NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 D 4.5983 8.3649 120.3122 53.3781 41.0281 174.7912 6 C 4.4937 8.0454 116.6544 58.2084 30.6746 173.6060 7 C 4.4399 8.4177 125.1255 55.2063 44.4238 173.4479 8 S 4.4855 8.4378 122.5940 57.9173 64.7267 174.4625 9 Y 3.8576 8.4769 122.8614 60.7143 38.5821 177.7331 10 E 4.0771 8.3353 119.1043 59.6807 29.5938 178.7904 11 D 4.3899 8.6819 119.0540 57.4282 40.7982 179.0823 12 R 3.7669 7.8770 118.3693 59.3121 29.8918 178.8616 13 R 3.8201 7.9938 118.3881 59.5257 30.0048 178.0586 14 E 4.0998 8.5193 118.5623 59.6726 29.5525 179.5712 15 I 3.8836 8.0169 119.5969 64.5603 37.1041 178.4019 16 R 4.1664 8.4196 118.1558 58.8942 30.0837 176.6445 17 H 4.7359 7.7669 115.1868 58.6818 31.0038 176.1760 18 I 3.8466 8.3398 121.9635 64.5022 36.9912 178.0768 19 W 4.4288 9.0641 129.1292 60.7572 30.5210 177.5797 20 D 4.5501 7.8699 116.0900 56.5538 40.4985 177.3413 21 D 4.5841 7.7502 117.1279 55.4708 41.9617 177.9384 22 V 3.7587 7.7127 112.4395 62.4345 32.5998 176.7383 23 W 4.1658 7.3154 127.6142 56.9724 30.2745 177.1472 24 S 4.2610 7.4337 114.4766 60.8803 63.5560 174.7030 25 S 4.3248 7.5099 117.6781 57.4351 63.5600 173.6287 26 S 4.6205 8.6078 115.4211 58.2289 63.2615 173.4448 27 F 4.5467 7.5013 118.6749 56.2687 40.9715 175.1402 28 T 3.7432 9.2045 116.5138 66.1742 68.4004 177.6292 29 D 3.9201 6.9051 120.2499 55.0804 41.9337 178.4463 30 R 3.7766 7.4653 117.8661 59.1336 30.0961 178.4814 31 R 3.7215 7.6025 115.0252 59.9471 29.0963 178.1236 32 V 3.4878 7.8021 118.1904 65.6199 31.4002 177.4268 33 A 4.0077 8.0658 119.6713 55.6161 18.2381 179.7221 34 I 3.5236 7.7005 117.8581 64.5480 37.3094 178.6392 35 V 3.4834 8.0630 119.2070 66.2779 31.1983 177.7864 36 R 3.9301 8.6581 118.4432 59.3127 29.7752 178.0830 37 A 3.9120 8.2426 120.9979 55.3077 18.6572 179.7549 38 V 3.2408 7.5005 116.5322 66.0982 31.5674 178.2641 39 F 3.6286 7.6894 117.4111 60.5226 38.7155 177.2627 40 D 4.6394 8.4115 118.8191 57.5514 40.1439 178.3609 41 D 4.4457 7.8070 117.7021 56.4162 41.1967 178.1100 42 L 3.8987 7.3438 120.8164 58.1340 41.7607 178.6390 43 F 4.8350 8.3667 118.2274 60.3758 38.6663 177.5821 44 K 4.1791 8.2760 118.2746 58.8149 32.0252 177.5848 45 H 4.6984 7.9337 114.8102 56.1481 31.7067 174.6169 46 Y 4.9065 8.8688 117.4416 54.6331 38.1208 174.1653 47 P 4.5917 0.0000 0.0000 65.3080 30.9172 178.4983 48 T 3.9418 8.2681 109.4041 65.1046 68.5062 175.9883 49 S 3.7003 8.2101 117.1095 60.6512 62.5861 176.1615 50 K 2.9522 7.8032 122.6540 59.4266 31.8946 177.8583 51 A 3.9107 7.5207 119.4354 55.5832 17.9693 179.3252 52 L 3.8126 7.7508 116.1609 57.1618 41.8036 178.1251 53 F 4.7748 8.0903 116.7082 57.2873 39.5405 177.8657 54 E 4.0102 8.0223 123.2822 59.0002 29.5006 179.5391 55 R 3.8684 8.0145 118.2064 58.6974 30.1839 177.1771 56 V 4.1566 7.4121 108.0883 60.3075 32.8106 175.3932 57 K 3.7061 7.9665 119.6556 57.2557 28.7719 176.8128 58 I 2.6257 7.1625 111.6889 62.5220 38.4113 177.8672 59 D 4.3442 7.8062 119.6730 55.0654 39.7963 176.3672 60 E 4.5577 7.4234 120.5792 52.8120 29.3226 174.1149 61 P 4.2615 0.0000 0.0000 65.9868 31.3166 178.1509 62 E 4.4569 8.2132 115.3239 55.6357 29.6115 177.4462 63 S 4.1778 8.3085 115.7992 62.2297 63.0906 174.6637 64 G 4.2882 8.6219 110.1288 45.6202 0.0000 175.6545 65 E 4.0144 8.3113 118.9279 58.6349 29.3610 178.7911 66 F 4.4310 8.8268 120.9913 60.5762 39.8061 177.5648 67 K 3.6301 8.2237 117.9109 59.5928 31.8463 178.8163 68 S 4.1226 8.1558 114.3120 62.2063 62.5304 175.6313 69 H 4.0823 7.7362 121.1996 58.9121 29.5324 176.7569 70 L 3.8188 7.7758 120.4777 57.9695 41.4964 179.7883 71 V 3.6670 7.7971 117.6480 66.3941 31.3654 178.0591 72 R 3.8580 