NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 L 4.4796 8.0276 120.5858 53.0330 43.6414 175.4277 4 K 4.5938 8.0440 120.7933 54.7242 34.7557 171.2322 5 V 4.0682 9.1416 124.4123 61.6292 33.0034 176.6782 6 K 4.2871 8.8895 127.1158 57.7998 32.8697 176.2196 7 G 4.0335 7.5823 105.2610 43.3166 0.0000 173.2215 8 A 3.8113 8.5745 120.0234 55.0623 18.0107 179.6969 9 R 2.5100 7.6231 116.6771 59.3665 30.0759 178.3438 10 D 4.3099 7.6478 117.9974 57.0119 40.6485 179.1161 11 V 3.4662 7.3062 118.4801 65.9693 31.2636 177.5254 12 F 4.0207 7.7018 120.3864 61.5012 38.8769 176.9652 13 E 3.7731 8.0685 117.1892 59.1984 29.3438 178.1834 14 Y 4.0325 7.9170 119.0534 60.9163 39.1199 177.7449 15 M 3.8340 8.0431 118.4193 55.4422 32.1000 176.1388 16 K 3.8397 6.6426 121.0585 57.0418 32.5602 177.2279 17 G 3.8584 8.6989 114.1790 45.7701 0.0000 173.7616 18 R 4.1541 7.4776 117.2773 56.0355 30.7020 176.3658 19 I 4.0722 7.2974 119.9522 59.7843 37.8899 173.4941 20 P 4.4649 0.0000 0.0000 64.9875 31.6651 176.2575 21 D 4.8096 7.7517 115.9783 51.6807 41.9290 175.9465 22 E 4.2162 8.9003 121.5402 58.6489 30.0661 178.8689 23 T 3.9429 8.0964 115.4049 66.0201 68.5929 174.0575 24 K 4.6486 7.5762 117.9181 54.2737 34.6000 175.6259 25 E 4.5865 8.3257 120.6134 56.1235 30.8621 175.6165 26 H 5.2119 9.5670 120.4999 53.7296 33.3727 172.1017 27 L 5.1033 8.1708 122.7183 53.3993 44.4983 175.3553 28 F 5.4286 9.8675 125.3709 55.7898 43.1069 174.3123 29 V 4.6194 8.5364 120.0175 61.1060 34.5373 174.0950 30 L 4.7745 8.8719 127.8340 53.1915 43.8317 175.2588 31 F 5.2398 8.6479 122.7547 55.9930 41.0089 174.9256 32 L 5.3872 8.9317 123.8089 52.7225 45.2885 176.8175 33 S 4.6836 8.9726 117.4239 57.6290 64.1372 175.2223 34 T 3.6255 8.4589 116.9738 66.7780 68.0426 175.4685 35 K 4.2365 7.9980 117.5541 56.0829 32.1593 176.3155 36 N 4.2522 8.2996 115.8786 54.2764 36.7104 173.5756 37 Q 4.5822 7.9512 117.4147 54.8895 29.7297 175.4095 38 I 4.0506 8.0783 124.0695 61.9027 36.8617 176.0632 39 L 4.3375 9.4662 129.4623 57.1482 42.3744 176.9006 40 R 4.7449 7.5076 112.5294 56.1559 32.4173 172.4420 41 H 5.5335 8.8541 113.3526 54.4443 32.1138 172.2616 42 E 4.9490 9.0477 117.1494 55.0069 34.1091 174.8675 43 T 4.5611 8.5963 118.2136 63.2226 69.2676 174.3774 44 I 4.2936 8.6445 126.8623 62.7689 39.0015 176.2941 45 T 4.7540 7.4890 116.4302 61.7185 73.0142 173.3387 46 I 4.7103 8.3767 123.9050 60.6232 40.6428 174.6191 47 G 3.7092 9.0935 111.2099 43.9605 0.0000 172.6685 48 T 3.8198 8.3437 113.9460 64.1134 68.6570 173.4562 49 L 4.2403 8.2529 127.9044 54.4539 42.2385 175.9925 50 T 4.5590 8.1265 115.8973 59.4152 71.5347 174.2604 51 A 3.8869 8.9213 129.0505 55.5687 18.6127 179.2116 52 S 3.9918 8.1962 108.3892 61.6066 62.2366 175.1113 53 L 4.3537 7.8818 116.8476 54.4981 41.6297 176.1588 54 I 4.2430 7.5822 113.6450 59.1155 39.1019 174.7369 55 H 4.7876 8.5006 122.5353 53.1958 29.8573 172.9370 56 P 4.3821 0.0000 0.0000 65.7765 31.0494 178.7268 57 R 4.1163 8.1153 114.3428 58.8787 29.5615 178.6059 58 E 4.0584 8.5229 119.5750 58.9836 29.8081 178.6854 59 I 3.6722 7.7034 119.2542 64.6974 37.1684 178.3194 60 F 4.4586 8.2085 117.7282 59.5418 38.7111 177.9821 61 K 3.9446 8.0799 119.4086 59.3369 31.9527 178.4939 62 A 3.8222 7.9078 120.4329 55.0740 18.3409 179.2132 63 A 3.7657 8.0553 119.1213 55.4601 18.3919 179.8539 64 I 3.5946 8.0428 118.2875 64.5929 37.0104 178.3219 65 R 3.8410 7.9482 118.4003 59.7011 29.8917 177.4856 66 E 4.0872 7.8963 114.5141 55.5562 29.7263 176.5475 67 S 3.6934 8.1198 114.2129 59.1200 61.1989 172.6858 68 A 4.1922 8.3030 123.0023 52.4986 18.9423 178.0950 69 H 4.6053 9.1494 124.3948 58.9597 31.2366 174.8444 70 S 