NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9670 8.3549 109.7382 45.4189 0.0000 172.7544 2 L 4.2118 8.0570 118.4723 51.5287 42.8024 175.9392 3 S 4.4941 9.7525 118.7949 57.7512 66.1630 174.8149 4 D 4.6732 8.8475 121.9676 57.8340 40.5346 179.5487 5 G 3.6661 8.1120 105.3395 47.8436 0.0000 175.4243 6 E 3.9104 8.2050 121.0169 58.9193 29.3982 179.3304 7 W 4.4426 8.2159 119.2439 59.9940 29.0959 178.3123 8 Q 4.0612 8.4633 119.3716 59.2926 28.4088 178.2931 9 Q 4.0373 8.2555 119.0513 58.9499 28.6980 178.8853 10 V 3.6894 8.1740 119.5086 66.3581 31.4931 178.1570 11 L 4.1981 8.4878 118.4451 57.1787 41.1876 179.1209 12 N 4.3364 8.1336 116.9354 56.6775 39.2975 176.4990 13 V 3.7126 8.0962 119.9743 66.0546 31.5210 177.7267 14 W 4.1788 8.7238 128.1253 60.2653 30.2165 177.8225 15 G 3.7426 7.7404 105.2981 47.8874 0.0000 175.2686 16 K 3.9541 7.8944 120.5623 59.2354 32.1475 179.5948 17 V 2.6976 6.9269 117.7841 65.6448 31.1168 177.7137 18 E 3.8704 7.6050 116.7232 58.6612 29.2802 178.7245 19 A 4.1987 7.3446 120.2408 53.8383 20.0706 177.6516 20 D 4.6563 7.6982 116.2594 52.0733 42.7215 175.1091 21 I 3.5625 7.9071 123.8947 63.7835 38.5273 176.5202 22 A 4.1473 7.4574 122.4949 54.5137 18.2485 179.7106 23 G 3.7733 8.2752 105.4045 47.7838 0.0000 175.7198 24 H 4.1308 8.3292 119.1853 58.2601 28.7202 178.1239 25 G 3.5546 8.3137 107.8567 47.8073 0.0000 175.2486 26 Q 3.8653 8.3198 122.9429 59.0585 28.9647 178.5830 27 E 3.8792 8.1126 119.3515 59.0789 29.3218 179.4864 28 V 3.5058 7.8796 118.5069 66.0040 31.5575 178.1631 29 L 3.3762 7.6696 118.5099 57.5902 41.3210 179.4614 30 I 3.5667 7.7054 120.0699 64.2855 37.0158 178.3659 31 R 3.7744 8.0285 119.5766 59.2470 29.9164 178.1768 32 L 3.9188 7.8711 120.1906 58.4201 41.9641 179.0909 33 F 4.6082 8.1231 118.2820 60.7156 38.6108 177.9445 34 T 4.0514 8.0846 109.0400 64.7307 68.8615 176.9143 35 G 3.6232 7.9025 107.4905 46.2729 0.0000 173.7681 36 H 4.7712 7.9770 117.7053 52.2375 30.1343 171.9563 37 P 4.5860 0.0000 0.0000 64.4804 31.3638 177.5338 38 E 4.1194 8.2739 116.3921 59.4581 29.3352 179.1725 39 T 3.9040 8.1466 111.4552 64.5378 68.7941 176.2649 40 L 3.5436 7.8498 122.9608 57.9306 41.7875 178.6781 41 E 4.1076 7.8055 117.0991 58.4823 29.4605 178.6302 42 K 4.4644 8.0745 117.4460 56.7046 32.6646 176.6704 43 F 4.6215 8.1673 119.0633 55.3307 39.2532 175.5954 44 D 4.4187 8.6826 127.4149 57.1350 40.7792 179.1174 45 K 3.8639 7.8022 115.6003 58.0954 33.1078 177.0968 46 F 5.0450 7.8760 117.5227 57.0116 40.2969 176.7365 47 K 4.1436 7.6164 119.9072 58.7477 32.5687 177.8711 48 H 4.3130 8.0531 114.7090 57.6645 28.9126 175.3407 49 L 4.0652 7.3507 119.8071 54.7392 40.1246 176.6684 50 K 4.2061 9.3600 125.1552 57.9289 32.7915 178.1680 51 T 4.7423 7.5398 107.8973 58.9102 73.2672 174.2657 52 E 3.9376 8.6776 121.4285 59.0905 29.6084 178.8258 53 A 3.9444 7.9407 120.5846 55.2830 18.3160 179.2182 54 E 3.9333 7.9617 115.5526 59.7175 29.8073 179.2852 55 M 4.1241 7.9498 118.6283 58.4543 31.8997 178.6559 56 K 3.8524 8.3342 118.2593 59.0876 32.3679 177.5587 57 A 4.5653 7.6928 118.1006 51.0362 19.2138 176.7417 58 S 4.4220 7.6314 114.3665 57.3312 62.6555 174.7573 59 E 4.0854 8.7724 128.5264 59.2074 29.2373 178.6079 60 D 4.4355 8.1544 117.9686 56.9221 41.2869 177.8751 61 L 3.6428 7.9908 121.0530 57.8239 42.0432 178.8328 62 K 3.8690 7.8335 119.6410 59.1775 32.1366 178.4999 63 K 3.8995 8.3074 120.1089 60.0062 32.0676 178.1021 64 H 4.3694 8.7765 118.7276 59.1736 29.7118 177.1299 65 G 3.7091 8.3650 107.7369 48.2772 0.0000 175.4942 66 T 3.8697 8.0068 118.4759 66.2837 68.4951 176.6500 67 V 3.7085 7.8166 119.8856 66.0350 31.5656 178.1615 68 V 3.5939 8.0058 118.0498 66.2601 31.4086 178.0707 69 L 4.3091 8.2386 118.6568 57.8306 