NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 K 4.3628 8.3144 121.7937 55.6645 34.2937 174.7882 5 T 4.6722 7.6311 112.6398 59.9495 69.5185 172.1760 6 M 4.5075 10.0299 129.5567 54.0095 34.9527 174.7525 7 R 4.6928 8.6136 119.7174 54.0946 33.9102 176.1820 8 V 3.5684 8.6524 121.5384 66.2671 31.2496 177.8434 9 Q 4.2803 8.0359 113.6084 57.6544 28.2461 175.9555 10 D 4.6438 8.7287 119.1546 54.6190 41.4003 174.9702 11 Y 4.7488 7.6944 121.2289 54.7392 40.7569 174.0067 12 P 3.0341 0.0000 0.0000 62.1825 33.2988 177.6631 13 L 4.0995 8.4872 121.8883 57.3416 41.3970 179.6357 14 A 4.0088 7.8225 119.4331 54.4721 18.3624 178.4263 15 T 4.1940 7.5355 109.8630 63.9487 68.4275 176.4224 16 R 4.1679 7.9657 118.9999 58.0498 31.6286 177.0760 17 C 5.2061 7.8286 113.5287 56.6319 29.0493 173.3540 18 P 4.2385 0.0000 0.0000 65.8561 31.8192 179.0944 19 E 3.9283 8.4160 117.0607 60.0125 29.3253 178.6514 20 H 4.4344 7.7913 112.8059 57.0670 28.9525 175.2917 21 I 4.3130 8.1459 122.8530 59.9447 37.1683 174.7601 22 L 4.9958 8.1443 125.0870 52.6066 45.0876 176.9081 23 T 4.1930 8.7734 112.6972 60.4893 69.4941 173.9119 24 P 4.1804 0.0000 0.0000 65.9585 31.3571 177.3579 25 T 4.0818 7.8577 107.2577 62.0052 68.8551 175.8370 26 G 4.0625 8.2848 112.0609 45.4121 0.0000 174.5140 27 K 4.1553 7.6916 119.8908 55.4429 32.8886 175.0583 28 P 4.6779 0.0000 0.0000 61.9521 32.5907 176.7548 29 L 3.9127 8.2627 122.6129 58.6879 41.8986 179.4449 30 T 4.0079 7.8514 106.0996 63.7114 68.6456 174.4535 31 D 4.5023 8.3104 122.0806 56.4229 41.2226 177.1824 32 I 4.1150 7.5873 120.9123 60.0992 35.6101 175.3039 33 T 4.7421 7.5844 114.6180 58.6426 73.4363 174.5932 34 L 3.9547 8.3840 120.9631 58.2221 41.5269 179.2544 35 E 3.9597 8.2432 117.6739 59.8864 29.5124 179.6028 36 K 4.0301 8.2302 117.7971 58.6785 31.9334 179.8506 37 V 3.7452 7.6440 119.2182 65.9869 31.3974 177.9934 38 L 4.0227 8.3267 117.8638 57.8006 41.5000 179.4552 39 S 4.3012 8.1193 113.7238 59.7345 63.1131 175.3546 40 G 4.0254 7.5920 109.0857 44.9144 0.0000 173.9335 41 E 3.9696 8.0515 121.1621 57.9279 29.8346 176.9848 42 V 4.3561 8.1863 119.1097 60.8480 32.9623 174.7927 43 G 4.2684 9.6349 115.5811 41.5481 0.0000 171.6563 44 P 4.2220 0.0000 0.0000 65.8796 31.1071 178.3087 45 Q 4.1216 8.0493 115.4223 57.8124 28.8456 177.3249 46 D 4.5630 8.0779 118.1567 55.4768 42.0231 177.5182 47 V 3.9732 7.1812 120.4526 61.9499 30.0652 174.1204 48 R 4.6830 7.1784 118.9914 54.3996 34.6916 175.0324 49 I 4.2117 8.0058 118.9795 60.0866 39.4794 175.4121 50 S 4.7629 8.0162 120.2824 56.3288 66.4933 175.4013 51 R 3.7921 8.2580 119.1732 59.5526 28.9615 178.3138 52 Q 3.6020 7.9734 120.0880 59.0564 28.8664 178.3254 53 T 3.8965 7.3630 116.0432 66.9636 68.4812 176.5365 54 L 3.8397 7.7276 120.4152 57.5029 41.4389 179.2515 55 E 3.9161 8.0911 119.4874 59.4592 29.5198 178.5635 56 Y 4.4369 7.8268 116.8485 61.4064 37.9152 178.4525 57 Q 4.2161 8.7003 119.1926 58.8375 28.7123 178.8662 58 A 4.2671 8.5273 122.2809 55.3615 18.6169 179.6141 59 Q 4.6477 8.3245 118.1682 58.7441 28.5859 179.2677 60 I 3.7004 8.1067 119.7541 64.2245 37.4339 177.9902 61 A 4.0672 8.4222 122.1704 55.2846 18.4146 179.5120 62 E 3.8629 8.5837 116.2599 59.5078 29.2933 178.4726 63 Q 4.3331 7.7519 115.5233 56.5552 28.5683 175.9180 64 M 4.3760 8.0404 119.8538 54.9253 32.6854 176.5023 65 Q 3.5645 8.1145 114.4687 57.3618 27.4877 175.5473 66 R 4.3413 6.8269 120.2750 55.3911 26.7910 176.6099 67 H 4.1560 7.6459 119.3527 58.6351 29.3856 177.2365 68 A 3.9886 7.9176 122.1957 55.1239 18.1607 179.7212 69 V 3.1521 7.5266 115.9847 65.8086 31.5642 177.8746 70 A 3.8404 7.6919 120.5072 55.2195 18.1874 179.6127 71 R 3.8021 8.3895 117.5811 59.3155 30.0101 178.2436 72 N 4.2109 8.0404 116.9258 56.7208 39.0197 176.7624 73 F 4.5060 8.2366 119.4699 60.9501 38.8133 177.9627 74 R 3.9880 8.1232 116.5039 59.2170 30.0283 178.8327 75 R 3.9861 8.2857 118.4746 59.3351 30.0087 178.4838 76 A 3.9669 8.4443 120.6811 54.8491 17.9418 179.3064 77 A 3.8794 8.0116 119.5287 55.4587 18.1467 179.5764 78 E 4.0980 7.8675 115.6837 58.6924 29.8923 178.4958 79 L 4.1791 7.9229 118.2137 55.2536 