NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1977 8.1727 122.0547 56.2900 34.1670 174.0683 2 V 4.5811 8.1851 126.5370 60.7678 32.4911 174.4941 3 F 4.4518 9.8941 128.7069 57.3397 40.3691 175.0558 4 E 4.3058 8.8090 120.1137 55.8029 30.9362 177.5349 5 R 3.3082 8.8153 121.6767 60.1764 30.1127 179.6957 6 C 4.3134 8.0387 115.4886 59.7316 38.0855 175.5060 7 E 3.8940 8.1822 120.6342 59.3770 29.2016 178.6090 8 L 3.7525 8.0475 120.0468 57.7260 42.0660 178.5160 9 A 3.9513 7.8222 120.8635 55.4408 18.4402 179.8996 10 R 3.8929 8.1009 116.3573 59.6134 30.2287 179.4732 11 T 3.8771 7.8995 115.5326 66.6627 68.4866 176.7430 12 L 3.8654 8.2169 121.2923 57.4672 41.6207 179.3140 13 K 3.8339 8.0365 119.6175 59.7489 31.9024 178.8145 14 R 3.9517 7.6522 116.9480 58.9748 30.0561 177.4996 15 L 4.3275 7.5118 116.0501 54.0321 42.0108 176.6133 16 G 3.8142 7.8837 106.9094 47.0790 0.0000 175.0870 17 M 3.8944 7.8064 120.7737 56.3846 32.5120 175.9440 18 D 4.5068 7.9956 117.9389 55.7743 41.2532 175.8569 19 G 3.9479 9.3475 115.4017 45.5606 0.0000 171.5644 20 Y 4.1897 8.2939 122.1120 58.7961 38.9515 176.3701 21 R 3.6191 9.0018 126.4841 57.2252 27.8770 177.1703 22 G 3.8372 8.1684 103.2288 45.6137 0.0000 173.8951 23 I 4.1514 7.8058 122.2084 59.0643 38.5004 175.9008 24 S 4.8052 8.3188 120.1019 57.6511 64.0813 174.7983 25 L 4.2213 9.1473 123.5347 58.6296 41.6541 179.3364 26 A 4.1617 8.1693 120.0903 55.2327 18.2557 179.2794 27 N 4.3819 8.1397 114.5634 56.4368 38.6762 177.7197 28 W 4.2222 7.9797 119.8107 59.8499 29.0715 178.4228 29 M 4.1684 8.4011 118.7645 58.5673 31.5054 177.7371 30 C 3.0276 8.0074 118.6600 59.2581 40.9278 175.2863 31 L 3.9449 8.1032 121.4450 58.3534 41.7140 178.7635 32 A 4.2316 8.2785 120.5845 54.9554 18.3795 179.4921 33 K 2.8303 8.2291 118.2742 59.3658 32.0550 179.1831 34 W 4.2344 7.7654 117.4937 59.2693 29.0497 178.5050 35 E 4.2852 8.6222 118.7823 58.8383 28.9812 177.9669 36 S 4.5521 7.8130 109.9161 56.6120 64.3417 174.1529 37 G 3.1877 8.1274 108.4711 47.1793 0.0000 173.6010 38 Y 3.6436 7.5943 112.7040 58.5187 35.6284 168.6591 39 N 5.3376 7.5750 119.0682 52.1501 39.9710 175.8804 40 T 4.2414 8.9599 117.1520 64.0323 69.2707 176.4187 41 R 4.2222 8.0910 119.7504 57.0366 30.7592 176.5904 42 A 4.2742 7.5675 120.2576 52.7602 19.1893 176.7488 43 T 5.0648 8.3978 111.3796 60.0362 72.4414 173.1464 44 N 4.8698 8.6651 121.9907 52.4741 42.2860 172.3325 45 Y 4.5807 8.7554 128.0107 57.1819 40.7999 173.9686 46 N 4.5093 8.1709 124.6716 51.2402 38.1713 175.3964 47 A 3.6683 8.2305 127.2249 54.6986 19.0659 179.1942 48 G 3.8857 8.1817 104.3445 48.3730 0.0000 173.8478 49 D 4.7284 7.4039 114.6594 51.8137 40.2673 175.4419 50 R 3.9488 8.2554 116.3858 57.2795 28.0995 175.8261 51 S 4.9683 7.7029 111.3032 56.9964 66.5633 172.6638 52 T 5.1328 8.9556 115.9596 61.9389 72.8904 172.9132 53 D 5.3400 8.9054 125.3908 53.5345 42.8114 175.1347 54 Y 4.9827 9.2761 121.3074 57.3391 41.8182 177.2747 55 G 4.3786 9.2209 112.0412 45.7977 0.0000 173.6039 56 I 3.7750 8.2303 116.8910 62.8677 37.6566 176.7109 57 F 4.7646 8.0464 115.3149 56.4251 39.8091 175.3720 58 Q 3.5091 8.0666 119.2483 57.1040 26.6142 174.1268 59 I 4.3668 8.2335 119.0449 61.0825 39.3201 176.8641 60 N 5.3489 9.2237 126.2305 53.3729 39.6886 175.8456 61 S 4.5217 9.1754 120.9557 61.0748 63.3848 175.5415 62 R 3.7650 8.7017 122.0681 58.6620 30.2800 177.7532 63 Y 4.2547 7.6936 113.8753 57.0567 40.5470 176.7047 64 W 4.9791 7.9425 118.6312 57.4815 31.3203 173.7327 65 C 5.8648 8.1079 111.4650 52.6491 45.7113 172.9019 66 N 5.0172 9.1514 119.2739 52.1807 40.0417 174.8046 67 D 4.7797 8.7772 123.8695 52.1692 40.7321 178.0084 68 G 4.1484 8.5781 112.5391 46.4501 0.0000 175.0628 69 K 4.2133 8.0947 116.1820 57.4786 33.2570 176.6967 70 T 4.4922 7.5433 118.2244 61.6138 68.9939 172.9025 71 P 4.2662 0.0000 