NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 G 3.8901 8.3393 109.7366 45.6007 0.0000 174.4579 20 S 4.2970 7.7766 113.3801 57.2553 64.4887 171.9770 21 S 4.5659 8.9530 117.2114 57.8015 67.4474 174.9295 22 I 5.1724 8.2612 125.2414 59.8213 40.9537 174.9174 23 T 4.2561 8.3831 116.5306 61.8618 70.4573 175.0302 24 T 3.3674 8.6415 114.9808 64.4117 64.9014 170.1562 25 P 4.3428 0.0000 0.0000 64.4612 32.6684 175.9152 26 E 4.4438 7.7755 120.7837 54.9861 30.5756 175.2388 27 E 4.8372 9.2949 127.0144 55.0947 34.1337 173.6451 28 M 5.2589 8.5040 122.0140 53.8271 35.8478 174.5589 29 I 4.5818 9.6009 125.7049 59.4143 40.4692 174.3303 30 E 5.2212 8.8791 126.0013 54.5916 31.9815 175.4836 31 K 4.7943 9.1087 122.6403 54.4028 37.5157 175.4071 32 A 4.4383 8.6400 123.6516 51.1893 19.6609 177.1389 33 K 3.7999 8.1246 122.6348 58.3292 32.8950 176.7119 34 G 4.5933 8.6442 113.4363 45.0301 0.0000 173.5053 35 E 4.5452 7.9657 118.8168 56.0794 31.2209 176.0897 36 T 5.2801 8.5939 117.9630 62.7169 69.7820 174.2024 37 A 4.5337 8.4047 128.2048 50.4604 20.6891 175.1923 38 Y 4.3855 8.6060 124.4639 57.7160 40.0583 174.8127 39 L 4.5398 7.8061 126.5757 52.1244 44.2296 173.6205 40 P 4.6674 0.0000 0.0000 62.2864 32.9323 176.6411 41 C 4.8495 10.0594 121.2785 55.4731 39.2954 172.9796 42 K 5.0149 8.8129 126.3774 54.4860 34.0281 174.5069 43 F 4.9456 8.2416 123.6221 55.9526 39.3797 176.0479 44 T 4.2782 8.4071 118.1474 63.3876 69.2204 174.1355 45 L 5.0766 8.2454 124.1278 53.3141 44.4139 176.2031 46 S 4.6593 8.8437 114.4645 56.5387 65.8574 173.9376 47 P 4.3813 0.0000 0.0000 65.6229 31.3733 177.3802 48 E 4.0963 7.6395 118.6801 59.0391 29.8931 177.4063 49 D 5.0088 8.1078 119.4274 54.0600 35.6025 176.4740 50 Q 4.3166 8.1542 121.2490 57.4348 30.0329 176.8863 51 G 3.8759 8.8945 107.9064 44.9562 0.0000 172.1652 52 P 4.5413 0.0000 0.0000 62.7365 32.7400 175.5503 53 L 4.4454 8.3967 122.6017 54.7689 42.3546 175.9194 54 D 5.2958 8.7728 122.2317 52.9031 45.4289 173.9825 55 I 5.1212 9.0527 123.5939 59.8577 41.9327 173.8320 56 E 5.1972 9.5506 125.9932 54.5513 34.0463 174.1984 57 W 6.1918 9.0273 124.1035 54.5862 33.4035 174.0002 58 L 5.1799 8.7375 124.4607 52.9151 44.6894 175.2527 59 I 4.6095 8.5818 121.9704 59.1920 41.6153 174.2913 60 S 4.5450 8.9371 125.1831 56.0738 65.5826 171.5398 61 P 5.3478 0.0000 0.0000 61.2237 31.4931 177.4645 62 A 4.0244 8.8268 128.8657 55.3475 18.6995 178.2775 63 D 4.4334 8.0611 114.4446 57.0632 41.0969 176.6330 64 N 4.7152 7.5631 116.1415 52.5511 39.8055 175.7304 65 Q 3.9241 8.4263 120.4571 57.9716 29.1227 177.4242 66 K 4.2312 7.1521 117.2077 56.5830 32.6344 177.0696 67 V 4.2081 8.1274 113.6722 61.6086 35.3807 173.2337 68 D 4.3077 9.0637 125.8159 54.7495 38.0138 172.4738 69 Q 4.5304 8.3469 119.4789 53.4311 33.1343 175.0517 70 V 4.0418 8.3202 121.7370 62.8846 32.2678 175.4265 71 I 4.4549 8.0390 117.5290 60.4409 39.8388 175.6927 72 I 4.8322 7.3026 120.2296 59.0391 40.9917 173.9570 73 L 5.6330 9.8055 128.0746 53.6873 47.0929 175.0585 74 Y 4.6929 10.0647 122.0362 56.3587 41.4367 173.7454 75 S 4.7454 7.9298 120.9171 56.8310 66.8041 173.6910 76 G 4.0094 9.4787 110.5782 46.7260 0.0000 174.3103 77 D 4.1830 8.0610 115.8778 53.9558 38.7952 173.9361 78 K 3.8519 7.4427 120.6790 54.3280 32.4297 175.5886 79 I 3.8666 7.7490 125.2818 60.2064 38.4891 174.2816 80 Y 5.2188 9.3609 127.6460 56.8870 39.6647 174.3545 81 D 4.7820 8.9900 126.1672 54.5189 46.1383 177.5344 82 D 4.4844 8.1100 118.6070 54.9539 40.0387 177.1086 83 Y 4.1004 7.9030 116.6812 60.3996 38.1995 175.1498 84 Y 4.2869 8.0088 117.6098 56.4838 38.2584 173.0562 85 P 4.3029 0.0000 0.0000 65.7279 31.6574 175.8930 86 D 4.4975 8.1832 119.2562 55.2737 40.0832 175.9540 87 L 3.8490 8.7364 124.1169 55.0100 38.8941 174.8032 88 K 4.6476 7.0393 