NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0000 8.0544 120.3807 62.4218 32.9577 176.0314 2 H 4.7989 8.8834 115.4996 54.4245 30.7097 170.8416 3 L 4.6503 8.1200 120.7737 53.6647 44.6577 177.5982 4 T 4.0728 8.4169 120.1034 62.5401 70.4078 174.0871 5 P 4.1373 0.0000 0.0000 66.2050 31.4296 178.8241 6 E 3.9670 8.0573 116.4994 59.5087 29.3418 179.1344 7 E 4.0012 7.9404 118.1143 59.0498 29.6801 179.4278 8 K 3.8974 8.5919 119.2506 59.3413 32.0928 179.3605 9 S 4.0546 8.1874 113.2092 61.3059 62.2243 175.9774 10 A 4.0274 7.8033 123.0174 55.1616 18.0154 179.7375 11 V 3.5576 7.5058 116.7567 66.3920 31.2883 178.0332 12 T 3.9293 7.7732 114.8799 67.0607 68.2020 176.3960 13 A 4.1105 8.3033 121.2031 54.7531 18.7073 179.2164 14 L 3.9452 7.9245 119.3343 57.9767 42.1488 178.7067 15 W 4.3254 8.8598 128.7946 60.6970 30.3932 178.0585 16 G 3.7918 7.8998 103.9720 47.1743 0.0000 174.6645 17 K 4.4295 7.7556 118.1130 55.3781 32.7542 176.5042 18 V 3.7279 7.2176 120.9580 61.8510 32.2712 175.8326 19 N 4.5107 8.2093 125.5763 52.2753 38.7227 175.2701 20 V 3.5114 8.0675 128.2797 65.8528 31.3378 176.9299 21 D 4.3687 8.1660 118.1156 57.6388 40.7338 178.7210 22 E 3.9320 8.3130 118.4239 59.4851 29.5133 179.5776 23 V 3.6123 7.7782 118.3743 66.0272 31.5483 178.3342 24 G 3.6680 8.4472 105.8383 47.6530 0.0000 176.0131 25 G 3.6183 7.8543 107.7998 47.4015 0.0000 175.5770 26 E 3.9643 8.3336 121.4360 58.6985 29.6785 178.6234 27 A 3.9231 8.2233 121.1925 55.2503 18.4219 179.4334 28 L 4.0024 7.9167 118.3992 58.0851 42.1784 179.3073 29 G 3.5288 7.9579 105.3560 47.7832 0.0000 176.0566 30 R 3.8994 8.2389 120.9692 58.5643 29.9864 178.7342 31 L 4.0119 7.9631 120.2212 58.4575 42.0186 179.2837 32 L 4.0972 7.6660 119.4248 56.4137 41.1813 179.5283 33 V 3.6745 7.0334 117.1850 65.4031 31.9162 177.8681 34 V 3.4633 7.6232 116.8800 64.4522 32.7478 175.7136 35 Y 3.7155 6.9251 116.7182 53.8971 37.6658 173.9405 36 P 4.4870 0.0000 0.0000 64.7861 31.4265 178.2475 37 W 4.4273 7.7880 115.4618 58.8664 28.1283 177.8116 38 T 4.2358 7.7977 111.0134 64.1041 68.4056 175.9012 39 Q 4.5292 8.1877 121.0899 57.5030 28.4804 177.9661 40 R 3.8435 7.5638 116.8307 58.4743 29.3394 177.8091 41 F 4.3358 7.2271 116.6515 57.1451 40.2300 175.6934 42 F 4.5128 7.3278 117.7333 56.5803 39.1407 177.0344 43 E 4.0303 8.0320 122.6946 59.4514 29.9061 179.7145 44 S 4.4838 8.0413 110.8956 59.8669 63.3854 175.0208 45 F 4.5878 8.0474 120.4100 59.4117 39.9848 175.3004 46 G 4.0871 7.1049 104.3256 44.5385 0.0000 176.3718 47 D 4.6130 8.8558 129.8777 53.3897 39.0572 175.0369 48 L 4.8579 8.2643 125.3811 54.4854 43.0053 179.0150 49 S 4.4427 8.0915 117.9666 61.1940 63.0737 175.1173 50 T 4.7357 7.3583 108.6758 58.1549 72.9613 172.7760 51 P 4.1781 0.0000 0.0000 66.1953 31.4942 178.3779 52 D 4.3538 8.1908 116.5144 57.6724 40.5422 178.9333 53 A 4.0490 7.8885 119.7763 54.7548 18.5818 179.7537 54 V 3.6849 8.0897 117.4255 66.5637 31.5634 178.1048 55 M 4.1294 8.2450 117.6943 58.4226 31.8440 178.6408 56 G 3.9026 7.8440 104.4837 45.6596 0.0000 173.4048 57 N 4.3270 7.7602 120.6475 53.1508 39.2076 173.7211 58 P 4.3152 0.0000 0.0000 65.4415 31.4536 178.4717 59 K 3.7717 8.1829 118.8253 58.7693 31.7135 179.4918 60 V 3.7119 7.6494 118.2897 65.9743 31.6560 177.8628 61 K 3.8494 8.1183 118.0144 59.7167 31.6433 179.2177 62 A 4.0661 8.0875 120.6594 55.1200 18.2180 179.1420 63 H 4.4131 8.1406 116.8687 59.0802 29.8505 177.7136 64 G 4.1322 8.3645 109.5234 47.3453 0.0000 175.6635 65 K 4.0125 7.9547 121.7678 58.9493 32.1605 178.9279 66 K 4.0355 7.7482 119.9262 