NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 G 3.8380 8.3544 109.7193 44.9044 0.0000 173.8107 4 D 4.2431 8.2421 119.6921 52.6679 42.8172 175.4433 5 K 3.8984 9.4141 128.7975 59.7805 32.8374 178.7410 6 K 4.0288 8.0813 117.9915 58.8052 31.9918 179.4164 7 V 3.6714 8.8360 119.4535 66.1029 31.4329 178.0023 8 I 3.7009 8.0764 119.8279 64.5231 36.9431 178.3649 9 Q 3.9611 8.1387 118.6934 59.3451 28.4758 178.5875 10 H 4.1049 8.2742 117.0681 59.0583 28.6946 177.8811 11 L 4.0181 8.1819 120.6789 57.8956 41.3594 179.3624 12 N 4.3548 8.4344 116.4840 55.8241 38.4210 177.4377 13 K 3.9796 7.9563 121.4759 59.3036 32.2575 179.0114 14 I 3.7025 8.0636 120.4693 64.0774 37.0338 177.8659 15 L 4.0167 8.1991 121.5679 58.3128 41.7999 178.9967 16 G 3.8404 8.3328 105.7884 48.2675 0.0000 175.1613 17 N 4.3493 8.1159 118.7508 56.0627 38.3673 177.4105 18 E 3.9910 8.3021 120.0182 59.4129 29.5838 179.4415 19 L 4.0775 8.4441 119.4336 57.6661 41.5519 179.7069 20 I 3.7482 7.6017 119.4619 64.2380 37.0327 178.3224 21 A 3.3105 7.8272 121.6513 54.6945 18.0958 179.4984 22 I 3.6227 7.8101 118.6504 64.8388 37.1758 178.4227 23 N 4.3425 7.6442 115.4986 56.1515 38.3693 177.2700 24 Q 3.8297 8.2004 121.2916 59.6159 29.1989 178.0699 25 Y 4.8411 7.9840 119.3559 60.6648 37.8485 178.5923 26 F 4.0277 8.3693 121.7060 61.0691 39.4654 177.0966 27 L 4.0148 8.3514 120.2827 58.4389 41.8334 178.5003 28 H 3.8224 8.3820 116.4593 58.6923 28.5535 177.6548 29 S 4.3029 8.1608 114.8228 61.7455 62.3165 176.6279 30 R 3.8964 7.7950 120.4751 59.0331 29.6983 179.0662 31 M 3.4695 7.7783 118.9000 57.8468 31.7464 178.6377 32 W 4.4644 7.8672 119.2227 59.9680 29.2986 178.2879 33 N 4.3561 8.3216 116.3149 56.4994 37.7874 176.9697 34 D 4.3712 8.2859 118.4509 56.8096 41.3483 177.5113 35 W 4.8868 7.8749 117.0779 56.7680 29.0946 177.1434 36 G 4.0004 8.3293 108.0858 45.8352 0.0000 174.0266 37 L 4.8307 8.1251 122.5626 53.3129 40.2419 177.5057 38 K 4.0304 8.6415 122.2929 59.0608 32.3960 178.8597 39 R 3.9122 8.0148 119.3481 59.1733 29.8957 178.5838 40 L 3.8288 7.7240 118.6769 57.2999 41.5162 179.3180 41 G 3.7805 8.2954 105.6507 47.9695 0.0000 175.6179 42 A 3.9843 8.3283 124.1686 54.9393 18.4275 179.2145 43 H 3.9970 8.2871 116.8566 59.3772 29.7912 177.1798 44 E 3.9967 8.5859 121.3563 59.1696 29.4640 178.0670 45 Y 3.9802 8.0546 119.8473 61.0810 38.8628 177.9645 46 H 4.0893 8.1169 116.8778 58.6087 28.7414 177.4939 47 E 3.8023 8.0190 120.5279 59.5172 29.1898 179.4009 48 S 4.2844 8.1777 112.9270 61.5031 62.4700 176.2577 49 I 3.6049 7.5175 122.4893 64.4728 36.7813 178.1397 50 D 4.2660 8.0816 119.6805 57.3213 40.5079 178.7868 51 E 4.2077 8.1738 120.4581 59.1153 29.4853 178.9871 52 M 3.9866 8.3403 119.1422 58.7028 32.0651 179.1064 53 K 4.0279 8.1576 118.2629 59.6183 32.1076 179.2674 54 H 4.3163 8.0305 116.1106 58.6621 28.5770 177.5902 55 A 3.9943 8.2949 122.8933 55.1467 18.1908 179.0695 56 D 4.2741 8.1198 116.4932 57.5529 41.2997 178.7250 57 K 3.9957 8.0386 118.8408 59.3956 31.9500 179.3353 58 L 4.0160 8.1375 119.2836 57.8237 41.5775 179.5020 59 I 3.7041 8.1009 120.0619 64.5780 37.0851 178.3015 60 E 4.0049 8.3205 119.2496 59.3298 29.2319 179.4035 61 R 3.9843 8.1630 118.6499 59.5828 30.2077 178.4397 62 I 3.7136 8.0369 119.8154 64.6602 37.1603 178.4849 63 L 4.0412 8.0682 119.6378 57.5904 41.2120 179.1923 64 F 4.3025 8.1270 119.9629 61.1865 39.4001 176.3541 65 L 3.9130 7.8910 115.3371 54.0506 41.4878 176.5950 66 E 3.6771 7.7860 117.3718 57.3234 27.3877 174.8038 67 G 3.9237 7.8521 108.6862 44.2650 0.0000 173.4033 68 L 4.5833 8.0525 119.0759 52.1207 42.7016 175.0866 69 P 4.4226 0.0000 0.0000 62.2557 31.9198 175.8935 70 N 4.7013 8.9159 121.7139 52.4657 38.6108 173.9677 71 L 4.6252 8.3462 124.0962 54.5305 42.4378 177.2867 72 Q 4.0868 8.4536 121.8509 57.6049 29.4812 175.3093 73 D 