117.2701 58.1711 32.6342 177.1281 89 G 4.0516 9.4882 110.1793 45.5128 0.0000 173.1583 90 R 5.0863 8.2307 115.1079 56.6618 32.6686 176.0218 91 V 3.9928 7.7564 121.7234 60.4790 29.7774 173.1492 92 H 4.8891 9.4769 126.5398 53.8337 31.5922 173.9030 93 F 5.8387 8.7864 122.2470 57.1865 39.3838 176.5057 94 T 4.1193 9.0162 114.2419 63.2424 69.0912 174.3952 95 S 4.5285 7.6654 119.3771 57.8325 63.1066 173.6829 96 N 4.7905 8.7443 122.2249 53.4234 38.4523 175.4591 97 D 4.8172 7.4327 118.4762 53.0152 42.2275 175.7372 98 L 4.6725 7.7081 121.1180 57.1866 42.2537 179.8118 99 K 4.2339 8.0225 116.0507 58.0340 31.9201 177.3132 100 S 4.3236 7.7688 113.2292 58.1345 63.5138 174.9553 101 G 2.4668 8.0725 110.2661 44.8042 0.0000 172.7514 102 D 4.9051 7.5976 120.2214 52.9350 41.7336 176.1549 103 A 4.6174 9.0149 125.1861 51.4526 20.3921 176.2716 104 S 4.7581 8.2991 114.0601 59.5382 64.3900 173.4104 105 I 4.9280 8.3279 116.8567 58.9545 40.4533 173.9348 106 N 5.1734 9.7151 123.8123 51.2343 40.5117 173.5856 107 V 4.6091 8.5681 121.5902 61.7162 33.2028 175.0983 108 T 4.3077 8.7145 119.2400 61.5249 70.3320 174.1119 109 N 5.0156 8.4022 118.7381 52.6285 35.8756 172.6942 110 L 4.0703 7.2947 118.9533 54.2606 43.1284 176.5263 111 Q 4.6880 7.8764 117.2637 55.7179 31.6435 174.2811 112 L 4.0335 8.1554 121.9164 58.1104 41.7528 179.8137 113 S 4.3732 7.9392 112.2660 60.5100 62.8444 175.0917 114 D 4.5398 8.0344 120.5934 56.4907 41.1097 176.6169 115 I 3.9251 7.4245 119.8600 61.8175 37.8301 173.8270 116 G 4.8979 8.1012 107.8912 44.5632 0.0000 172.9856 117 T 4.2701 8.2455 119.6910 64.0496 69.7497 172.6431 118 Y 5.2776 10.0282 124.2530 56.2374 41.6195 174.4099 119 Q 4.7720 9.2939 124.8813 54.5098 31.9066 173.3313 120 C 3.6827 8.8159 128.3022 54.6618 40.5120 172.5555 121 K 5.3089 8.8485 127.6479 53.8667 34.6782 175.8952 122 V 4.3406 8.0772 126.5330 61.5180 32.9391 174.5313 123 K 4.6342 8.6710 131.5224 55.0791 33.5395 175.6600 124 K 5.0545 8.8758 129.2746 54.1646 34.8340 174.7882 125 A 4.3527 8.7291 129.7431 51.5653 19.2818 175.8290 126 P 4.8982 0.0000 0.0000 61.7340 30.7736 177.6541 127 G 3.8509 9.0990 110.6687 45.1069 0.0000 171.6423 128 V 4.3828 8.3038 119.9828 59.9991 32.5931 175.7382 129 A 4.8407 9.4589 129.4770 50.4211 21.2399 175.4589 130 N 5.4697 8.4383 118.2382 51.3140 40.4243 173.7822 131 K 4.6714 9.2729 121.1296 55.3982 36.9370 174.8248 132 K 5.0026 9.0436 120.8124 55.1041 34.6985 175.9375 133 I 4.9022 9.3036 124.5232 60.3295 41.4153 173.7219 134 H 5.4102 9.1656 125.7369 54.1780 30.8893 173.9786 135 L 4.9261 8.7703 126.6631 54.1873 43.4201 175.3130 136 V 4.7030 9.3821 127.2287 61.0885 34.2442 174.0504 137 V 4.7227 8.4050 127.8335 61.4603 32.8281 175.3047 138 L 4.4624 8.9295 128.2714 53.9098 43.4017 176.4862 139 V 3.9764 8.2555 121.5078 62.6534 32.1321 175.3094 140 K 4.3438 8.2759 124.4041 55.1231 34.7301 172.5117 141 P 4.2767 0.0000 0.0000 62.7812 30.6156 175.4622 142 S 3.3861 7.9221 109.5312 58.4880 63.0253 175.3382 143 G 3.9323 8.2214 114.6456 45.3910 0.0000 173.1604 144 A 4.2109 7.6780 125.8229 51.8716 18.8016 176.6165 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 19 G 8.34 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 20 S 7.78 4.30 0.00 4.08 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 21 S 8.95 4.57 0.00 3.77 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 22 I 8.26 5.17 1.87 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 1.43 0.58 0.92 0.00 0.00 23 T 8.38 4.26 4.25 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 1.21 0.00 0.00 24 T 8.64 3.37 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 1.23 0.00 0.00 25 P 0.00 4.34 0.00 2.20 2.16 0.00 3.69 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 2.06 1.94 0.00 26 E 7.78 4.44 0.00 1.99 