0.0000 63.6971 31.9502 176.2853 72 G 3.7947 8.5404 109.5610 46.6787 0.0000 172.9711 73 A 4.6683 7.8082 119.1281 50.2716 21.3054 177.4210 74 V 4.3457 8.5007 112.1613 59.3363 35.5633 175.8759 75 N 4.9761 8.1391 118.6376 51.7785 37.7231 174.4944 76 A 4.0027 9.0111 125.1379 54.7924 19.1137 178.4808 77 C 4.5108 8.4658 111.2528 57.2939 40.7141 173.1102 78 H 4.1154 7.7573 115.8469 57.0030 26.4560 174.4141 79 L 4.8905 7.6694 116.2191 52.6482 45.9397 176.4001 80 S 4.6515 8.3048 115.0742 58.0652 63.2880 176.0536 81 C 4.0841 8.6098 124.0772 59.7207 40.7872 176.3096 82 S 3.9341 7.7603 114.4522 61.4324 61.6276 176.0259 83 A 4.0498 7.7718 122.3512 54.6260 18.1390 177.9739 84 L 4.4560 7.7445 116.0788 55.0553 41.7176 177.6535 85 L 5.0166 7.9279 117.2394 54.5092 42.4604 176.8069 86 Q 4.3499 7.7592 117.7772 55.4447 29.4945 175.9762 87 D 4.4672 8.5410 119.8759 57.1156 41.1753 176.9318 88 N 4.5906 8.0888 118.0835 53.3075 39.4896 174.6671 89 I 4.3299 8.3854 118.4053 61.0820 38.1101 177.2314 90 A 3.9370 8.4849 125.6717 55.9129 18.0920 180.2783 91 D 4.3122 8.0636 116.6794 57.2833 40.9287 178.6141 92 A 4.0780 7.9669 120.9623 55.1033 18.4050 179.7520 93 V 3.4026 8.1768 116.8544 66.0566 31.6445 178.0914 94 A 3.8273 7.8856 120.5781 55.2666 18.1456 178.8595 95 C 4.1830 8.4239 116.8340 59.7075 38.2064 175.5767 96 A 3.8853 8.1875 122.7043 55.0872 17.5927 179.8019 97 K 3.7133 7.6573 116.2524 59.3877 32.3522 179.2136 98 R 4.0575 7.7614 119.0347 59.2880 30.1252 178.6320 99 V 2.4538 7.4381 117.9750 65.7561 30.9441 177.9561 100 V 3.9362 7.6596 109.5366 62.6096 31.2963 178.0520 101 R 4.1493 7.7402 117.8203 57.3562 30.4932 176.5443 102 D 4.7168 7.4045 118.7938 52.8378 41.8979 175.3685 103 P 4.2415 0.0000 0.0000 66.1110 31.1696 178.0900 104 Q 4.0172 8.2045 116.4525 56.9408 29.8421 177.5154 105 G 3.9802 8.1090 106.8559 46.7738 0.0000 175.8187 106 I 3.6009 7.8048 119.6735 63.5239 38.0188 178.1291 107 R 4.1894 7.3641 117.6050 58.0156 29.9689 177.5186 108 A 4.1028 7.6038 120.2339 53.1773 18.5513 177.2366 109 W 4.7171 8.0002 116.4794 54.5578 30.0323 174.7391 110 P 4.3315 0.0000 0.0000 65.9201 30.6879 178.4110 111 A 4.1128 8.2277 118.3845 54.2865 18.2248 179.3305 112 W 3.9577 8.4576 127.6945 60.5798 30.5659 178.3805 113 R 3.6206 8.0917 116.4937 59.3332 29.6910 178.3750 114 N 4.3472 7.8676 114.9172 55.4359 38.6231 176.7741 115 R 4.0645 7.7911 116.7914 55.8682 31.9920 176.0887 116 C 4.5915 7.1373 114.3725 57.6511 42.8603 174.2213 117 Q 3.3285 6.5900 119.9084 57.2244 28.7167 175.5491 118 N 4.1801 8.6111 119.7019 54.1017 36.2631 173.9898 119 R 4.4849 7.2824 116.1094 54.3040 32.3365 176.4008 120 D 4.5792 8.3154 119.4479 54.0172 39.9458 176.0116 121 V 4.4548 8.1189 117.2591 61.3054 32.4842 178.4053 122 R 4.0363 8.1827 121.7955 59.4030 29.7662 178.3858 123 Q 3.9410 8.2430 116.8583 60.0187 27.9059 178.8632 124 Y 4.3155 7.8748 116.8946 59.7571 38.0723 177.0833 125 V 4.4027 7.8321 111.3004 60.5443 32.9829 175.5312 126 Q 3.9867 7.6873 118.1656 57.3028 28.7541 176.4348 127 G 3.9480 8.7230 108.2080 46.8287 0.0000 174.8647 128 C 4.4318 8.0059 116.7365 56.7104 40.6684 174.6372 129 G 3.8695 8.2912 107.1952 46.1679 0.0000 173.9516 130 V 3.9994 7.7430 117.9922 61.0895 31.9760 175.7913 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 K 8.17 4.20 0.00 1.94 1.78 0.00 1.28 0.00 0.00 1.04 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.00 1.08 7.81 2 V 8.19 4.58 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 0.91 0.00 0.00 0.95 0.00 0.00 3 F 9.89 4.45 0.00 2.91 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 4 E 8.81 4.31 0.00 1.91 1.85 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 2.28 2.47 0.00 5 R 8.82 3.31 0.00 1.89 1.91 0.00 3.37 0.00 0.00 3.46 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.74 0.00 6 C 8.04 4.31 