NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3810 8.3044 120.3482 54.7110 33.6707 174.3682 2 E 3.9616 8.5527 122.5854 55.9223 30.4186 173.9241 3 K 5.2559 8.9111 126.0255 54.8171 35.5468 174.9323 4 S 4.7991 9.0248 117.0023 56.5727 66.2841 172.2603 5 F 5.3257 9.0400 127.4468 56.9613 40.9288 174.3704 6 I 4.5889 7.9864 127.1625 59.4627 40.2400 174.3163 7 M 4.6427 8.2371 126.1673 53.3505 35.4072 174.2654 8 I 4.3525 8.3904 127.9987 60.9139 38.2326 176.2791 9 K 4.3932 9.3482 127.8267 55.4897 33.1399 176.6705 10 P 4.9599 0.0000 0.0000 65.4225 31.2173 178.7561 11 D 4.5464 7.9445 118.2107 56.1502 39.2463 178.8838 12 G 3.5928 8.0960 107.4644 47.8304 0.0000 175.9198 13 V 3.6472 7.5995 120.4317 65.6396 31.4100 178.0007 14 Q 4.0531 8.0903 117.2137 58.5751 28.6577 177.9493 15 R 4.3093 7.7324 115.7173 55.0125 31.2836 176.2129 16 G 3.8011 7.7066 106.2522 47.2037 0.0000 174.3376 17 L 4.4101 7.7296 115.3717 54.1922 43.1191 179.4227 18 V 3.6389 7.7482 119.6150 66.0199 31.4110 177.6158 19 G 3.8280 8.1085 104.6561 48.4454 0.0000 174.9346 20 T 3.9335 7.9679 118.1786 66.3063 68.4032 176.3738 21 I 3.7844 8.1035 121.5550 64.5016 37.2124 178.4077 22 I 3.9016 7.9311 120.4545 64.6351 36.9532 178.2879 23 K 3.9704 8.5519 119.5632 60.0443 31.8226 179.3740 24 R 3.9152 8.0950 117.8336 59.3109 29.4348 179.2089 25 F 3.7763 7.9922 117.3036 60.0953 38.7514 177.7149 26 E 4.3209 8.8633 118.6614 59.6790 29.1772 179.6962 27 K 4.0812 8.2336 117.1113 59.0390 32.1332 178.9383 28 K 4.0887 7.5003 117.5775 57.5827 32.0366 177.4888 29 G 3.8633 8.0522 106.6651 45.9376 0.0000 172.8571 30 Y 4.8417 7.6986 116.3687 56.7513 40.5644 174.6738 31 K 4.9515 9.3428 122.7400 54.5798 34.2035 174.9591 32 L 3.5978 8.8838 131.1242 54.8962 41.9182 176.1959 33 I 4.7565 8.4073 118.8457 60.8479 40.4241 175.1670 34 A 4.7539 7.2663 123.9361 50.5401 22.4186 174.8728 35 I 5.1354 8.2565 121.2412 59.7517 41.3890 173.8543 36 K 4.6227 9.1685 128.7096 55.5538 36.1073 173.6046 37 M 5.2251 8.5757 126.7374 53.8590 33.6199 174.6708 38 L 4.5877 8.6032 124.5270 54.8035 44.6196 174.5730 39 N 4.8771 8.6238 118.7314 51.1915 38.8289 173.1247 40 P 4.3203 0.0000 0.0000 62.1092 32.4382 176.8772 41 T 4.0850 8.1215 113.4420 61.4847 70.8944 175.2617 42 E 3.9975 8.6417 122.5624 58.7737 29.2208 178.7953 43 E 4.0608 7.9129 118.1894 59.1411 29.8177 178.4822 44 I 3.4387 7.1166 118.4760 64.2712 37.0582 178.4975 45 L 4.0419 7.8074 119.6889 57.3498 41.2350 179.3638 46 K 4.0371 7.7576 118.0046 59.5653 32.1298 178.4712 47 E 4.2616 7.8381 117.1035 58.9053 29.4883 178.2617 48 H 4.1377 7.8417 117.4586 58.4725 29.9179 176.1464 49 Y 5.0734 8.0359 118.4721 57.6513 39.2500 178.3758 50 K 3.9303 7.9519 122.7515 59.7428 32.3436 177.2612 51 E 3.9819 8.2801 118.2724 58.9106 29.4682 176.8964 52 L 4.6424 7.6339 117.2903 54.7820 41.6088 177.8901 53 S 3.3806 7.9009 113.2995 59.4990 62.5821 173.6035 54 D 4.7401 7.2145 119.8998 54.3696 40.7408 175.8882 55 Q 4.6049 7.5124 118.0304 53.6100 32.7409 172.1701 56 P 4.4043 0.0000 0.0000 65.5390 31.4407 177.0518 57 F 4.8583 8.2032 122.0357 56.5517 38.2714 173.6705 58 F 4.6494 8.2599 126.8118 58.9183 41.5559 177.5016 59 K 4.0233 8.1883 118.0814 58.6956 32.2913 177.3748 60 N 4.3854 7.3579 115.0621 54.0969 39.7694 177.0394 61 L 4.0480 7.2763 119.7387 58.1077 42.0513 179.2076 62 V 3.6032 7.2834 111.6125 64.1747 31.2196 178.3079 63 A 3.9615 7.7274 119.5153 55.3464 18.7164 178.3746 64 Y 4.2336 7.6569 116.6974 61.2052 38.6868 178.5118 65 I 3.2490 7.5186 120.3279 63.7244 37.2753 178.2351 66 S 4.4450 7.4873 115.1303 61.0969 62.2660 175.3693 67 K 4.1203 7.8562 121.6166 58.3083 32.1340 177.7286 68 G 3.7899 7.1764 108.6401 44.4483 0.0000 170.7026 69 P 4.5835 0.0000 0.0000 62.6302 33.1791 