NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 L 4.4007 8.1844 120.6412 54.8610 43.4144 175.2740 8 H 4.8959 8.6447 122.2708 53.8887 32.3888 171.3946 9 K 4.6746 9.4418 126.3637 55.9273 33.6882 175.5546 10 E 4.8883 9.1721 123.5284 53.4655 33.2894 173.8445 11 P 4.9024 0.0000 0.0000 63.3358 32.1946 174.8914 12 A 5.0225 8.6825 122.4600 51.0634 23.1557 175.1135 13 T 4.6486 8.6613 114.7623 61.3741 71.8938 174.1753 14 L 4.2461 8.6865 127.9453 55.9054 42.4058 175.6461 15 I 4.3730 8.2893 125.8573 62.1868 39.1339 176.0504 16 K 4.4391 7.5620 119.3455 55.4699 35.4740 173.7811 17 A 4.5736 8.7551 130.5121 51.8605 19.3465 177.1069 18 I 4.1930 8.0200 122.9758 61.5534 38.7117 175.0319 19 D 4.3505 7.5578 118.3292 53.5094 43.5308 176.7001 20 G 3.7605 9.0095 110.7743 48.0464 0.0000 174.0254 21 D 4.8554 8.0077 116.3567 52.9863 40.4740 175.3233 22 T 5.1561 7.7974 117.1226 62.3025 72.9394 173.0611 23 V 4.7715 8.7462 124.9970 61.0707 35.8822 173.9469 24 K 5.1311 9.2729 126.0272 54.9793 34.0017 175.5256 25 L 5.3596 9.4835 124.7423 52.9938 46.1500 175.3284 26 M 4.8964 9.0106 122.2324 55.0610 33.5555 174.2476 27 Y 4.9866 9.1030 127.9199 56.2537 42.0009 175.7367 28 K 3.7577 9.3778 127.0424 57.3588 29.8342 175.0607 29 G 4.1185 8.3492 106.9212 44.9316 0.0000 173.4588 30 Q 4.9165 7.8502 118.0481 53.0287 31.6976 173.8173 31 P 4.9438 0.0000 0.0000 63.6823 32.4622 175.2501 32 M 4.7031 8.9952 120.0024 54.6536 36.4086 173.3184 33 V 4.6145 8.3140 125.4582 62.0601 33.6145 174.3123 34 F 5.1560 9.4037 126.4967 55.6406 42.2197 174.0685 35 R 4.8980 8.9652 123.9771 54.5336 31.7657 175.2642 36 L 4.3246 8.6361 127.7268 54.5053 41.9321 177.2515 37 L 3.8825 8.6622 124.6960 55.3430 43.0505 177.5180 38 L 4.1400 8.7202 120.2095 55.7144 39.2559 173.9778 39 V 4.9480 7.2549 110.3291 59.6626 35.2054 175.2446 40 D 4.7769 9.1314 124.9710 52.9231 42.5521 175.0507 41 I 4.6549 7.9972 124.1415 58.3505 39.9307 174.4156 42 P 4.2162 0.0000 0.0000 62.9556 31.9352 175.8193 43 E 4.5171 8.7852 121.6688 55.9864 30.4881 177.0507 44 T 4.3635 8.2060 115.1448 62.3453 69.2394 175.0088 45 K 4.5591 7.8338 120.6253 55.8339 32.9722 176.0806 46 H 5.0932 8.4094 119.1094 54.9254 30.3363 173.0381 47 P 4.1846 0.0000 0.0000 65.3110 30.9057 175.9946 48 K 4.4250 7.7706 118.8318 54.7790 34.3465 174.7306 49 K 4.2662 8.6576 123.9833 54.7025 31.3209 178.7697 50 G 4.0116 7.5103 105.9777 44.8771 0.0000 174.0462 51 V 3.8322 8.4725 123.9990 63.5509 32.1793 175.1947 52 E 4.7878 8.7210 125.9256 53.6040 33.6819 174.9779 53 K 3.9685 8.4889 121.9189 58.3295 32.2627 177.1688 54 Y 4.4885 7.9814 121.7292 58.7721 37.1315 171.7256 55 G 4.0527 7.9344 107.2029 47.6231 0.0000 173.9545 56 P 4.3762 0.0000 0.0000 65.0470 31.3246 178.6359 57 E 4.0532 8.0816 116.9013 59.0941 29.5574 178.9014 58 A 3.9858 8.5861 121.1059 55.1649 18.4756 179.5100 59 A 4.0487 8.5095 119.5297 55.2965 18.4346 179.7458 60 A 3.9628 8.2762 119.3464 55.0645 18.3967 179.5770 61 F 3.9188 8.3793 119.1523 61.7656 39.5262 177.4352 62 T 3.8746 8.1895 115.2005 66.4954 68.2971 176.2130 63 K 3.7852 8.1050 121.4407 59.8062 32.2836 178.8268 64 K 3.9146 8.5198 118.7241 59.6274 31.6930 179.1075 65 M 3.8706 7.7789 117.7042 58.3509 32.0967 178.1281 66 V 3.9081 7.7108 112.0256 63.2719 31.7915 178.3696 67 E 3.9483 8.1481 117.9596 59.0172 29.4074 177.4143 68 N 4.6465 7.8692 113.0095 52.9114 38.9002 174.9799 69 A 4.4614 7.2239 122.0928 51.5854 19.3089 178.4652 70 K 4.1498 8.7661 121.5313 58.4993 32.5734 178.0037 71 K 4.6166 8.4655 118.2781 54.5681 35.7876 175.5347 72 I 4.9777 8.4005 125.6714 59.7133 39.4911 174.5434 73 E 5.2711 9.4818 126.0409 54.5797 33.6204 175.1810 74 V 4.6361 8.7785 115.8135 59.5021 35.1019 174.6428 75 E 5.1998 8.7943 124.6015 53.1771 32.1781 174.9255 76 F 4.5540 8.9678 125.7623 57.7627 40.0868 175.3245 77 D 5.0411 8.5769 121.0468 53.1205 43.2743 175.6843 78 K 4.4195 9.0331 117.3502 57.3592 33.6871 177.8423 79 G 4.1465 7.7835 110.6232 44.6097 0.0000 173.2394 80 Q 4.1202 8.5425 119.8333 56.3746 29.4493 176.4161 81 R 4.6249 8.5491 119.4932 56.5380 31.3360 176.0713 