NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9155 8.3544 109.7396 44.9010 0.0000 173.5511 2 I 3.4026 7.4332 119.4536 59.8135 38.2993 173.7267 3 D 4.4240 8.5830 127.0878 53.8432 42.0756 174.6480 4 P 4.4824 0.0000 0.0000 64.8691 31.4439 176.5804 5 N 4.8013 8.6508 116.9969 53.0773 38.6824 176.1894 6 Y 4.1612 7.8416 120.5470 60.1591 38.0903 178.8388 7 R 3.3696 6.8005 118.4148 58.4244 30.0664 177.3476 8 T 4.3905 7.2864 104.8375 61.5073 69.5384 175.0806 9 S 4.6609 7.8065 114.8397 58.0518 65.0361 174.0821 10 R 4.6561 8.1494 120.4637 54.2740 31.7967 175.6657 11 Q 4.1739 8.4638 123.1410 56.0057 30.4533 174.9869 12 V 4.0334 8.3972 126.7758 63.0639 31.5353 175.8231 13 V 4.0736 8.8624 121.6692 60.7648 32.6545 176.3120 14 G 3.8726 6.7731 108.5952 45.7267 0.0000 170.7260 15 E 4.9420 8.1266 117.8423 54.5979 32.2796 175.5749 16 H 4.5941 9.0413 121.4006 55.3126 31.9930 173.1209 17 Q 3.3313 9.9450 128.4124 56.8790 27.3320 174.2884 18 G 3.9515 8.5664 103.0460 44.7623 0.0000 173.4973 19 H 5.0102 7.7831 115.4307 53.1779 31.1704 173.8019 20 K 4.4211 8.3524 120.0313 56.3554 33.6598 175.8028 21 V 4.5537 8.9421 123.7326 61.3190 34.3094 173.7639 22 Y 4.8549 9.4470 126.4165 56.5309 39.7929 176.2977 23 G 4.2836 8.9627 113.7478 44.6321 0.0000 171.0300 24 P 4.8793 0.0000 0.0000 62.4497 32.4773 176.0903 25 V 4.4509 8.1850 120.1311 60.3164 34.0708 175.7379 26 D 4.7769 9.0452 123.2708 52.4903 42.4714 172.5936 27 P 4.6933 0.0000 0.0000 61.6345 32.3416 174.7447 28 P 4.7293 0.0000 0.0000 62.9492 31.9107 177.4467 29 K 4.0123 7.9148 118.5523 57.6851 32.7382 176.8044 30 V 4.6202 8.0900 119.0937 61.1150 33.0841 175.3977 31 L 4.6337 9.8953 126.4666 53.3216 44.0883 178.3642 32 G 3.8852 9.2072 108.6009 44.9004 0.0000 171.7824 33 I 4.7577 7.9057 119.3469 59.7314 39.2461 174.2500 34 H 4.8282 8.7748 122.5247 55.0337 30.2777 175.1858 35 G 4.5924 8.9625 110.4812 46.9670 0.0000 172.5033 36 T 4.6451 8.9114 114.3813 65.3173 70.9145 176.2301 37 I 4.1277 8.0850 121.1563 63.2686 38.4880 175.6434 38 V 4.5705 8.2207 124.1127 61.1136 33.8202 174.1222 39 G 4.3942 9.4002 116.6531 43.9143 0.0000 171.5259 40 V 4.9269 8.6574 125.2608 60.9608 34.5648 174.0646 41 D 4.8065 9.1264 129.1181 53.6428 39.9820 176.9189 42 F 4.4237 9.3128 126.9149 60.4208 39.1222 177.4007 43 D 4.5343 8.3796 118.8520 55.5495 41.0246 176.8273 44 L 4.5076 7.1791 118.6543 55.7487 43.4179 177.0165 45 C 3.9020 7.9900 118.3008 60.2332 31.5616 173.2310 46 I 4.3276 8.3612 118.1729 60.0024 37.9834 174.7496 47 A 3.8493 7.9592 121.5531 53.7211 15.2352 178.7978 48 D 4.3364 8.2878 122.0901 56.9648 41.9729 177.1587 49 G 4.1566 8.4736 105.5868 45.8416 0.0000 175.0093 50 S 4.1640 8.0018 117.6521 61.1299 62.8062 176.2503 51 C 3.9593 7.7804 117.0216 61.4684 29.0326 176.0354 52 I 3.6523 7.1882 120.7985 64.0996 36.7825 178.1660 53 T 3.9913 7.9627 115.5035 65.6976 68.2660 175.7360 54 A 4.5429 7.3636 120.9737 52.2597 20.0038 177.0665 55 C 4.2128 7.6407 118.9096 58.8242 31.8038 172.5324 56 P 4.3959 0.0000 0.0000 64.6223 31.3128 176.9678 57 V 4.3132 6.8022 112.8794 60.9769 32.4672 174.6481 58 N 4.1305 8.3781 114.3354 54.7539 37.3266 175.3621 59 V 3.5382 7.6927 118.2743 65.2893 32.7625 175.7021 60 F 5.3519 7.7909 117.1199 56.2907 40.6673 175.3589 61 Q 4.5060 9.3087 122.3721 53.7416 32.8175 174.2495 62 W 5.1669 8.7368 125.0026 57.6179 30.1146 174.8585 63 Y 4.9987 9.4334 124.8676 56.0450 41.6487 173.7893 64 D 4.8493 8.4069 126.7564 53.6372 42.1298 177.1007 65 T 4.4703 9.2947 112.6948 58.6884 68.5108 171.1906 66 P 4.6764 0.0000 0.0000 65.0716 32.0489 177.9294 67 G 3.9152 9.4129 111.3025 45.4304 0.0000 173.0028 68 H 4.7192 8.2406 120.6539 54.3992 30.3267 174.4262 69 P 4.1265 0.0000 0.0000 65.0825 31.4250 177.0581 70 A 4.3485 7.7940 120.8411 53.6720 19.5663 176.8341 71 S 4.5311 7.1605 106.5519 