NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9405 8.3544 109.7400 45.6511 0.0000 173.4676 2 S 4.1957 7.8963 114.2690 57.9219 63.7986 172.2770 3 S 3.9718 8.2954 115.1211 59.6800 63.3130 172.9267 4 G 4.4326 7.6424 110.9535 43.2046 0.0000 171.3649 5 S 4.6909 7.8589 114.0579 56.5741 65.5089 172.5448 6 S 4.7690 8.3094 118.2508 57.1853 66.5873 173.1140 7 G 4.1075 8.3882 108.6662 46.2381 0.0000 173.8395 8 S 4.4566 8.6708 112.1480 57.3953 64.3356 173.3373 9 D 4.7850 7.8282 124.6363 51.3024 39.8652 174.7346 10 S 4.5878 7.3758 113.8259 57.5446 66.7327 175.7056 11 L 4.9101 8.3558 123.3519 53.4348 45.5440 176.1632 12 V 4.2755 8.0870 117.0582 61.3884 31.6646 176.5240 13 V 3.5048 7.4608 117.9833 63.1340 31.7584 174.9240 14 C 5.0219 8.8046 119.8638 58.0051 31.5295 173.4151 15 E 4.3980 8.4073 121.1684 55.8970 31.4214 176.3286 16 V 4.4552 8.0536 120.7195 60.0954 31.6860 174.5844 17 D 4.4079 8.5457 126.2383 53.7303 41.7724 176.1963 18 P 4.2823 0.0000 0.0000 65.8116 31.2776 178.6209 19 E 4.1079 8.8872 117.0194 58.4950 29.7393 178.5100 20 L 4.1695 8.0149 120.9209 57.8236 42.4854 178.3021 21 K 3.9986 8.0658 119.8418 59.6636 32.1092 178.0065 22 E 3.9477 7.7808 118.8779 59.8165 29.3436 179.1230 23 T 3.8975 8.0240 115.9962 66.9513 68.4428 176.3899 24 L 3.9679 7.7789 119.8528 57.9725 41.6929 179.1488 25 R 3.6047 7.4786 116.8363 59.3311 30.1283 178.2963 26 K 4.1626 8.3733 118.4922 59.0527 32.0801 178.7803 27 F 4.2322 8.1919 120.0178 61.6823 39.3308 177.2545 28 R 3.9197 7.7237 116.2155 57.8846 30.0006 176.8064 29 F 5.1805 7.2635 117.5030 56.8765 39.9925 175.3054 30 R 4.3040 7.9319 115.9699 56.0755 30.2800 175.3709 31 K 4.4671 8.3329 115.3481 57.0447 32.4677 176.4578 32 E 4.7596 7.9218 117.7295 55.1868 32.3416 176.4262 33 T 4.2446 7.9347 106.5131 61.5977 69.1590 172.6108 34 N 4.8418 7.5234 119.0685 51.3977 40.1690 172.3742 35 N 5.2906 8.5570 114.6177 52.3889 39.8446 174.6552 36 A 5.0858 8.5705 123.6985 50.3107 23.5266 174.2820 37 A 5.4492 9.5518 120.5577 50.3294 23.3746 175.6930 38 I 4.6936 8.3625 119.9794 59.6926 40.9596 174.6124 39 I 4.8362 8.4879 129.2958 60.2798 38.6904 175.0654 40 M 5.3403 9.3260 127.4463 53.3686 35.6218 175.0479 41 K 5.2178 9.1001 120.8855 55.0192 36.9197 174.7077 42 V 4.7990 8.1156 118.8205 59.8982 33.6041 174.9637 43 D 4.6157 8.6609 126.1416 53.3207 41.2335 177.6941 44 K 4.0292 8.8316 125.1983 58.5789 32.7316 177.2948 45 D 4.4540 8.1181 117.5789 56.6588 41.3409 176.7329 46 R 4.3894 7.7711 114.1268 55.5223 31.0988 175.9708 47 Q 3.2690 8.0622 117.6319 56.4960 27.0267 173.6225 48 M 5.0625 7.2559 114.7531 53.4620 35.8685 175.2769 49 V 4.2601 9.0470 122.3030 63.0773 32.6975 175.1682 50 V 4.7743 9.0462 121.5269 58.8615 35.3487 175.0696 51 L 4.1320 8.7120 125.4814 56.3511 41.9187 175.8658 52 E 4.5931 8.5551 124.3280 57.7435 32.1083 175.0997 53 D 4.6304 8.5185 116.5982 53.9144 46.4022 175.2251 54 E 4.9251 8.6403 119.4896 55.4146 33.2044 174.7157 55 L 4.8686 8.8913 124.9650 52.9916 44.7387 175.8898 56 Q 4.8720 8.6000 120.4801 53.5399 32.3042 174.6725 57 N 4.1748 8.4488 115.3764 54.8548 36.1636 174.5050 58 I 4.5817 7.7938 115.5650 59.1728 41.3075 175.0234 59 S 4.8296 8.6494 122.3267 56.4112 63.7626 173.0552 60 P 4.1291 0.0000 0.0000 64.1275 31.0964 176.7492 61 E 4.3246 7.8535 118.0728 57.9835 30.9875 177.5446 62 E 4.0339 8.0463 119.4949 58.8691 29.7015 178.0595 63 L 3.8052 7.7866 119.9921 58.3681 41.7432 178.7143 64 K 3.7681 7.8628 117.2220 59.5830 32.0490 178.1479 65 L 4.1082 7.7245 118.5759 57.5647 41.6255 178.8964 66 E 4.0791 7.8909 117.4221 58.1473 29.7812 177.6291 67 L 4.1620 7.0693 118.0606 53.5563 42.4573 176.4499 68 P 4.5623 0.0000 0.0000 62.4014 32.4586 174.9924 69 E 4.6199 8.4806 112.9310 56.6324 31.2738 176.6333 70 R 