41.4642 179.5739 70 T 4.0116 8.2594 115.9020 66.5345 68.3704 176.5200 71 A 4.0053 8.1093 122.7427 55.0041 18.4541 179.3981 72 L 3.6911 8.0695 119.0328 58.1163 42.1451 179.3934 73 G 3.1250 8.4993 106.1688 47.4203 0.0000 175.7442 74 G 3.6296 7.8496 107.0932 47.5639 0.0000 175.3709 75 I 3.8396 7.5600 122.5536 64.1710 37.1537 178.5024 76 L 3.9603 7.9521 119.9145 57.7202 41.1812 179.5507 77 K 3.9797 7.6531 116.5667 58.1732 32.2636 178.6473 78 K 3.9523 7.9020 118.4385 55.9244 32.7101 176.4832 79 K 2.0000 8.2519 118.3880 56.3649 29.7281 175.8302 80 G 3.8667 7.6939 105.8049 45.7924 0.0000 173.6933 81 H 4.5352 7.3466 119.2614 55.2674 27.4694 174.8519 82 H 5.5239 7.3258 110.7994 54.0515 29.8732 175.8127 83 E 3.9059 8.6774 122.2452 60.3168 28.9746 178.7444 84 A 3.9935 7.9186 118.4169 55.0988 18.8832 178.9909 85 E 4.0999 8.0515 116.7051 59.3559 29.7516 178.9736 86 L 3.9431 8.4391 120.8360 57.5530 42.0682 178.3890 87 K 3.7986 8.2364 120.2237 59.3178 32.0110 176.7892 88 P 4.2411 0.0000 0.0000 65.7925 31.0949 178.2883 89 L 4.0028 7.4829 116.1283 57.5226 41.6089 178.9099 90 A 4.0939 8.2738 121.1464 55.6690 18.1777 179.8095 91 Q 3.9117 8.3639 116.6281 59.1109 28.7441 179.1613 92 S 3.9938 8.4803 115.7599 61.7413 62.9852 176.2613 93 H 4.2055 8.6007 119.6449 58.1147 28.4749 177.7238 94 A 2.5800 7.8568 122.6345 54.8240 18.0048 179.7268 95 T 3.7968 7.4780 112.6818 65.4373 68.8405 176.2611 96 K 4.0718 7.4284 119.9596 58.8578 32.7981 177.2796 97 H 4.3236 8.0412 114.3392 56.1124 29.3916 175.4888 98 K 3.6015 7.3890 116.7474 56.1614 29.0198 176.6076 99 I 4.2403 8.2563 119.7252 58.9431 37.5243 175.0177 100 P 4.4918 0.0000 0.0000 62.3176 31.9546 177.3060 101 I 3.5810 8.6195 119.6341 64.1703 37.6215 177.7822 102 K 3.5712 8.0740 120.0682 60.0372 31.7797 178.0403 103 Y 4.1464 8.0784 116.6612 60.9184 37.7596 178.3564 104 L 4.2068 7.8999 119.7925 57.4228 41.7996 178.7367 105 E 3.9591 8.1922 119.4307 59.3776 29.5157 178.6500 106 F 4.4993 8.1217 117.9628 61.1119 39.0246 177.7269 107 I 3.8416 8.1599 117.7301 63.7483 37.7375 177.9813 108 S 4.2054 8.3140 116.4064 61.8113 62.6854 176.3180 109 D 4.4307 8.3287 121.1227 57.3898 40.5112 178.6441 110 A 4.0455 8.3455 121.3545 55.3489 18.2778 179.7752 111 I 3.6723 8.0365 118.1974 64.5535 37.3184 178.6810 112 I 3.8505 7.8187 120.6189 64.6513 36.8922 177.8652 113 H 4.1722 8.4932 119.0548 59.4592 29.6678 177.3521 114 V 3.4899 8.1317 120.2663 65.9129 31.2578 177.9222 115 L 3.8164 8.0367 118.7903 58.0957 41.2741 179.2093 116 H 4.3425 8.1145 115.7783 59.0068 28.4330 177.8776 117 S 4.1326 8.0934 114.1615 61.1903 62.3218 175.8738 118 K 4.0979 8.1401 119.8877 57.6355 33.1468 176.6872 119 H 4.9706 8.0707 116.1666 53.7569 29.3386 172.0771 120 P 4.5286 0.0000 0.0000 63.7066 31.8056 177.3525 121 G 3.9712 9.1690 110.6369 45.7294 0.0000 172.8101 122 D 4.9248 8.4518 117.5041 53.5417 41.6918 175.8459 123 F 4.9471 7.9860 119.9261 54.9193 39.7161 174.9695 124 G 3.7948 8.2196 112.9480 43.3740 0.0000 170.9355 125 A 3.8834 8.4504 122.4320 55.1799 18.2766 179.7764 126 D 4.2166 8.0052 116.6941 56.5554 39.4001 178.4498 127 A 4.0075 7.8351 121.8711 54.7372 18.4222 179.0601 128 Q 3.6488 7.8410 118.5268 59.1450 29.0077 178.6468 129 G 3.6501 8.0261 106.4106 47.8675 0.0000 175.4595 130 A 3.8316 8.0331 123.3351 54.9709 18.3980 179.2326 131 M 4.0145 8.4179 117.1686 59.1704 32.1915 178.4925 132 T 3.8888 8.3196 116.0414 66.6818 68.5991 176.4241 133 K 3.7721 8.1033 120.1144 59.6113 32.0961 179.1597 134 A 3.8512 7.9231 120.5759 55.1990 18.2967 179.7200 135 L 4.0534 8.2550 117.8401 58.0067 41.6561 179.6933 136 E 4.0207 8.5594 118.8740 59.0119 29.3021 178.9438 137 L 3.9377 8.2399 120.7716 58.1946 42.2003 178.4554 138 F 4.1151 8.3554 120.4360 