57.9066 65.4456 175.8669 72 E 4.5442 8.2438 120.0287 57.5007 30.3154 175.9806 73 K 4.6427 7.4181 117.0500 55.7747 35.6426 174.9448 74 K 4.7376 9.3476 119.4383 54.4270 37.0187 175.7861 75 A 4.3404 8.5822 123.8191 51.6726 18.8748 176.3363 76 D 5.0823 9.2387 123.5589 52.5848 42.7860 175.3530 77 P 4.5013 0.0000 0.0000 62.1547 28.3607 176.4180 78 I 3.8370 7.6605 120.7076 63.7821 39.2682 175.5103 79 N 4.9915 8.0615 119.4288 52.0207 38.9224 176.2768 80 E 3.7684 8.0650 118.5950 59.5362 30.0081 179.3299 81 Q 4.1639 8.0314 116.6675 58.0536 28.7978 177.1427 82 A 4.1115 7.8444 119.5749 52.8498 18.9380 177.3361 83 C 3.8888 8.0246 117.5708 59.4993 31.8097 173.4365 84 I 3.7811 7.6947 119.6518 60.1739 36.2367 175.0239 85 F 3.9810 7.3854 116.7165 59.4359 36.3418 177.4518 86 C 4.3150 8.1628 116.1072 59.7882 29.7002 174.3363 87 M 3.2566 7.9277 116.8477 56.0306 29.9653 178.2325 88 A 4.0027 8.0383 122.6188 55.2996 18.5956 179.8359 89 C 4.0191 8.1260 112.4724 61.8873 29.4607 176.3530 90 V 3.6930 7.1010 110.7807 63.5030 31.1989 177.4116 91 N 4.7034 7.8602 113.2616 53.6639 38.9667 175.9467 92 V 4.1399 7.4947 112.5657 61.5231 33.4076 175.8853 93 C 4.2208 7.8788 121.7304 58.4615 31.6909 172.3342 94 P 4.4045 0.0000 0.0000 64.6153 31.2684 177.1833 95 V 4.1154 7.6983 116.1015 60.2768 32.5422 175.0651 96 A 3.6609 7.6280 122.4745 53.6789 16.2605 178.0296 97 A 4.5912 7.6467 121.0572 52.5045 20.7136 178.2611 98 I 5.0608 7.6498 116.0251 59.3028 40.2285 174.6810 99 D 4.8380 9.4000 125.6658 52.6432 44.0742 174.2887 100 V 4.9750 8.5906 125.4926 61.4498 34.1372 174.6921 101 K 4.5782 9.2108 126.8339 54.2933 35.9529 174.2491 102 P 3.4262 0.0000 0.0000 61.3843 31.6888 174.4308 103 P 4.4635 0.0000 0.0000 63.4201 31.2560 176.2149 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 3.92 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 2 I 7.43 3.40 1.99 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.85 0.99 0.00 0.00 3 D 8.58 4.42 0.00 2.83 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 4 P 0.00 4.48 0.00 2.23 2.19 0.00 3.83 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 2.00 2.01 0.00 5 N 8.65 4.80 0.00 2.87 2.81 0.00 0.00 6.58 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 6 Y 7.84 4.16 0.00 2.93 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 7 R 6.80 3.37 0.00 1.37 1.75 0.00 2.78 0.00 0.00 3.02 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.50 0.00 8 T 7.29 4.39 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 1.15 0.00 0.00 9 S 7.81 4.66 0.00 3.99 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 10 R 8.15 4.66 0.00 2.25 2.16 0.00 3.33 0.00 0.00 3.57 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 11 Q 8.46 4.17 0.00 2.17 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.10 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 12 V 8.40 4.03 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 0.62 0.00 0.00 0.64 0.00 0.00 13 V 8.86 4.07 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 0.96 0.00 0.00 14 G 6.77 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 15 E 8.13 4.94 0.00 1.87 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 2.14 2.15 0.00 16 H 9.04 4.59 0.00 2.86 2.81 0.00 5.75 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 Q 9.94 3.33 0.00 1.88 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.34 0.00 0.00 0.00 0.00 0.00 2.19 2.32 0.00 18 G 8.57 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 19 H 7.78 5.01 0.00 3.25 3.44 0.00 5.26 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 K 8.35 4.42 0.00 1.62 1.22 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.77 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.38 7.81 21 V 8.94 4.55 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 0.91 0.00 0.00 0.50 0.00 