0.00 3.00 3.11 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 0.00 0.00 0.00 7 E 8.18 3.89 0.00 2.05 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 0.00 2.59 2.41 0.00 8 L 8.05 3.75 0.00 1.45 1.41 -0.14 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.82 3.95 1.40 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 0.00 0.00 0.00 10 R 8.10 3.89 0.00 1.88 1.99 0.00 3.14 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 11 T 7.90 3.88 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 1.21 0.00 0.00 12 L 8.22 3.87 0.00 1.58 1.59 0.94 0.39 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 13 K 8.04 3.83 0.00 1.93 1.95 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.47 7.81 14 R 7.65 3.95 0.00 2.05 2.04 0.00 3.30 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.51 4.33 0.00 1.72 1.56 0.84 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.88 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 0.00 0.00 0.00 17 M 7.81 3.89 0.00 1.27 1.96 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.33 0.00 18 D 8.00 4.51 0.00 2.68 2.67 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 19 G 9.35 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 20 Y 8.29 4.19 0.00 3.32 3.14 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 21 R 9.00 3.62 0.00 1.91 1.85 0.00 3.26 0.00 0.00 3.04 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 1.46 0.00 22 G 8.17 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 0.00 0.00 0.00 23 I 7.81 4.15 1.77 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.77 -0.14 0.00 0.00 24 S 8.32 4.81 0.00 4.07 4.03 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 25 L 9.15 4.22 0.00 2.03 1.82 0.99 0.99 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 26 A 8.17 4.16 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.14 4.38 0.00 2.79 2.66 0.00 0.00 6.97 7.05 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 28 W 7.98 4.22 0.00 3.55 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 29 M 8.40 4.17 0.00 2.20 2.37 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.93 0.00 30 C 8.01 3.03 0.00 2.54 3.14 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 31 L 8.10 3.94 0.00 1.74 1.78 0.43 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.28 4.23 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 33 K 8.23 2.83 0.00 1.67 1.44 0.00 1.16 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.60 1.27 7.81 34 W 7.77 4.23 0.00 3.32 3.24 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 35 E 8.62 4.29 0.00 1.97 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 2.56 2.41 0.00 36 S 7.81 4.55 0.00 4.09 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 37 G 8.13 3.19 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 0.00 38 Y 7.59 3.64 0.00 3.24 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 39 N 7.57 5.34 0.00 2.83 2.86 0.00 0.00 7.00 7.10 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 40 T 8.96 4.24 4.43 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 1.45 0.00 0.00 41 R 8.09 4.22 0.00 2.00 2.05 0.00 3.20 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.61 0.00 42 A 7.57 4.27 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 43 T 8.40 5.06 4.03 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 1.32 0.00 0.00 44 N 8.67 4.87 0.00 2.86 2.78 0.00 0.00 6.82 7.57 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 45 Y 8.76 4.58 0.00 3.03 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 46 N 8.17 4.51 0.00 2.71 2.61 0.00 0.00 6.54 6.44 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 47 A 8.23 3.67 1.33 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 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.18 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 