8.1354 117.6734 59.3516 29.8711 179.2628 73 V 3.6666 8.0617 117.6824 66.3358 31.6312 177.3103 74 A 4.2814 8.8061 120.5295 56.0206 18.2432 179.0262 75 N 4.4045 9.7888 114.8176 56.6447 38.6590 177.9864 76 G 3.8013 8.5229 107.2174 47.3921 0.0000 175.7098 77 L 3.8099 7.8797 122.6542 57.7250 42.1388 178.4819 78 K 3.2932 7.9842 120.0772 59.5801 31.7030 178.0320 79 L 3.8336 7.8791 119.0419 58.4727 42.0587 178.5714 80 L 3.9375 7.4135 118.7912 57.5353 41.5085 179.1230 81 I 3.4511 7.4149 119.2374 64.6890 36.8864 178.3191 82 N 4.7661 7.8829 112.3296 53.6071 38.2892 175.4120 83 L 4.6265 7.9434 122.4186 54.3958 43.7771 178.0514 84 L 3.8696 7.6757 117.7480 57.3822 41.5992 177.2152 85 D 4.6249 7.8330 115.7931 54.2822 41.9545 175.7914 86 D 4.8272 7.9731 119.8978 59.4572 41.2407 181.6495 87 T 3.1159 6.6392 106.6175 62.1380 71.5485 173.2089 88 L 3.9074 7.6841 119.8890 57.2651 41.9187 180.0281 89 V 3.6432 8.1763 118.1257 65.6843 31.5146 177.6436 90 L 3.8690 7.8592 119.6730 58.4569 41.4336 178.5583 91 Q 4.0818 8.6006 119.4962 59.0132 28.7302 178.4050 92 S 3.9915 7.5685 112.7620 61.5018 62.6237 175.5755 93 H 4.1000 8.4464 121.0463 59.1087 29.2525 176.9088 94 L 3.9207 8.2705 122.2174 57.6903 42.0742 179.0611 95 G 3.6009 7.4841 105.4980 48.1655 0.0000 175.0026 96 H 3.9948 8.3194 121.7714 59.0323 29.4636 176.8014 97 L 3.9966 7.9109 120.8425 57.4493 42.0189 178.6507 98 A 4.0723 8.4349 121.5232 55.3116 18.3641 179.0250 99 D 3.9841 8.1449 116.6520 57.9186 40.6635 178.9975 100 Q 4.1770 7.8287 116.0448 57.8246 28.9085 176.9389 101 H 4.8031 9.0540 117.3968 56.0529 30.1123 176.5120 102 I 3.8012 7.5893 120.9272 64.2317 37.1944 176.8847 103 Q 4.1420 7.8150 116.3336 56.8072 28.6781 176.7361 104 R 4.2727 7.3890 119.4173 53.7942 29.1009 174.7388 105 K 3.8112 8.2875 123.4102 57.7730 32.4423 176.7767 106 G 4.0254 9.0518 113.2960 45.3319 0.0000 173.4519 107 V 4.2398 7.4726 120.5703 62.1138 30.8465 176.2787 108 T 4.4087 8.8224 118.5882 60.7641 71.1299 175.3065 109 K 4.1412 8.3745 121.5306 59.0523 32.1363 178.6084 110 E 3.9333 7.9881 119.5086 59.6409 29.7915 177.8287 111 Y 4.2070 8.0854 117.0715 61.4276 37.9068 179.2362 112 F 3.8734 8.1059 118.7406 60.6652 38.8778 177.6891 113 R 4.1155 7.9692 117.9447 59.3067 29.7204 178.6827 114 G 3.2117 8.0415 105.8118 47.4210 0.0000 175.6278 115 I 3.8790 7.8955 120.7481 63.1082 37.9469 178.2799 116 G 3.9325 8.4096 107.1957 47.9937 0.0000 175.5983 117 E 4.0914 7.9032 119.6262 59.1885 29.6775 178.6031 118 A 4.1358 7.7575 121.7059 54.7659 18.2245 179.3919 119 F 3.6924 8.1908 114.2621 60.5927 39.0214 177.8381 120 A 4.1996 7.7638 117.3040 54.1234 18.2048 178.2775 121 R 4.3583 7.8629 115.8404 56.9052 31.8862 177.4588 122 V 3.6700 7.2909 117.6916 64.9663 31.7681 177.3807 123 L 3.5019 7.6432 118.9059 57.2189 41.3190 177.8494 124 P 4.2271 0.0000 0.0000 64.7879 31.1114 176.8335 125 Q 4.3971 8.2081 117.0675 56.7191 30.2547 177.2208 126 V 3.9313 7.4759 111.8923 61.3409 32.2331 175.8035 127 L 4.4996 6.7398 116.7065 54.5249 42.9223 175.0569 128 S 4.5601 8.3456 116.3577 58.2177 64.9386 173.2130 129 C 3.7700 8.4337 115.6241 61.1172 24.5689 174.0868 130 F 4.8616 8.0275 120.6905 56.8531 40.8974 176.2034 131 N 4.5461 8.2595 129.8163 52.1703 35.5096 175.2341 132 V 3.1388 7.0328 125.7837 64.7735 31.9888 178.0881 133 D 4.2686 8.0366 118.9307 56.8605 40.8573 178.1349 134 A 3.9456 7.9704 120.5954 55.3405 18.2490 178.8851 135 W 3.9591 8.2077 126.4701 60.5439 30.7127 177.4744 136 N 4.4136 8.9999 116.5535 56.9680 38.2212 177.1187 137 R 3.8595 8.6125 119.1501 59.9268 30.2553 178.5867 138 C 4.2771 8.1746 115.7009 59.4760 37.6602 176.0953 139 F 3.5690 8.1930 123.2848 