NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 S 4.3447 8.3301 115.2815 58.4731 64.6029 174.8235 8 A 3.9158 8.9360 125.9743 53.1443 18.6878 176.6501 9 T 4.5109 7.4895 105.3144 61.5674 71.1540 172.6089 10 I 4.5360 8.7108 116.1105 59.0662 40.7282 174.0845 11 K 4.9450 8.5085 125.0595 55.2499 33.2126 175.7842 12 V 4.7633 8.5864 120.4065 59.9223 35.1885 174.6087 13 T 4.9081 8.2511 110.8515 59.2632 72.2278 174.6880 14 D 4.4127 9.3505 121.8535 57.0519 40.4063 179.1620 15 A 4.0624 8.0056 119.7226 54.5965 18.7747 178.7441 16 S 4.4894 8.0155 110.3496 58.9157 63.6254 175.9950 17 F 3.8568 8.0681 125.5872 61.4162 39.2263 176.6913 18 A 4.0193 8.0614 119.8300 55.4928 18.0911 179.6530 19 T 3.8011 7.7141 112.3778 67.0118 68.7572 176.4123 20 D 4.3908 8.0775 119.5855 56.1791 41.1370 177.3636 21 V 3.8652 7.3769 116.0095 64.3547 32.7956 177.6992 22 L 3.9627 7.5084 116.7483 57.4841 41.6070 178.2119 23 S 4.5028 7.6210 109.6458 58.0247 63.6242 174.3712 24 S 4.1355 7.2367 116.2858 58.5129 62.6250 173.6482 25 N 4.4119 8.7924 125.8564 55.7638 39.1162 174.8919 26 K 4.4861 7.2875 117.0698 53.8692 33.8373 174.1057 27 P 4.6078 0.0000 0.0000 62.9652 32.7464 175.1537 28 V 4.7889 8.7122 122.9601 61.0200 34.5004 173.7777 29 L 5.0040 8.8607 130.5132 53.7014 43.8094 174.8757 30 V 4.6096 8.9014 127.3126 61.2858 33.9854 173.8991 31 D 5.2620 9.0712 128.5530 52.7524 42.6604 174.9400 32 F 5.2647 9.4118 127.1159 56.6339 40.2100 175.2616 33 W 5.5771 9.0675 120.1039 55.0238 32.5421 173.3986 34 A 4.1989 8.2635 120.9490 49.8405 20.6204 177.6192 35 T 3.4476 7.3892 119.1069 66.1157 68.5983 175.4924 36 W 4.5136 6.8891 114.9280 56.6133 28.5837 175.0630 37 C 4.7170 7.3528 121.3929 57.5608 32.4122 174.5187 38 G 3.6237 8.8241 117.0204 48.2261 0.0000 173.5457 39 P 4.3482 0.0000 0.0000 64.9538 31.0628 178.6312 40 S 4.2916 7.5435 112.0195 60.4367 63.2500 175.6180 41 K 4.1701 7.8847 120.6499 57.1395 32.0194 178.2824 42 M 4.0599 7.5487 118.8295 58.2816 32.1838 178.3305 43 V 3.6897 7.7448 117.0518 64.9246 31.7393 177.5153 44 A 3.8493 7.6433 120.8873 55.0010 18.1110 177.8047 45 P 4.1544 0.0000 0.0000 65.6188 31.4600 179.0174 46 V 3.5820 7.6665 116.6886 65.9202 31.4659 177.9516 47 L 3.9807 7.9419 118.9073 57.5748 40.9020 179.0647 48 E 3.8829 8.1132 119.4141 59.2085 29.4796 178.7946 49 E 3.9642 8.3005 118.6848 59.4687 29.5429 179.3959 50 I 3.6764 7.7789 119.6706 64.2468 36.9168 178.3414 51 A 3.9803 7.8978 120.6819 55.4087 18.2602 179.6132 52 T 3.9571 7.3258 112.4593 66.9471 68.6603 176.6791 53 E 4.1829 8.3696 119.5254 58.1195 30.1375 177.7001 54 R 4.6639 8.0299 117.8384 55.2584 29.9072 177.6170 55 A 4.1687 8.1373 123.0635 55.5264 18.8028 180.7115 56 T 4.0912 7.8136 104.5237 64.1402 69.2658 175.2084 57 D 4.5821 8.2315 122.3023 56.2114 41.4652 176.1560 58 L 4.7534 7.1558 114.0088 55.1231 43.7355 174.9574 59 T 4.6208 8.5191 116.6820 61.8835 71.4042 173.6897 60 V 4.7783 8.2761 124.3908 61.0874 34.1914 174.0262 61 A 5.2847 9.0443 129.1405 50.0079 22.8018 174.5548 62 K 5.0175 9.1597 119.7825 54.4210 35.7174 175.0495 63 L 4.9552 8.8168 126.3456 53.2061 45.3239 174.7702 64 D 4.3775 8.6259 126.2949 52.9789 41.5262 177.2794 65 V 3.7616 8.1345 121.3626 64.3275 31.9522 177.4360 66 D 4.6304 8.3186 118.8668 57.1269 41.1321 176.8445 67 T 4.3894 7.7130 105.6986 62.0227 70.3076 174.2480 68 N 5.3580 8.1414 118.6996 49.4155 39.2397 173.1925 69 P 4.3059 0.0000 0.0000 65.8085 31.8508 178.6545 70 E 3.9197 8.0974 117.9090 59.6059 29.0090 179.2487 71 T 3.7536 7.8753 115.6629 66.3918 68.3557 176.7309 72 A 4.0411 7.7025 122.2114 55.2466 18.4415 179.7226 73 R 3.7911 7.9387 117.1415 59.5184 29.8829 178.4509 74 N 4.1803 8.1708 115.8644 55.6814 38.5294 176.4097 75 F 4.6917 7.4497 115.9893 56.1629 39.4744 175.6249 76 Q 3.4863 7.6532 115.8866 56.6357 26.6870 174.2712 77 V 3.5976 7.8311 117.6586 62.9874 31.8882 175.5021 78 V 4.3418 8.3730 125.2890 62.6353 33.6388 175.3103 79 S 4.8677 7.9168 113.9299 56.3630 66.3279 172.9968 80 I 4.7216 8.1215 116.1318 58.2674 