41.7546 178.4830 80 I 3.5800 7.0345 118.8493 64.4844 37.2684 177.2192 81 A 4.1319 7.8034 119.3688 54.0700 18.6915 177.7237 82 I 2.4177 6.8205 117.1686 59.5541 37.6492 174.9881 83 P 4.2695 0.0000 0.0000 62.7811 33.0733 177.1130 84 D 4.3171 8.6987 121.0029 57.8681 40.7446 179.3033 85 E 3.9637 8.0720 118.3545 59.3888 29.5165 179.2498 86 R 3.9239 7.7824 118.3307 59.2487 30.1706 178.3986 87 I 3.6397 7.9644 120.0565 64.3814 37.0298 178.3770 88 L 4.0793 8.1580 119.6484 57.7919 41.3555 179.5163 89 A 4.0185 8.1979 120.8370 55.1454 18.0902 179.8260 90 I 3.6835 8.0701 117.9449 64.4779 37.5007 177.6209 91 Y 4.4240 8.2523 120.5124 61.1144 38.6637 178.0792 92 N 3.8826 8.4075 117.1258 56.1372 38.3801 177.2663 93 A 4.0884 7.9935 121.3297 54.6021 18.5057 179.0355 94 L 4.2705 7.6247 116.2771 55.8419 42.4003 177.8580 95 R 4.0048 7.1433 118.8924 54.5970 30.6578 174.0826 96 P 3.4782 0.0000 0.0000 64.5415 31.1913 175.8702 97 F 4.1728 8.8925 119.3174 58.5287 37.4158 177.4240 98 R 4.0103 7.9743 121.0777 58.5745 30.2081 177.0858 99 S 5.1237 7.8704 112.4938 56.6921 65.8100 173.5321 100 S 4.9236 8.7099 117.9731 57.0906 65.8264 175.2543 101 Q 3.8905 8.4861 122.0598 59.3227 28.7665 177.9577 102 A 4.0034 8.0181 121.1970 55.3205 18.3729 179.2181 103 E 3.9330 8.2362 116.8993 59.6705 29.5813 179.6537 104 L 3.9716 7.9062 118.9198 57.7667 41.5437 179.6556 105 L 3.9941 8.1406 118.7964 57.5855 41.5538 179.3023 106 A 4.2678 8.3796 122.5613 54.7332 18.2344 179.7471 107 I 3.7121 8.0449 118.1663 64.4507 37.0781 178.4748 108 A 4.0380 8.0864 121.6150 55.2310 17.7495 179.3615 109 D 4.3599 8.3919 117.7344 57.5029 40.8513 178.6636 110 E 3.9583 8.3483 119.6641 59.2243 29.6007 178.7095 111 L 4.2873 8.3468 119.3437 57.9454 41.7664 179.2339 112 E 3.9516 8.4878 119.2118 59.7017 29.4810 178.2710 113 H 4.4387 8.1881 114.3647 57.4773 29.1781 176.7292 114 T 3.8954 7.7911 116.6901 64.9303 68.8266 175.8480 115 W 4.7036 7.7408 117.4167 56.2764 29.8936 176.1169 116 H 4.8300 8.3164 112.7996 56.1686 26.1873 176.3732 117 A 4.4609 8.5350 124.1943 50.8004 15.3671 178.2308 118 T 3.7725 7.7955 119.4403 64.6446 67.9564 175.3422 119 V 3.6229 8.8528 120.3241 66.1847 31.5956 177.8604 120 N 4.5764 9.2534 116.3174 55.9613 38.2588 177.4015 121 A 4.0019 8.3113 122.3362 55.1348 18.5334 179.4938 122 A 3.9654 8.0450 119.3854 55.1245 18.3942 179.4540 123 F 3.9627 8.6482 119.5866 61.6882 39.4082 177.6522 124 V 3.4607 8.4304 118.1642 65.7452 31.3542 177.8534 125 R 3.7828 8.4024 119.0581 59.3534 29.8313 178.0731 126 E 3.8422 8.5050 119.7105 59.2531 29.5772 178.9161 127 S 3.7065 7.7572 114.1169 61.0526 62.8341 176.2783 128 A 3.7058 7.7718 124.5047 54.7781 18.0491 179.1543 129 E 3.8076 7.8154 117.1461 59.4380 29.7825 178.9899 130 V 3.6014 7.8639 118.3512 66.4964 31.4912 177.5735 131 Y 4.2022 8.7971 116.6501 61.0299 37.1202 178.5012 132 Q 3.9266 8.2808 120.5157 59.4069 29.0170 178.3162 133 Q 4.0665 8.2846 118.1799 58.2909 28.8178 177.8264 134 R 4.4121 8.2742 116.4999 54.9742 31.5261 175.9559 135 H 4.0413 7.4823 113.8141 57.6442 26.3631 174.9411 136 K 4.0561 8.6721 116.2937 55.8411 34.0815 178.3013 137 L 4.6789 7.9559 120.1162 53.9390 42.7627 176.7119 138 R 4.3041 9.1930 122.7021 55.9766 30.5777 176.3042 139 K 3.7042 8.7857 125.4761 59.1004 32.1283 177.2957 140 G 3.9985 9.3754 113.1904 45.7166 0.0000 172.9650 141 S 4.2638 8.5485 119.0820 58.3488 62.2179 174.3165 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 4 K 8.31 4.36 0.00 1.76 1.89 0.00 1.62 0.00 0.00 1.78 0.00 0.00 3.02 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.55 7.81 5 T 7.63 4.67 4.28 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 1.22 0.00 0.00 6 M 10.03 4.51 0.00 1.86 1.97 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.53 0.00 7 R 8.61 4.69 0.00 1.81 1.88 0.00 3.17 0.00 0.00 3.09 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.67 0.00 8 V 8.65 3.57 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 0.95 0.00 0.00 0.90 0.00 0.00 9 Q 8.04 4.28 0.00 2.19 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.73 0.00 0.00 0.00 0.00 0.00 2.33 2.45 0.00 10 D 8.73 