NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3282 0.0000 0.0000 61.6808 32.5839 175.7120 3 K 3.8340 8.7826 123.1630 55.7766 32.7017 175.1390 4 K 3.8858 9.4460 127.7135 57.2538 33.6018 175.0347 5 V 4.9258 8.4472 126.5963 61.1863 33.6601 174.3201 6 L 4.9112 8.8079 126.5352 53.1705 46.2527 175.3053 7 T 5.0802 8.2239 115.9971 62.0893 71.7969 173.7599 8 G 4.0742 8.7565 111.9827 45.6515 0.0000 171.0244 9 V 4.8008 7.9727 119.1479 60.9401 33.7889 175.5230 10 V 4.2425 8.7195 128.3098 63.1162 31.1931 175.8788 11 V 4.3840 8.4027 119.7631 61.0091 32.5474 176.0460 12 S 4.6521 7.6157 115.4050 57.3371 65.5043 173.8004 13 D 4.9428 8.7905 123.4668 53.6504 42.2992 176.7007 14 K 4.2431 7.7921 116.2931 58.8262 32.0607 176.5186 15 M 4.6294 7.2885 117.1440 53.3458 34.0624 175.2728 16 Q 4.4637 8.3335 118.7172 55.7358 29.7541 176.5492 17 K 5.2878 9.1830 120.4339 56.4768 30.0307 174.3566 18 T 5.2998 7.4647 112.4360 62.2725 72.7601 173.9506 19 V 4.7248 8.9859 117.0594 60.0934 36.7326 174.5601 20 T 4.9185 8.4277 119.9921 62.2914 70.1363 173.8167 21 V 4.4805 8.9893 127.4986 61.2651 34.1294 174.5837 22 L 4.7342 8.8589 130.4252 53.3283 42.5573 174.2078 23 V 4.2170 8.5955 125.7055 62.2729 32.6810 174.1765 24 E 4.9716 8.6960 128.3287 54.8477 32.0951 175.0649 25 R 4.6091 8.7530 124.7112 55.5101 33.6394 174.4908 26 Q 4.9406 8.8049 125.5804 54.1110 31.1609 174.8085 27 F 5.0468 7.4071 117.4265 56.0578 41.3062 171.3969 28 P 4.8750 0.0000 0.0000 62.7025 32.1059 175.6849 29 H 4.4235 9.8274 126.2443 55.4219 30.4518 173.8662 30 P 4.2593 0.0000 0.0000 65.3070 30.9964 176.5318 31 L 4.2938 7.9742 118.0204 55.9066 43.6845 176.1476 32 Y 4.4143 7.7507 113.6539 57.0701 38.1185 176.2571 33 G 4.0697 7.9866 106.4200 46.0071 0.0000 174.1034 34 K 4.3048 7.8552 119.1328 56.3128 34.1795 176.7454 35 V 4.2744 8.3131 122.6743 63.0520 31.7655 175.0710 36 I 4.5749 8.5346 120.5420 58.8194 41.4430 174.2941 37 K 4.5767 8.4668 124.2403 54.9765 33.9532 175.2858 38 R 4.7212 8.2893 128.8649 55.4432 32.6662 174.5258 39 S 5.1415 8.2595 114.2569 57.5429 65.8607 173.3754 40 K 4.5970 9.0789 120.8481 55.0586 36.0963 174.5877 41 K 4.9460 8.3717 124.1531 55.0255 33.8634 175.2095 42 Y 4.5814 9.0637 123.2980 56.2290 40.9543 175.2284 43 L 5.0704 8.6330 122.4992 53.4804 42.6625 175.6326 44 A 4.8961 9.0845 127.2622 50.8615 21.0576 175.4734 45 H 4.8106 9.3239 122.7915 56.1203 31.3250 173.7015 46 D 4.8586 9.2996 125.9263 51.6414 42.1958 174.1744 47 P 4.2084 0.0000 0.0000 65.4487 31.6271 178.4065 48 E 4.2627 8.1601 113.1842 56.4011 29.2395 176.3920 49 E 3.9755 8.0062 116.6661 57.0864 28.0413 177.2510 50 K 3.7475 8.4703 119.9719 59.5805 32.4423 176.7868 51 Y 4.2725 7.9560 116.2546 57.5840 38.5320 175.2219 52 K 4.6557 8.8275 124.4667 53.9734 34.1006 175.1695 53 L 4.0357 8.6084 124.2591 57.8035 41.0883 175.4388 54 G 3.5088 8.1482 120.3915 45.8273 0.0000 172.6721 55 D 4.7477 7.9453 121.0229 54.2571 42.7046 175.8100 56 V 4.5664 8.3976 120.3117 61.6706 33.5422 175.0322 57 V 4.8125 8.4514 120.8442 59.6045 35.7660 174.2993 58 E 5.0397 8.8143 121.2843 55.0468 31.4384 175.9417 59 I 4.8192 9.0667 126.0324 59.9769 40.2688 174.5452 60 I 5.0914 8.4712 123.7335 59.0163 41.6144 173.9415 61 E 3.2416 9.2661 130.8812 57.0324 29.9084 175.9931 62 S 4.6703 7.9927 121.7424 56.6958 67.6301 173.2198 63 R 4.1023 8.5359 120.5623 55.2518 30.4991 173.8780 64 P 4.3172 0.0000 0.0000 62.8571 31.9146 175.8696 65 I 4.5375 8.2111 120.1264 59.9868 39.2825 175.4884 66 S 4.6374 7.5802 114.1116 57.2640 64.2749 176.6670 67 K 3.6839 8.6643 122.6580 58.0613 32.1667 175.3724 68 R 3.6915 8.4865 127.6791 54.2113 27.3651 174.3455 69 K 5.6003 6.8663 131.4607 56.5890 33.7128 174.0626 70 R 4.7455 7.6711 128.7567 54.9931 32.0313 174.2865 71 F 5.2042 8.3497 115.7164 56.1882 43.8555 174.1610 72 R 4.8831 8.8390 121.1616 54.3144 33.6304 175.9306 73 V 3.5592 7.9861 121.9018 62.1602 30.2518 175.6353 74 L 4.1827 8.6154 129.4158 57.2515 41.6275 176.7381 75 R 4.8462 