39.8765 173.5283 81 P 4.9178 0.0000 0.0000 63.0639 32.7061 175.3358 82 T 4.7406 8.7735 117.3676 61.8500 72.0399 172.8340 83 L 5.2623 8.7541 126.0921 53.2182 44.1141 175.3734 84 I 4.8815 8.8213 125.0012 59.3291 40.2953 174.4033 85 L 4.7751 8.7278 129.9338 54.2824 43.4946 175.0267 86 F 5.1973 9.7577 126.6512 55.7168 41.3385 174.7771 87 K 4.6524 8.7636 124.7022 54.9079 35.1290 175.7815 88 D 4.4834 9.9587 127.7665 55.4892 38.2166 175.0095 89 G 4.0883 8.7746 106.4419 45.3875 0.0000 173.9965 90 Q 4.7654 7.7838 119.0898 53.3070 31.0322 173.5821 91 P 3.9952 0.0000 0.0000 62.0262 30.2190 175.9916 92 V 3.9998 7.9607 118.4904 62.6828 32.5604 176.4312 93 K 4.5832 7.6432 121.4319 54.9442 35.7523 174.4801 94 R 5.0754 8.6241 125.4642 54.4252 33.0212 174.9153 95 I 4.5700 8.8249 124.5920 59.5638 40.0065 175.1129 96 V 4.6167 8.4939 119.6309 60.3699 35.0364 172.4398 97 G 3.8731 8.9385 117.6469 44.9705 0.0000 173.5975 98 A 4.1219 8.5193 127.6629 52.2678 19.0476 176.4003 99 K 4.6482 8.2910 119.7466 53.9912 35.8436 176.8211 100 G 3.9537 8.1739 107.4617 43.5047 0.0000 174.7908 101 K 3.9087 8.4553 119.9212 59.4125 32.1109 178.4590 102 A 3.9617 7.9534 120.2644 55.1620 18.4127 179.3147 103 A 3.9480 7.9192 118.8514 55.1024 18.5278 179.4853 104 L 3.8994 7.6940 119.0371 58.3438 42.3219 179.2491 105 L 4.0093 8.0642 119.0049 57.6569 41.2757 179.4913 106 R 3.9851 7.8083 119.2984 58.9097 29.8515 178.0963 107 E 4.1098 8.2110 118.4252 59.5049 29.5034 179.3955 108 L 3.8107 8.0120 118.9688 57.3099 41.1790 179.4732 109 S 4.8302 7.7749 115.1824 60.7023 62.5005 176.3327 110 D 4.3549 7.5327 122.0667 56.4913 40.6571 177.1317 111 V 4.1792 7.6876 115.9357 62.2934 33.1834 175.1541 112 V 4.3785 8.2145 120.4409 60.2761 33.5245 172.4508 113 P 4.4084 0.0000 0.0000 63.6335 32.1384 175.8987 114 N 4.6237 8.8900 119.1477 53.3831 37.8377 174.1398 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 7 S 8.33 4.34 0.00 3.83 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 8 A 8.94 3.92 1.28 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 9 T 7.49 4.51 4.26 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 1.14 0.00 0.00 10 I 8.71 4.54 1.83 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.06 0.87 0.00 0.00 11 K 8.51 4.95 0.00 1.81 1.76 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.53 7.81 12 V 8.59 4.76 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 0.64 0.00 0.00 0.96 0.00 0.00 13 T 8.25 4.91 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 1.25 0.00 0.00 14 D 9.35 4.41 0.00 2.74 2.77 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 15 A 8.01 4.06 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 16 S 8.02 4.49 0.00 4.11 4.14 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 17 F 8.07 3.86 0.00 3.20 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 18 A 8.06 4.02 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 19 T 7.71 3.80 4.22 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 1.19 0.00 0.00 20 D 8.08 4.39 0.00 2.60 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 21 V 7.38 3.87 0.95 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 0.11 0.00 0.00 -0.14 0.00 0.00 22 L 7.51 3.96 0.00 1.80 1.76 1.14 0.82 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 23 S 7.62 4.50 0.00 4.00 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 24 S 7.24 4.14 0.00 3.91 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 25 N 8.79 4.41 0.00 2.71 2.82 0.00 0.00 6.96 6.68 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 26 K 7.29 4.49 0.00 1.77 1.65 0.00 1.84 0.00 0.00 1.59 0.00 0.00 3.12 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.38 7.81 27 P 0.00 4.61 0.00 2.11 1.96 0.00 3.71 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 2.11 2.09 0.00 28 V 8.71 4.79 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 0.87 0.00 0.00 0.90 0.00 0.00 29 L 8.86 5.00 0.00 1.80 1.52 0.95 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 30 V 8.90 4.61 