.1664 8.8862 112.7253 45.7039 0.0000 171.0986 23 E 4.4932 8.3185 114.2904 56.9246 31.3124 173.1012 24 E 4.2716 9.2935 121.5182 57.3587 27.6371 176.0705 25 I 4.5256 7.5744 108.4245 60.6951 38.7761 175.8309 26 N 5.0331 7.7374 115.6399 52.6609 38.4059 175.4538 27 E 4.0736 7.8831 119.8862 59.0553 30.0092 178.8846 28 Q 3.8460 8.0038 119.4882 59.2341 29.0468 178.6115 29 V 3.1487 7.4858 118.3751 65.9536 31.4978 177.0509 30 N 4.1601 8.1994 115.9481 56.6137 38.7468 176.2857 31 G 3.6941 8.0746 106.3948 46.8593 0.0000 175.6638 32 I 3.7653 7.6463 120.9605 63.3341 36.8055 178.2748 33 V 3.6210 8.2463 120.6584 64.6864 30.9490 177.9776 34 H 4.2975 8.0465 118.2353 58.7431 30.1104 175.8736 35 A 4.2706 7.8109 121.5093 54.0027 19.0159 179.1981 36 A 3.8899 8.4682 118.3094 54.9004 17.7656 179.6344 37 A 3.9905 7.5742 119.7747 55.4593 18.5148 179.6733 38 A 4.6746 7.8419 119.9838 54.4032 18.6005 178.9151 39 Y 3.7657 8.5817 118.8859 61.1183 38.6250 178.6612 40 I 3.7561 8.0163 120.0192 63.9368 37.5705 177.7887 41 E 3.4566 7.5717 117.3273 58.2860 29.4142 178.5733 42 E 4.0580 7.8222 119.0121 57.3983 31.0846 176.6920 43 Q 4.4535 7.3928 115.8627 53.4927 28.8996 171.8516 44 P 4.3006 0.0000 0.0000 60.9557 34.3559 175.1548 45 F 5.0020 6.6628 112.1628 54.2481 39.6846 174.9606 46 P 4.5802 0.0000 0.0000 65.0810 31.4328 177.2769 47 G 4.3264 8.3629 106.0941 45.0361 0.0000 172.5550 48 F 4.7360 8.7638 123.3175 58.7656 39.3134 173.8420 49 I 4.1060 8.0252 125.0581 61.8899 38.6832 175.0240 50 E 4.5733 7.8390 120.7549 55.5042 33.6949 173.3985 51 C 5.4887 8.7301 118.8030 57.1200 32.5438 172.9855 52 I 4.6528 9.2949 118.1039 58.2896 40.0579 172.9040 53 P 4.7576 0.0000 0.0000 61.3606 31.7314 176.9879 54 A 4.7129 9.2520 131.5188 51.5989 19.2136 176.8406 55 F 4.1515 8.7077 130.1954 58.9219 39.2871 175.4029 56 T 4.8046 7.7815 105.8767 61.1514 70.9692 172.1991 57 S 5.3194 8.3154 115.7082 57.0918 66.7920 172.5998 58 L 4.9143 9.4419 125.4204 53.4628 44.0139 176.0675 59 T 4.4914 9.0347 122.9617 62.5542 69.5595 174.2539 60 V 4.8847 8.8440 128.4361 61.2663 33.6439 174.4262 61 F 4.7901 9.4835 127.9277 56.2508 41.8047 174.4898 62 Y 5.2574 7.6169 118.0039 56.8896 41.4394 171.8879 63 D 5.2855 9.8005 121.2283 53.1016 42.2382 177.2103 64 M 4.1718 9.1041 124.5642 58.2152 31.0293 177.6950 65 Y 4.4660 8.8135 121.3545 60.4660 38.6200 177.1014 66 E 3.4775 8.0092 119.0407 57.6310 29.9103 178.4810 67 V 3.3734 7.3297 112.1973 64.1920 31.6136 177.7059 68 Y 4.3515 8.1590 115.9857 60.9523 37.7181 178.3846 69 K 4.0103 7.5162 119.5656 59.9402 32.2212 176.9168 70 H 4.2783 7.6163 115.6219 53.2446 30.2150 175.6157 71 L 3.5192 8.3859 121.4058 55.3839 39.6102 173.3466 72 P 4.2814 0.0000 0.0000 62.2876 32.4205 176.6928 73 Q 4.2665 8.3262 119.9491 59.6268 27.8948 174.5273 74 G 3.3897 8.5926 117.5625 45.5582 0.0000 172.6413 75 I 4.0312 7.6383 123.0102 61.2986 36.7508 175.9827 76 S 4.6454 9.3894 121.8633 58.5579 63.6625 174.7376 77 S 4.6924 7.3831 116.6461 55.2339 66.7857 172.3294 78 P 3.8574 0.0000 0.0000 65.9897 31.1859 178.7538 79 F 4.4622 8.3346 113.7887 59.4301 37.3660 176.7810 80 E 3.0594 7.0413 118.7400 58.3213 29.6643 178.2960 81 S 4.0379 7.6545 113.6077 61.0151 62.4651 176.1784 82 V 3.0120 7.1128 120.4385 65.4425 31.0445 177.6854 83 K 3.8590 7.5929 118.0347 59.7780 31.8554 179.3408 84 R 3.8422 7.7189 117.5388 59.2507 29.7854 178.7937 85 D 4.3908 7.7505 117.3439 57.1830 41.0456 178.5506 86 V 4.0123 7.9428 112.7147 63.7307 31.4084 178.0666 87 E 4.0871 8.7456 119.2810 59.7112 29.2173 179.4361 88 E 4.0156 7.9883 115.5463 59.1595 28.4885 179.0477 89 R 4.3377 7.7704 118.4418 58.8590 30.6981 178.4001 90 L 3.5657 8.6248 119.3872 57.6556 41.7121 179.0889 91 A 3.9610 8.6188 121.3825 55.6401 18.0924 179.2059 92 E 4.0453 7.4379 111.9703 58.1911 29.5339 178.4068 93 I 4.0227 7.5302 112.5362 61.5844 38.5669 175.3699 94 A 3.9335 7.3260 131.4230 51.7019 23.1967 178.0110 95 E 4.2399 7.4125 113.3698 58.0800 29.3227 178.1924 96 D 4.6780 7.6529 119.7604 56.6530 39.3382 177.4464 97 Y 4.6023 7.4761 116.8938 60.3963 37.9669 175.6764 98 E 4.5559 8.6275 118.3742 53.6410 30.7731 172.0846 99 V 3.6258 7.9063 129.6585 62.2117 31.2283 172.6073 100 N 4.0647 8.7980 124.3180 52.8891 37.7277 175.3205 101 R 4.1143 7.3593 124.3800 56.9782 31.6691 175.2855 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 8.35 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 0.00 0.00 0.00 2 S 8.44 4.56 0.00 3.97 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 3 M 8.34 4.84 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.56 0.00 4 T 8.43 4.45 4.54 