61.6716 39.1797 177.0375 139 R 3.6106 8.3280 117.9531 59.4253 29.9032 178.0387 140 N 4.2402 8.7516 117.1184 56.7535 38.8203 176.6855 141 D 4.3527 8.4140 120.7645 57.1541 40.7903 178.7996 142 I 3.4231 7.5133 120.1989 64.1961 36.9993 178.2467 143 A 3.7316 8.0156 121.6722 54.9280 18.1414 179.4599 144 A 3.9366 7.9589 119.2414 55.4425 18.5096 180.0972 145 K 4.0355 7.8379 117.0380 59.7262 31.9843 179.2794 146 Y 4.3192 8.4580 117.6843 60.9344 37.7920 178.4519 147 K 3.9656 8.4247 120.7413 59.3378 32.1076 178.1595 148 E 3.9426 8.0254 118.5865 59.6380 29.6188 178.6236 149 L 4.2775 7.8860 115.9342 54.8456 41.8713 177.4457 150 G 3.8377 7.8394 106.7190 46.3028 0.0000 173.0636 151 F 4.4105 8.3409 122.3418 57.5103 40.1247 175.6281 152 Q 3.4928 7.9678 125.7084 56.2732 28.1941 173.2691 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 G 8.35 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 2 L 8.06 4.21 0.00 0.28 0.64 0.51 -0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.75 4.49 0.00 4.01 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 4 D 8.85 4.67 0.00 2.77 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 5 G 8.11 3.67 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 0.00 0.00 0.00 6 E 8.20 3.91 0.00 2.06 1.70 0.00 0.00 0.00 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 2.27 0.00 7 W 8.22 4.44 0.00 3.50 3.17 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 0.00 8 Q 8.46 4.06 0.00 2.31 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 9 Q 8.26 4.04 0.00 2.33 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.55 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 10 V 8.17 3.69 2.50 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 1.26 0.00 0.00 0.85 0.00 0.00 11 L 8.49 4.20 0.00 1.82 1.79 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.13 4.34 0.00 2.88 3.04 0.00 0.00 7.11 7.26 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 13 V 8.10 3.71 2.34 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 0.77 0.00 0.00 1.15 0.00 0.00 14 W 8.72 4.18 0.00 3.63 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 15 G 7.74 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.89 3.95 0.00 1.61 1.51 0.00 1.43 0.00 0.00 1.14 0.00 0.00 3.11 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.33 1.40 7.81 17 V 6.93 2.70 0.67 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 0.04 0.00 0.00 0.15 0.00 0.00 18 E 7.61 3.87 0.00 1.86 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 2.30 2.16 0.00 19 A 7.34 4.20 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 7.70 4.66 0.00 2.73 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 I 7.91 3.56 1.79 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 1.57 1.30 0.89 0.00 0.00 22 A 7.46 4.15 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 23 G 8.28 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 24 H 8.33 4.13 0.00 3.30 3.22 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 25 G 8.31 3.55 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 0.00 0.00 0.00 26 Q 8.32 3.87 0.00 2.07 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.75 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 27 E 8.11 3.88 0.00 1.97 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 2.25 2.41 0.00 28 V 7.88 3.51 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 1.10 0.00 0.00 0.94 0.00 0.00 29 L 7.67 3.38 0.00 1.50 0.80 0.83 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 30 I 7.71 3.57 1.77 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 1.33 0.66 0.86 0.00 0.00 31 R 8.03 3.77 0.00 1.94 2.11 0.00 3.04 0.00 0.00 2.95 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 32 L 7.87 3.92 0.00 