61.0853 38.8431 176.9536 140 H 4.0025 8.4331 116.0092 58.8440 28.1040 177.5569 141 R 3.7987 7.6803 119.9429 59.4439 29.6607 178.5538 142 L 3.7627 7.3288 118.0619 57.5803 41.5011 179.5783 143 V 3.3784 7.7016 118.1996 65.9041 31.2633 177.4266 144 A 3.8589 8.0590 119.3436 55.6850 18.2416 179.4165 145 R 3.8628 7.3271 114.6686 59.3435 30.1322 178.6270 146 I 3.7092 7.1275 119.0283 63.1219 37.7439 177.2461 147 A 4.4040 7.4145 121.6780 51.2107 19.0650 177.5746 148 K 3.9998 7.9013 123.9212 59.5122 32.7905 176.9300 149 D 4.8857 7.7054 114.9667 53.8938 41.5753 176.9426 150 L 4.0745 7.7968 121.2917 56.9990 41.9380 175.2322 151 P 4.4413 0.0000 0.0000 63.1599 30.8356 175.5600 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 5 D 8.36 4.60 0.00 2.78 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 6 C 8.05 4.49 0.00 3.01 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 7 C 8.42 4.44 0.00 2.84 2.95 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 0.00 0.00 0.00 8 S 8.44 4.49 0.00 4.20 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 9 Y 8.48 3.86 0.00 3.05 2.95 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 0.00 0.00 0.00 10 E 8.34 4.08 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 2.44 2.54 0.00 11 D 8.68 4.39 0.00 2.76 2.68 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 12 R 7.88 3.77 0.00 1.74 1.69 0.00 2.93 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 1.47 1.48 0.00 13 R 7.99 3.82 0.00 1.91 2.22 0.00 3.18 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.74 0.00 14 E 8.52 4.10 0.00 2.15 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 2.49 2.52 0.00 15 I 8.02 3.88 2.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.71 0.95 0.00 0.00 16 R 8.42 4.17 0.00 1.90 2.13 0.00 3.26 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.66 0.00 17 H 7.77 4.74 0.00 3.40 3.58 0.00 5.87 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 18 I 8.34 3.85 2.35 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.25 1.37 0.00 0.00 19 W 9.06 4.43 0.00 3.56 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 7.87 4.55 0.00 2.88 2.77 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 21 D 7.75 4.58 0.00 2.64 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 22 V 7.71 3.76 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 0.65 0.00 0.00 -0.10 0.00 0.00 23 W 7.32 4.17 0.00 2.33 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 S 7.43 4.26 0.00 3.97 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 25 S 7.51 4.32 0.00 4.01 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 26 S 8.61 4.62 0.00 3.94 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 27 F 7.50 4.55 0.00 2.89 2.95 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 0.00 0.00 0.00 28 T 9.20 3.74 4.19 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 1.15 0.00 0.00 29 D 6.91 3.92 0.00 2.76 2.69 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 30 R 7.47 3.78 0.00 1.74 1.66 0.00 3.06 0.00 0.00 3.27 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 31 R 7.60 3.72 0.00 1.71 1.33 0.00 2.82 0.00 0.00 2.86 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 32 V 7.80 3.49 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 0.79 0.00 0.00 0.88 0.00 0.00 33 A 8.07 4.01 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 34 I 7.70 3.52 1.96 0.00 0.00 0.72 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 0.77 0.83 0.00 0.00 35 V 8.06 3.48 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 1.14 0.00 0.00 1.19 0.00 0.00 36 R 8.66 3.93 0.00 1.94 2.06 0.00 3.21 0.00 0.00 3.24 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.77 