4.4968 7.4587 116.6015 54.0725 29.1099 175.2382 71 Q 4.2146 7.7457 119.2510 54.6548 31.5785 171.8831 72 P 4.4873 0.0000 0.0000 62.8927 32.3375 175.6033 73 R 4.0430 8.4020 117.6962 55.6340 33.3820 173.2631 74 F 5.2398 8.8659 118.7904 56.5787 41.4448 175.7380 75 V 4.7413 8.0509 121.2207 61.7352 35.2457 173.6938 76 V 4.7737 9.1219 129.2503 61.5685 32.4906 173.1241 77 Y 5.3322 8.4513 129.3261 56.5733 40.8608 174.1643 78 S 4.7170 8.9754 121.7688 56.6732 64.0701 172.6290 79 Y 4.4654 8.0918 128.0997 55.8391 40.8643 173.6556 80 K 4.8207 6.4255 123.2162 54.8820 34.1376 174.0882 81 Y 4.9509 9.3722 130.4415 56.0512 40.7266 175.1113 82 V 4.4552 8.7370 125.5341 61.3138 33.7532 173.5740 83 H 4.6059 9.6915 117.1470 54.5440 30.3733 176.7063 84 D 5.3887 7.9323 129.1005 56.4183 41.3333 178.9353 85 D 4.3274 8.0057 116.4367 55.4071 41.2412 175.8323 86 G 3.9758 7.0012 107.8730 45.7135 0.0000 173.5519 87 R 4.6040 8.1663 119.1987 53.7729 32.5804 175.2137 88 V 4.9309 8.1528 121.1181 60.4243 34.0454 174.6124 89 S 4.2405 9.1268 120.9685 56.6629 66.8021 173.1301 90 Y 5.6551 7.8467 119.8962 55.1689 38.1375 173.7064 91 P 4.4580 0.0000 0.0000 62.2766 30.4442 175.9530 92 L 4.3491 8.3092 124.9339 55.2073 41.9761 176.2328 93 C 5.0636 9.0743 120.1745 57.9688 33.1960 172.9645 94 F 4.8714 8.8899 123.1197 56.9722 40.6547 174.7988 95 I 4.6118 8.7735 129.5609 60.1094 38.1740 175.4614 96 F 4.8034 8.9579 131.9468 57.1439 40.3291 175.0796 97 S 4.4972 8.9736 123.3166 57.8265 62.5122 172.7481 98 S 4.6290 7.8371 121.7187 55.2260 63.9103 172.0228 99 P 4.5365 0.0000 0.0000 62.9701 32.1140 176.8412 100 V 4.1685 8.1565 115.1964 61.4472 31.4398 176.3309 101 G 3.9318 7.7833 107.4691 45.5072 0.0000 173.2971 102 C 4.5180 7.6823 114.9116 57.1441 31.3864 173.3111 103 K 4.4774 8.1133 118.7753 54.6775 33.8693 176.2484 104 P 4.4618 0.0000 0.0000 65.1020 31.1978 178.3206 105 E 3.7956 8.0833 118.8594 58.8726 29.9493 177.8132 106 Q 4.3354 8.0418 117.4459 58.7824 29.4699 177.7058 107 Q 4.0159 7.9881 120.3893 59.7798 29.1389 179.3256 108 M 4.1688 7.8205 119.2212 58.8084 31.6131 178.3762 109 M 4.0504 8.6455 119.0837 58.7396 32.0046 178.2021 110 Y 4.2574 8.2088 115.3598 60.1924 38.3155 177.6464 111 A 4.3085 8.8682 121.5545 54.6186 18.5417 179.1799 112 G 3.8275 8.6740 103.5275 46.5176 0.0000 175.4640 113 S 4.5400 7.7650 114.4221 58.6847 63.3651 175.8669 114 K 3.2987 8.2429 123.7911 59.8371 31.8783 177.8845 115 N 4.1283 8.0794 115.7161 56.3160 38.4682 177.1630 116 R 3.6873 7.6095 119.2421 59.2877 30.3279 178.0257 117 L 3.6792 7.9036 120.3518 57.9861 41.9797 179.0750 118 V 2.8150 7.4061 118.1763 66.0215 31.1919 177.8606 119 Q 3.9124 7.9701 116.5232 59.3612 28.5186 179.2587 120 T 3.9583 7.3731 115.7121 66.4656 68.6493 176.3035 121 A 4.0245 7.4850 119.8955 52.0615 19.4278 176.3840 122 E 3.4700 7.6531 116.8404 56.9905 26.8848 175.1864 123 L 4.4921 7.2442 119.3735 53.4652 42.6053 178.0278 124 T 3.8025 8.4729 118.8667 63.3202 67.9096 173.8584 125 K 4.3844 7.4806 121.4155 54.7373 34.3994 175.3701 126 V 4.7792 7.9396 124.5349 61.0690 34.2768 174.4766 127 F 5.5147 9.3853 125.8736 55.7324 43.2672 173.6220 128 E 5.0861 9.2039 121.6408 54.5406 31.8612 174.8704 129 I 4.3541 8.1460 121.6034 59.4247 38.8626 176.8497 130 R 4.0086 8.9129 127.2659 57.5098 30.4519 175.8406 131 T 3.9771 7.1706 109.3364 62.0550 71.2942 173.1139 132 T 3.6567 8.1506 118.0222 65.1081 68.5796 175.5814 133 D 4.2846 8.0973 120.4355 57.0207 41.0248 177.6793 134 D 4.0623 7.8217 117.5472 56.9677 41.0822 176.7767 135 L 3.1965 7.2037 122.2434 54.8138 39.7057 175.8972 136 T 4.7084 7.6421 113.2149 58.4964 73.2696 174.0929 137 E 3.9412 8.8698 123.0901 60.5858 29.6003 179.3739 138 T 3.9449 8.0026 115.1795 65.7740 68.5880 176.3118 139 W 4.5059 7.9050 