4.9836 7.9119 111.0102 57.0367 67.0935 172.6020 71 I 5.1782 8.7680 111.9865 59.3039 41.2768 174.2583 72 I 4.9709 8.3248 123.5636 59.5791 40.7890 174.5359 73 L 4.7948 8.5179 126.6730 53.7922 43.4275 175.8811 74 V 5.5975 8.7413 122.3900 60.3627 35.0268 173.5466 75 H 5.6932 9.0883 126.6503 54.3702 32.7554 171.2412 76 N 5.8573 8.8249 122.8546 50.8956 39.8766 173.3755 77 H 5.1019 8.6225 120.4088 53.6569 29.6593 174.3034 78 P 4.4940 0.0000 0.0000 64.8483 31.2307 177.8141 79 S 4.1228 8.0827 113.0445 59.4943 62.8847 175.4385 80 G 3.8998 8.3281 108.6592 44.8339 0.0000 172.6760 81 D 4.4867 7.6467 119.2155 54.0738 40.7303 175.7705 82 V 4.3245 8.2268 119.3110 61.1892 31.9217 176.4088 83 Q 3.5677 7.9490 120.2766 54.4592 29.0414 174.4375 84 P 4.2400 0.0000 0.0000 62.5621 32.0572 176.5919 85 S 4.3953 8.6566 118.2894 58.1015 63.6260 174.9600 86 N 4.4204 8.6083 118.7128 56.3811 38.4359 177.3175 87 A 4.2719 8.0141 123.2933 54.7174 18.4625 179.0599 88 D 4.3957 8.0734 116.2104 57.7798 40.9388 179.9248 89 K 4.3860 8.2519 118.3227 59.1156 32.0173 179.7119 90 Q 4.0405 8.5355 119.0801 58.9420 28.7075 178.6260 91 V 3.6946 7.7328 112.7750 64.8872 31.5844 178.3147 92 T 3.7299 7.5169 115.1542 66.8996 68.4003 176.3806 93 S 4.1232 7.8080 114.6184 61.4689 62.4367 176.3568 94 I 3.7587 7.5953 122.2223 64.4413 36.8950 178.4463 95 L 4.2255 8.1986 120.0841 57.5280 41.3972 179.4367 96 K 3.9567 8.4300 119.9329 59.5022 32.1719 178.8705 97 K 3.8801 7.9651 118.0311 59.5034 31.9802 178.9216 98 A 3.9392 8.1311 121.0227 55.4123 18.1812 180.0260 99 G 3.5671 8.2348 105.2153 47.1510 0.0000 175.8389 100 D 4.3145 8.0768 121.2644 57.0571 40.6226 178.4381 101 L 3.9146 7.6819 119.6539 58.1427 42.2717 178.5099 102 L 4.0997 7.6858 115.4007 54.3042 41.9751 176.6506 103 Q 3.5162 7.6316 116.2041 57.3526 26.8657 174.5272 104 I 4.7958 7.5770 118.2383 57.5372 38.5351 173.8814 105 E 3.9905 8.3473 126.5750 56.0466 31.0797 175.2576 106 L 4.6250 8.6271 129.0086 54.9748 41.3867 175.8448 107 L 4.2393 8.6502 129.8861 57.8796 42.8906 175.8788 108 D 4.7456 7.7449 115.8187 53.5671 45.4290 173.2635 109 H 5.3469 8.8731 120.4863 54.3678 32.8721 171.8812 110 V 5.1791 9.4252 126.5624 61.3483 34.0782 174.1310 111 I 5.1112 9.1125 129.1522 60.3094 39.1304 175.1968 112 V 5.1335 9.1864 120.2856 60.0058 34.9914 175.6624 113 G 4.3149 9.2273 112.3779 44.6274 0.0000 171.7555 114 N 4.4583 8.8191 119.0755 54.2076 38.0495 175.8839 115 N 4.8233 9.3617 119.8084 53.5564 37.3323 173.6638 116 D 4.7323 7.7702 117.0627 51.9780 44.4065 173.7958 117 W 5.8390 7.5507 117.9335 55.4026 31.5759 173.6093 118 F 4.7773 9.8623 123.1063 56.6084 42.0406 173.2493 119 S 4.9573 8.3449 121.0024 57.3539 63.6885 174.3859 120 F 4.0075 9.5544 126.8133 60.9846 39.2180 177.7637 121 R 3.9690 8.9116 119.0850 59.5703 29.9561 178.1263 122 D 4.4449 8.1608 116.1370 56.6160 40.9683 176.6434 123 H 4.4496 7.5628 113.5566 54.9910 28.6507 175.1035 124 A 3.7485 7.7543 119.8505 53.1539 16.4945 178.7167 125 L 4.4798 7.9987 115.6568 55.6257 41.7625 176.9372 126 L 4.3996 7.8421 126.5132 55.1656 42.1050 175.9090 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 3 L 8.03 4.48 0.00 1.62 1.84 0.93 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 4 K 8.04 4.59 0.00 1.91 1.78 0.00 1.55 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.47 7.81 5 V 9.14 4.07 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.80 0.00 0.00 6 K 8.89 4.29 0.00 1.78 1.83 0.00 1.81 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.60 1.50 7.81 7 G 7.58 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 8 A 8.57 3.81 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 