0.00 37 A 8.24 3.91 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 38 V 7.50 3.24 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 -0.30 0.00 0.00 0.17 0.00 0.00 39 F 7.69 3.63 0.00 3.06 2.33 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 40 D 8.41 4.64 0.00 2.80 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 D 7.81 4.45 0.00 2.65 2.68 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 42 L 7.34 3.90 0.00 1.57 1.43 0.91 1.12 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 43 F 8.37 4.84 0.00 3.14 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 44 K 8.28 4.18 0.00 2.00 2.00 0.00 1.82 0.00 0.00 1.78 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.52 7.81 45 H 7.93 4.70 0.00 3.44 3.28 0.00 5.84 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 46 Y 8.87 4.91 0.00 3.34 3.29 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 47 P 0.00 4.59 0.00 2.32 2.48 0.00 4.06 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 2.17 1.96 0.00 48 T 8.27 3.94 4.60 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 1.35 0.00 0.00 49 S 8.21 3.70 0.00 3.99 3.24 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 50 K 7.80 2.95 0.00 1.54 1.68 0.00 1.40 0.00 0.00 1.44 0.00 0.00 2.73 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.00 0.34 7.81 51 A 7.52 3.91 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 52 L 7.75 3.81 0.00 1.32 1.16 0.70 0.60 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 53 F 8.09 4.77 0.00 2.97 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 54 E 8.02 4.01 0.00 2.02 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 2.25 2.37 0.00 55 R 8.01 3.87 0.00 1.72 1.94 0.00 3.38 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 56 V 7.41 4.16 2.24 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 0.78 0.00 0.00 1.22 0.00 0.00 57 K 7.97 3.71 0.00 2.01 1.83 0.00 1.68 0.00 0.00 1.93 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.33 1.37 7.81 58 I 7.16 2.63 1.27 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.25 0.47 0.00 0.00 59 D 7.81 4.34 0.00 2.72 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 60 E 7.42 4.56 0.00 2.02 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 2.18 2.15 0.00 61 P 0.00 4.26 0.00 2.24 2.25 0.00 3.77 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 62 E 8.21 4.46 0.00 2.01 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 2.32 2.26 0.00 63 S 8.31 4.18 0.00 3.97 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 0.00 64 G 8.62 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 0.00 0.00 0.00 0.00 65 E 8.31 4.01 0.00 2.24 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 0.00 2.45 2.35 0.00 66 F 8.83 4.43 0.00 3.29 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 67 K 8.22 3.63 0.00 1.84 1.82 0.00 1.74 0.00 0.00 2.04 0.00 0.00 3.20 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.57 7.81 68 S 8.16 4.12 0.00 4.07 4.31 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 69 H 7.74 4.08 0.00 3.17 3.49 0.00 5.82 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 L 7.78 3.82 0.00 1.73 1.67 0.49 0.67 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 71 V 7.80 3.67 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 1.12 0.00 0.00 0.92 0.00 0.00 72 R 8.14 3.86 0.00 2.14 2.05 0.00 3.24 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.72 0.00 73 V 8.06 3.67 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 1.29 0.00 0.00 1.05 0.00 0.00 74 A 8.81 4.28 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 0.00 0.00 0.00 0.00 0.00 75 N 9.79 4.40 0.00 