129.8074 60.5017 30.7923 177.7447 140 L 3.6571 8.4604 120.4388 57.7359 41.7617 178.8289 141 K 3.7845 7.8669 118.1217 58.9127 31.8995 179.3697 142 E 3.8652 8.4475 119.7741 59.3263 29.1738 179.3571 143 K 3.6911 6.9575 117.0781 58.9607 31.8775 179.3641 144 L 4.1622 7.7080 117.8339 58.6412 41.9084 178.4596 145 A 3.6177 7.7084 117.2813 53.6515 19.5434 177.7383 146 S 4.4876 8.1712 106.2034 57.9233 65.2285 173.0134 147 G 3.8732 8.2963 118.2911 43.2832 0.0000 170.4671 148 P 4.3008 0.0000 0.0000 62.1759 32.6352 174.9965 149 S 4.4297 8.4069 115.1457 57.9945 63.2687 174.1497 150 S 3.5228 8.7993 124.6679 57.6184 62.1854 172.7821 151 G 4.3739 8.6043 108.2594 46.3097 0.0000 173.3123 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 3.94 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 0.00 0.00 0.00 2 S 7.90 4.20 0.00 3.92 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 3 S 8.30 3.97 0.00 4.02 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 4 G 7.64 4.43 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 0.00 5 S 7.86 4.69 0.00 3.78 3.68 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 0.00 0.00 0.00 0.00 6 S 8.31 4.77 0.00 3.97 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 7 G 8.39 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 0.00 0.00 0.00 8 S 8.67 4.46 0.00 3.85 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 9 D 7.83 4.79 0.00 2.64 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 S 7.38 4.59 0.00 3.84 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 11 L 8.36 4.91 0.00 1.59 1.59 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 12 V 8.09 4.28 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 0.75 0.00 0.00 0.91 0.00 0.00 13 V 7.46 3.50 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 0.82 0.00 0.00 0.91 0.00 0.00 14 C 8.80 5.02 0.00 2.78 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 15 E 8.41 4.40 0.00 1.83 1.87 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 2.29 2.38 0.00 16 V 8.05 4.46 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 0.74 0.00 0.00 0.89 0.00 0.00 17 D 8.55 4.41 0.00 2.90 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 18 P 0.00 4.28 0.00 2.30 2.29 0.00 3.75 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.02 0.00 19 E 8.89 4.11 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.44 0.00 20 L 8.01 4.17 0.00 1.74 1.69 1.03 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 21 K 8.07 4.00 0.00 2.00 1.80 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.52 7.81 22 E 7.78 3.95 0.00 2.13 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 2.34 2.56 0.00 23 T 8.02 3.90 4.41 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 1.18 0.00 0.00 24 L 7.78 3.97 0.00 1.76 1.70 0.88 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 25 R 7.48 3.60 0.00 1.79 2.14 0.00 3.34 0.00 0.00 3.37 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.96 0.00 26 K 8.37 4.16 0.00 1.97 1.88 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.48 7.81 27 F 8.19 4.23 0.00 3.06 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 28 R 7.72 3.92 0.00 0.67 1.74 0.00 3.11 0.00 0.00 3.29 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.26 0.00 29 F 7.26 5.18 0.00 3.05 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 30 R 7.93 4.30 0.00 1.93 2.06 0.00 2.81 0.00 0.00 2.52 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 31 K 8.33 4.47 0.00 1.76 1.88 0.00 1.63 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.54 7.81 32 E 7.92 4.76 0.00 1.82 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 0.00 2.19 2.24 0.00 33 T 7.93 4.24 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 1.28 0.00 0.00 34 N 7.52 4.84 