7.4653 112.4836 54.8417 33.2428 172.7704 76 L 4.4625 8.6251 121.9012 55.0457 42.7533 175.3862 77 V 4.3018 9.1213 125.0809 63.7220 32.4720 175.1210 78 E 4.7380 7.6512 115.9637 54.4439 32.8850 174.4412 79 S 4.9558 8.6359 118.2638 57.7510 63.7004 174.9979 80 G 3.5956 8.5768 107.0572 45.6507 0.0000 174.5180 81 R 5.5353 6.9517 133.0235 56.1545 30.4041 174.8712 82 M 4.1757 7.4960 124.9753 58.2932 32.4902 177.1428 83 D 4.3521 8.2652 119.6457 56.7891 39.1393 179.0060 84 L 4.0752 7.7610 119.8371 57.5324 41.8052 179.3852 85 V 3.7373 7.8625 117.5554 65.9236 31.2136 177.7198 86 E 3.9933 8.9303 118.8405 59.3546 29.3774 178.9207 87 K 4.0096 7.5400 117.4519 60.0752 32.3248 178.1206 88 Y 4.1795 7.9445 118.8617 60.9860 38.5890 178.0845 89 L 3.5618 8.6884 119.8491 58.0003 41.7877 179.6374 90 I 3.5684 8.3272 120.2614 64.5937 36.8494 178.4612 91 R 3.7628 7.6605 118.0119 59.2139 30.1794 178.2917 92 R 3.0485 7.2665 118.1303 59.0358 29.8454 178.2189 93 Q 3.9559 7.7054 118.1553 58.9970 29.0781 177.8314 94 N 4.5283 7.7480 117.4993 56.1551 38.4322 176.5514 95 Y 4.3543 7.6116 117.0095 61.5629 38.1708 178.6052 96 Q 4.1351 8.2817 117.9683 59.0362 28.8417 177.0115 97 S 4.7005 9.3389 118.1288 58.1702 63.9764 172.4063 98 L 4.3721 7.6073 130.3264 54.7884 38.6294 176.3467 99 S 4.6527 7.3732 119.6993 58.6049 69.9563 175.1092 100 K 4.5858 8.0747 120.4383 54.9698 33.8697 176.7453 101 R 4.3063 7.8642 115.0084 53.0969 32.8305 176.5567 102 G 3.9206 7.9617 104.9102 44.2169 0.0000 172.3875 103 G 3.8237 8.6670 104.7651 46.6239 0.0000 173.6750 104 K 3.4108 8.6276 119.3136 56.4585 32.2068 174.5230 105 A 4.0931 8.2187 123.1097 53.3271 18.9970 176.5411 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 2 P 0.00 4.33 0.00 2.06 2.07 0.00 3.66 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.11 0.00 3 K 8.78 3.83 0.00 1.70 1.87 0.00 1.74 0.00 0.00 1.86 0.00 0.00 2.79 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.40 1.47 7.81 4 K 9.45 3.89 0.00 1.93 1.85 0.00 1.49 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.53 1.51 7.81 5 V 8.45 4.93 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 0.91 0.00 0.00 1.00 0.00 0.00 6 L 8.81 4.91 0.00 1.18 1.23 0.09 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.22 5.08 4.20 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 1.22 0.00 0.00 8 G 8.76 4.07 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 0.00 9 V 7.97 4.80 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 0.91 0.00 0.00 0.91 0.00 0.00 10 V 8.72 4.24 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 0.90 0.00 0.00 0.94 0.00 0.00 11 V 8.40 4.38 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 0.52 0.00 0.00 0.39 0.00 0.00 12 S 7.62 4.65 0.00 3.90 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 13 D 8.79 4.94 0.00 2.73 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 14 K 7.79 4.24 0.00 1.95 1.87 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.50 1.44 7.81 15 M 7.29 4.63 0.00 2.06 2.00 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 2.57 2.50 0.00 16 Q 8.33 4.46 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.31 0.00 0.00 0.00 0.00 0.00 2.44 2.35 0.00 17 K 9.18 5.29 0.00 2.04 2.01 0.00 1.98 0.00 0.00 1.94 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.59 1.44 7.81 18 T 7.46 5.30 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 1.31 0.00 0.00 19 V 8.99 4.72 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 0.78 0.00 0.00 0.94 0.00 0.00 20 T 8.43 4.92 4.20 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 1.13 0.00 0.00 21 V 8.99 4.48 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 0.90 0.00 0.00 0.84 0.00 0.00 22 L 8.86 4.73 0.00 1.44 1.47 0.90 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 23 V 8.60 4.22 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 0.85 0.00 0.00 0.81 0.00 0.00 24 E 8.70 4.97 0.00 2.00 1.80 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 2.21 2.29 0.00 