9 R 7.62 2.51 0.00 1.84 1.84 0.00 3.26 0.00 0.00 3.47 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 10 D 7.65 4.31 0.00 2.80 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.31 3.47 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 1.00 0.00 0.00 0.83 0.00 0.00 12 F 7.70 4.02 0.00 2.84 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 13 E 8.07 3.77 0.00 1.95 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 2.39 2.52 0.00 14 Y 7.92 4.03 0.00 2.92 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 15 M 8.04 3.83 0.00 1.78 1.89 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.63 0.00 16 K 6.64 3.84 0.00 1.27 1.42 0.00 1.48 0.00 0.00 1.06 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.24 1.25 7.81 17 G 8.70 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 18 R 7.48 4.15 0.00 1.52 1.60 0.00 2.21 0.00 0.00 2.53 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.15 0.00 19 I 7.30 4.07 1.84 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.29 0.96 0.00 0.00 20 P 0.00 4.46 0.00 2.14 2.19 0.00 3.55 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.17 0.00 21 D 7.75 4.81 0.00 2.79 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 22 E 8.90 4.22 0.00 2.09 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 2.43 2.35 0.00 23 T 8.10 3.94 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 24 K 7.58 4.65 0.00 1.67 1.64 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.60 1.56 7.81 25 E 8.33 4.59 0.00 1.95 1.91 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 2.61 2.21 0.00 26 H 9.57 5.21 0.00 2.97 2.12 0.00 5.75 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 L 8.17 5.10 0.00 1.60 1.35 0.82 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 28 F 9.87 5.43 0.00 2.84 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 29 V 8.54 4.62 1.71 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 0.32 0.00 0.00 0.74 0.00 0.00 30 L 8.87 4.77 0.00 1.55 1.32 0.86 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 31 F 8.65 5.24 0.00 2.98 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 L 8.93 5.39 0.00 1.56 1.52 0.92 0.66 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 33 S 8.97 4.68 0.00 3.97 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 34 T 8.46 3.63 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 1.10 0.00 0.00 35 K 8.00 4.24 0.00 1.73 1.82 0.00 1.88 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.44 7.81 36 N 8.30 4.25 0.00 2.93 2.99 0.00 0.00 6.99 8.51 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 37 Q 7.95 4.58 0.00 2.07 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.47 6.98 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 38 I 8.08 4.05 1.51 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.18 0.53 0.00 0.00 39 L 9.47 4.34 0.00 1.64 1.76 1.00 -0.06 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 40 R 7.51 4.74 0.00 1.93 2.10 0.00 2.94 0.00 0.00 3.76 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.82 0.00 41 H 8.85 5.53 0.00 3.27 3.30 0.00 5.47 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 E 9.05 4.95 0.00 2.03 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 2.35 2.59 0.00 43 T 8.60 4.56 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 1.08 0.00 0.00 44 I 8.64 4.29 1.78 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.51 0.87 0.00 0.00 45 T 7.49 4.75 4.15 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 1.16 0.00 0.00 46 I 8.38 4.71 1.79 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 1.17 0.50 0.81 0.00 0.00 47 G 9.09 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 