2.28 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 0.42 0.00 0.00 0.84 0.00 0.00 31 D 9.07 5.26 0.00 2.77 2.49 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 32 F 9.41 5.26 0.00 3.15 3.04 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 33 W 9.07 5.58 0.00 3.40 3.27 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 34 A 8.26 4.20 -0.42 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 35 T 7.39 3.45 4.00 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 36 W 6.89 4.51 0.00 3.57 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 37 C 7.35 4.72 0.00 2.32 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 38 G 8.82 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 39 P 0.00 4.35 0.00 2.20 2.14 0.00 3.65 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 2.15 2.17 0.00 40 S 7.54 4.29 0.00 3.95 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 41 K 7.88 4.17 0.00 1.95 1.75 0.00 1.70 0.00 0.00 2.03 0.00 0.00 2.97 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.53 1.80 7.81 42 M 7.55 4.06 0.00 2.00 2.12 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.83 0.00 43 V 7.74 3.69 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 1.03 0.00 0.00 0.92 0.00 0.00 44 A 7.64 3.85 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 45 P 0.00 4.15 0.00 2.13 2.06 0.00 3.76 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 2.07 2.08 0.00 46 V 7.67 3.58 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 1.05 0.00 0.00 0.91 0.00 0.00 47 L 7.94 3.98 0.00 1.80 1.63 0.83 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.11 3.88 0.00 2.19 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 2.35 0.00 49 E 8.30 3.96 0.00 2.03 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 0.00 2.30 2.55 0.00 50 I 7.78 3.68 1.92 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 1.44 0.56 0.89 0.00 0.00 51 A 7.90 3.98 1.30 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 0.00 0.00 52 T 7.33 3.96 4.41 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 1.19 0.00 0.00 53 E 8.37 4.18 0.00 1.99 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 2.33 2.33 0.00 54 R 8.03 4.66 0.00 1.79 2.07 0.00 3.28 0.00 0.00 3.16 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 55 A 8.14 4.17 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 56 T 7.81 4.09 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 57 D 8.23 4.58 0.00 2.76 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 58 L 7.16 4.75 0.00 1.72 1.58 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 59 T 8.52 4.62 4.19 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 1.16 0.00 0.00 60 V 8.28 4.78 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 0.93 0.00 0.00 0.90 0.00 0.00 61 A 9.04 5.28 1.08 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 0.00 0.00 62 K 9.16 5.02 0.00 1.70 1.78 0.00 1.46 0.00 0.00 1.34 0.00 0.00 2.36 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.17 1.25 7.81 63 L 8.82 4.96 0.00 1.56 1.15 1.03 1.03 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 64 D 8.63 4.38 0.00 2.36 2.36 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 65 V 8.13 3.76 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 0.86 0.00 0.00 0.98 0.00 0.00 66 D 8.32 4.63 0.00 3.07 3.04 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 67 T 7.71 4.39 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 68 N 8.14 5.36 0.00 2.86 3.03 0.00 0.00 7.00 7.37 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 69 P 0.00 4.31 0.00 2.26 2.33 0.00 3.78 0.00 0.00 3.91 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 70 E 8.10 3.92 0.00 1.97 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 2.38 2.32 0.00 71 T 7.88 3.75 4.19 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 0.68 0.00 0.00 72 A 7.70 4.04 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 73 R 7.94 3.79 0.00 1.91 2.03 0.00 3.08 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 