25 R 8.75 4.61 0.00 1.97 1.82 0.00 3.18 0.00 0.00 3.24 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.74 0.00 26 Q 8.80 4.94 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.85 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 27 F 7.41 5.05 0.00 3.17 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 28 P 0.00 4.87 0.00 2.19 2.19 0.00 4.05 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.05 0.00 29 H 9.83 4.42 0.00 3.17 3.36 0.00 5.61 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.26 0.00 2.15 2.16 0.00 3.58 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.90 0.00 31 L 7.97 4.29 0.00 1.36 1.25 0.75 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 7.75 4.41 0.00 2.97 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 33 G 7.99 4.07 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 0.00 34 K 7.86 4.30 0.00 1.91 1.97 0.00 1.17 0.00 0.00 1.54 0.00 0.00 2.95 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.42 1.44 7.81 35 V 8.31 4.27 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 0.75 0.00 0.00 0.94 0.00 0.00 36 I 8.53 4.57 1.69 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 -0.07 0.93 0.00 0.00 37 K 8.47 4.58 0.00 1.68 1.69 0.00 1.75 0.00 0.00 2.02 0.00 0.00 2.75 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.29 1.37 7.81 38 R 8.29 4.72 0.00 2.08 1.95 0.00 3.39 0.00 0.00 3.31 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 39 S 8.26 5.14 0.00 3.99 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 40 K 9.08 4.60 0.00 1.76 1.62 0.00 1.45 0.00 0.00 1.43 0.00 0.00 2.13 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.54 1.13 7.81 41 K 8.37 4.95 0.00 1.56 1.61 0.00 1.68 0.00 0.00 1.28 0.00 0.00 2.84 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.10 1.25 7.81 42 Y 9.06 4.58 0.00 2.71 2.69 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 43 L 8.63 5.07 0.00 1.59 1.69 0.95 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 44 A 9.08 4.90 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 45 H 9.32 4.81 0.00 3.26 3.24 0.00 5.72 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 9.30 4.86 0.00 2.80 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 47 P 0.00 4.21 0.00 2.20 2.09 0.00 3.60 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.69 0.00 48 E 8.16 4.26 0.00 1.93 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 2.30 2.33 0.00 49 E 8.01 3.98 0.00 2.18 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 2.26 2.38 0.00 50 K 8.47 3.75 0.00 1.53 1.42 0.00 1.73 0.00 0.00 1.37 0.00 0.00 2.79 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.55 1.14 7.81 51 Y 7.96 4.27 0.00 3.07 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 52 K 8.83 4.66 0.00 1.83 1.71 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.47 7.81 53 L 8.61 4.04 0.00 1.61 1.67 1.02 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.15 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 D 7.95 4.75 0.00 2.77 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 56 V 8.40 4.57 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 0.86 0.00 0.00 0.96 0.00 0.00 57 V 8.45 4.81 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 0.56 0.00 0.00 0.74 0.00 0.00 58 E 8.81 5.04 0.00 1.85 1.80 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 2.20 2.24 0.00 59 I 9.07 4.82 1.54 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 0.90 0.78 0.59 0.00 0.00 60 I 8.47 5.09 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.73 0.95 0.00 0.00 61 E 9.27 3.24 0.00 1.99 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 2.09 1.89 0.00 62 S 7.99 4.67 0.00 3.63 3.67 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 0.00 0.00 0.00 63 R 8.54 4.10 0.00 1.73 1.79 0.00 3.26 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 64 P 0.00 4.32 0.00 2.06 1.97 0.00 3.64 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.12 0.00 65 I 8.21 4.54 1.83 