1.76 1.46 1.07 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.12 4.61 0.00 2.98 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 T 8.08 4.05 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 1.22 0.00 0.00 35 G 7.90 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 H 7.98 4.77 0.00 3.02 3.03 0.00 5.63 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 37 P 0.00 4.59 0.00 2.15 2.10 0.00 3.84 0.00 0.00 3.59 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 38 E 8.27 4.12 0.00 2.31 2.31 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 2.28 2.58 0.00 39 T 8.15 3.90 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 0.74 0.00 0.00 40 L 7.85 3.54 0.00 1.57 1.71 -0.18 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.81 4.11 0.00 2.16 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 0.00 2.39 2.54 0.00 42 K 8.07 4.46 0.00 1.92 1.72 0.00 1.89 0.00 0.00 1.77 0.00 0.00 3.18 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.74 2.01 7.81 43 F 8.17 4.62 0.00 3.21 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 D 8.68 4.42 0.00 2.66 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 45 K 7.80 3.86 0.00 1.61 1.72 0.00 1.35 0.00 0.00 1.49 0.00 0.00 2.85 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.64 0.21 7.81 46 F 7.88 5.05 0.00 2.76 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.62 4.14 0.00 1.69 1.96 0.00 1.62 0.00 0.00 1.78 0.00 0.00 3.01 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.66 1.40 7.81 48 H 8.05 4.31 0.00 3.28 3.51 0.00 5.72 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 49 L 7.35 4.07 0.00 1.62 1.62 0.79 0.75 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 50 K 9.36 4.21 0.00 1.83 1.86 0.00 1.65 0.00 0.00 1.83 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.59 1.52 7.81 51 T 7.54 4.74 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 1.21 0.00 0.00 52 E 8.68 3.94 0.00 2.04 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 2.35 2.35 0.00 53 A 7.94 3.94 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 54 E 7.96 3.93 0.00 2.14 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 2.37 2.36 0.00 55 M 7.95 4.12 0.00 2.05 2.26 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.53 0.00 56 K 8.33 3.85 0.00 1.77 1.97 0.00 1.63 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.49 7.81 57 A 7.69 4.57 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 58 S 7.63 4.42 0.00 4.04 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 59 E 8.77 4.09 0.00 2.05 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 2.32 0.00 60 D 8.15 4.44 0.00 2.91 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 61 L 7.99 3.64 0.00 1.42 1.65 0.73 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.83 3.87 0.00 1.79 1.94 0.00 1.85 0.00 0.00 1.57 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.43 7.81 63 K 8.31 3.90 0.00 2.00 2.11 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.52 7.81 64 H 8.78 4.37 0.00 3.66 3.69 0.00 5.85 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 65 G 8.36 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 T 8.01 3.87 4.45 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 1.23 0.00 0.00 67 V 7.82 3.71 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 1.06 0.00 0.00 1.03 0.00 0.00 68 V 8.01 3.59 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 1.05 0.00 0.00 0.93 0.00 0.00 69 L 8.24 4.31 0.00 1.78 1.84 0.82 0.86 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 70 T 8.26 4.01 4.46 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 1.26 0.00 0.00 71 A 8.11 4.01 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 72 L 8.07 3.69 0.00 1.60 1.79 0.11 