4.64 0.00 2.85 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 11 Y 7.69 4.75 0.00 2.94 2.99 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 12 P 0.00 3.03 0.00 1.92 1.32 0.00 3.67 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.82 0.00 13 L 8.49 4.10 0.00 1.69 1.76 1.06 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 14 A 7.82 4.01 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 15 T 7.54 4.19 4.17 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 0.00 0.00 0.00 1.17 0.00 0.00 16 R 7.97 4.17 0.00 1.96 1.94 0.00 3.31 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.96 0.00 17 C 7.83 5.21 0.00 2.91 2.90 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 18 P 0.00 4.24 0.00 2.15 2.09 0.00 3.59 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.28 0.00 19 E 8.42 3.93 0.00 1.88 1.94 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 2.34 2.37 0.00 20 H 7.79 4.43 0.00 3.24 3.48 0.00 5.64 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 I 8.15 4.31 2.02 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 1.36 0.99 0.92 0.00 0.00 22 L 8.14 5.00 0.00 1.59 1.53 0.94 1.00 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 23 T 8.77 4.19 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 24 P 0.00 4.18 0.00 2.18 2.21 0.00 3.75 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.93 0.00 25 T 7.86 4.08 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 1.24 0.00 0.00 26 G 8.28 4.06 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 0.00 0.00 0.00 27 K 7.69 4.16 0.00 1.87 1.73 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.11 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.37 7.81 28 P 0.00 4.68 0.00 2.21 2.16 0.00 3.94 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.94 0.00 29 L 8.26 3.91 0.00 1.64 1.72 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 30 T 7.85 4.01 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 31 D 8.31 4.50 0.00 2.86 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 I 7.59 4.11 1.86 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 1.34 0.34 0.90 0.00 0.00 33 T 7.58 4.74 4.37 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 1.24 0.00 0.00 34 L 8.38 3.95 0.00 1.70 1.76 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.24 3.96 0.00 2.04 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 0.00 2.40 2.48 0.00 36 K 8.23 4.03 0.00 1.93 1.85 0.00 1.93 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.59 1.44 7.81 37 V 7.64 3.75 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.01 0.00 0.00 38 L 8.33 4.02 0.00 1.61 1.72 0.92 1.09 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 39 S 8.12 4.30 0.00 4.01 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 G 7.59 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 0.00 0.00 0.00 41 E 8.05 3.97 0.00 1.96 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 0.00 2.32 2.24 0.00 42 V 8.19 4.36 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 0.82 0.00 0.00 0.97 0.00 0.00 43 G 9.63 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 0.00 0.00 0.00 0.00 44 P 0.00 4.22 0.00 2.21 2.34 0.00 3.70 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 45 Q 8.05 4.12 0.00 2.22 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.84 0.00 0.00 0.00 0.00 0.00 2.41 2.33 0.00 46 D 8.08 4.56 0.00 2.79 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 7.18 3.97 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 0.74 0.00 0.00 0.98 0.00 0.00 48 R 7.18 4.68 0.00 1.73 1.74 0.00 3.27 0.00 0.00 3.12 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.60 0.00 49 I 8.01 4.21 1.79 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.73 0.82 0.00 0.00 50 S 8.02 4.76 0.00 4.03 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 51 R 8.26 3.79 0.00 2.00 2.20 0.00 2.95 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 52 Q 7.97 3.60 0.00 2.03 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.88 0.00 0.00 0.00 0.00 0.00 2.31 1.86 0.00 53 T 7.36 3.90 4.33 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 