4.5378 8.1152 118.1998 52.8700 40.2614 175.1655 74 L 4.4144 8.1865 126.9130 52.9035 42.8776 176.9266 75 G 3.8143 8.2888 116.1228 44.6416 0.0000 171.4355 76 K 4.1382 8.3332 120.8546 55.5632 32.4986 177.0784 77 L 4.0988 8.3710 126.6142 54.6606 42.2123 177.1358 78 L 4.4625 8.5776 123.3422 53.3104 41.0607 175.2117 79 I 4.2876 8.0264 124.0116 59.5058 38.2644 176.7290 80 G 4.0161 8.6849 114.9266 44.8395 0.0000 172.6602 81 E 4.7794 8.7982 114.1864 55.2077 30.6300 175.3188 82 N 5.1057 7.7168 116.9323 50.7779 42.0172 175.0317 83 T 4.3584 8.5380 116.2752 67.0849 68.5407 176.5544 84 Q 3.9917 8.1999 120.8643 59.3389 29.0716 178.0515 85 E 4.0344 9.0455 120.0515 59.5226 29.4787 179.0892 86 M 3.9126 8.7326 119.1223 58.4794 32.0086 178.8772 87 L 4.2036 8.3307 119.0690 57.9036 41.7240 179.3714 88 Q 4.0315 8.2360 119.6007 59.3679 28.9598 178.0849 89 C 4.2260 8.5875 118.2719 62.8126 28.1623 175.7696 90 D 4.6947 8.3798 120.7280 57.2675 40.4045 178.5650 91 L 3.9975 8.1284 120.8801 58.2246 42.1307 178.7299 92 N 4.3511 8.4851 116.7230 56.3589 38.4222 177.1794 93 L 4.0273 8.0537 121.6969 58.2280 42.1731 178.8948 94 E 4.0717 8.5076 118.6278 59.0962 29.3626 179.2411 95 L 4.0058 8.1512 119.3257 57.5725 41.6920 179.2830 96 K 3.8663 8.1241 119.3262 59.6240 32.1434 178.5418 97 A 4.0365 8.2062 121.1032 55.6152 18.2627 179.7979 98 T 3.9268 8.1505 114.2403 66.2938 68.5418 177.0471 99 K 3.9178 8.0589 121.6373 59.8311 32.3125 178.5429 100 D 4.4399 8.0845 118.9939 57.3713 40.5722 179.0272 101 L 4.0181 7.9228 119.5498 57.7680 41.6687 179.5773 102 R 3.9205 8.0819 117.9917 59.4476 30.1113 178.9666 103 E 3.9863 8.2464 118.0567 59.2975 29.3482 179.3717 104 A 3.6218 8.0805 120.8253 54.9736 18.4688 179.7066 105 I 3.6089 7.9564 118.5588 64.4530 37.2043 178.4886 106 V 3.5683 7.7182 119.0362 66.4593 31.2639 177.4167 107 H 3.9818 7.9990 117.3025 59.5528 29.6268 176.6455 108 C 3.8880 8.3025 118.8289 63.0210 27.9849 175.9342 109 E 3.8840 8.1867 120.5453 59.1891 29.0043 178.5577 110 Q 3.9656 7.7177 118.5027 59.0189 29.1802 177.9001 111 V 3.9067 7.1376 110.0652 60.6706 31.7488 175.6691 112 H 2.9867 7.5386 114.1505 57.0443 26.6277 176.1375 113 D 4.5109 7.5132 121.0413 53.5679 39.0139 175.3119 114 Y 4.3468 7.6281 121.8820 59.7599 38.4119 177.3238 115 V 3.6553 7.7851 119.3232 66.0550 31.8464 177.8839 116 S 4.1513 8.3852 114.9555 61.6100 62.5779 176.6306 117 R 3.8984 8.0331 121.2686 59.5916 29.8489 178.0114 118 D 4.3185 8.2997 117.7410 57.1845 41.1874 177.8570 119 L 3.9389 7.9490 120.8242 58.3617 42.0365 179.0932 120 L 4.0318 8.0558 118.8224 57.5873 41.5197 179.4229 121 K 3.9586 8.4369 119.9917 59.4192 32.2008 178.7314 122 D 4.3752 8.0428 119.4339 57.2635 40.6495 178.7145 123 I 3.5094 7.7275 120.3857 64.1976 37.0201 178.1044 124 L 3.9282 8.1399 121.4116 58.2461 41.8577 178.7023 125 E 3.9228 8.2618 119.2033 59.3587 29.5745 178.7784 126 S 4.1862 8.0724 112.9202 61.3287 62.4541 175.9950 127 E 4.1344 8.5160 121.8057 59.3507 29.1563 179.1026 128 E 4.1007 8.6051 118.9791 59.1520 29.4999 179.1177 129 E 4.0200 8.2987 118.9939 59.6558 29.4385 178.7817 130 H 4.3496 8.3678 118.2897 59.4421 29.9042 177.3782 131 I 3.7313 8.0075 121.6534 64.2702 36.9144 177.8999 132 D 4.3170 8.3656 118.9830 57.4679 41.0611 177.5603 133 Y 4.1000 8.1476 119.9574 60.7280 38.7942 178.1869 134 L 3.7764 8.3677 119.9852 57.9411 41.7933 179.2114 135 E 3.9248 8.2427 118.4580 59.7807 29.3922 179.6340 136 T 3.7918 7.8781 115.4954 66.8557 68.5591 176.7097 137 Q 3.8519 7.7527 119.8628 58.8125 28.3163 178.8253 138 L 3.8944 7.8263 120.2443 57.5461 41.6370 179.7318 139 G 3.6480 8.1459 105.8146 47.7356 0.0000 175.7964 140 L 4.0600 7.8162 121.2170 57.4531 41.7075 179.2449 141 I 3.5900 7.4319 119.8414 64.7073 36.7665 178.4445 142 Q 3.9908 7.4135 116.2664 58.8383 28.6252 178.5023 143 K 4.1619 