0.00 2.70 2.73 0.00 0.00 6.25 8.03 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 35 N 8.56 5.29 0.00 2.68 2.93 0.00 0.00 7.32 7.05 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 36 A 8.57 5.09 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 37 A 9.55 5.45 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 38 I 8.36 4.69 1.60 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 -0.36 0.84 0.00 0.00 39 I 8.49 4.84 1.87 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 0.69 0.97 0.00 0.00 40 M 9.33 5.34 0.00 2.05 2.24 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.50 0.00 41 K 9.10 5.22 0.00 1.92 2.05 0.00 1.28 0.00 0.00 1.79 0.00 0.00 3.20 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.58 1.53 7.81 42 V 8.12 4.80 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 -0.67 0.00 0.00 0.73 0.00 0.00 43 D 8.66 4.62 0.00 2.65 2.63 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 44 K 8.83 4.03 0.00 1.70 1.83 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.36 7.81 45 D 8.12 4.45 0.00 2.66 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 46 R 7.77 4.39 0.00 1.80 1.90 0.00 3.36 0.00 0.00 3.22 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 47 Q 8.06 3.27 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.23 6.74 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 48 M 7.26 5.06 0.00 2.20 2.08 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 2.54 2.52 0.00 49 V 9.05 4.26 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 1.21 0.00 0.00 1.08 0.00 0.00 50 V 9.05 4.77 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 0.75 0.00 0.00 0.99 0.00 0.00 51 L 8.71 4.13 0.00 1.64 1.61 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.56 4.59 0.00 2.08 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 2.19 2.36 0.00 53 D 8.52 4.63 0.00 2.54 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 54 E 8.64 4.93 0.00 1.76 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 2.02 2.23 0.00 55 L 8.89 4.87 0.00 1.62 1.56 0.95 0.60 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 56 Q 8.60 4.87 0.00 1.91 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.92 0.00 0.00 0.00 0.00 0.00 2.44 2.51 0.00 57 N 8.45 4.17 0.00 2.82 2.83 0.00 0.00 6.64 7.45 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 58 I 7.79 4.58 1.91 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.15 1.08 0.00 0.00 59 S 8.65 4.83 0.00 3.98 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 60 P 0.00 4.13 0.00 2.34 2.45 0.00 3.91 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.26 0.00 61 E 7.85 4.32 0.00 1.97 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 2.22 2.28 0.00 62 E 8.05 4.03 0.00 1.94 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 2.28 2.45 0.00 63 L 7.79 3.81 0.00 1.41 1.43 0.74 0.34 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 64 K 7.86 3.77 0.00 1.74 1.70 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.43 7.81 65 L 7.72 4.11 0.00 1.85 1.67 0.87 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.89 4.08 0.00 2.02 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 2.56 2.31 0.00 67 L 7.07 4.16 0.00 1.71 1.50 0.80 0.89 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 68 P 0.00 4.56 0.00 2.09 2.04 0.00 3.61 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 1.95 1.87 0.00 69 E 8.48 4.62 0.00 1.98 1.99 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 2.11 2.19 0.00 70 R 7.46 4.50 0.00 1.92 1.92 0.00 3.00 0.00 0.00 3.11 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.62 0.00 71 Q 7.75 4.21 0.00 1.89 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.95 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 72 P 0.00 4.49 