59.1418 32.1401 179.1370 67 V 3.5973 7.9912 118.7043 66.2050 31.5267 178.2095 68 L 4.3336 8.4702 119.0836 57.5107 41.3100 179.4330 69 G 3.8633 8.2103 105.7375 48.0127 0.0000 175.4442 70 A 4.1151 7.8952 122.8934 54.3702 18.8053 179.1380 71 F 4.3187 8.5460 119.0937 61.6231 39.4414 176.9769 72 S 4.2650 9.1579 113.2871 62.0089 61.9107 176.0885 73 D 4.5479 8.5671 121.3486 57.2458 40.5021 179.0395 74 G 3.5143 8.1088 106.2392 47.2357 0.0000 175.1079 75 L 3.9697 7.3024 118.4545 55.7780 41.6774 177.8934 76 A 4.4189 7.3992 119.8145 52.3822 20.0886 176.5663 77 H 4.8295 8.0516 115.2307 54.8707 29.7659 175.1048 78 L 4.1296 8.0240 121.3507 57.3188 42.2474 176.6627 79 D 4.6377 7.7781 115.9428 55.2806 42.1975 176.4296 80 N 4.9639 8.1708 117.6027 51.7704 40.3768 174.8411 81 L 4.0653 7.7684 122.4688 57.3668 42.0655 178.9211 82 K 3.9612 8.1389 119.5034 59.8123 31.9246 178.9667 83 G 3.4548 8.0375 104.1629 47.8089 0.0000 175.5333 84 T 3.7820 7.6783 117.3912 65.5510 68.5541 175.8328 85 F 4.8035 8.0088 117.3414 57.0695 39.3727 177.2957 86 A 4.0790 7.4962 123.3757 55.9772 18.1577 180.8089 87 T 3.9309 7.8491 113.5523 66.5092 68.6104 176.8098 88 L 4.1160 7.9536 122.0208 57.9673 41.7124 178.7947 89 S 4.4461 8.4775 115.1617 60.9964 62.3190 176.0351 90 E 3.9538 8.2702 121.3517 58.9432 29.0830 179.0353 91 L 3.9031 7.9622 120.6019 58.6038 42.2189 178.8567 92 H 4.1830 8.2965 116.1112 59.2137 28.3844 176.6898 93 C 3.6097 7.5373 120.3058 61.9165 31.0793 175.2656 94 D 4.3852 8.3456 122.0924 56.2548 40.6554 177.4185 95 K 4.3283 7.8897 117.1677 57.7492 33.6756 177.5327 96 L 4.1476 7.7593 115.8306 55.0857 42.5028 176.1390 97 H 4.1569 7.1638 113.6100 56.6428 26.5704 175.0575 98 V 3.9508 8.1673 118.0569 61.0105 33.0101 174.6772 99 D 4.4323 8.5905 127.0816 53.3643 41.8325 175.0523 100 P 3.3163 0.0000 0.0000 64.5675 31.7484 177.9326 101 E 3.8882 8.0907 118.8678 59.2206 29.3349 178.3131 102 N 4.2132 7.9565 116.5844 56.2669 38.5292 177.2943 103 F 4.5047 7.4843 119.1906 60.5333 39.0014 177.9812 104 R 3.9160 7.8053 117.1877 59.2255 30.0016 178.7340 105 L 3.7688 7.9605 118.9100 57.7316 41.3130 179.3618 106 L 4.0439 8.1268 120.2122 58.0391 41.9437 178.8661 107 G 4.2557 7.9848 105.5719 48.3403 0.0000 175.2726 108 N 4.3999 8.1276 119.2882 55.6322 38.5345 177.7422 109 V 3.5943 7.9632 119.7214 65.8844 31.6818 177.4023 110 L 3.8534 8.8522 121.0786 58.6051 41.9563 179.1774 111 V 3.6061 8.0518 117.8135 66.3299 31.3829 177.8031 112 C 4.1782 7.9246 116.0311 62.5463 27.8999 176.2399 113 V 3.5458 7.8637 119.9316 65.9798 31.1373 178.0844 114 L 3.8938 7.6996 118.5065 57.6865 41.3224 179.4476 115 A 3.8238 7.2220 120.2719 55.0645 18.0556 179.0326 116 H 4.0955 7.8236 115.9244 59.8083 29.9893 177.0412 117 H 3.9069 8.0511 116.3423 58.5637 28.9874 177.1787 118 F 4.5647 8.6856 117.7217 55.4807 39.5447 178.7234 119 G 3.8705 8.8942 108.9306 45.5721 0.0000 175.3549 120 K 3.9010 9.3919 122.4391 59.7862 31.9764 177.3638 121 E 4.0429 8.3002 119.2642 58.2822 29.9739 177.2189 122 F 4.5229 8.0573 123.0217 56.9279 37.8683 175.5039 123 T 4.1621 7.2954 115.1520 60.2703 71.3211 173.4756 124 P 4.1873 0.0000 0.0000 65.7370 31.2429 177.1924 125 P 4.2231 0.0000 0.0000 65.4795 31.3888 178.9214 126 V 3.5671 7.5058 116.8651 65.6638 31.2959 177.9229 127 Q 3.5258 8.3809 119.9131 58.9030 28.7034 177.7947 128 A 3.9751 8.2522 122.0010 55.4957 18.4749 179.5667 129 A 3.9110 7.7860 119.0690 55.4536 18.4485 179.5276 130 Y 3.8301 8.0022 115.0722 61.1523 37.9118 178.5757 131 Q 4.1807 8.6391 119.5353 59.0640 28.7776 179.1180 