49 D 7.40 4.73 0.00 2.70 2.67 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 50 R 8.26 3.95 0.00 2.03 2.18 0.00 3.11 0.00 0.00 3.18 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.54 0.00 51 S 7.70 4.97 0.00 3.89 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 52 T 8.96 5.13 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 0.59 0.00 0.00 53 D 8.91 5.34 0.00 2.68 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 54 Y 9.28 4.98 0.00 2.91 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 55 G 9.22 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 56 I 8.23 3.77 1.66 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 1.72 0.03 0.00 0.00 57 F 8.05 4.76 0.00 3.22 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 58 Q 8.07 3.51 0.00 2.50 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.84 0.00 0.00 0.00 0.00 0.00 2.52 2.70 0.00 59 I 8.23 4.37 2.14 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.00 1.11 0.00 0.00 60 N 9.22 5.35 0.00 3.08 3.03 0.00 0.00 6.97 7.14 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 61 S 9.18 4.52 0.00 4.08 4.50 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.70 3.77 0.00 1.54 1.09 0.00 2.68 0.00 0.00 2.84 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.96 0.00 63 Y 7.69 4.25 0.00 1.43 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 0.00 0.00 0.00 64 W 7.94 4.98 0.00 3.56 3.26 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 65 C 8.11 5.86 0.00 3.03 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 66 N 9.15 5.02 0.00 2.83 2.71 0.00 0.00 7.12 8.10 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 67 D 8.78 4.78 0.00 2.98 2.79 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 68 G 8.58 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 69 K 8.09 4.21 0.00 1.92 1.96 0.00 1.63 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.49 7.81 70 T 7.54 4.49 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 1.18 0.00 0.00 71 P 0.00 4.27 0.00 2.14 2.05 0.00 3.66 0.00 0.00 3.89 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 72 G 8.54 3.79 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 0.00 73 A 7.81 4.67 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 74 V 8.50 4.35 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 0.87 0.00 0.00 75 N 8.14 4.98 0.00 2.78 2.64 0.00 0.00 6.76 8.45 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 76 A 9.01 4.00 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 77 C 8.47 4.51 0.00 3.34 3.21 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 78 H 7.76 4.12 0.00 3.39 3.41 0.00 5.61 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 7.67 4.89 0.00 1.67 1.51 0.96 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.30 4.65 0.00 3.83 3.69 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 81 C 8.61 4.08 0.00 2.29 1.18 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 0.00 0.00 0.00 0.00 82 S 7.76 3.93 0.00 3.87 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 83 A 7.77 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 84 L 7.74 4.46 0.00 1.94 1.81 1.06 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.93 5.02 0.00 1.76 1.73 1.10 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.76 4.35 0.00 2.21 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.73 7.10 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 87 D 8.54 4.47 0.00 2.64 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 88 N 8.09 4.59 0.00 2.70 2.74 0.00 0.00 6.91 7.94 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 89 I 8.39 4.33 1.75 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.78 0.95 0.00 0.00 90 A 8.48 3.94 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 91 D 8.06 4.31 0.00 2.75 