175.4791 70 V 4.7403 8.2084 119.5784 61.3405 35.4809 174.1425 71 V 4.3525 8.4002 127.5403 61.2669 33.0094 174.1463 72 A 4.5269 8.8639 131.2990 51.5309 20.2914 175.8974 73 M 5.3840 8.6303 119.9553 53.6993 37.4042 174.2478 74 V 4.8890 8.2820 120.5885 60.9436 34.7502 174.3241 75 W 5.2383 8.9867 126.8904 54.8295 32.4823 174.1363 76 E 5.1390 10.7800 124.3055 53.8564 32.4601 175.2037 77 G 4.9701 8.2766 114.5120 43.8024 0.0000 172.8489 78 V 3.6181 7.9736 120.4618 63.0456 32.4485 175.9059 79 D 4.3729 8.8870 122.9765 55.4199 39.7865 174.3549 80 M 3.9888 7.8998 121.6184 58.0788 32.7857 176.9943 81 V 3.5584 8.4241 118.7178 65.8887 31.7125 177.9604 82 K 3.9187 7.9686 118.8572 59.6732 32.1646 178.4254 83 Q 4.0670 8.1336 119.5360 58.9131 28.9715 178.2933 84 G 3.5779 8.2105 107.0153 47.8758 0.0000 175.9340 85 R 3.9912 7.9973 120.6559 58.7073 29.8016 179.2976 86 K 3.9150 8.0249 117.7686 59.6278 32.3788 179.1111 87 L 3.9834 8.1912 119.4577 57.5202 41.3561 179.8478 88 I 3.7877 7.7956 119.9714 64.7584 37.2878 175.7247 89 G 4.2383 8.1164 102.1339 44.8678 0.0000 172.5278 90 E 4.2485 8.2793 118.1063 56.2584 30.1650 177.8926 91 T 3.9230 8.4903 116.6364 66.7516 68.7892 174.8358 92 N 4.5899 8.0161 122.0401 52.1576 38.7863 173.5759 93 P 4.5211 0.0000 0.0000 64.3466 31.7902 177.7624 94 L 4.1750 8.0739 118.4792 57.2228 41.8039 177.7785 95 T 4.2837 7.5177 105.6400 61.6902 69.6791 174.8755 96 S 4.2745 7.7509 118.9467 57.6771 62.8500 173.0071 97 N 4.6769 8.5377 124.9355 52.4889 37.9398 174.5451 98 T 3.8821 8.0830 110.4814 63.0152 69.5232 173.4464 99 G 4.0604 8.6721 112.7129 46.3309 0.0000 175.2213 100 T 4.3272 7.3881 108.7430 60.7940 71.0944 175.7538 101 I 3.7963 8.3039 123.4598 65.0258 37.2446 179.2150 102 R 4.1541 8.2713 118.8223 58.9650 29.6776 178.9267 103 G 3.7496 8.0364 103.7380 46.3505 0.0000 174.6760 104 D 4.4031 7.7359 119.8366 54.9445 41.5378 177.0711 105 F 5.0853 7.9854 114.9279 56.9542 41.2244 174.7101 106 C 5.0623 7.9949 117.1602 57.8976 30.9198 173.3943 107 L 4.6022 8.5271 119.3271 55.2428 44.2587 176.8638 108 E 4.7608 7.7612 117.9640 53.7175 32.1250 176.9054 109 V 3.7621 8.0329 125.0704 64.5364 31.6698 177.8969 110 S 4.2890 8.2216 114.3795 60.1823 63.2054 174.2801 111 K 4.6039 7.6588 119.9545 54.0324 31.9463 175.0436 112 N 4.9338 8.2605 117.8143 51.7993 38.2404 178.7901 113 V 3.2215 8.4280 116.7782 63.5528 31.6279 172.4541 114 I 5.1675 8.5863 117.3550 59.4612 41.5129 173.9661 115 H 5.0787 9.4165 127.0344 54.3373 32.5655 172.9665 116 G 4.4566 8.2074 110.6481 43.9982 0.0000 172.4480 117 S 4.6855 8.1964 118.2373 58.6886 62.8771 174.6158 118 D 4.5699 8.9527 123.6853 55.5379 40.1147 176.8617 119 S 4.7284 7.5993 112.7189 55.4526 67.5842 174.8057 120 V 3.5766 8.4048 121.1125 66.1638 30.7425 177.9743 121 A 4.0212 7.9457 120.0973 55.2276 18.3469 179.4298 122 S 4.1133 8.0543 111.4744 61.1083 62.3791 176.3034 123 A 4.0822 8.3354 123.8541 55.4227 18.0474 179.3089 124 N 4.3594 8.1188 114.8516 56.2466 38.5921 177.6620 125 K 3.9784 7.8287 120.3140 59.5664 32.4995 178.6890 126 E 3.9959 8.2643 118.7994 59.5594 29.3331 179.4320 127 I 3.8219 8.2050 120.1153 64.6262 36.9680 178.2803 128 N 4.3895 7.7176 116.0405 56.2937 38.4001 177.0229 129 I 3.7449 7.4617 118.8395 63.4047 38.1384 177.3375 130 W 4.2056 7.8831 118.2076 56.7927 29.6238 176.5372 131 F 5.1244 7.9756 116.0057 55.3406 41.9777 175.0491 132 K 4.3956 8.7612 121.9203 55.4215 32.7481 178.2894 133 A 4.0518 8.5918 124.0508 55.3552 18.5588 179.8196 134 E 4.0410 8.2064 115.4296 59.2481 30.0408 177.8889 135 E 4.1245 8.0638 117.7742 59.1973 29.6379 177.1366 136 L 4.1605 7.4918 118.8322 55.2976 41.9194 177.0424 137 T 4.4971 8.6709 115.8140 60.4042 70.4521 174.1143 138 Q 4.6361 8.7088 126.8453 