NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 3.9367 8.0549 120.5913 62.6518 32.7301 174.4067 3 Q 4.4799 8.5392 126.2265 53.5598 32.3582 172.8541 4 L 5.2420 8.7364 122.9731 52.9544 45.7092 175.4196 5 Q 4.5276 8.8505 123.9583 54.5220 32.2034 173.8836 6 E 5.3363 8.9832 125.8505 56.0533 31.5709 175.1176 7 S 4.5137 9.4579 116.2314 58.2056 66.8458 175.1626 8 G 3.9879 8.6532 107.1402 46.2741 0.0000 173.7750 9 G 4.0184 7.0831 107.8057 43.6302 0.0000 172.8795 10 G 3.7838 6.9060 103.7026 45.5575 0.0000 169.9577 11 L 5.2507 8.0421 122.2999 53.3117 43.7852 177.4172 12 V 4.5866 8.7722 125.1093 59.9011 35.3913 174.3853 13 Q 4.6661 8.9107 123.3570 54.9072 30.3791 175.1288 14 A 4.3707 8.2938 128.4774 54.1702 18.9138 177.2677 15 G 4.0104 9.0771 110.2978 45.2941 0.0000 174.1623 16 G 4.0001 7.8765 106.8125 45.8061 0.0000 172.5519 17 S 5.8856 8.3029 113.9309 55.8673 67.3939 173.2997 18 L 4.6443 7.9622 119.2753 53.2291 46.3519 175.5046 19 R 4.8218 8.1637 119.5536 54.5878 32.7624 174.4299 20 L 4.4410 8.3064 126.9789 54.5573 43.3051 176.3513 21 S 5.1721 9.2912 117.3349 57.0107 67.3037 172.5317 22 C 5.3489 9.4220 123.4588 54.8187 43.6080 172.3136 23 A 5.0771 8.9874 129.2275 51.0547 19.8627 175.6372 24 A 5.2545 8.9281 124.5195 49.9175 21.9790 175.7189 25 S 4.3681 8.5833 116.1032 57.2790 65.6103 173.7157 26 G 3.8242 8.7866 111.9180 45.9642 0.0000 172.2009 27 A 2.5800 7.6714 120.0946 53.0054 15.8021 178.1543 28 T 2.9762 7.3254 106.9156 61.9602 69.6839 174.4996 29 G 3.9022 7.6479 112.0261 45.2980 0.0000 174.8474 30 S 4.3715 8.7380 114.4016 61.2509 62.9329 175.9893 31 T 4.3231 7.8290 108.1681 62.1814 69.3956 173.9368 32 Y 4.7601 8.0973 121.0408 57.6308 39.6030 174.2008 33 D 5.5600 9.6745 121.3282 52.9650 44.8362 175.0789 34 M 5.2456 9.0991 120.2408 53.6388 35.7662 174.9446 35 G 4.6182 9.4214 110.0555 44.2673 0.0000 171.4980 36 W 5.3651 8.9708 122.4194 54.9511 31.5992 175.3954 37 F 5.6048 9.9298 122.2416 55.9454 43.4407 173.9078 38 R 4.8911 9.0687 115.8460 54.8977 33.1993 173.9840 39 Q 4.6854 8.9291 122.3464 54.6441 32.4967 173.5504 40 A 4.8200 8.5809 128.1520 49.9644 21.0221 174.6485 41 P 4.3000 0.0000 0.0000 64.5029 31.6928 177.2572 42 G 3.9553 9.1324 111.2045 45.1170 0.0000 172.7606 43 K 4.6702 7.4632 117.7846 54.0046 35.1656 175.7657 44 E 4.1570 8.3833 119.8862 55.9202 30.1196 177.1144 45 R 4.3689 8.3808 123.1079 56.5700 30.9018 175.3471 46 E 5.0129 9.2639 123.5101 54.3275 33.0505 175.5643 47 S 4.4114 8.9612 117.0262 59.2986 63.5494 173.0127 48 V 4.4476 8.5408 120.0916 63.9972 33.6541 175.0084 49 A 5.0992 7.7760 119.0044 51.3240 22.8617 173.8960 50 A 5.1005 8.7279 119.6658 51.2406 23.3917 175.2596 51 I 5.3949 8.7638 118.5711 59.6732 42.2340 173.1436 52 N 5.2435 8.5721 126.9186 51.7132 39.8186 175.7334 52A W 4.2650 8.9676 127.0475 60.0343 29.5909 178.1281 53 G 3.8009 8.2322 106.5595 48.5506 0.0000 174.8695 54 S 4.2730 8.0971 112.8538 57.5004 63.8687 174.4562 55 A 3.7786 8.1573 122.1781 52.6479 16.7417 177.2919 56 G 3.7255 8.1138 106.9687 47.8288 0.0000 173.7278 57 T 4.9593 8.0964 114.3074 60.0819 71.6515 173.2856 58 Y 4.7693 8.3134 119.2218 56.6068 42.2539 174.0719 59 Y 5.2763 8.5981 118.7890 56.1190 42.3232 174.8427 60 A 4.4748 8.9345 123.2731 51.2099 19.8490 178.9576 61 S 4.1058 8.8618 114.9275 61.1870 62.7282 176.6292 62 S 4.1786 8.0719 113.5033 60.2217 63.1073 174.9579 63 V 3.8375 7.4525 112.7803 60.4348 32.3579 175.0035 64 R 3.9006 7.4660 121.8058 57.3336 30.0844 177.0253 65 G 3.9310 8.6594 113.5189 45.3569 0.0000 173.6289 66 R 4.5353 7.6502 117.4116 56.6450 32.8427 175.9501 67 F 5.6664 8.1698 115.8773 56.0212 41.7357 175.6909 68 T 4.8718 8.9545 118.2398 61.9282 71.8109 172.7592 69 I 5.0882 9.2236 127.4701 59.8508 39.9824 174.4911 70 S 4.9279 8.8827 121.9393 57.5731 66.9312 172.6694 71 R 5.1282 8.3943 115.2647 54.8216 32.7318 174.0163 72 D 4.9014 9.3889 120.6970 52.7616 43.3986 176.1366 73 N 4.5117 9.2795 124.3301 56.4806 38.9902 177.5494 74 A 4.0235 8.2033 119.5989 54.9487 18.5953 178.4576 75 K 4.1775 8.1929 113.2507 56.6613 32.9143 176.8628 76 K 3.7959 7.7385 118.6246 57.7359 30.2745 174.5436 77 T 5.2167 8.1816 112.6613 61.8619 73.2022 174.4583 78 V 4.6942 8.3973 124.4233 61.2950 34.7000 173.9125 79 Y 5.4004 9.2930 123.8262 56.1805 42.2874 174.5867 80 L 4.5347 8.5949 124.3900 53.0462 44.3819 174.8660 