7.9678 118.6246 58.5211 32.3002 178.8598 144 V 4.2189 8.3798 110.2512 59.7885 33.1823 176.7006 145 G 4.0787 7.5985 105.9997 45.7946 0.0000 174.3016 146 L 3.9903 8.5642 122.8969 58.2467 41.9679 179.5274 147 E 3.9887 8.1018 117.8759 59.4618 29.5463 178.8786 148 N 4.3293 8.1231 116.1217 56.2892 38.4401 176.5556 149 Y 3.9433 7.9558 120.0075 60.7855 39.2256 178.0378 150 L 4.1013 8.2881 119.9564 57.6779 41.8343 179.0343 151 Q 3.9174 8.1917 119.6217 59.5058 28.7935 178.6555 152 S 4.2620 7.8654 113.3223 60.2701 62.9999 174.5436 153 H 4.6338 7.5423 118.3466 55.6534 29.5621 176.0641 154 M 4.1715 8.0027 121.2478 57.8099 31.9330 176.0958 155 H 5.1214 7.5349 113.9912 53.8913 30.5991 174.9325 156 E 4.1334 8.7050 121.6720 56.7877 29.2715 176.8479 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 3 G 8.35 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 4 D 8.24 4.24 0.00 2.86 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 K 9.41 3.90 0.00 1.84 1.77 0.00 1.75 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.51 7.81 6 K 8.08 4.03 0.00 1.89 1.61 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.62 1.44 7.81 7 V 8.84 3.67 2.25 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 1.13 0.00 0.00 1.02 0.00 0.00 8 I 8.08 3.70 2.02 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 1.52 0.52 0.90 0.00 0.00 9 Q 8.14 3.96 0.00 2.18 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.78 0.00 0.00 0.00 0.00 0.00 2.34 2.50 0.00 10 H 8.27 4.10 0.00 3.45 3.35 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.18 4.02 0.00 1.85 1.74 0.95 0.57 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 12 N 8.43 4.35 0.00 2.83 2.85 0.00 0.00 6.64 7.19 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 13 K 7.96 3.98 0.00 1.82 2.00 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.47 7.81 14 I 8.06 3.70 1.99 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.71 0.92 0.00 0.00 15 L 8.20 4.02 0.00 1.85 1.79 0.92 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.33 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 17 N 8.12 4.35 0.00 2.99 2.88 0.00 0.00 7.08 7.68 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 18 E 8.30 3.99 0.00 2.15 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 0.00 2.55 2.53 0.00 19 L 8.44 4.08 0.00 1.74 1.68 0.90 0.81 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 20 I 7.60 3.75 1.94 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 1.50 0.74 0.87 0.00 0.00 21 A 7.83 3.31 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.81 3.62 1.97 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 1.56 0.80 0.88 0.00 0.00 23 N 7.64 4.34 0.00 2.81 2.82 0.00 0.00 6.73 7.93 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 24 Q 8.20 3.83 0.00 1.95 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.79 0.00 0.00 0.00 0.00 0.00 2.51 2.33 0.00 25 Y 7.98 4.84 0.00 3.08 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 26 F 8.37 4.03 0.00 3.32 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 27 L 8.35 4.01 0.00 1.82 1.67 0.89 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.38 3.82 0.00 3.43 2.80 0.00 5.70 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.16 4.30 0.00 3.98 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 30 R 7.79 3.90 0.00 1.89 1.89 0.00 2.94 0.00 0.00 2.50 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.66 0.00 31 M 7.78 3.47 0.00 0.82 1.54 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.18 0.00 32 W 7.87 4.46 0.00 3.68 3.32 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 33 N 8.32 4.36 0.00 2.86 2.85 0.00 0.00 6.70 7.60 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 34 D 8.29 4.37 0.00 2.50 2.66 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 0.00 0.00 0.00 0.00 35 W 