132 K 4.0587 7.7893 119.4374 59.0661 32.0107 179.7926 133 V 3.4691 7.5571 118.3807 66.1081 31.5008 178.5200 134 V 3.8278 8.4936 112.3172 64.4035 31.3492 178.5144 135 A 4.1028 8.1882 120.7173 55.0150 18.1787 179.8826 136 G 3.5281 8.2402 104.3926 47.9236 0.0000 176.0726 137 V 3.3181 8.3519 120.9750 65.5622 31.5313 177.9590 138 A 3.8678 8.0937 120.5284 55.1548 18.3133 179.3884 139 N 4.2608 8.3321 114.8198 56.4462 38.4143 177.5479 140 A 4.0576 7.9202 121.1608 55.1797 18.2521 179.4482 141 L 3.8658 8.0231 117.5019 57.4101 41.5227 179.1533 142 A 4.1726 8.1192 120.2130 53.7755 18.4749 178.7253 143 H 4.0308 7.7459 116.8647 59.4203 29.8615 175.8182 144 K 4.4584 8.3853 115.8310 56.3087 31.9516 176.2713 145 Y 4.1949 8.1833 117.7766 58.3273 38.4255 175.6406 146 H 4.4556 8.3752 117.8686 56.1546 28.2925 173.2608 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 V 8.05 4.00 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 0.94 0.00 0.00 0.94 0.00 0.00 2 H 8.88 4.80 0.00 3.15 3.16 0.00 5.77 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.12 4.65 0.00 1.57 1.47 0.85 0.90 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 4 T 8.42 4.07 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 5 P 0.00 4.14 0.00 2.12 2.11 0.00 3.56 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 6 E 8.06 3.97 0.00 2.02 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 2.38 2.44 0.00 7 E 7.94 4.00 0.00 2.19 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 2.35 2.34 0.00 8 K 8.59 3.90 0.00 1.93 1.80 0.00 1.45 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.40 7.81 9 S 8.19 4.05 0.00 3.89 4.08 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 0.00 0.00 0.00 10 A 7.80 4.03 1.40 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 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.51 3.56 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.46 0.00 0.00 12 T 7.77 3.93 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 13 A 8.30 4.11 1.38 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 0.00 0.00 0.00 14 L 7.92 3.95 0.00 1.88 2.07 0.30 0.08 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 15 W 8.86 4.33 0.00 3.83 3.37 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 16 G 7.90 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 17 K 7.76 4.43 0.00 2.16 2.15 0.00 1.96 0.00 0.00 1.83 0.00 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.51 7.81 18 V 7.22 3.73 1.16 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 -0.07 0.00 0.00 0.67 0.00 0.00 19 N 8.21 4.51 0.00 2.69 2.58 0.00 0.00 6.84 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 20 V 8.07 3.51 2.09 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 1.19 0.00 0.00 0.92 0.00 0.00 21 D 8.17 4.37 0.00 3.05 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 22 E 8.31 3.93 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 2.29 2.42 0.00 23 V 7.78 3.61 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 1.02 0.00 0.00 0.69 0.00 0.00 24 G 8.45 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 7.85 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 0.00 0.00 0.00 26 E 8.33 3.96 0.00 2.20 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 2.28 2.30 0.00 27 A 8.22 3.92 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 28 L 7.92 4.00 0.00 1.74 1.64 0.86 1.04 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 29 G 7.96 3.53 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 0.00 30 R 8.24 3.90 0.00 1.88 1.93 0.00 3.10 0.00 