81 Q 4.3825 8.9852 129.2971 56.0190 30.3868 174.4905 82 M 4.0369 8.9421 127.3297 53.6654 33.7575 174.9330 82A N 5.0297 8.7551 121.0747 50.4431 41.1740 175.1052 82B S 3.7127 8.4172 113.6014 59.7038 60.5748 173.3380 82C L 4.4877 7.9476 119.6820 54.8548 42.5837 177.3044 83 K 4.9596 9.0067 120.6475 53.6819 35.8765 175.5163 84 P 4.4093 0.0000 0.0000 65.9982 31.3024 178.4205 85 E 4.2116 8.0867 113.6604 58.3137 29.7774 177.2841 86 D 4.7209 8.2239 119.1785 56.1077 41.0905 176.6229 87 T 4.3937 8.0058 117.3703 63.4814 68.8929 173.7353 88 A 4.3916 8.5596 127.8212 51.6726 23.7677 175.1176 89 V 4.3807 7.9191 119.8852 62.8969 32.9893 174.3619 90 Y 5.2501 9.4955 126.1391 56.8231 40.1240 174.8682 91 T 5.4634 9.4428 120.8003 61.9483 72.6070 170.6932 92 C 5.0365 9.5127 120.1462 53.9620 43.3633 172.8403 93 G 3.9515 8.8680 106.4698 44.4469 0.0000 171.2258 94 A 5.4455 9.0353 122.8116 49.4621 22.6442 176.6765 95 G 4.3790 8.0090 105.5855 46.2580 0.0000 172.5180 96 R 4.9953 8.7385 121.7849 54.4683 33.2356 175.3363 97 I 3.5255 8.4898 124.4657 60.8939 37.8597 174.2350 98H R 3.9610 8.5537 125.5090 55.9240 29.5722 176.2563 98I E 4.5391 8.3869 115.2045 56.0109 30.2063 177.5950 98J S 4.1006 8.3355 115.6882 61.4071 62.3426 175.3919 99 W 4.3057 8.0883 116.3787 58.2334 28.3857 176.0487 100 V 3.1178 6.5787 120.1762 62.8594 31.1238 175.3214 101 T 3.9264 8.2743 123.7113 63.8183 69.9812 175.2552 102 W 5.0021 7.4602 119.7133 54.4651 33.0909 174.6044 103 W 4.9120 8.9151 122.9343 54.9520 31.5162 177.1358 104 G 4.0003 8.9311 111.3865 46.4229 0.0000 172.6246 105 Q 4.5066 9.1941 117.9412 55.5043 30.4587 176.7464 106 G 4.2385 9.1214 104.0445 45.0656 0.0000 172.6059 107 T 4.7344 9.1801 115.4116 59.9464 71.2409 172.6053 108 Q 4.3517 8.8675 130.0802 55.9336 30.7638 174.3000 109 V 4.8133 9.0530 126.5302 61.4523 34.2959 174.1418 110 T 4.8672 8.9050 124.7045 61.8182 71.5283 173.1172 111 V 4.7587 8.6239 127.9043 61.4795 32.6508 175.6205 112 S 4.7172 9.0045 123.5268 57.1746 65.9530 174.8362 113 S 4.3843 8.3788 114.9851 58.7482 62.8593 174.4857 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 V 8.05 3.94 0.72 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 0.37 0.00 0.00 -0.74 0.00 0.00 3 Q 8.54 4.48 0.00 1.90 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.62 0.00 0.00 0.00 0.00 0.00 2.23 2.35 0.00 4 L 8.74 5.24 0.00 1.47 1.48 0.98 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 5 Q 8.85 4.53 0.00 2.15 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.83 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 6 E 8.98 5.34 0.00 2.05 2.20 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 2.54 2.40 0.00 7 S 9.46 4.51 0.00 3.89 4.01 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 0.00 0.00 0.00 0.00 8 G 8.65 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 0.00 0.00 0.00 9 G 7.08 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 0.00 0.00 0.00 0.00 10 G 6.91 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 0.00 0.00 0.00 11 L 8.04 5.25 0.00 1.63 1.55 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 12 V 8.77 4.59 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 0.74 0.00 0.00 0.95 0.00 0.00 13 Q 8.91 4.67 0.00 2.16 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.07 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 14 A 8.29 4.37 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 15 G 9.08 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.88 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 0.00 0.00 0.00 0.00 17 S 8.30 5.89 0.00 3.68 3.71 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 18 L 7.96 4.64 0.00 1.26 1.28 0.75 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.16 4.82 0.00 1.87 1.70 0.00 2.88 0.00 0.00 3.19 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.57 0.00 20 L 8.31 4.44 0.00 0.66 1.02 0.02 0.27 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 21 S 9.29 5.17 0.00 3.82 3.74 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 22 C 9.42 5.35 0.00 2.63 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 23 A 8.99 5.08 1.26 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 0.00 0.00 24 A 8.93 5.25 1.22 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 0.00 0.00 25 S 8.58 4.37 0.00 3.73 3.84 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 