82 T 5.1417 7.5160 106.8355 59.7632 71.9384 173.2074 83 D 4.8976 8.4741 123.3545 51.6818 41.4216 177.2241 84 K 3.8968 8.4972 117.2818 59.3967 32.4820 177.0726 85 Y 4.3519 8.1635 115.9325 57.5356 37.9727 176.0434 86 G 3.9157 8.3164 107.7219 45.8849 0.0000 174.0400 87 R 4.3009 8.4834 119.6258 55.1175 31.5891 176.5076 88 G 3.7210 8.6191 111.3966 46.3045 0.0000 172.6329 89 L 5.2671 8.8026 124.1145 53.2949 42.5805 175.5630 90 A 4.4457 8.2886 125.0124 50.5823 23.6314 174.1035 91 Y 4.7087 8.4861 117.4503 57.4493 39.5843 174.9933 92 I 4.7136 8.6185 125.1249 59.7346 39.9762 174.0837 93 Y 5.0044 9.3334 124.5967 56.1515 40.6699 174.5983 94 A 4.8835 9.1091 126.9973 50.0547 20.7118 176.3797 95 D 4.2567 10.1711 125.5706 56.4143 38.8600 175.8078 96 G 3.9436 8.4173 104.7659 45.3824 0.0000 173.2457 97 K 4.5179 7.7438 121.7663 54.5575 33.9782 174.7687 98 M 4.0460 8.4493 125.5876 54.8781 33.1924 176.9720 99 V 3.5975 8.6562 127.1766 66.0831 31.6908 177.6036 100 N 4.2936 8.0305 115.7289 56.3756 38.4717 176.7379 101 E 3.8508 8.0706 119.6572 59.1694 29.8494 178.0972 102 A 4.0553 8.0583 120.8902 55.5654 18.3842 179.5815 103 L 3.5158 8.0063 117.0520 57.8525 41.6828 180.1011 104 V 3.7266 7.5971 117.8048 65.9840 31.2986 178.0207 105 R 4.0023 8.2439 117.7771 59.2826 29.9851 177.4361 106 Q 4.1884 7.8968 116.6472 55.6687 29.3738 175.7761 107 G 3.9702 8.3843 107.5804 47.6655 0.0000 174.5651 108 L 4.3211 7.8000 116.9063 53.6363 42.2339 176.0583 109 A 4.4519 7.3537 118.3213 51.2960 21.9316 176.1422 110 K 4.7517 8.7494 119.1048 54.4105 35.7194 175.9945 111 V 4.3048 8.9673 122.7609 62.6194 31.6710 175.9936 112 A 4.1432 8.3468 130.3928 51.1941 19.4466 176.4755 113 Y 4.2471 7.7942 116.5242 57.7779 38.5262 176.5893 114 V 3.8605 8.3819 122.2115 62.7935 31.8513 174.8344 115 Y 4.5088 8.7817 129.1140 57.9246 39.7916 175.3706 116 K 3.6575 9.3740 126.4022 57.4581 29.8562 176.1244 117 G 3.9752 8.3714 103.5300 45.9012 0.0000 174.7028 118 N 4.8253 8.2142 119.2340 51.7583 37.3299 174.2525 119 N 5.1795 8.2085 115.8750 52.6181 39.0942 177.1449 120 T 3.8649 8.7832 118.1687 67.0774 68.7281 174.8329 121 H 4.8860 7.9665 117.0187 55.6205 29.2998 176.4663 122 E 4.0143 8.3045 123.5490 59.5686 29.2754 178.7794 123 Q 3.9596 8.0034 117.6399 58.7420 29.0527 177.8105 124 L 3.9158 8.0130 120.9335 58.5542 42.0076 179.0495 125 L 4.0820 8.0180 118.5423 57.7183 41.5576 179.6647 126 R 3.9987 8.2313 118.3144 58.8217 29.9063 179.2322 127 K 3.8942 8.3888 118.6429 59.4203 32.1096 179.0062 128 A 3.9665 7.7902 120.5325 55.3584 18.2727 179.3581 129 E 3.9101 8.2639 117.4288 59.0091 29.6756 178.9280 130 A 3.6969 7.9512 121.0789 54.9523 18.4782 179.0829 131 Q 3.7748 7.9072 117.8977 59.5871 29.0869 178.8237 132 A 4.0067 7.9968 121.3426 54.8216 18.3217 179.8736 133 K 3.1199 7.4642 117.1090 59.4234 31.8388 179.7489 134 K 3.9475 8.0663 117.5117 58.9079 31.9526 178.2185 135 E 4.3524 7.9069 116.2588 54.7829 30.4278 176.0522 136 K 4.1532 7.8936 117.7122 56.0394 30.6056 175.1101 137 L 4.3535 8.1130 117.8504 56.1085 44.1315 179.1947 138 N 3.5477 9.3448 117.7365 54.2010 38.5996 176.1322 139 I 3.2199 5.4200 123.7646 63.2502 38.1240 177.7036 140 W 4.7559 8.3797 121.0083 56.2592 29.3212 176.5373 141 S 5.0774 8.0345 120.7226 58.4383 62.3319 174.2844 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 L 8.18 4.40 0.00 1.74 1.81 1.22 0.90 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 8 H 8.64 4.90 0.00 3.31 3.22 0.00 5.68 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 9 K 9.44 4.67 0.00 1.57 1.60 0.00 1.47 0.00 0.00 1.10 0.00 0.00 2.21 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.06 1.28 7.81 10 E 9.17 4.89 0.00 2.10 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 2.25 2.17 0.00 11 P 0.00 4.90 0.00 2.09 2.07 0.00 3.75 0.00 0.00 3.68 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 12 A 8.68 5.02 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 13 T 8.66 4.65 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 14 L 8.69 4.25 0.00 1.62 1.57 0.91 1.00 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 