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.50 3.12 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 74 G 7.85 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 0.00 0.00 0.00 75 I 7.56 3.84 1.90 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.00 0.99 0.00 0.00 76 L 7.95 3.96 0.00 1.19 1.53 -0.15 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.65 3.98 0.00 1.77 1.78 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.15 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.46 7.81 78 K 7.90 3.95 0.00 1.82 1.79 0.00 1.74 0.00 0.00 1.59 0.00 0.00 2.86 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.58 1.73 7.81 79 K 8.25 2.00 0.00 1.16 0.74 0.00 1.43 0.00 0.00 1.55 0.00 0.00 2.81 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.58 1.03 7.81 80 G 7.69 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 81 H 7.35 4.54 0.00 3.17 3.23 0.00 5.79 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.33 5.52 0.00 3.27 3.41 0.00 5.67 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.68 3.91 0.00 2.12 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 2.39 2.48 0.00 84 A 7.92 3.99 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 85 E 8.05 4.10 0.00 2.25 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 2.39 2.43 0.00 86 L 8.44 3.94 0.00 1.67 1.70 0.63 0.42 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 87 K 8.24 3.80 0.00 1.98 1.82 0.00 1.85 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.48 7.81 88 P 0.00 4.24 0.00 2.33 2.31 0.00 3.80 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 2.26 2.08 0.00 89 L 7.48 4.00 0.00 1.98 1.76 1.05 0.75 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 90 A 8.27 4.09 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 91 Q 8.36 3.91 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.55 0.00 92 S 8.48 3.99 0.00 3.90 4.11 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 93 H 8.60 4.21 0.00 3.51 3.58 0.00 5.81 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 94 A 7.86 2.58 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 7.48 3.80 4.16 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 1.11 0.00 0.00 96 K 7.43 4.07 0.00 1.53 1.57 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.25 1.35 7.81 97 H 8.04 4.32 0.00 3.01 3.15 0.00 5.86 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 98 K 7.39 3.60 0.00 1.92 1.99 0.00 1.83 0.00 0.00 2.45 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.34 7.81 99 I 8.26 4.24 2.11 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 1.55 0.95 1.20 0.00 0.00 100 P 0.00 4.49 0.00 1.92 1.89 0.00 2.87 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 1.39 0.00 101 I 8.62 3.58 1.86 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.08 0.88 0.00 0.00 102 K 8.07 3.57 0.00 1.75 1.64 0.00 1.64 0.00 0.00 1.75 0.00 0.00 3.16 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.35 0.52 7.81 103 Y 8.08 4.15 0.00 3.21 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 0.00 104 L 7.90 4.21 0.00 1.82 1.79 0.74 1.03 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 0.00 105 E 8.19 3.96 0.00 1.99 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 2.40 2.40 0.00 106 F 8.12 4.50 0.00 3.28 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 I 8.16 3.84 2.04 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.40 1.13 0.00 0.00 108 S 8.31 4.21 0.00 4.17 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 0.00 109 D 8.33 4.43 0.00 3.04 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 0.00 110 A 8.35 4.05 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 0.00 111 I 8.04 3.67 2.09 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 