1.19 0.00 0.00 54 L 7.73 3.84 0.00 1.79 1.65 0.92 0.44 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 55 E 8.09 3.92 0.00 1.95 1.80 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 2.18 2.30 0.00 56 Y 7.83 4.44 0.00 3.25 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 57 Q 8.70 4.22 0.00 2.02 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.59 2.36 0.00 58 A 8.53 4.27 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Q 8.32 4.65 0.00 2.44 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.75 0.00 0.00 0.00 0.00 0.00 2.58 2.64 0.00 60 I 8.11 3.70 2.10 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.70 0.69 0.00 0.00 61 A 8.42 4.07 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 62 E 8.58 3.86 0.00 2.16 2.21 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 2.53 2.37 0.00 63 Q 7.75 4.33 0.00 2.19 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.99 0.00 0.00 0.00 0.00 0.00 2.40 2.56 0.00 64 M 8.04 4.38 0.00 1.90 2.11 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 65 Q 8.11 3.56 0.00 2.21 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.61 7.06 0.00 0.00 0.00 0.00 0.00 2.24 2.45 0.00 66 R 6.83 4.34 0.00 2.01 1.74 0.00 3.04 0.00 0.00 3.08 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.72 0.00 67 H 7.65 4.16 0.00 3.22 3.34 0.00 5.82 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 68 A 7.92 3.99 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 69 V 7.53 3.15 1.93 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 0.22 0.00 0.00 0.75 0.00 0.00 70 A 7.69 3.84 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 71 R 8.39 3.80 0.00 1.89 2.07 0.00 3.13 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 72 N 8.04 4.21 0.00 2.78 2.77 0.00 0.00 7.19 7.32 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 73 F 8.24 4.51 0.00 3.19 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 74 R 8.12 3.99 0.00 1.79 2.01 0.00 3.19 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.95 0.00 75 R 8.29 3.99 0.00 1.94 1.97 0.00 2.74 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 76 A 8.44 3.97 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 77 A 8.01 3.88 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 78 E 7.87 4.10 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.59 0.00 79 L 7.92 4.18 0.00 1.67 1.55 0.82 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 80 I 7.03 3.58 1.83 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.40 0.87 0.00 0.00 81 A 7.80 4.13 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 82 I 6.82 2.42 1.47 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.07 0.15 0.00 0.00 83 P 0.00 4.27 0.00 2.13 1.98 0.00 3.23 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.24 0.00 84 D 8.70 4.32 0.00 2.69 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 85 E 8.07 3.96 0.00 2.07 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 2.41 2.43 0.00 86 R 7.78 3.92 0.00 1.94 1.91 0.00 3.29 0.00 0.00 3.45 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.74 0.00 87 I 7.96 3.64 1.96 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.56 0.85 0.00 0.00 88 L 8.16 4.08 0.00 1.90 1.78 0.94 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 89 A 8.20 4.02 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 90 I 8.07 3.68 2.02 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 1.45 0.76 0.97 0.00 0.00 91 Y 8.25 4.42 0.00 3.03 3.25 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 92 N 8.41 3.88 0.00 2.93 2.78 0.00 0.00 7.00 8.33 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 93 A 7.99 4.09 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 94 L 7.62 4.27 0.00 2.03 1.84 0.88 0.90 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 95 R 7.14 4.00 0.00 1.85 1.70 0.00 2.33 0.00 0.00 2.96 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.11 0.00 96 P 0.00 3.48 0.00 1.42 1.50 0.00 3.77 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.86 0.00 97 F 8.89 4.17 0.00 3.22 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 0.00 