1.88 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 2.25 2.26 0.00 27 E 9.29 4.84 0.00 1.97 1.92 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 2.22 2.30 0.00 28 M 8.50 5.26 0.00 1.91 1.92 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 2.49 2.65 0.00 29 I 9.60 4.58 1.84 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 1.24 1.29 0.91 0.00 0.00 30 E 8.88 5.22 0.00 1.82 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 2.22 2.32 0.00 31 K 9.11 4.79 0.00 1.59 1.62 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.52 7.81 32 A 8.64 4.44 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 33 K 8.12 3.80 0.00 1.83 1.76 0.00 1.84 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 3.43 0.00 0.00 0.00 0.00 1.61 1.43 7.81 34 G 8.64 4.59 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 0.00 0.00 0.00 35 E 7.97 4.55 0.00 2.12 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 2.33 0.00 36 T 8.59 5.28 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 1.22 0.00 0.00 37 A 8.40 4.53 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 8.61 4.39 0.00 2.90 2.87 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 39 L 7.81 4.54 0.00 1.10 1.55 -0.04 0.63 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 40 P 0.00 4.67 0.00 2.15 2.23 0.00 3.90 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 41 C 10.06 4.85 0.00 2.96 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 42 K 8.81 5.01 0.00 1.82 1.63 0.00 1.51 0.00 0.00 1.86 0.00 0.00 2.93 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.31 1.29 7.81 43 F 8.24 4.95 0.00 3.04 2.97 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 44 T 8.41 4.28 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 1.21 0.00 0.00 45 L 8.25 5.08 0.00 1.61 1.59 0.86 1.14 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 46 S 8.84 4.66 0.00 3.93 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 47 P 0.00 4.38 0.00 2.06 2.20 0.00 3.68 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 2.04 2.11 0.00 48 E 7.64 4.10 0.00 1.80 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 2.29 0.00 49 D 8.11 5.01 0.00 2.70 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 50 Q 8.15 4.32 0.00 1.96 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 7.08 0.00 0.00 0.00 0.00 0.00 2.51 2.31 0.00 51 G 8.89 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 0.00 0.00 0.00 52 P 0.00 4.54 0.00 2.09 2.01 0.00 3.59 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 2.12 2.14 0.00 53 L 8.40 4.45 0.00 1.58 1.53 0.97 1.03 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 54 D 8.77 5.30 0.00 2.69 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 55 I 9.05 5.12 2.10 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.62 1.43 0.00 0.00 56 E 9.55 5.20 0.00 1.99 1.79 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 2.20 2.32 0.00 57 W 9.03 6.19 0.00 3.49 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 58 L 8.74 5.18 0.00 1.55 1.50 0.98 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.58 4.61 1.10 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 0.83 -0.07 0.79 0.00 0.00 60 S 8.94 4.54 0.00 3.66 3.70 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 0.00 0.00 0.00 61 P 0.00 5.35 0.00 2.05 2.06 0.00 4.05 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.86 0.00 62 A 8.83 4.02 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 63 D 8.06 4.43 0.00 2.69 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 64 N 7.56 4.72 0.00 2.92 2.65 0.00 0.00 7.32 7.00 0.00 0.00 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 Q 8.43 3.92 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 66 K 7.15 4.23 0.00 1.58 1.71 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.40 