0.00 1.30 1.80 0.00 3.67 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.94 0.00 73 R 8.40 4.04 0.00 1.95 1.83 0.00 2.69 0.00 0.00 3.12 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.47 0.00 74 F 8.87 5.24 0.00 3.20 3.01 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 75 V 8.05 4.74 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.91 0.00 0.00 76 V 9.12 4.77 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 1.29 0.00 0.00 1.17 0.00 0.00 77 Y 8.45 5.33 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 78 S 8.98 4.72 0.00 3.88 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 Y 8.09 4.47 0.00 2.98 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 K 6.43 4.82 0.00 1.70 1.32 0.00 1.90 0.00 0.00 1.54 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.71 7.81 81 Y 9.37 4.95 0.00 3.31 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 V 8.74 4.46 2.16 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 0.97 0.00 0.00 1.06 0.00 0.00 83 H 9.69 4.61 0.00 3.21 3.23 0.00 5.81 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 D 7.93 5.39 0.00 2.89 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 85 D 8.01 4.33 0.00 2.64 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 86 G 7.00 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 0.00 0.00 0.00 87 R 8.17 4.60 0.00 1.60 1.60 0.00 3.16 0.00 0.00 3.32 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.41 0.00 88 V 8.15 4.93 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 1.05 0.00 0.00 89 S 9.13 4.24 0.00 3.74 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 90 Y 7.85 5.66 0.00 2.82 2.92 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 91 P 0.00 4.46 0.00 2.32 2.22 0.00 4.19 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 92 L 8.31 4.35 0.00 1.59 1.74 0.78 1.13 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 93 C 9.07 5.06 0.00 3.08 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 94 F 8.89 4.87 0.00 3.10 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 95 I 8.77 4.61 2.06 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.25 1.01 0.00 0.00 96 F 8.96 4.80 0.00 3.35 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 97 S 8.97 4.50 0.00 3.93 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 98 S 7.84 4.63 0.00 3.35 2.63 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 99 P 0.00 4.54 0.00 2.14 2.00 0.00 3.52 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.88 0.00 100 V 8.16 4.17 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 0.66 0.00 0.00 0.90 0.00 0.00 101 G 7.78 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 0.00 102 C 7.68 4.52 0.00 3.04 2.92 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 0.00 103 K 8.11 4.48 0.00 1.83 1.76 0.00 1.66 0.00 0.00 1.87 0.00 0.00 3.12 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.48 1.47 7.81 104 P 0.00 4.46 0.00 2.28 2.32 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.03 0.00 105 E 8.08 3.80 0.00 2.01 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 2.31 2.35 0.00 106 Q 8.04 4.34 0.00 2.20 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.53 0.00 0.00 0.00 0.00 0.00 2.46 2.39 0.00 107 Q 7.99 4.02 0.00 2.37 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.97 0.00 0.00 0.00 0.00 0.00 2.35 2.57 0.00 108 M 7.82 4.17 0.00 2.03 2.25 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.65 0.00 109 M 8.65 4.05 0.00 1.71 2.17 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.56 0.00 110 Y 8.21 4.26 0.00 3.23 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.87 4.31 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 G 8.67 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 0.00 113 S 