7.87 4.89 0.00 3.59 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 36 G 8.33 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 37 L 8.13 4.83 0.00 1.96 1.61 1.33 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 38 K 8.64 4.03 0.00 1.94 1.86 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.49 1.68 7.81 39 R 8.01 3.91 0.00 2.03 1.84 0.00 2.96 0.00 0.00 2.96 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 40 L 7.72 3.83 0.00 1.16 0.13 0.30 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.30 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 42 A 8.33 3.98 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 43 H 8.29 4.00 0.00 3.33 3.26 0.00 5.79 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.59 4.00 0.00 2.56 2.24 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 2.72 2.70 0.00 45 Y 8.05 3.98 0.00 3.02 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 46 H 8.12 4.09 0.00 3.28 3.21 0.00 5.70 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.02 3.80 0.00 1.88 1.57 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 2.21 2.11 0.00 48 S 8.18 4.28 0.00 4.08 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 49 I 7.52 3.60 1.78 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.32 0.84 0.00 0.00 50 D 8.08 4.27 0.00 2.82 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.17 4.21 0.00 2.17 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 0.00 2.80 2.53 0.00 52 M 8.34 3.99 0.00 2.00 2.27 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.57 0.00 53 K 8.16 4.03 0.00 1.85 1.81 0.00 1.60 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.65 7.81 54 H 8.03 4.32 0.00 3.35 3.33 0.00 5.64 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.29 3.99 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 56 D 8.12 4.27 0.00 2.81 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 57 K 8.04 4.00 0.00 1.99 1.87 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.49 7.81 58 L 8.14 4.02 0.00 1.87 1.73 0.96 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.10 3.70 2.01 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 1.53 1.02 0.92 0.00 0.00 60 E 8.32 4.00 0.00 2.03 2.02 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 2.34 2.55 0.00 61 R 8.16 3.98 0.00 2.10 2.13 0.00 3.32 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.80 0.00 62 I 8.04 3.71 2.03 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 1.54 0.70 0.93 0.00 0.00 63 L 8.07 4.04 0.00 1.97 1.77 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.13 4.30 0.00 3.00 3.30 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 65 L 7.89 3.91 0.00 1.76 1.60 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.79 3.68 0.00 2.03 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 2.16 2.24 0.00 67 G 7.85 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 68 L 8.05 4.58 0.00 1.61 1.60 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.42 0.00 2.04 1.98 0.00 3.65 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 70 N 8.92 4.70 0.00 2.65 2.80 0.00 0.00 7.05 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 71 L 8.35 4.63 0.00 1.61 1.62 0.91 0.94 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 72 Q 8.45 4.09 0.00 1.98 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.48 6.93 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 73 D 8.12 4.54 0.00 2.69 2.62 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 74 L 8.19 4.41 0.00 1.54 1.55 0.91 1.06 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 75 G 8.29 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 76 K 8.33 4.14 0.00 1.70 1.73 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.41 1.51 7.81 77 L 8.37 4.10 0.00 1.63 1.54 0.92 0.97 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 