74 N 8.17 4.18 0.00 2.62 2.25 0.00 0.00 7.00 8.30 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 75 F 7.45 4.69 0.00 2.97 3.06 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 76 Q 7.65 3.49 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.82 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 77 V 7.83 3.60 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 0.64 0.00 0.00 0.12 0.00 0.00 78 V 8.37 4.34 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 0.93 0.00 0.00 79 S 7.92 4.87 0.00 3.86 3.72 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 80 I 8.12 4.72 1.90 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.68 0.96 0.00 0.00 81 P 0.00 4.92 0.00 2.18 2.18 0.00 3.74 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 2.02 2.03 0.00 82 T 8.77 4.74 4.27 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 1.22 0.00 0.00 83 L 8.75 5.26 0.00 1.65 1.63 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 84 I 8.82 4.88 2.18 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.02 0.46 0.00 0.00 85 L 8.73 4.78 0.00 1.76 1.49 0.97 0.78 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 86 F 9.76 5.20 0.00 2.98 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 K 8.76 4.65 0.00 1.74 1.63 0.00 1.81 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.33 1.54 7.81 88 D 9.96 4.48 0.00 2.90 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 89 G 8.77 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 0.00 0.00 0.00 0.00 90 Q 7.78 4.77 0.00 2.23 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.91 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 91 P 0.00 4.00 0.00 1.92 1.43 0.00 3.84 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.14 0.00 92 V 7.96 4.00 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 0.61 0.00 0.00 0.94 0.00 0.00 93 K 7.64 4.58 0.00 1.75 1.54 0.00 1.63 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.45 7.81 94 R 8.62 5.08 0.00 1.67 1.78 0.00 3.18 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.58 0.00 95 I 8.82 4.57 1.89 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 1.37 0.73 0.97 0.00 0.00 96 V 8.49 4.62 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 0.72 0.00 0.00 0.94 0.00 0.00 97 G 8.94 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 98 A 8.52 4.12 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 99 K 8.29 4.65 0.00 1.69 1.68 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.26 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.45 7.81 100 G 8.17 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 0.00 101 K 8.46 3.91 0.00 1.82 1.81 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.92 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.49 1.50 7.81 102 A 7.95 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 0.00 103 A 7.92 3.95 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 0.00 104 L 7.69 3.90 0.00 1.80 1.94 0.92 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 105 L 8.06 4.01 0.00 1.88 1.69 0.91 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 106 R 7.81 3.99 0.00 2.00 2.12 0.00 3.11 0.00 0.00 3.07 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.52 0.00 107 E 8.21 4.11 0.00 2.19 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 2.33 2.57 0.00 108 L 8.01 3.81 0.00 1.71 1.71 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 109 S 7.77 4.83 0.00 4.07 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 0.00 110 D 7.53 4.35 0.00 2.50 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 0.00 111 V 7.69 4.18 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 0.78 0.00 0.00 0.92 0.00 0.00 112 V 8.21 4.38 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 0.96 0.00 0.00 0.99 0.00 0.00 113 P 0.00 4.41 0.00 2.19 2.04 0.00 3.52 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 1.98 2.09 0.00 114 N 8.89 4.62 0.00 2.87 3.19 0.00 0.00 6.96 7.56 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