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 1.38 0.00 0.00 5 V 7.92 3.43 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 0.81 0.00 0.00 1.29 0.00 0.00 6 R 8.53 4.69 0.00 1.70 2.02 0.00 3.47 0.00 0.00 3.30 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 7 Y 8.41 4.95 0.00 2.29 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 9.25 4.33 0.00 1.90 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.02 0.00 0.00 0.00 0.00 0.00 2.18 2.20 0.00 9 I 8.31 4.92 1.93 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.62 1.14 0.00 0.00 10 E 8.99 4.73 0.00 1.91 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 2.10 0.00 11 Q 8.06 3.90 0.00 0.98 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.99 6.97 0.00 0.00 0.00 0.00 0.00 2.02 2.15 0.00 12 L 8.39 3.91 0.00 1.47 1.43 0.79 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 13 G 7.59 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 0.00 0.00 0.00 14 D 8.45 4.84 0.00 2.78 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 15 S 7.66 4.75 0.00 4.06 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 16 A 7.81 3.70 0.69 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 0.00 0.00 17 M 8.82 5.00 0.00 2.46 2.34 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 2.68 2.62 0.00 18 M 8.69 5.27 0.00 2.06 1.71 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.48 0.00 19 I 9.01 5.01 1.89 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.95 0.68 0.00 0.00 20 R 8.80 5.02 0.00 1.93 2.07 0.00 3.09 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 1.56 1.76 0.00 21 F 9.34 5.09 0.00 2.81 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 22 G 8.89 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 23 E 8.32 4.49 0.00 2.14 2.04 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 2.26 2.38 0.00 24 E 9.29 4.27 0.00 2.20 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 0.00 2.24 2.33 0.00 25 I 7.57 4.53 1.88 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 1.44 0.70 0.93 0.00 0.00 26 N 7.74 5.03 0.00 2.87 2.74 0.00 0.00 7.09 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 27 E 7.88 4.07 0.00 2.01 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 28 Q 8.00 3.85 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 6.67 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 29 V 7.49 3.15 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 0.86 0.00 0.00 0.81 0.00 0.00 30 N 8.20 4.16 0.00 2.48 2.88 0.00 0.00 7.10 7.66 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 31 G 8.07 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 0.00 0.00 0.00 32 I 7.65 3.77 1.91 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 1.44 1.36 0.51 0.00 0.00 33 V 8.25 3.62 1.86 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 0.91 0.00 0.00 1.03 0.00 0.00 34 H 8.05 4.30 0.00 3.06 3.49 0.00 5.92 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 7.81 4.27 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 36 A 8.47 3.89 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 37 A 7.57 3.99 1.50 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 0.00 0.00 0.00 38 A 7.84 4.67 1.38 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 0.00 0.00 39 Y 8.58 3.77 0.00 3.12 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 I 8.02 3.76 1.75 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.86 0.52 0.00 0.00 41 E 7.57 3.46 0.00 2.13 2.13 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 2.31 2.27 0.00 42 E 7.82 4.06 0.00 1.72 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.48 0.00 43 Q 7.39 4.45 0.00 1.82 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.69 5.62 0.00 0.00 0.00 0.00 0.00 2.14 2.02 0.00 44 P 0.00 4.30 0.00 1.78 1.51 0.00 3.62 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.91 0.00 45 F 6.66 5.00 0.00 3.26 3.16 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 46 P 0.00 4.58 0.00 2.29 2.29 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 2.18 2.19 0.00 47 G 8.36 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 F 8.76 4.74 0.00 2.13 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 49 I 8.03 4.11 1.97 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 1.58 1.08 0.80 0.00 0.00 50 E 7.84 4.57 0.00 1.79 1.55 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 2.19 2.19 0.00 51 C 8.73 5.49 0.00 3.18 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 I 9.29 4.65 1.96 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.18 0.96 0.00 0.00 53 P 0.00 4.76 0.00 1.94 2.28 0.00 3.66 