78 L 8.58 4.46 0.00 1.75 1.67 0.95 0.69 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 79 I 8.03 4.29 1.88 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.77 0.90 0.00 0.00 80 G 8.68 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 81 E 8.80 4.78 0.00 2.16 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 0.00 2.47 2.24 0.00 82 N 7.72 5.11 0.00 2.88 2.85 0.00 0.00 6.21 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 83 T 8.54 4.36 4.49 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 1.56 0.00 0.00 84 Q 8.20 3.99 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.92 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 85 E 9.05 4.03 0.00 2.32 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 0.00 2.35 2.48 0.00 86 M 8.73 3.91 0.00 1.29 2.17 0.00 0.00 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.16 0.00 87 L 8.33 4.20 0.00 1.89 1.75 0.81 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 88 Q 8.24 4.03 0.00 2.19 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 89 C 8.59 4.23 0.00 3.29 3.16 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 90 D 8.38 4.69 0.00 3.01 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 91 L 8.13 4.00 0.00 1.90 1.89 0.94 0.45 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 92 N 8.49 4.35 0.00 2.96 2.88 0.00 0.00 6.70 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 93 L 8.05 4.03 0.00 1.93 1.92 0.91 0.97 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 94 E 8.51 4.07 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 2.68 2.52 0.00 95 L 8.15 4.01 0.00 1.85 1.74 0.97 0.48 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 96 K 8.12 3.87 0.00 1.90 1.99 0.00 1.54 0.00 0.00 1.66 0.00 0.00 3.35 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.52 7.81 97 A 8.21 4.04 1.41 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 0.00 0.00 0.00 98 T 8.15 3.93 4.56 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 0.00 0.00 0.00 1.23 0.00 0.00 99 K 8.06 3.92 0.00 1.85 1.98 0.00 1.80 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.50 7.81 100 D 8.08 4.44 0.00 2.92 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 0.00 101 L 7.92 4.02 0.00 1.88 1.72 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.08 3.92 0.00 2.03 1.99 0.00 3.14 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.83 0.00 103 E 8.25 3.99 0.00 2.19 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 2.35 2.51 0.00 104 A 8.08 3.62 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 0.00 105 I 7.96 3.61 2.01 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 1.42 0.91 0.93 0.00 0.00 106 V 7.72 3.57 2.23 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 1.00 0.00 0.00 0.99 0.00 0.00 107 H 8.00 3.98 0.00 3.26 3.29 0.00 5.86 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 C 8.30 3.89 0.00 3.09 3.16 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 0.00 109 E 8.19 3.88 0.00 2.23 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 0.00 2.37 2.45 0.00 110 Q 7.72 3.97 0.00 2.24 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.98 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 111 V 7.14 3.91 1.95 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 0.68 0.00 0.00 0.82 0.00 0.00 112 H 7.54 2.99 0.00 3.14 3.18 0.00 5.66 0.00 0.00 0.00 0.00 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.51 4.51 0.00 2.59 2.45 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 0.00 114 Y 7.63 4.35 0.00 3.07 2.94 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 0.00 115 V 7.79 3.66 2.15 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 1.09 0.00 0.00 1.00 0.00 0.00 116 S 8.39 4.15 0.00 4.03 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 0.00 117 R 8.03 3.90 