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 92 A 7.97 4.08 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 93 V 8.18 3.40 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 0.74 0.00 0.00 0.94 0.00 0.00 94 A 7.89 3.83 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 95 C 8.42 4.18 0.00 3.11 3.26 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 96 A 8.19 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.66 3.71 0.00 1.62 1.36 0.00 1.31 0.00 0.00 0.94 0.00 0.00 2.35 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.30 0.93 7.81 98 R 7.76 4.06 0.00 1.98 2.10 0.00 3.26 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.89 0.00 99 V 7.44 2.45 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 -0.18 0.00 0.00 -0.75 0.00 0.00 100 V 7.66 3.94 2.13 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 1.04 0.00 0.00 1.38 0.00 0.00 101 R 7.74 4.15 0.00 2.08 2.05 0.00 3.23 0.00 0.00 3.37 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.10 0.00 102 D 7.40 4.72 0.00 3.01 2.60 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 0.00 103 P 0.00 4.24 0.00 2.01 2.13 0.00 3.69 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 104 Q 8.20 4.02 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.75 0.00 0.00 0.00 0.00 0.00 2.42 2.33 0.00 105 G 8.11 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 0.00 106 I 7.80 3.60 1.07 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.08 -0.44 0.00 0.00 107 R 7.36 4.19 0.00 2.03 2.03 0.00 3.24 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.54 0.00 108 A 7.60 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.00 4.72 0.00 3.45 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 0.00 110 P 0.00 4.33 0.00 2.24 2.19 0.00 3.77 0.00 0.00 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.24 0.00 111 A 8.23 4.11 1.46 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 0.00 112 W 8.46 3.96 0.00 3.44 3.45 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 0.00 113 R 8.09 3.62 0.00 1.93 1.94 0.00 3.33 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.97 0.00 114 N 7.87 4.35 0.00 2.55 2.71 0.00 0.00 6.94 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 0.00 115 R 7.79 4.06 0.00 1.12 0.84 0.00 2.78 0.00 0.00 2.85 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.72 0.00 116 C 7.14 4.59 0.00 1.83 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 0.00 117 Q 6.59 3.33 0.00 0.93 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.62 0.00 0.00 0.00 0.00 0.00 2.16 2.22 0.00 118 N 8.61 4.18 0.00 2.80 2.83 0.00 0.00 6.91 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 0.00 119 R 7.28 4.48 0.00 1.84 1.84 0.00 3.27 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 120 D 8.32 4.58 0.00 2.63 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 0.00 121 V 8.12 4.45 2.33 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 0.99 0.00 0.00 1.05 0.00 0.00 122 R 8.18 4.04 0.00 1.92 2.03 0.00 3.43 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 123 Q 8.24 3.94 0.00 2.02 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.90 0.00 0.00 0.00 0.00 0.00 2.25 1.65 0.00 124 Y 7.87 4.32 0.00 3.14 3.19 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 0.00 125 V 7.83 4.40 2.14 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 0.90 0.00 0.00 1.06 0.00 0.00 126 Q 7.69 3.99 0.00 2.21 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.56 0.00 0.00 0.00 0.00 0.00 2.48 2.30 0.00 127 G 8.72 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 0.00 128 C 8.01 4.43 0.00 2.95 3.14 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 0.00 129 G 8.29 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 0.00 130 V 7.74 4.00 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 0.76 0.00 0.00 0.96 0.00 0.00