3.08 3.03 0.00 0.00 7.05 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 G 8.52 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 77 L 7.88 3.81 0.00 1.84 1.95 0.68 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 78 K 7.98 3.29 0.00 0.79 1.42 0.00 1.49 0.00 0.00 0.98 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.04 1.29 7.81 79 L 7.88 3.83 0.00 1.70 1.79 0.61 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 80 L 7.41 3.94 0.00 1.66 1.43 0.75 0.72 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 81 I 7.41 3.45 1.28 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 -0.07 0.67 0.00 0.00 82 N 7.88 4.77 0.00 2.76 2.78 0.00 0.00 6.82 7.40 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 83 L 7.94 4.63 0.00 1.90 1.49 0.85 0.83 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 84 L 7.68 3.87 0.00 1.59 1.56 0.75 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 85 D 7.83 4.62 0.00 2.56 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 86 D 7.97 4.83 0.00 2.70 2.58 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 87 T 6.64 3.12 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 1.18 0.00 0.00 88 L 7.68 3.91 0.00 1.69 1.78 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 89 V 8.18 3.64 2.14 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 1.05 0.00 0.00 0.91 0.00 0.00 90 L 7.86 3.87 0.00 1.85 1.83 0.82 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 91 Q 8.60 4.08 0.00 2.06 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.58 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 92 S 7.57 3.99 0.00 3.96 3.95 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 0.00 0.00 0.00 93 H 8.45 4.10 0.00 3.25 3.28 0.00 5.84 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 L 8.27 3.92 0.00 1.78 1.60 0.79 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 95 G 7.48 3.60 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 0.00 0.00 0.00 96 H 8.32 3.99 0.00 3.24 3.48 0.00 5.78 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 L 7.91 4.00 0.00 1.62 1.72 0.96 1.13 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 98 A 8.43 4.07 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 99 D 8.14 3.98 0.00 2.79 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.83 4.18 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.76 0.00 0.00 0.00 0.00 0.00 2.29 2.52 0.00 101 H 9.05 4.80 0.00 3.29 3.45 0.00 5.81 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 I 7.59 3.80 1.86 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 1.37 0.62 0.90 0.00 0.00 103 Q 7.81 4.14 0.00 2.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 7.01 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 104 R 7.39 4.27 0.00 1.98 1.83 0.00 3.23 0.00 0.00 3.06 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.59 0.00 105 K 8.29 3.81 0.00 1.71 1.74 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.46 7.81 106 G 9.05 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 V 7.47 4.24 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 1.21 0.00 0.00 1.03 0.00 0.00 108 T 8.82 4.41 4.10 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 1.04 0.00 0.00 109 K 8.37 4.14 0.00 1.91 1.82 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.84 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.48 1.57 7.81 110 E 7.99 3.93 0.00 2.04 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 2.42 2.53 0.00 111 Y 8.09 4.21 0.00 3.16 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 0.00 112 F 8.11 3.87 0.00 3.46 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 0.00 113 R 7.97 4.12 