0.00 3.03 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 31 L 7.96 4.01 0.00 1.88 1.87 1.00 0.50 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 32 L 7.67 4.10 0.00 1.76 1.68 0.71 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.03 3.67 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 0.72 0.00 0.00 0.90 0.00 0.00 34 V 7.62 3.46 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 0.09 0.00 0.00 0.77 0.00 0.00 35 Y 6.93 3.72 0.00 2.51 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 36 P 0.00 4.49 0.00 2.34 2.33 0.00 3.69 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 1.92 0.00 37 W 7.79 4.43 0.00 3.59 3.52 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 38 T 7.80 4.24 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 1.11 0.00 0.00 39 Q 8.19 4.53 0.00 2.22 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.83 0.00 0.00 0.00 0.00 0.00 2.42 2.52 0.00 40 R 7.56 3.84 0.00 1.63 1.94 0.00 2.96 0.00 0.00 2.54 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 41 F 7.23 4.34 0.00 1.51 2.35 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 42 F 7.33 4.51 0.00 2.89 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 0.00 0.00 0.00 43 E 8.03 4.03 0.00 2.01 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 0.00 2.34 2.21 0.00 44 S 8.04 4.48 0.00 4.10 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 45 F 8.05 4.59 0.00 3.14 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 46 G 7.10 4.09 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 0.00 0.00 0.00 47 D 8.86 4.61 0.00 2.67 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 48 L 8.26 4.86 0.00 1.73 1.61 1.07 1.00 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 49 S 8.09 4.44 0.00 3.86 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 50 T 7.36 4.74 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 1.21 0.00 0.00 51 P 0.00 4.18 0.00 2.15 2.12 0.00 3.60 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.17 0.00 52 D 8.19 4.35 0.00 2.67 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 53 A 7.89 4.05 1.42 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 0.00 0.00 0.00 0.00 0.00 0.00 54 V 8.09 3.68 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 1.06 0.00 0.00 0.96 0.00 0.00 55 M 8.25 4.13 0.00 1.97 2.11 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.93 0.00 56 G 7.84 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 57 N 7.76 4.33 0.00 2.99 2.94 0.00 0.00 6.84 7.79 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 58 P 0.00 4.32 0.00 2.26 2.26 0.00 3.73 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 59 K 8.18 3.77 0.00 1.85 0.85 0.00 1.35 0.00 0.00 1.10 0.00 0.00 2.79 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.03 1.22 7.81 60 V 7.65 3.71 2.35 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 1.14 0.00 0.00 1.09 0.00 0.00 61 K 8.12 3.85 0.00 2.01 1.84 0.00 1.74 0.00 0.00 1.82 0.00 0.00 3.14 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.50 7.81 62 A 8.09 4.07 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 63 H 8.14 4.41 0.00 3.53 3.49 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.36 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 0.00 0.00 0.00 0.00 65 K 7.95 4.01 0.00 1.92 2.00 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.59 7.81 66 K 7.75 4.04 0.00 1.91 1.99 0.00 1.77 0.00 0.00 1.64 0.00 0.00 3.03 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.50 1.50 7.81 67 V 7.99 3.60 2.17 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 