54.6224 29.9174 174.6821 139 W 5.2711 8.3500 122.3854 54.6769 31.2436 174.4487 140 K 4.0107 8.7117 120.3641 55.7572 32.0617 176.3252 141 H 4.3675 8.2292 124.7974 55.6175 29.7303 175.0863 142 H 4.1784 9.3088 127.9462 59.5469 29.9901 175.9493 143 M 4.5178 8.3174 116.9600 56.1894 32.5344 177.6934 144 K 3.6556 7.7596 120.2432 59.6474 31.8556 178.0366 145 E 3.6614 8.0690 117.4921 58.4935 29.3413 178.2418 146 W 4.8171 7.8960 115.6696 56.5443 29.5799 176.5456 147 I 4.2986 7.5325 119.9438 61.7096 38.8753 175.0121 148 C 4.6142 7.9339 116.1871 57.6538 30.8127 174.0836 149 S 3.9807 8.4860 115.3958 59.3453 62.6427 172.4252 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 M 8.30 4.38 0.00 2.04 2.11 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.57 0.00 2 E 8.55 3.96 0.00 2.22 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 2.42 2.44 0.00 3 K 8.91 5.26 0.00 1.68 1.71 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.84 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.41 7.81 4 S 9.02 4.80 0.00 3.86 3.66 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 5 F 9.04 5.33 0.00 3.23 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 I 7.99 4.59 1.70 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.37 0.46 0.00 0.00 7 M 8.24 4.64 0.00 1.66 0.75 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.16 0.00 8 I 8.39 4.35 1.81 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 1.20 0.82 0.88 0.00 0.00 9 K 9.35 4.39 0.00 1.83 1.90 0.00 1.68 0.00 0.00 1.82 0.00 0.00 3.13 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.59 1.52 7.81 10 P 0.00 4.96 0.00 2.03 2.01 0.00 3.68 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.92 0.00 11 D 7.94 4.55 0.00 3.07 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 12 G 8.10 3.59 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 13 V 7.60 3.65 2.18 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 1.05 0.00 0.00 0.90 0.00 0.00 14 Q 8.09 4.05 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.71 0.00 0.00 0.00 0.00 0.00 2.64 2.58 0.00 15 R 7.73 4.31 0.00 1.97 1.89 0.00 3.32 0.00 0.00 3.47 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 16 G 7.71 3.80 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 0.00 0.00 0.00 17 L 7.73 4.41 0.00 1.57 1.38 0.59 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.75 3.64 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 1.05 0.00 0.00 0.91 0.00 0.00 19 G 8.11 3.83 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 0.00 0.00 0.00 20 T 7.97 3.93 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 1.31 0.00 0.00 21 I 8.10 3.78 2.14 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 1.63 1.42 0.97 0.00 0.00 22 I 7.93 3.90 2.14 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.77 1.25 0.00 0.00 23 K 8.55 3.97 0.00 2.05 1.96 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.54 1.71 7.81 24 R 8.10 3.92 0.00 2.10 1.85 0.00 3.14 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.94 0.00 25 F 7.99 3.78 0.00 2.23 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.86 4.32 0.00 2.27 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 2.83 2.81 0.00 27 K 8.23 4.08 0.00 1.71 1.89 0.00 1.75 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.69 1.62 7.81 28 K 7.50 4.09 0.00 1.86 2.04 0.00 1.60 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.53 1.29 7.81 29 G 8.05 3.86 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 0.00 0.00 0.00 30 Y 7.70 4.84 0.00 3.36 3.22 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 31 K 9.34 4.95 0.00 1.92 1.81 0.00 1.13 0.00 0.00 1.29 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.03 0.89 7.81 32 L 8.88 3.60 0.00 0.63 1.33 -0.16 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 33 I 8.41 4.76 1.97 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 1.15 0.87 0.92 0.00 0.00 34 A 7.27 4.75 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 35 I 8.26 5.14 1.73 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.80 0.84 0.00 0.00 36 K 9.17 4.62 0.00 1.90 1.53 0.00 1.57 0.00 0.00 1.46 0.00 0.00 2.14 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.27 1.35 7.81 37 M 8.58 5.23 0.00 2.04 1.91 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.50 0.00 38 L 8.60 4.59 0.00 1.75 1.70 1.02 0.76 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 39 N 8.62 4.88 0.00 2.59 2.83 0.00 0.00 6.99 8.02 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 40 P 0.00 4.32 0.00 2.25 2.06 0.00 3.74 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 2.34 2.39 0.00 41 T 8.12 4.09 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 1.14 0.00 0.00 42 E 8.64 4.00 0.00 2.01 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 0.00 2.33 2.35 0.00 43 E 7.91 4.06 0.00 2.00 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 2.33 2.41 0.00 44 I 7.12 3.44 1.58 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.15 -0.37 0.00 0.00 45 L 7.81 4.04 0.00 1.68 1.79 1.05 0.91 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 46 K 7.76 4.04 0.00 1.89 1.92 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.62 1.66 7.81 47 E 7.84 4.26 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 2.27 2.29 0.00 48 H 7.84 4.14 0.00 3.06 3.42 0.00 5.91 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 Y 8.04 5.07 0.00 3.22 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 50 K 7.95 3.93 0.00 2.02 1.84 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.61 7.81 51 E 8.28 3.98 0.00 2.01 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 2.41 0.00 52 L 7.63 4.64 0.00 1.89 1.86 1.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 53 S 7.90 3.38 0.00 3.43 3.83 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 54 D 7.21 4.74 0.00 2.51 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 55 Q 7.51 4.60 0.00 2.18 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.77 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 56 P 0.00 4.40 0.00 2.16 2.17 0.00 3.78 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.12 0.00 57 F 8.20 4.86 0.00 2.85 3.02 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 58 F 8.26 4.65 0.00 3.21 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 59 K 8.19 4.02 0.00 1.76 1.83 0.00 1.86 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.65 7.81 60 N 7.36 4.39 0.00 1.44 1.98 0.00 0.00 6.82 6.74 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 61 L 7.28 4.05 0.00 1.73 1.47 0.87 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 62 V 7.28 3.60 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 0.67 0.00 0.00 0.58 0.00 0.00 63 A 7.73 3.96 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 64 Y 7.66 4.23 0.00 3.05 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 65 I 7.52 3.25 1.90 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 1.18 0.45 0.96 0.00 0.00 66 S 7.49 4.45 0.00 3.94 4.04 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 67 K 7.86 4.12 0.00 2.04 1.73 0.00 1.90 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.61 7.81 68 G 7.18 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 69 P 0.00 4.58 0.00 2.11 2.17 0.00 3.62 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.95 0.00 70 V 8.21 4.74 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 0.82 0.00 0.00 0.90 0.00 0.00 71 V 8.40 4.35 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 0.87 0.00 