15 I 8.29 4.37 2.07 0.00 0.00 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 1.15 0.81 0.94 0.00 0.00 16 K 7.56 4.44 0.00 1.79 1.60 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.86 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.38 1.40 7.81 17 A 8.76 4.57 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 18 I 8.02 4.19 1.99 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.94 0.90 0.00 0.00 19 D 7.56 4.35 0.00 2.62 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 G 9.01 3.76 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 0.00 0.00 0.00 21 D 8.01 4.86 0.00 2.81 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 22 T 7.80 5.16 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 1.26 0.00 0.00 23 V 8.75 4.77 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 1.10 0.00 0.00 0.93 0.00 0.00 24 K 9.27 5.13 0.00 1.91 1.76 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.43 7.81 25 L 9.48 5.36 0.00 1.66 1.55 0.35 0.60 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 26 M 9.01 4.90 0.00 2.18 2.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.56 0.00 27 Y 9.10 4.99 0.00 3.31 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 28 K 9.38 3.76 0.00 1.32 1.58 0.00 0.61 0.00 0.00 1.23 0.00 0.00 2.84 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.08 1.25 7.81 29 G 8.35 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 0.00 0.00 0.00 0.00 30 Q 7.85 4.92 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.92 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 31 P 0.00 4.94 0.00 2.12 2.10 0.00 3.84 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 2.03 2.00 0.00 32 M 9.00 4.70 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.24 0.00 33 V 8.31 4.61 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 0.98 0.00 0.00 0.94 0.00 0.00 34 F 9.40 5.16 0.00 2.92 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 35 R 8.97 4.90 0.00 1.85 1.76 0.00 3.26 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 1.48 1.58 0.00 36 L 8.64 4.32 0.00 1.51 1.58 0.94 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.66 3.88 0.00 1.01 1.31 0.31 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.72 4.14 0.00 2.00 1.82 1.15 1.01 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 39 V 7.25 4.95 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 0.91 0.00 0.00 40 D 9.13 4.78 0.00 2.44 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 41 I 8.00 4.65 1.83 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 1.29 0.52 0.93 0.00 0.00 42 P 0.00 4.22 0.00 2.21 2.18 0.00 3.56 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.07 0.00 43 E 8.79 4.52 0.00 2.26 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 2.12 0.00 44 T 8.21 4.36 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 1.25 0.00 0.00 45 K 7.83 4.56 0.00 1.75 1.75 0.00 1.89 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.32 7.81 46 H 8.41 5.09 0.00 3.27 3.24 0.00 5.74 0.00 0.00 0.00 0.00 6.85 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 4.18 0.00 2.22 2.18 0.00 4.03 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 2.09 1.98 0.00 48 K 7.77 4.42 0.00 1.64 1.62 0.00 1.61 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.27 1.40 7.81 49 K 8.66 4.27 0.00 1.72 2.09 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.26 1.33 7.81 50 G 7.51 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 51 V 8.47 3.83 2.06 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 0.79 0.00 0.00 0.97 0.00 0.00 52 E 8.72 4.79 0.00 1.98 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 2.24 2.39 0.00 53 K 8.49 3.97 0.00 1.65 1.70 0.00 1.07 0.00 0.00 1.42 0.00 0.00 2.57 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.29 1.02 7.81 54 Y 7.98 4.49 0.00 3.19 2.96 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 55 G 7.93 4.05 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 0.00 0.00 0.00 56 P 0.00 4.38 0.00 2.16 2.11 0.00 3.51 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.16 