1.01 0.00 0.00 0.90 0.00 0.00 68 L 8.47 4.33 0.00 1.98 1.85 1.21 0.82 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 69 G 8.21 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 70 A 7.90 4.12 1.52 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 0.00 0.00 71 F 8.55 4.32 0.00 3.21 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 9.16 4.26 0.00 4.58 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 73 D 8.57 4.55 0.00 2.72 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 74 G 8.11 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.30 3.97 0.00 1.30 1.41 -0.36 0.50 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 76 A 7.40 4.42 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.05 4.83 0.00 3.05 3.15 0.00 5.82 0.00 0.00 0.00 0.00 8.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.02 4.13 0.00 1.47 1.61 0.73 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.78 4.64 0.00 2.66 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 80 N 8.17 4.96 0.00 2.67 2.61 0.00 0.00 7.09 6.67 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 81 L 7.77 4.07 0.00 1.79 1.90 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.14 3.96 0.00 1.81 1.75 0.00 1.55 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.23 1.34 7.81 83 G 8.04 3.45 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 0.00 84 T 7.68 3.78 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 0.41 0.00 0.00 85 F 8.01 4.80 0.00 3.08 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 86 A 7.50 4.08 1.42 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 0.00 0.00 0.00 0.00 0.00 0.00 87 T 7.85 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 1.22 0.00 0.00 88 L 7.95 4.12 0.00 1.89 1.96 1.04 1.10 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 89 S 8.48 4.45 0.00 4.18 4.09 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 90 E 8.27 3.95 0.00 2.07 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 2.63 0.00 91 L 7.96 3.90 0.00 1.89 1.86 0.92 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.30 4.18 0.00 3.64 3.83 0.00 5.86 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 93 C 7.54 3.61 0.00 1.48 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 D 8.35 4.39 0.00 2.80 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 95 K 7.89 4.33 0.00 1.81 1.79 0.00 1.54 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.40 7.81 96 L 7.76 4.15 0.00 1.69 1.63 0.70 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.16 4.16 0.00 3.45 3.43 0.00 5.64 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.17 3.95 1.65 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 0.20 0.00 0.00 0.43 0.00 0.00 99 D 8.59 4.43 0.00 2.81 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 P 0.00 3.32 0.00 1.97 1.93 0.00 3.37 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.48 0.00 101 E 8.09 3.89 0.00 2.06 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 2.31 2.38 0.00 102 N 7.96 4.21 0.00 2.50 2.67 0.00 0.00 6.94 7.51 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 0.00 103 F 7.48 4.50 0.00 3.12 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 0.00 104 R 7.81 3.92 0.00 2.05 1.95 0.00 3.12 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 105 L 7.96 3.77 0.00 1.69 1.37 0.65 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.13 4.04 0.00 1.81 1.86 0.93 1.08 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 0.00 107 G 7.98 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 