0.00 22 Y 9.45 4.85 0.00 2.87 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 23 G 8.96 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 24 P 0.00 4.88 0.00 2.11 2.08 0.00 3.75 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 25 V 8.19 4.45 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 0.74 0.00 0.00 1.04 0.00 0.00 26 D 9.05 4.78 0.00 2.78 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 27 P 0.00 4.69 0.00 2.12 2.03 0.00 3.75 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.13 0.00 28 P 0.00 4.73 0.00 2.32 2.29 0.00 3.70 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 2.02 1.98 0.00 29 K 7.91 4.01 0.00 1.77 1.88 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.41 7.81 30 V 8.09 4.62 2.30 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 1.24 0.00 0.00 0.96 0.00 0.00 31 L 9.90 4.63 0.00 1.76 1.85 1.06 1.19 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 32 G 9.21 3.89 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 0.00 33 I 7.91 4.76 1.53 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.80 0.19 0.00 0.00 34 H 8.77 4.83 0.00 2.65 2.99 0.00 5.60 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 G 8.96 4.59 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 0.00 0.00 0.00 36 T 8.91 4.65 4.36 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 1.30 0.00 0.00 37 I 8.09 4.13 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 1.32 1.16 1.16 0.00 0.00 38 V 8.22 4.57 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 0.99 0.00 0.00 0.85 0.00 0.00 39 G 9.40 4.39 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 40 V 8.66 4.93 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 1.29 0.00 0.00 1.25 0.00 0.00 41 D 9.13 4.81 0.00 2.73 2.59 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 42 F 9.31 4.42 0.00 3.24 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 43 D 8.38 4.53 0.00 2.94 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 44 L 7.18 4.51 0.00 1.82 1.71 1.01 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 45 C 7.99 3.90 0.00 2.96 2.85 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 0.00 0.00 0.00 46 I 8.36 4.33 1.86 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 1.35 0.82 0.95 0.00 0.00 47 A 7.96 3.85 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 48 D 8.29 4.34 0.00 2.67 2.73 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 0.00 0.00 0.00 0.00 49 G 8.47 4.16 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 0.00 50 S 8.00 4.16 0.00 3.85 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 C 7.78 3.96 0.00 2.18 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 52 I 7.19 3.65 1.64 0.00 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 -0.27 0.62 0.00 0.00 53 T 7.96 3.99 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 54 A 7.36 4.54 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 55 C 7.64 4.21 0.00 3.33 2.93 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 56 P 0.00 4.40 0.00 2.20 2.15 0.00 3.76 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.97 0.00 57 V 6.80 4.31 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 0.63 0.00 0.00 0.84 0.00 0.00 58 N 8.38 4.13 0.00 2.79 2.80 0.00 0.00 7.15 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 59 V 7.69 3.54 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 0.11 0.00 0.00 0.71 0.00 0.00 60 F 7.79 5.35 0.00 2.77 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 61 Q 9.31 4.51 0.00 2.03 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.97 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 62 W 8.74 5.17 0.00 3.28 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 63 Y 9.43 5.00 0.00 3.04 2.85 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 0.00 0.00 0.00 64 