26 G 8.79 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 27 A 7.67 2.58 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.33 2.98 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 0.65 0.00 0.00 29 G 7.65 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 0.00 0.00 0.00 30 S 8.74 4.37 0.00 4.08 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 0.00 31 T 7.83 4.32 4.12 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 1.18 0.00 0.00 32 Y 8.10 4.76 0.00 3.46 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 33 D 9.67 5.56 0.00 2.39 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 0.00 0.00 0.00 0.00 34 M 9.10 5.25 0.00 1.70 1.57 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.78 0.00 35 G 9.42 4.62 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 36 W 8.97 5.37 0.00 3.37 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 37 F 9.93 5.60 0.00 3.20 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 R 9.07 4.89 0.00 0.84 1.11 0.00 2.60 0.00 0.00 3.12 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.45 0.00 39 Q 8.93 4.69 0.00 2.05 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.91 0.00 0.00 0.00 0.00 0.00 2.21 2.36 0.00 40 A 8.58 4.82 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 41 P 0.00 4.30 0.00 2.05 2.03 0.00 3.71 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 42 G 9.13 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 0.00 0.00 0.00 43 K 7.46 4.67 0.00 1.87 1.70 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.36 7.81 44 E 8.38 4.16 0.00 1.96 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 2.29 2.28 0.00 45 R 8.38 4.37 0.00 1.71 1.85 0.00 3.15 0.00 0.00 3.11 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.88 0.00 46 E 9.26 5.01 0.00 2.09 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 0.00 2.34 2.30 0.00 47 S 8.96 4.41 0.00 3.89 3.84 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 48 V 8.54 4.45 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 1.12 0.00 0.00 49 A 7.78 5.10 1.24 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 0.00 0.00 0.00 50 A 8.73 5.10 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.76 5.39 1.78 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 2.21 0.68 0.00 0.00 52 N 8.57 5.24 0.00 3.02 2.69 0.00 0.00 7.69 7.95 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 52A W 8.97 4.26 0.00 3.57 3.28 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 53 G 8.23 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 0.00 0.00 0.00 54 S 8.10 4.27 0.00 3.99 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 0.00 55 A 8.16 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 56 G 8.11 3.73 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 0.00 0.00 0.00 57 T 8.10 4.96 3.86 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 0.00 0.00 0.00 1.20 0.00 0.00 58 Y 8.31 4.77 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 59 Y 8.60 5.28 0.00 2.86 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 60 A 8.93 4.47 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 61 S 8.86 4.11 0.00 3.89 3.88 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 62 S 8.07 4.18 0.00 3.97 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 63 V 7.45 3.84 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 0.30 0.00 0.00 1.10 0.00 0.00 64 R 7.47 3.90 0.00 1.69 1.75 0.00 3.27 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.42 0.00 65 G 8.66 3.93 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 0.00 0.00 0.00 66 R 7.65 4.54 0.00 1.65 2.20 0.00 3.00 0.00 0.00 3.11 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.52 0.00 67 F 8.17 5.67 0.00 2.83 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 68 T 8.95 4.87 4.29 0.00 0.00 0.00 0.00 0.00 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 69 I 9.22 5.09 1.98 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.24 0.77 0.00 0.00 70 S 8.88 4.93 0.00 4.00 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 71 R 8.39 5.13 0.00 1.39 1.55 0.00 3.19 0.00 0.00 3.40 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.66 0.00 72 D 9.39 4.90 0.00 2.97 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 73 N 9.28 4.51 0.00 2.93 2.92 0.00 0.00 6.97 7.54 