NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4627 8.1776 115.2906 57.9169 63.6858 174.6401 3 V 3.4736 8.2832 127.9468 64.4325 30.6352 176.8472 4 Y 4.0078 8.5994 119.2724 60.9287 38.0653 178.9338 5 D 4.4103 8.1636 119.3337 57.2012 41.0301 178.4418 6 A 3.9612 7.9274 120.7187 55.0971 18.4059 179.5543 7 A 3.8705 8.0434 118.9587 55.0114 18.1458 179.5705 8 A 4.0685 7.5548 118.0264 54.8594 18.4837 179.3627 9 Q 4.1914 7.8594 115.6825 57.4111 29.9501 177.2530 10 L 4.2321 7.3259 121.3996 53.8129 40.0312 177.0181 11 T 4.2014 7.6204 114.1478 60.5504 71.6289 175.0715 12 A 3.9408 8.5050 122.4928 55.5870 18.1757 179.6700 13 D 4.2593 7.9481 116.6677 57.5061 40.9769 178.9422 14 V 3.5213 7.4383 118.6690 65.9855 31.4339 178.2431 15 K 3.8579 8.2441 118.4065 59.0846 31.7194 179.3288 16 K 3.9630 7.9019 119.5641 59.7116 32.1733 178.7351 17 D 4.5810 8.0922 119.1539 57.1948 40.5685 178.8234 18 L 3.7652 8.0718 119.7185 57.8082 41.6185 179.7430 19 R 4.0499 8.2966 118.2846 59.3950 28.4535 178.8914 20 D 4.4805 8.5557 119.1441 57.4993 40.8864 179.0939 21 S 3.2767 8.2866 114.8340 60.8827 62.9635 176.3212 22 W 4.3789 8.8577 132.3403 59.9317 30.1952 177.7673 23 K 3.7410 7.9517 119.1272 59.0237 31.7856 178.2713 24 V 3.8098 6.9063 117.2068 65.2353 31.3376 178.0297 25 I 3.6003 7.4687 112.8921 63.4314 37.1217 177.4801 26 G 2.0000 6.8792 105.4251 44.7391 0.0000 175.1137 27 S 4.3138 7.2966 115.7893 59.3403 64.0926 174.1611 28 D 4.5954 7.1684 121.7413 51.1389 41.3975 175.2784 29 K 3.8668 8.1221 123.4327 58.5856 32.3974 178.3341 30 K 4.0144 7.9760 119.4944 59.4325 32.4497 178.9978 31 G 3.6113 8.0278 106.7193 47.5556 0.0000 175.2827 32 N 4.4833 8.3818 119.6392 55.2758 38.6171 177.9818 33 G 3.5790 8.2362 107.6766 47.8444 0.0000 176.0070 34 V 3.5924 7.8577 120.9104 65.3244 31.4993 177.8115 35 A 3.8990 7.8086 120.2463 55.1885 18.2346 179.5475 36 L 3.6416 7.8022 117.2437 58.1140 41.6728 179.7731 37 M 3.5598 7.7223 118.4075 58.4772 31.9276 179.0480 38 T 3.9756 7.9662 110.0912 64.9838 68.8098 176.8091 39 T 3.7926 7.8187 118.7265 66.0795 68.4174 176.3683 40 L 3.7213 7.4475 122.2532 58.2667 41.7032 179.1884 41 F 4.6326 7.5574 117.4020 60.3349 38.5384 177.6808 42 A 4.0435 7.8912 119.7364 55.4904 18.3737 179.1823 43 D 4.5790 8.1808 116.1466 55.8137 42.5304 176.8016 44 N 5.1849 8.4131 116.4474 49.4287 38.8755 174.5659 45 Q 4.3592 8.4428 123.7764 58.1015 29.6090 176.7501 46 E 4.2155 8.2704 117.7537 58.4281 29.8211 178.1439 47 T 4.6172 8.2381 110.7080 63.6328 69.3429 176.5613 48 I 3.9392 7.9046 123.2615 64.4686 36.8147 178.0308 49 G 3.6755 8.1579 107.5808 48.8340 0.0000 174.2275 50 Y 4.1655 7.8378 116.7181 60.1409 38.0368 176.4586 51 F 4.9405 8.2305 118.5600 56.7760 39.7812 177.9175 52 K 3.8272 8.3557 123.1586 60.1388 32.2220 178.6946 53 R 3.9350 8.0445 118.2852 59.0497 30.0371 177.1455 54 L 4.1896 8.0503 116.3897 55.3548 42.4805 179.1789 55 G 3.7949 7.8058 106.4833 46.1041 0.0000 176.0227 56 N 4.5344 8.4017 116.5214 53.0386 38.0879 176.0554 57 V 3.8328 7.8916 119.9558 62.7306 31.6466 177.4904 58 S 4.2865 7.8971 113.3813 60.7890 62.9865 175.7688 59 Q 4.1605 8.1748 121.0304 55.8614 28.9310 177.2786 60 G 3.8983 8.4654 109.2971 46.2315 0.0000 175.6369 61 M 3.9204 9.1387 121.4859 58.4445 31.9033 177.1807 62 A 4.0007 7.6012 120.2816 54.6840 18.8048 177.3431 63 N 4.4279 8.2540 114.8554 53.6039 39.4988 175.0517 64 D 4.3970 8.7713 129.1084 57.5825 40.9747 179.0677 65 K 4.0384 8.0936 118.3054 59.3940 32.0901 179.0599 66 L 4.0420 8.5733 120.9048 58.1676 42.0006 179.0121 67 R 4.0212 8.5344 119.2821 59.2588 30.0689 178.8000 68 G 