1.57 0.79 0.99 0.00 0.00 112 I 7.82 3.85 2.15 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.55 1.16 0.00 0.00 113 H 8.49 4.17 0.00 3.31 3.52 0.00 5.79 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.13 3.49 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 0.97 0.00 0.00 1.03 0.00 0.00 115 L 8.04 3.82 0.00 1.24 0.47 0.51 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.11 4.34 0.00 3.44 3.39 0.00 5.62 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 8.09 4.13 0.00 3.68 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 8.14 4.10 0.00 1.53 1.48 0.00 1.61 0.00 0.00 1.24 0.00 0.00 2.53 0.00 0.00 2.34 0.00 0.00 0.00 0.00 1.26 1.41 7.81 119 H 8.07 4.97 0.00 3.23 3.20 0.00 5.62 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.53 0.00 2.19 2.09 0.00 3.47 0.00 0.00 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.92 0.00 121 G 9.17 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 0.00 122 D 8.45 4.92 0.00 2.62 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 0.00 123 F 7.99 4.95 0.00 2.75 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 0.00 124 G 8.22 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 0.00 125 A 8.45 3.88 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 0.00 126 D 8.01 4.22 0.00 2.95 2.91 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 0.00 127 A 7.84 4.01 1.55 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 0.00 0.00 128 Q 7.84 3.65 0.00 1.13 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.70 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 129 G 8.03 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 0.00 130 A 8.03 3.83 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 0.00 131 M 8.42 4.01 0.00 2.43 2.34 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.79 0.00 132 T 8.32 3.89 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 133 K 8.10 3.77 0.00 1.80 1.68 0.00 1.58 0.00 0.00 1.50 0.00 0.00 2.79 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.52 7.81 134 A 7.92 3.85 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 0.00 135 L 8.25 4.05 0.00 1.89 1.81 1.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.56 4.02 0.00 2.15 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 2.35 2.48 0.00 137 L 8.24 3.94 0.00 1.89 2.00 0.99 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.36 4.12 0.00 3.14 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 R 8.33 3.61 0.00 2.12 2.02 0.00 3.16 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 140 N 8.75 4.24 0.00 2.93 2.78 0.00 0.00 7.26 8.41 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 0.00 141 D 8.41 4.35 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 0.00 142 I 7.51 3.42 1.47 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.12 0.12 0.00 0.00 143 A 8.02 3.73 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 A 7.96 3.94 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 0.00 145 K 7.84 4.04 0.00 1.94 1.94 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.64 1.61 7.81 146 Y 8.46 4.32 0.00 3.14 3.09 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 0.00 147 K 8.42 3.97 0.00 1.86 1.97 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.46 7.81 148 E 8.03 3.94 0.00 2.14 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 2.35 2.39 0.00 149 L 7.89 4.28 0.00 1.84 1.68 0.89 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 150 G 7.84 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 0.00 151 F 8.34 4.41 0.00 2.71 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 0.00 152 Q 7.97 3.49 0.00 1.24 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.86 6.42 0.00 0.00 0.00 0.00 0.00 1.69 2.00 0.00