0.00 0.91 0.00 0.00 72 A 8.86 4.53 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 73 M 8.63 5.38 0.00 1.63 1.94 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 74 V 8.28 4.89 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 0.00 0.00 0.97 0.00 0.00 0.55 0.00 0.00 75 W 8.99 5.24 0.00 3.17 3.02 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 76 E 10.78 5.14 0.00 1.98 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 2.22 2.24 0.00 77 G 8.28 4.97 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 78 V 7.97 3.62 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 0.69 0.00 0.00 0.95 0.00 0.00 79 D 8.89 4.37 0.00 2.92 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 80 M 7.90 3.99 0.00 2.24 2.36 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.79 0.00 81 V 8.42 3.56 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 0.97 0.00 0.00 1.03 0.00 0.00 82 K 7.97 3.92 0.00 2.06 1.97 0.00 1.67 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.57 7.81 83 Q 8.13 4.07 0.00 2.66 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.51 2.49 0.00 84 G 8.21 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 R 8.00 3.99 0.00 2.17 2.00 0.00 3.16 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 86 K 8.02 3.92 0.00 1.83 1.83 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.62 7.81 87 L 8.19 3.98 0.00 1.44 1.32 -0.08 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 88 I 7.80 3.79 2.13 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 1.53 0.87 0.94 0.00 0.00 89 G 8.12 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 0.00 0.00 0.00 0.00 90 E 8.28 4.25 0.00 1.98 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 0.00 2.33 2.35 0.00 91 T 8.49 3.92 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 1.27 0.00 0.00 92 N 8.02 4.59 0.00 2.81 2.72 0.00 0.00 7.15 7.71 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 93 P 0.00 4.52 0.00 2.15 2.30 0.00 3.74 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.14 0.00 94 L 8.07 4.18 0.00 1.74 1.72 0.95 1.01 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 95 T 7.52 4.28 4.32 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 1.21 0.00 0.00 96 S 7.75 4.27 0.00 4.04 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 N 8.54 4.68 0.00 2.96 2.91 0.00 0.00 6.02 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 98 T 8.08 3.88 4.18 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 1.17 0.00 0.00 99 G 8.67 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 0.00 100 T 7.39 4.33 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 1.31 0.00 0.00 101 I 8.30 3.80 1.96 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 1.74 0.71 1.11 0.00 0.00 102 R 8.27 4.15 0.00 1.94 2.01 0.00 3.35 0.00 0.00 3.30 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.81 0.00 103 G 8.04 3.75 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 0.00 0.00 0.00 104 D 7.74 4.40 0.00 1.88 1.60 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 0.00 105 F 7.99 5.09 0.00 3.17 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 C 7.99 5.06 0.00 3.10 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 L 8.53 4.60 0.00 1.60 1.66 0.94 0.83 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 0.00 108 E 7.76 4.76 0.00 1.92 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 2.24 2.17 0.00 109 V 8.03 3.76 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 0.77 0.00 0.00 1.01 0.00 0.00 110 S 8.22 4.29 0.00 3.91 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 0.00 111 K 7.66 4.60 0.00 1.78 1.93 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.53 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.28 