0.00 1.94 2.22 0.00 3.25 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 118 D 8.30 4.32 0.00 3.04 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 0.00 119 L 7.95 3.94 0.00 1.95 1.82 0.95 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 120 L 8.06 4.03 0.00 1.91 1.71 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 121 K 8.44 3.96 0.00 1.88 1.98 0.00 1.64 0.00 0.00 1.66 0.00 0.00 3.19 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.49 7.81 122 D 8.04 4.38 0.00 2.95 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 0.00 123 I 7.73 3.51 1.98 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.77 0.83 0.00 0.00 124 L 8.14 3.93 0.00 1.81 1.85 0.98 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 125 E 8.26 3.92 0.00 2.11 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 2.33 2.33 0.00 126 S 8.07 4.19 0.00 4.03 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 0.00 127 E 8.52 4.13 0.00 2.17 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 2.60 2.53 0.00 128 E 8.61 4.10 0.00 2.03 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 0.00 2.36 2.57 0.00 129 E 8.30 4.02 0.00 2.26 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 2.37 2.45 0.00 130 H 8.37 4.35 0.00 3.25 3.50 0.00 5.61 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 I 8.01 3.73 2.08 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.54 0.94 0.00 0.00 132 D 8.37 4.32 0.00 2.93 2.94 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 0.00 133 Y 8.15 4.10 0.00 3.18 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 0.00 134 L 8.37 3.78 0.00 1.86 1.68 1.15 0.82 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 0.00 135 E 8.24 3.92 0.00 1.99 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 2.32 2.64 0.00 136 T 7.88 3.79 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 1.17 0.00 0.00 137 Q 7.75 3.85 0.00 1.83 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 1.35 1.91 0.00 138 L 7.83 3.89 0.00 1.90 1.61 0.83 0.96 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 0.00 139 G 8.15 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 0.00 0.00 0.00 140 L 7.82 4.06 0.00 1.88 1.87 0.99 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.43 3.59 1.81 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.08 0.80 0.00 0.00 142 Q 7.41 3.99 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.00 0.00 0.00 0.00 0.00 0.00 2.56 2.50 0.00 143 K 7.97 4.16 0.00 1.74 1.86 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.77 7.81 144 V 8.38 4.22 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 0.78 0.00 0.00 1.11 0.00 0.00 145 G 7.60 4.08 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 0.00 146 L 8.56 3.99 0.00 1.76 1.70 0.97 0.96 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 0.00 147 E 8.10 3.99 0.00 2.06 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 2.40 2.40 0.00 148 N 8.12 4.33 0.00 3.06 2.88 0.00 0.00 6.75 7.48 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 0.00 149 Y 7.96 3.94 0.00 2.99 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 0.00 150 L 8.29 4.10 0.00 1.76 1.74 0.96 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 8.19 3.92 0.00 2.22 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.84 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 152 S 7.87 4.26 0.00 3.77 3.63 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 0.00 153 H 7.54 4.63 0.00 2.94 3.04 0.00 5.81 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 M 8.00 4.17 0.00 1.96 1.94 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.44 0.00 155 H 7.53 5.12 0.00 3.10 3.18 0.00 5.72 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 E 8.71 4.13 0.00 1.95 1.86 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 2.31 2.31 0.00