0.00 57 E 8.08 4.05 0.00 2.33 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 0.00 2.50 2.48 0.00 58 A 8.59 3.99 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 59 A 8.51 4.05 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 60 A 8.28 3.96 1.44 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 0.00 0.00 0.00 0.00 0.00 0.00 61 F 8.38 3.92 0.00 3.28 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 62 T 8.19 3.87 4.30 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 1.27 0.00 0.00 63 K 8.10 3.79 0.00 1.88 2.08 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.43 1.67 7.81 64 K 8.52 3.91 0.00 1.80 1.70 0.00 1.70 0.00 0.00 1.52 0.00 0.00 2.90 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.43 1.54 7.81 65 M 7.78 3.87 0.00 1.92 1.69 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.47 0.00 66 V 7.71 3.91 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 1.00 0.00 0.00 67 E 8.15 3.95 0.00 2.07 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 2.31 0.00 68 N 7.87 4.65 0.00 2.77 2.80 0.00 0.00 7.02 6.95 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 69 A 7.22 4.46 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 70 K 8.77 4.15 0.00 1.97 1.87 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.40 7.81 71 K 8.47 4.62 0.00 1.80 1.66 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.38 7.81 72 I 8.40 4.98 2.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.26 0.84 0.00 0.00 73 E 9.48 5.27 0.00 1.86 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 2.19 2.24 0.00 74 V 8.78 4.64 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 0.26 0.00 0.00 0.61 0.00 0.00 75 E 8.79 5.20 0.00 2.24 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 0.00 2.51 2.40 0.00 76 F 8.97 4.55 0.00 3.09 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.58 5.04 0.00 2.71 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.03 4.42 0.00 1.88 1.96 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.12 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.48 7.81 79 G 7.78 4.15 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 0.00 80 Q 8.54 4.12 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.79 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 81 R 8.55 4.62 0.00 1.78 1.69 0.00 3.37 0.00 0.00 3.32 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.62 0.00 82 T 7.52 5.14 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 1.18 0.00 0.00 83 D 8.47 4.90 0.00 2.96 2.86 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 0.00 84 K 8.50 3.90 0.00 1.54 1.86 0.00 1.00 0.00 0.00 1.41 0.00 0.00 3.01 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.31 0.97 7.81 85 Y 8.16 4.35 0.00 3.09 3.01 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 86 G 8.32 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 87 R 8.48 4.30 0.00 2.06 1.80 0.00 3.09 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 1.61 1.60 0.00 88 G 8.62 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 0.00 0.00 0.00 89 L 8.80 5.27 0.00 1.67 1.69 1.19 0.55 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 90 A 8.29 4.45 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 8.49 4.71 0.00 3.11 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 92 I 8.62 4.71 1.75 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.78 0.85 0.00 0.00 93 Y 9.33 5.00 0.00 2.87 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 94 A 9.11 4.88 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 95 D 10.17 4.26 0.00 2.76 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 96 G 8.42 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 97 K 7.74 4.52 0.00 1.87 1.84 0.00 1.54 0.00 0.00 1.60 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.40 7.81 98 M 8.45 4.05 0.00 1.92 1.55 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 2.44 0.00 99 V 8.66 3.60 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 1.01 0.00 0.00 0.91 0.00 0.00 100 N 8.03 4.29 0.00 2.88 2.91 0.00 0.00 6.76 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 0.00 101 E 8.07 3.85 0.00 1.96 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 2.36 2.35 0.00 102 A 8.06 4.06 1.65 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 0.00 0.00 103 L 8.01 3.52 0.00 1.87 1.63 0.99 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 104 V 7.60 3.73 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 1.05 0.00 0.00 0.96 0.00 0.00 105 R 8.24 4.00 0.00 1.84 2.10 0.00 3.34 0.00 0.00 3.13 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 106 Q 7.90 4.19 0.00 2.