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 74 A 8.20 4.02 1.36 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 0.00 0.00 75 K 8.19 4.18 0.00 1.86 1.98 0.00 2.17 0.00 0.00 1.90 0.00 0.00 3.13 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.55 1.59 7.81 76 K 7.74 3.80 0.00 1.79 1.70 0.00 1.32 0.00 0.00 1.21 0.00 0.00 2.74 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.44 1.42 7.81 77 T 8.18 5.22 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 0.73 0.00 0.00 78 V 8.40 4.69 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 1.15 0.00 0.00 0.28 0.00 0.00 79 Y 9.29 5.40 0.00 2.97 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 80 L 8.59 4.53 0.00 0.48 0.75 0.55 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 8.99 4.38 0.00 2.16 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.52 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 82 M 8.94 4.04 0.00 0.96 1.45 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.07 0.00 82A N 8.76 5.03 0.00 2.80 2.74 0.00 0.00 7.08 7.72 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 82B S 8.42 3.71 0.00 4.02 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 82C L 7.95 4.49 0.00 1.82 1.62 0.84 0.87 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 83 K 9.01 4.96 0.00 1.80 1.81 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.36 1.50 7.81 84 P 0.00 4.41 0.00 2.19 2.15 0.00 3.62 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.12 0.00 85 E 8.09 4.21 0.00 2.11 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 2.31 2.30 0.00 86 D 8.22 4.72 0.00 2.98 3.03 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 87 T 8.01 4.39 4.35 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 1.33 0.00 0.00 88 A 8.56 4.39 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 89 V 7.92 4.38 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 1.03 0.00 0.00 0.97 0.00 0.00 90 Y 9.50 5.25 0.00 3.22 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 T 9.44 5.46 4.51 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 1.49 0.00 0.00 92 C 9.51 5.04 0.00 2.23 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 93 G 8.87 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 94 A 9.04 5.45 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.01 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 0.00 0.00 0.00 0.00 96 R 8.74 5.00 0.00 1.79 1.78 0.00 3.09 0.00 0.00 3.01 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 97 I 8.49 3.53 1.14 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.22 0.00 0.00 98H R 8.55 3.96 0.00 2.11 2.05 0.00 3.21 0.00 0.00 3.34 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 98I E 8.39 4.54 0.00 1.84 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 2.25 2.25 0.00 98J S 8.34 4.10 0.00 3.90 4.04 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 99 W 8.09 4.31 0.00 3.77 3.28 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 0.00 100 V 6.58 3.12 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.98 0.00 0.00 -0.91 0.00 0.00 101 T 8.27 3.93 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 -0.28 0.00 0.00 102 W 7.46 5.00 0.00 3.18 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 0.00 103 W 8.92 4.91 0.00 3.11 3.03 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 0.00 104 G 8.93 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 0.00 0.00 0.00 0.00 105 Q 9.19 4.51 0.00 2.07 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.60 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 106 G 9.12 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 0.00 0.00 0.00 0.00 107 T 9.18 4.73 4.40 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 1.47 0.00 0.00 108 Q 8.87 4.35 0.00 2.29 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.62 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 109 V 9.05 4.81 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 0.82 0.00 0.00 0.56 0.00 0.00 110 T 8.90 4.87 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 1.24 0.00 0.00 111 V 8.62 4.76 2.20 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 0.81 0.00 0.00 0.99 0.00 0.00 112 S 9.00 4.72 0.00 3.92 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 0.00 113 S 8.38 4.38 0.00 3.88 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