98 R 7.97 4.01 0.00 2.05 2.00 0.00 3.24 0.00 0.00 3.35 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.65 0.00 99 S 7.87 5.12 0.00 3.90 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 0.00 100 S 8.71 4.92 0.00 4.06 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 0.00 101 Q 8.49 3.89 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 102 A 8.02 4.00 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 0.00 103 E 8.24 3.93 0.00 2.27 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 2.35 2.37 0.00 104 L 7.91 3.97 0.00 1.80 1.60 0.65 0.64 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 0.00 105 L 8.14 3.99 0.00 1.91 1.71 0.93 0.78 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 0.00 106 A 8.38 4.27 1.38 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 0.00 107 I 8.04 3.71 2.08 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.95 0.97 0.00 0.00 108 A 8.09 4.04 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 D 8.39 4.36 0.00 2.93 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 0.00 110 E 8.35 3.96 0.00 2.10 2.26 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 2.58 2.35 0.00 111 L 8.35 4.29 0.00 1.98 1.96 1.00 0.84 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 0.00 112 E 8.49 3.95 0.00 1.95 1.74 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 1.95 2.25 0.00 113 H 8.19 4.44 0.00 3.07 3.29 0.00 5.89 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 T 7.79 3.90 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 0.23 0.00 0.00 115 W 7.74 4.70 0.00 3.46 3.18 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 0.00 116 H 8.32 4.83 0.00 3.35 3.42 0.00 5.94 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 0.00 117 A 8.53 4.46 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 0.00 118 T 7.80 3.77 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 1.32 0.00 0.00 119 V 8.85 3.62 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.96 0.00 0.00 120 N 9.25 4.58 0.00 2.94 2.88 0.00 0.00 6.94 7.63 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 0.00 121 A 8.31 4.00 1.48 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 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.05 3.97 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 0.00 123 F 8.65 3.96 0.00 3.21 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 0.00 124 V 8.43 3.46 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 1.03 0.00 0.00 1.13 0.00 0.00 125 R 8.40 3.78 0.00 2.17 1.91 0.00 3.20 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 126 E 8.50 3.84 0.00 2.01 1.90 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 2.14 2.23 0.00 127 S 7.76 3.71 0.00 3.22 3.54 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 0.00 0.00 0.00 0.00 128 A 7.77 3.71 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 0.00 129 E 7.82 3.81 0.00 2.02 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 2.38 2.30 0.00 130 V 7.86 3.60 2.27 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 0.97 0.00 0.00 0.96 0.00 0.00 131 Y 8.80 4.20 0.00 3.08 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 0.00 132 Q 8.28 3.93 0.00 2.16 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.54 0.00 133 Q 8.28 4.07 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.60 0.00 134 R 8.27 4.41 0.00 1.78 1.94 0.00 3.51 0.00 0.00 3.24 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.80 0.00 135 H 7.48 4.04 0.00 3.37 3.46 0.00 5.79 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 K 8.67 4.06 0.00 0.81 0.83 0.00 1.06 0.00 0.00 1.30 0.00 0.00 2.97 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.06 0.99 7.81 137 L 7.96 4.68 0.00 1.62 1.78 0.96 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 138 R 9.19 4.30 0.00 1.85 1.93 0.00 3.15 0.00 0.00 3.12 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.63 0.00 139 K 8.79 3.70 0.00 1.72 1.73 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.17 1.14 7.81 140 G 9.38 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 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