N 8.13 4.40 0.00 2.96 2.95 0.00 0.00 6.75 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 0.00 109 V 7.96 3.59 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 1.06 0.00 0.00 1.16 0.00 0.00 110 L 8.85 3.85 0.00 1.61 1.91 0.87 0.16 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 0.00 111 V 8.05 3.61 2.30 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 1.24 0.00 0.00 1.17 0.00 0.00 112 C 7.92 4.18 0.00 3.22 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 0.00 113 V 7.86 3.55 2.17 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 1.04 0.00 0.00 0.95 0.00 0.00 114 L 7.70 3.89 0.00 0.99 0.88 0.64 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.22 3.82 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 H 7.82 4.10 0.00 3.24 3.50 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.05 3.91 0.00 3.18 2.66 0.00 5.70 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.69 4.56 0.00 3.23 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 0.00 119 G 8.89 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 0.00 120 K 9.39 3.90 0.00 1.92 2.05 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.54 7.81 121 E 8.30 4.04 0.00 2.28 2.29 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 2.39 2.35 0.00 122 F 8.06 4.52 0.00 3.09 3.16 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 0.00 0.00 0.00 0.00 123 T 7.30 4.16 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 124 P 0.00 4.19 0.00 2.15 2.15 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 125 P 0.00 4.22 0.00 2.11 2.06 0.00 3.46 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 126 V 7.51 3.57 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 1.02 0.00 0.00 0.89 0.00 0.00 127 Q 8.38 3.53 0.00 1.64 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.50 0.00 0.00 0.00 0.00 0.00 2.39 2.52 0.00 128 A 8.25 3.98 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 0.00 129 A 7.79 3.91 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 0.00 130 Y 8.00 3.83 0.00 3.27 3.28 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 0.00 131 Q 8.64 4.18 0.00 2.27 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.72 2.62 0.00 132 K 7.79 4.06 0.00 1.73 1.83 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.46 1.66 7.81 133 V 7.56 3.47 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.72 0.00 0.00 134 V 8.49 3.83 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 1.02 0.00 0.00 1.11 0.00 0.00 135 A 8.19 4.10 1.41 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 0.00 0.00 0.00 136 G 8.24 3.53 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 0.00 137 V 8.35 3.32 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 0.64 0.00 0.00 0.71 0.00 0.00 138 A 8.09 3.87 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.33 4.26 0.00 2.98 2.88 0.00 0.00 6.89 7.72 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 0.00 140 A 7.92 4.06 1.44 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 0.00 0.00 0.00 141 L 8.02 3.87 0.00 1.29 0.47 -0.03 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.12 4.17 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 0.00 143 H 7.75 4.03 0.00 3.32 3.69 0.00 5.74 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.39 4.46 0.00 1.79 1.80 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.47 1.79 7.81 145 Y 8.18 4.19 0.00 3.12 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 0.00 146 H 8.38 4.46 0.00 3.22 3.23 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00