D 8.41 4.85 0.00 2.40 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 0.00 0.00 0.00 0.00 65 T 9.29 4.47 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 1.13 0.00 0.00 66 P 0.00 4.68 0.00 2.16 2.06 0.00 3.75 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.91 0.00 67 G 9.41 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 68 H 8.24 4.72 0.00 3.21 3.41 0.00 5.64 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.13 0.00 2.16 2.11 0.00 3.12 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 1.78 1.84 0.00 70 A 7.79 4.35 1.41 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 0.00 0.00 71 S 7.16 4.53 0.00 3.96 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 72 E 8.24 4.54 0.00 1.79 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 2.31 2.17 0.00 73 K 7.42 4.64 0.00 1.66 1.52 0.00 0.91 0.00 0.00 1.21 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.82 1.12 7.81 74 K 9.35 4.74 0.00 0.97 0.74 0.00 1.34 0.00 0.00 1.32 0.00 0.00 2.68 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.43 1.10 7.81 75 A 8.58 4.34 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 D 9.24 5.08 0.00 3.08 2.83 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 0.00 0.00 0.00 77 P 0.00 4.50 0.00 1.94 1.97 0.00 3.88 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.22 0.00 78 I 7.66 3.84 1.87 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 1.39 0.78 0.89 0.00 0.00 79 N 8.06 4.99 0.00 2.79 2.66 0.00 0.00 6.58 7.44 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 80 E 8.06 3.77 0.00 2.08 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 2.34 2.33 0.00 81 Q 8.03 4.16 0.00 2.03 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.07 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 82 A 7.84 4.11 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 83 C 8.02 3.89 0.00 2.70 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 84 I 7.69 3.78 1.79 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.05 0.77 0.00 0.00 85 F 7.39 3.98 0.00 3.27 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 86 C 8.16 4.31 0.00 3.10 3.07 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 87 M 7.93 3.26 0.00 2.28 2.31 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.88 0.00 88 A 8.04 4.00 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 89 C 8.13 4.02 0.00 3.15 3.35 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 90 V 7.10 3.69 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 0.90 0.00 0.00 1.03 0.00 0.00 91 N 7.86 4.70 0.00 2.79 2.87 0.00 0.00 6.92 8.98 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 92 V 7.49 4.14 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 0.69 0.00 0.00 1.02 0.00 0.00 93 C 7.88 4.22 0.00 2.90 2.80 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 94 P 0.00 4.40 0.00 2.22 2.17 0.00 3.76 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 95 V 7.70 4.12 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 0.81 0.00 0.00 0.94 0.00 0.00 96 A 7.63 3.66 1.41 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 0.00 0.00 97 A 7.65 4.59 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 98 I 7.65 5.06 1.92 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 1.24 0.67 1.18 0.00 0.00 99 D 9.40 4.84 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 0.00 100 V 8.59 4.98 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 1.11 0.00 0.00 1.05 0.00 0.00 101 K 9.21 4.58 0.00 1.75 1.56 0.00 1.73 0.00 0.00 1.62 0.00 0.00 2.76 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.30 1.35 7.81 102 P 0.00 3.43 0.00 1.78 1.35 0.00 3.56 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.36 0.00 103 P 0.00 4.46 0.00 2.20 2.12 0.00 3.58 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 1.98 2.04 0.00