7.81 67 V 8.13 4.21 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 0.70 0.00 0.00 0.91 0.00 0.00 68 D 9.06 4.31 0.00 2.73 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 69 Q 8.35 4.53 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 7.00 0.00 0.00 0.00 0.00 0.00 2.25 2.25 0.00 70 V 8.32 4.04 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 0.17 0.00 0.00 0.93 0.00 0.00 71 I 8.04 4.45 1.95 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 1.24 1.89 0.86 0.00 0.00 72 I 7.30 4.83 1.72 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.53 0.68 0.00 0.00 73 L 9.81 5.63 0.00 1.99 2.17 1.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 10.06 4.69 0.00 3.10 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 75 S 7.93 4.75 0.00 4.43 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 G 9.48 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 D 8.06 4.18 0.00 2.77 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 78 K 7.44 3.85 0.00 1.52 1.25 0.00 1.73 0.00 0.00 1.54 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.19 1.35 7.81 79 I 7.75 3.87 2.63 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.91 1.09 0.00 0.00 80 Y 9.36 5.22 0.00 3.51 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 81 D 8.99 4.78 0.00 2.70 2.70 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 0.00 0.00 0.00 82 D 8.11 4.48 0.00 2.60 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 83 Y 7.90 4.10 0.00 3.05 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 84 Y 8.01 4.29 0.00 3.21 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 P 0.00 4.30 0.00 2.24 2.17 0.00 3.73 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.17 0.00 86 D 8.18 4.50 0.00 2.87 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 87 L 8.74 3.85 0.00 1.90 1.80 1.10 0.74 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 88 K 7.04 4.65 0.00 1.95 2.07 0.00 1.62 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.36 7.81 89 G 9.49 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 R 8.23 5.09 0.00 1.93 2.16 0.00 3.06 0.00 0.00 3.31 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.32 0.00 91 V 7.76 3.99 1.89 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 0.55 0.00 0.00 0.33 0.00 0.00 92 H 9.48 4.89 0.00 3.26 3.24 0.00 5.82 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 F 8.79 5.84 0.00 3.04 2.97 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 94 T 9.02 4.12 4.39 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 1.49 0.00 0.00 95 S 7.67 4.53 0.00 3.99 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 96 N 8.74 4.79 0.00 2.86 2.96 0.00 0.00 6.09 8.07 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 97 D 7.43 4.82 0.00 2.66 2.57 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 0.00 0.00 0.00 98 L 7.71 4.67 0.00 1.34 1.29 0.84 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.02 4.23 0.00 1.77 1.91 0.00 1.78 0.00 0.00 1.80 0.00 0.00 3.08 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.52 1.49 7.81 100 S 7.77 4.32 0.00 3.91 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 0.00 101 G 8.07 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 7.60 4.91 0.00 2.63 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 A 9.01 4.62 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 0.00 104 S 8.30 4.76 0.00 3.89 3.61 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 0.00 105 I 8.33 4.93 1.04 0.00 0.00 -1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.18 -0.69 0.00 0.00 106 N 9.72 5.17 0.00 2.70 3.10 0.00 0.00 6.33 7.58 0.00 0.00 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 V 8.57 4.61 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 0.97 