T 8.34 3.82 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 1.21 0.00 0.00 49 L 8.25 4.24 0.00 1.64 1.58 0.64 0.87 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 50 T 8.13 4.56 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 51 A 8.92 3.89 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 52 S 8.20 3.99 0.00 3.83 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 53 L 7.88 4.35 0.00 1.76 1.66 0.91 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 54 I 7.58 4.24 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 1.25 0.65 0.85 0.00 0.00 55 H 8.50 4.79 0.00 3.20 3.29 0.00 5.65 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 P 0.00 4.38 0.00 2.27 2.36 0.00 3.66 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 2.19 2.26 0.00 57 R 8.12 4.12 0.00 2.08 2.25 0.00 2.96 0.00 0.00 3.36 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.76 0.00 58 E 8.52 4.06 0.00 2.03 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 2.35 2.52 0.00 59 I 7.70 3.67 1.64 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.04 0.44 0.00 0.00 60 F 8.21 4.46 0.00 3.27 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 61 K 8.08 3.94 0.00 2.14 1.94 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.48 7.81 62 A 7.91 3.82 1.46 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 63 A 8.06 3.77 1.58 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 64 I 8.04 3.59 2.02 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.80 0.91 0.00 0.00 65 R 7.95 3.84 0.00 1.79 2.07 0.00 3.20 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 66 E 7.90 4.09 0.00 1.43 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 1.86 1.47 0.00 67 S 8.12 3.69 0.00 3.95 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 68 A 8.30 4.19 1.47 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 69 H 9.15 4.61 0.00 3.26 3.46 0.00 5.56 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 S 7.91 4.98 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 71 I 8.77 5.18 1.68 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.73 0.98 0.00 0.00 72 I 8.32 4.97 1.76 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 1.27 0.84 0.87 0.00 0.00 73 L 8.52 4.79 0.00 1.41 1.16 0.73 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 74 V 8.74 5.60 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 1.11 0.00 0.00 0.95 0.00 0.00 75 H 9.09 5.69 0.00 3.37 3.26 0.00 5.89 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 76 N 8.82 5.86 0.00 2.92 3.06 0.00 0.00 6.80 7.80 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 77 H 8.62 5.10 0.00 3.14 3.25 0.00 5.65 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 P 0.00 4.49 0.00 2.20 2.43 0.00 3.43 0.00 0.00 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 79 S 8.08 4.12 0.00 4.00 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 80 G 8.33 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 0.00 0.00 0.00 81 D 7.65 4.49 0.00 2.69 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 82 V 8.23 4.32 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 0.99 0.00 0.00 1.02 0.00 0.00 83 Q 7.95 3.57 0.00 1.92 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 84 P 0.00 4.24 0.00 2.03 1.78 0.00 2.88 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.99 0.00 85 S 8.66 4.40 0.00 4.04 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 86 N 8.61 4.42 0.00 2.69 2.89 0.00 0.00 6.86 7.35 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 87 A 8.01 4.27 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 88 D 8.07 4.40 0.00 3.04 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 