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 1.32 0.70 0.72 0.00 0.00 66 S 7.58 4.64 0.00 3.96 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 67 K 8.66 3.68 0.00 1.74 1.80 0.00 1.89 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.45 7.81 68 R 8.49 3.69 0.00 2.00 1.98 0.00 3.44 0.00 0.00 3.16 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 69 K 6.87 5.60 0.00 1.95 1.89 0.00 1.75 0.00 0.00 1.83 0.00 0.00 3.00 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.30 1.48 7.81 70 R 7.67 4.75 0.00 1.76 1.61 0.00 3.25 0.00 0.00 3.38 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.67 0.00 71 F 8.35 5.20 0.00 2.94 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 72 R 8.84 4.88 0.00 1.77 1.82 0.00 3.15 0.00 0.00 3.13 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.56 0.00 73 V 7.99 3.56 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 -0.72 0.00 0.00 0.83 0.00 0.00 74 L 8.62 4.18 0.00 1.70 1.70 0.97 0.68 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 75 R 7.47 4.85 0.00 1.93 2.00 0.00 3.03 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.65 0.00 76 L 8.63 4.46 0.00 2.02 1.71 0.96 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 77 V 9.12 4.30 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 0.84 0.00 0.00 0.96 0.00 0.00 78 E 7.65 4.74 0.00 2.02 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 2.25 2.29 0.00 79 S 8.64 4.96 0.00 3.92 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 80 G 8.58 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 6.95 5.54 0.00 2.37 2.18 0.00 2.97 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.33 0.00 82 M 7.50 4.18 0.00 2.06 2.17 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 2.70 2.55 0.00 83 D 8.27 4.35 0.00 2.87 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 84 L 7.76 4.08 0.00 1.67 1.75 0.92 0.89 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 85 V 7.86 3.74 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 1.17 0.00 0.00 0.96 0.00 0.00 86 E 8.93 3.99 0.00 2.20 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 2.55 2.50 0.00 87 K 7.54 4.01 0.00 2.14 1.91 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.64 7.81 88 Y 7.94 4.18 0.00 3.04 3.17 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 89 L 8.69 3.56 0.00 1.81 1.62 0.93 0.81 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 90 I 8.33 3.57 2.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.48 0.86 0.00 0.00 91 R 7.66 3.76 0.00 1.83 1.82 0.00 3.21 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 92 R 7.27 3.05 0.00 1.26 1.64 0.00 2.98 0.00 0.00 2.99 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.33 0.00 93 Q 7.71 3.96 0.00 2.12 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 94 N 7.75 4.53 0.00 2.98 2.92 0.00 0.00 6.81 8.83 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 95 Y 7.61 4.35 0.00 3.06 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 96 Q 8.28 4.14 0.00 2.06 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.02 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 97 S 9.34 4.70 0.00 4.20 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 98 L 7.61 4.37 0.00 1.73 1.79 0.91 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 99 S 7.37 4.65 0.00 3.94 3.75 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 0.00 100 K 8.07 4.59 0.00 1.71 1.81 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.77 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.32 1.41 7.81 101 R 7.86 4.31 0.00 1.73 1.71 0.00 3.36 0.00 0.00 3.23 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.54 0.00 102 G 7.96 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 0.00 103 G 8.67 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 0.00 0.00 0.00 104 K 8.63 3.41 0.00 1.83 1.96 0.00 1.92 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.36 7.81 105 A 8.22 4.09 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