0.00 0.00 0.69 0.00 0.00 108 T 8.71 4.31 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 109 N 8.40 5.02 0.00 2.84 2.88 0.00 0.00 7.26 7.84 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 0.00 110 L 7.29 4.07 0.00 1.96 1.66 0.94 0.57 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 0.00 111 Q 7.88 4.69 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.91 0.00 0.00 0.00 0.00 0.00 2.29 2.23 0.00 112 L 8.16 4.03 0.00 1.76 1.71 0.93 0.72 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 0.00 113 S 7.94 4.37 0.00 3.87 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 0.00 114 D 8.03 4.54 0.00 3.00 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 0.00 115 I 7.42 3.93 2.18 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 1.36 0.96 0.94 0.00 0.00 116 G 8.10 4.90 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 0.00 0.00 0.00 117 T 8.25 4.27 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 1.31 0.00 0.00 118 Y 10.03 5.28 0.00 3.22 3.33 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 0.00 119 Q 9.29 4.77 0.00 2.04 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.75 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 120 C 8.82 3.68 0.00 1.23 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 0.00 0.00 0.00 0.00 121 K 8.85 5.31 0.00 1.55 1.59 0.00 1.78 0.00 0.00 1.61 0.00 0.00 2.73 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.24 1.03 7.81 122 V 8.08 4.34 1.89 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 0.04 0.00 0.00 0.91 0.00 0.00 123 K 8.67 4.63 0.00 1.83 1.65 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.76 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.34 7.81 124 K 8.88 5.05 0.00 1.58 1.50 0.00 1.66 0.00 0.00 1.83 0.00 0.00 3.14 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.30 1.48 7.81 125 A 8.73 4.35 1.25 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 0.00 0.00 126 P 0.00 4.90 0.00 2.07 2.11 0.00 3.73 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.10 0.00 127 G 9.10 3.85 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 0.00 0.00 0.00 128 V 8.30 4.38 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 0.63 0.00 0.00 0.91 0.00 0.00 129 A 9.46 4.84 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 N 8.44 5.47 0.00 2.60 2.68 0.00 0.00 5.84 7.11 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 0.00 131 K 9.27 4.67 0.00 1.87 1.83 0.00 1.23 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.27 7.81 132 K 9.04 5.00 0.00 1.63 1.71 0.00 1.62 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.38 7.81 133 I 9.30 4.90 2.26 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.99 0.98 0.00 0.00 134 H 9.17 5.41 0.00 3.13 3.27 0.00 5.62 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 0.00 135 L 8.77 4.93 0.00 1.48 1.99 0.88 1.04 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 0.00 136 V 9.38 4.70 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 0.96 0.00 0.00 0.98 0.00 0.00 137 V 8.41 4.72 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 0.88 0.00 0.00 0.99 0.00 0.00 138 L 8.93 4.46 0.00 1.59 1.56 0.93 0.67 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 0.00 139 V 8.26 3.98 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 0.90 0.00 0.00 0.94 0.00 0.00 140 K 8.28 4.34 0.00 1.82 1.74 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.39 1.44 7.81 141 P 0.00 4.28 0.00 2.19 2.14 0.00 3.80 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.02 0.00 142 S 7.92 3.39 0.00 3.88 3.82 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 0.00 143 G 8.22 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 0.00 0.00 0.00 144 A 7.68 4.21 1.30 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 0.00 0.00