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 1.92 2.07 0.00 54 A 9.25 4.71 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 55 F 8.71 4.15 0.00 3.18 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 T 7.78 4.80 4.38 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 1.26 0.00 0.00 57 S 8.32 5.32 0.00 3.99 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 58 L 9.44 4.91 0.00 1.77 1.69 1.06 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 59 T 9.03 4.49 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 1.08 0.00 0.00 60 V 8.84 4.88 2.42 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 1.30 0.00 0.00 1.13 0.00 0.00 61 F 9.48 4.79 0.00 2.99 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 62 Y 7.62 5.26 0.00 3.49 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 63 D 9.80 5.29 0.00 2.94 2.92 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 64 M 9.10 4.17 0.00 2.37 2.18 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.85 0.00 65 Y 8.81 4.47 0.00 3.23 3.41 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.01 3.48 0.00 2.00 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 1.95 2.53 0.00 67 V 7.33 3.37 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 0.30 0.00 0.00 0.59 0.00 0.00 68 Y 8.16 4.35 0.00 3.10 2.92 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 69 K 7.52 4.01 0.00 1.64 1.90 0.00 1.64 0.00 0.00 1.65 0.00 0.00 3.15 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.46 1.42 7.81 70 H 7.62 4.28 0.00 3.22 3.11 0.00 5.98 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 71 L 8.39 3.52 0.00 1.94 1.86 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 72 P 0.00 4.28 0.00 2.13 1.94 0.00 3.51 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 2.05 2.08 0.00 73 Q 8.33 4.27 0.00 2.03 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 7.17 0.00 0.00 0.00 0.00 0.00 2.36 2.29 0.00 74 G 8.59 3.39 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 0.00 75 I 7.64 4.03 1.95 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.75 0.84 0.00 0.00 76 S 9.39 4.65 0.00 3.80 3.91 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 0.00 0.00 0.00 77 S 7.38 4.69 0.00 3.71 3.91 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 0.00 0.00 0.00 78 P 0.00 3.86 0.00 2.06 1.57 0.00 3.65 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.29 0.00 79 F 8.33 4.46 0.00 3.42 3.37 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 80 E 7.04 3.06 0.00 1.19 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 2.06 1.93 0.00 81 S 7.65 4.04 0.00 3.74 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 82 V 7.11 3.01 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 0.19 0.00 0.00 -0.18 0.00 0.00 83 K 7.59 3.86 0.00 1.86 1.92 0.00 1.87 0.00 0.00 1.47 0.00 0.00 2.67 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.40 7.81 84 R 7.72 3.84 0.00 1.83 1.91 0.00 3.21 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.71 0.00 85 D 7.75 4.39 0.00 2.62 2.92 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 86 V 7.94 4.01 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 1.16 0.00 0.00 1.07 0.00 0.00 87 E 8.75 4.09 0.00 2.15 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 2.39 2.54 0.00 88 E 7.99 4.02 0.00 2.15 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 0.00 2.63 2.40 0.00 89 R 7.77 4.34 0.00 2.21 2.34 0.00 3.22 0.00 0.00 3.41 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 2.13 0.00 90 L 8.62 3.57 0.00 1.54 1.85 0.95 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 91 A 8.62 3.96 1.32 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 0.00 0.00 92 E 7.44 4.05 0.00 1.92 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 2.44 2.52 0.00 93 I 7.53 4.02 1.68 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.38 0.70 0.00 0.00 94 A 7.33 3.93 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 95 E 7.41 4.24 0.00 2.15 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 2.22 1.97 0.00 96 D 7.65 4.68 0.00 2.83 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 97 Y 7.48 4.60 0.00 3.02 2.99 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 98 E 8.63 4.56 0.00 2.25 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 2.41 2.58 0.00 99 V 7.91 3.63 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 1.28 0.00 0.00 1.01 0.00 0.00 100 N 8.80 4.06 0.00 2.74 2.67 0.00 0.00 7.38 8.63 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 0.00 101 R 7.36 4.11 0.00 1.83 1.89 0.00 3.31 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00