7.76 4.54 0.00 4.14 3.94 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 0.00 114 K 8.24 3.30 0.00 1.96 1.77 0.00 1.89 0.00 0.00 1.59 0.00 0.00 3.04 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.32 1.50 7.81 115 N 8.08 4.13 0.00 2.70 2.78 0.00 0.00 6.60 7.67 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 0.00 116 R 7.61 3.69 0.00 1.84 2.03 0.00 3.18 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.65 0.00 117 L 7.90 3.68 0.00 1.13 0.86 0.78 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 118 V 7.41 2.81 1.59 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 0.57 0.00 0.00 -1.04 0.00 0.00 119 Q 7.97 3.91 0.00 2.12 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.69 0.00 0.00 0.00 0.00 0.00 2.28 2.54 0.00 120 T 7.37 3.96 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 1.17 0.00 0.00 121 A 7.48 4.02 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 0.00 122 E 7.65 3.47 0.00 2.14 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 2.21 2.44 0.00 123 L 7.24 4.49 0.00 1.64 1.60 1.09 0.68 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 0.00 124 T 8.47 3.80 4.22 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 1.20 0.00 0.00 125 K 7.48 4.38 0.00 1.70 1.29 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.30 1.31 7.81 126 V 7.94 4.78 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 1.06 0.00 0.00 0.82 0.00 0.00 127 F 9.39 5.51 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 0.00 128 E 9.20 5.09 0.00 2.18 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 2.15 2.36 0.00 129 I 8.15 4.35 1.73 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.69 0.42 0.00 0.00 130 R 8.91 4.01 0.00 1.75 1.94 0.00 3.27 0.00 0.00 3.11 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 131 T 7.17 3.98 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 132 T 8.15 3.66 4.22 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 1.16 0.00 0.00 133 D 8.10 4.28 0.00 2.56 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 0.00 134 D 7.82 4.06 0.00 2.43 1.78 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 0.00 135 L 7.20 3.20 0.00 1.03 1.48 0.90 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 136 T 7.64 4.71 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 137 E 8.87 3.94 0.00 2.12 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 2.45 2.57 0.00 138 T 8.00 3.94 4.30 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 1.22 0.00 0.00 139 W 7.91 4.51 0.00 3.29 3.36 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 0.00 140 L 8.46 3.66 0.00 2.18 2.05 0.57 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 141 K 7.87 3.78 0.00 1.83 1.71 0.00 1.42 0.00 0.00 1.62 0.00 0.00 2.63 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.72 0.34 7.81 142 E 8.45 3.87 0.00 1.93 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 2.27 2.37 0.00 143 K 6.96 3.69 0.00 0.90 0.74 0.00 0.61 0.00 0.00 0.92 0.00 0.00 2.35 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.51 0.21 7.81 144 L 7.71 4.16 0.00 1.80 1.83 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.71 3.62 1.34 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 0.00 0.00 146 S 8.17 4.49 0.00 3.78 3.68 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 0.00 0.00 0.00 0.00 147 G 8.30 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 0.00 148 P 0.00 4.30 0.00 2.09 1.87 0.00 3.67 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.83 0.00 149 S 8.41 4.43 0.00 3.85 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 0.00 150 S 8.80 3.52 0.00 4.01 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 0.00 151 G 8.60 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 0.00 0.00 0.00 0.00