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.35 0.00 0.00 0.00 0.00 0.00 1.96 2.24 0.00 107 G 8.38 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 0.00 0.00 0.00 108 L 7.80 4.32 0.00 1.30 1.46 0.30 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.35 4.45 1.10 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 0.00 0.00 110 K 8.75 4.75 0.00 1.60 1.95 0.00 1.40 0.00 0.00 1.22 0.00 0.00 2.74 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.07 1.30 7.81 111 V 8.97 4.30 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 0.73 0.00 0.00 0.98 0.00 0.00 112 A 8.35 4.14 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 0.00 113 Y 7.79 4.25 0.00 3.06 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 0.00 114 V 8.38 3.86 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 0.87 0.00 0.00 1.07 0.00 0.00 115 Y 8.78 4.51 0.00 3.08 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 0.00 116 K 9.37 3.66 0.00 1.55 1.51 0.00 1.47 0.00 0.00 1.38 0.00 0.00 2.34 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.30 0.53 7.81 117 G 8.37 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 0.00 0.00 0.00 118 N 8.21 4.83 0.00 2.93 2.86 0.00 0.00 6.63 7.92 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 0.00 119 N 8.21 5.18 0.00 2.94 3.01 0.00 0.00 6.13 7.22 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 0.00 120 T 8.78 3.86 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 1.07 0.00 0.00 121 H 7.97 4.89 0.00 2.77 3.05 0.00 5.62 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 0.00 122 E 8.30 4.01 0.00 2.22 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 2.35 2.42 0.00 123 Q 8.00 3.96 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.61 0.00 0.00 0.00 0.00 0.00 2.47 2.37 0.00 124 L 8.01 3.92 0.00 1.75 1.84 0.90 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 125 L 8.02 4.08 0.00 1.96 1.72 0.99 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.23 4.00 0.00 1.84 1.96 0.00 3.14 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.80 0.00 127 K 8.39 3.89 0.00 1.97 1.83 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.56 7.81 128 A 7.79 3.97 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 0.00 129 E 8.26 3.91 0.00 2.19 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 0.00 2.17 2.57 0.00 130 A 7.95 3.70 1.29 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 0.00 0.00 0.00 131 Q 7.91 3.77 0.00 2.26 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.55 0.00 132 A 8.00 4.01 1.49 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 0.00 0.00 133 K 7.46 3.12 0.00 1.54 1.31 0.00 1.01 0.00 0.00 0.61 0.00 0.00 2.42 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.21 7.81 134 K 8.07 3.95 0.00 1.72 1.81 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.47 7.81 135 E 7.91 4.35 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 2.27 2.48 0.00 136 K 7.89 4.15 0.00 1.98 1.96 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.35 7.81 137 L 8.11 4.35 0.00 1.82 1.74 0.99 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 138 N 9.34 3.55 0.00 2.62 1.95 0.00 0.00 6.88 7.33 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 0.00 139 I 5.42 3.22 1.26 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 -0.36 0.35 0.00 0.00 140 W 8.38 4.76 0.00 3.39 3.13 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 0.00 0.00 0.00 141 S 8.03 5.08 0.00 4.20 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