89 K 8.25 4.39 0.00 2.11 1.99 0.00 1.80 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.64 1.74 7.81 90 Q 8.54 4.04 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.78 0.00 0.00 0.00 0.00 0.00 2.40 2.57 0.00 91 V 7.73 3.69 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 0.86 0.00 0.00 0.93 0.00 0.00 92 T 7.52 3.73 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 0.96 0.00 0.00 93 S 7.81 4.12 0.00 3.97 4.07 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 94 I 7.60 3.76 1.89 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 1.54 1.01 0.95 0.00 0.00 95 L 8.20 4.23 0.00 1.81 1.75 1.02 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 96 K 8.43 3.96 0.00 1.90 2.11 0.00 1.57 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.57 7.81 97 K 7.97 3.88 0.00 2.05 1.85 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.59 7.81 98 A 8.13 3.94 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 99 G 8.23 3.57 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 0.00 100 D 8.08 4.31 0.00 2.88 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 0.00 101 L 7.68 3.91 0.00 1.55 1.74 0.88 0.86 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 0.00 102 L 7.69 4.10 0.00 1.27 1.51 0.31 0.76 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 0.00 103 Q 7.63 3.52 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 7.07 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 104 I 7.58 4.80 2.15 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.42 1.16 0.00 0.00 105 E 8.35 3.99 0.00 2.04 1.82 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 2.40 2.33 0.00 106 L 8.63 4.63 0.00 1.76 1.66 0.97 0.98 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 0.00 107 L 8.65 4.24 0.00 1.71 1.67 0.94 1.20 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 0.00 108 D 7.74 4.75 0.00 2.75 2.48 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 0.00 0.00 0.00 0.00 109 H 8.87 5.35 0.00 2.95 2.59 0.00 5.69 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 V 9.43 5.18 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 1.12 0.00 0.00 0.99 0.00 0.00 111 I 9.11 5.11 2.19 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.70 0.86 0.00 0.00 112 V 9.19 5.13 2.42 0.00 0.00 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 1.08 0.00 0.00 113 G 9.23 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 0.00 0.00 0.00 114 N 8.82 4.46 0.00 2.83 2.86 0.00 0.00 6.92 6.92 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 0.00 115 N 9.36 4.82 0.00 2.93 3.07 0.00 0.00 6.87 8.06 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 0.00 116 D 7.77 4.73 0.00 2.59 2.43 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 0.00 117 W 7.55 5.84 0.00 3.45 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 0.00 118 F 9.86 4.78 0.00 3.12 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 0.00 119 S 8.34 4.96 0.00 4.12 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 9.55 4.01 0.00 3.39 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 0.00 121 R 8.91 3.97 0.00 1.99 1.99 0.00 3.28 0.00 0.00 3.19 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 122 D 8.16 4.44 0.00 2.59 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 0.00 123 H 7.56 4.45 0.00 3.03 3.23 0.00 5.79 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 A 7.75 3.75 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 0.00 125 L 8.00 4.48 0.00 1.92 1.88 0.63 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 126 L 7.84 4.40 0.00 1.69 1.60 1.05 0.97 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