1.45 7.81 112 N 8.26 4.93 0.00 2.90 3.04 0.00 0.00 6.16 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 0.00 113 V 8.43 3.22 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 0.83 0.00 0.00 1.01 0.00 0.00 114 I 8.59 5.17 1.91 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 1.08 0.97 1.01 0.00 0.00 115 H 9.42 5.08 0.00 3.36 3.08 0.00 5.77 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 0.00 116 G 8.21 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 0.00 0.00 0.00 0.00 117 S 8.20 4.69 0.00 3.88 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 0.00 118 D 8.95 4.57 0.00 2.84 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 0.00 119 S 7.60 4.73 0.00 4.03 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 0.00 120 V 8.40 3.58 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 1.07 0.00 0.00 0.96 0.00 0.00 121 A 7.95 4.02 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 S 8.05 4.11 0.00 3.90 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 0.00 123 A 8.34 4.08 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 N 8.12 4.36 0.00 2.81 2.91 0.00 0.00 6.75 7.17 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 0.00 125 K 7.83 3.98 0.00 1.90 1.99 0.00 1.51 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.53 7.81 126 E 8.26 4.00 0.00 2.39 1.84 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 2.41 2.51 0.00 127 I 8.21 3.82 1.93 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.93 0.96 0.00 0.00 128 N 7.72 4.39 0.00 2.90 2.88 0.00 0.00 7.04 7.28 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 0.00 129 I 7.46 3.74 1.94 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 1.34 0.44 0.52 0.00 0.00 130 W 7.88 4.21 0.00 2.98 2.98 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 0.00 131 F 7.98 5.12 0.00 3.16 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 K 8.76 4.40 0.00 2.10 1.76 0.00 1.76 0.00 0.00 1.83 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.39 7.81 133 A 8.59 4.05 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 0.00 134 E 8.21 4.04 0.00 1.96 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 2.32 2.30 0.00 135 E 8.06 4.12 0.00 2.55 2.36 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 2.69 2.43 0.00 136 L 7.49 4.16 0.00 1.69 1.61 0.74 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 137 T 8.67 4.50 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 1.30 0.00 0.00 138 Q 8.71 4.64 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.77 0.00 0.00 0.00 0.00 0.00 2.30 2.42 0.00 139 W 8.35 5.27 0.00 3.49 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 0.00 140 K 8.71 4.01 0.00 1.86 1.81 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.71 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.42 7.81 141 H 8.23 4.37 0.00 2.39 2.93 0.00 5.70 0.00 0.00 0.00 0.00 6.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 H 9.31 4.18 0.00 3.29 3.51 0.00 5.97 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 M 8.32 4.52 0.00 2.27 2.31 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.72 0.00 144 K 7.76 3.66 0.00 1.78 1.76 0.00 1.45 0.00 0.00 1.51 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.44 7.81 145 E 8.07 3.66 0.00 1.61 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 0.00 0.00 0.00 1.98 2.19 0.00 146 W 7.90 4.82 0.00 3.35 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 I 7.53 4.30 1.81 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.71 0.81 0.00 0.00 148 C 7.93 4.61 0.00 3.06 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 0.00 149 S 8.49 3.98 0.00 3.81 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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