0.00 1.90 2.15 0.00 3.39 0.00 0.00 3.29 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.88 0.00 114 G 8.04 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 I 7.90 3.88 1.76 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.96 1.00 0.00 0.00 116 G 8.41 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 0.00 117 E 7.90 4.09 0.00 2.13 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 0.00 2.48 2.73 0.00 118 A 7.76 4.14 1.17 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 0.00 0.00 119 F 8.19 3.69 0.00 2.97 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 0.00 120 A 7.76 4.20 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.86 4.36 0.00 1.98 1.85 0.00 3.27 0.00 0.00 3.17 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 122 V 7.29 3.67 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 0.82 0.00 0.00 0.75 0.00 0.00 123 L 7.64 3.50 0.00 0.57 0.20 -0.29 0.75 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 0.00 124 P 0.00 4.23 0.00 2.23 2.35 0.00 3.48 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.29 0.00 125 Q 8.21 4.40 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.84 6.92 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 126 V 7.48 3.93 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 0.64 0.00 0.00 0.77 0.00 0.00 127 L 6.74 4.50 0.00 1.79 1.51 0.99 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 128 S 8.35 4.56 0.00 3.89 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 0.00 129 C 8.43 3.77 0.00 3.20 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 0.00 130 F 8.03 4.86 0.00 2.85 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 N 8.26 4.55 0.00 2.77 2.58 0.00 0.00 6.88 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 0.00 132 V 7.03 3.14 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 0.92 0.00 0.00 1.05 0.00 0.00 133 D 8.04 4.27 0.00 2.72 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 0.00 134 A 7.97 3.95 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 W 8.21 3.96 0.00 3.30 3.04 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 0.00 136 N 9.00 4.41 0.00 3.13 2.94 0.00 0.00 7.15 7.56 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 0.00 137 R 8.61 3.86 0.00 1.93 1.92 0.00 3.23 0.00 0.00 3.15 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.82 0.00 138 C 8.17 4.28 0.00 2.76 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 0.00 139 F 8.19 3.57 0.00 2.15 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 0.00 140 H 8.43 4.00 0.00 3.49 3.33 0.00 5.88 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 R 7.68 3.80 0.00 1.76 1.80 0.00 3.15 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.75 0.00 142 L 7.33 3.76 0.00 1.36 1.32 0.53 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 143 V 7.70 3.38 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 1.16 0.00 0.00 0.52 0.00 0.00 144 A 8.06 3.86 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 0.00 145 R 7.33 3.86 0.00 1.71 1.85 0.00 3.23 0.00 0.00 3.15 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 146 I 7.13 3.71 1.74 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 1.33 0.75 0.65 0.00 0.00 147 A 7.41 4.40 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 K 7.90 4.00 0.00 1.75 1.76 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.40 7.81 149 D 7.71 4.89 0.00 2.62 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 0.00 150 L 7.80 4.07 0.00 1.60 1.64 0.59 1.19 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 0.00 151 P 0.00 4.44 0.00 2.15 2.06 0.00 3.71 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 1.97 1.98 0.00