3.6289 8.2559 105.7640 47.9858 0.0000 175.2924 69 H 4.2832 8.5859 120.8771 59.0840 29.7918 177.5577 70 S 4.1148 8.4630 117.2949 61.6158 62.4439 176.7969 71 I 3.7974 7.5745 121.2489 64.8649 37.3435 178.3411 72 T 4.2101 7.9564 116.4143 66.5013 68.2807 176.3562 73 L 3.9946 8.2686 122.6643 58.6032 42.1096 179.0778 74 M 4.2423 7.9326 118.3889 58.3534 31.8093 178.1079 75 Y 3.9807 7.9604 116.1748 60.1113 38.0526 177.8014 76 A 3.7383 7.7724 122.2709 54.8752 18.4184 179.6463 77 L 3.3640 7.3679 117.0047 57.4823 41.6459 179.2441 78 Q 3.3881 7.7662 119.6113 58.8596 29.1028 177.8343 79 N 4.2171 7.7842 117.9151 56.7911 38.7981 176.6153 80 F 4.3342 7.3399 117.5084 60.8610 39.3187 177.4692 81 I 3.6314 7.5881 119.2666 64.4806 36.6239 178.3262 82 D 4.4537 8.0126 118.3157 56.6346 40.9314 177.7590 83 Q 4.3807 7.6821 116.5992 55.8148 28.8182 177.1892 84 L 3.9202 7.4456 120.8978 57.9458 41.7806 177.9475 85 D 4.4793 7.9223 115.5408 55.4124 41.2938 176.4627 86 N 4.8350 8.1259 117.9054 49.9275 39.9332 172.0500 87 P 4.1505 0.0000 0.0000 65.7236 31.0979 178.0270 88 D 4.5308 8.0750 119.7683 56.8936 40.7114 178.3011 89 D 4.3710 8.1572 118.9206 56.8170 40.9829 178.3537 90 L 3.8168 8.0723 121.2123 58.1221 42.0809 179.2256 91 V 3.2759 7.7409 118.5756 66.0360 31.3672 177.7995 92 C 4.1380 7.7578 114.2161 61.2543 29.4387 176.2137 93 V 3.7843 7.8438 115.0152 63.8790 31.2164 178.6681 94 V 3.4143 7.8316 118.3016 66.0141 31.0724 178.0205 95 E 3.9790 8.2900 118.4014 59.0761 29.0061 179.2713 96 K 4.0389 7.7618 118.7154 59.4232 32.9246 178.2993 97 F 4.2785 8.6041 120.8568 61.3587 39.2563 176.9889 98 A 3.8318 8.3241 120.3623 54.7215 18.0641 179.3231 99 V 3.4634 7.3363 115.6753 66.8102 31.0550 178.0690 100 N 4.2780 7.9825 115.1120 56.6366 38.4052 177.0102 101 H 4.1667 7.4882 116.8963 58.4695 28.7789 177.9036 102 I 3.7251 8.0154 122.4989 64.4691 36.7225 178.5236 103 T 3.9566 7.7511 109.4506 64.1516 68.6537 175.8213 104 R 4.2469 7.2168 117.5129 55.2108 30.4447 176.2232 105 K 3.7918 7.7985 117.1798 57.4806 29.8316 176.0982 106 I 3.9687 7.6417 121.1277 60.1338 36.8466 177.0044 107 S 4.4825 8.3838 121.0166 57.3872 65.3855 174.7037 108 A 4.0128 8.5103 123.2365 55.3086 17.8189 179.7528 109 A 4.0275 7.9406 117.8531 55.2808 18.8720 179.2830 110 E 4.1490 8.2114 116.8296 59.6853 29.6229 179.2584 111 F 4.1590 8.7723 121.1629 61.3017 39.4195 177.1329 112 G 3.9161 8.4515 104.7054 46.9031 0.0000 175.2754 113 K 4.2400 8.2471 120.5138 58.4715 32.1835 178.3545 114 F 4.0433 8.1972 120.9465 60.0637 39.2866 176.6461 115 N 4.5497 8.3098 116.6888 56.4612 38.2188 177.3548 116 G 3.5114 7.6576 106.2096 47.4519 0.0000 173.8317 117 P 4.0255 0.0000 0.0000 65.0852 31.1581 178.7471 118 I 3.4503 7.3253 118.1196 64.0811 36.9234 178.3531 119 K 3.9043 7.9934 120.3780 59.4899 32.0462 178.9450 120 K 3.9047 8.1369 118.8656 59.5072 31.7352 179.5582 121 V 3.5216 7.5579 117.3978 65.6859 31.6264 177.8528 122 L 4.0301 8.0433 118.6759 57.7895 41.4799 179.0660 123 A 4.1676 8.2569 121.2019 55.4445 18.0939 179.7141 124 S 4.2050 7.9556 110.7276 60.3432 63.0211 175.6897 125 K 4.4419 7.9887 120.9790 55.5831 32.3135 175.6317 126 N 4.2004 8.3615 115.7415 54.3156 36.0030 174.1273 127 F 4.3299 8.1916 117.2242 55.5390 40.5862 176.8907 128 G 4.0702 8.5646 115.2368 44.3317 0.0000 172.0072 129 D 4.5126 8.9008 118.7048 57.5776 40.9242 178.5407 130 K 3.9149 8.1846 119.4800 59.8427 32.1192 178.2902 131 Y 4.1781 8.1091 116.2661 60.9308 37.8468 177.9475 132 A 4.2630 8.1982 121.3620 55.2522 18.4381 179.2802 133 N 4.3402 8.8396 115.3621 56.3829 38.3787 177.4592 134 A 3.9733 7.9341 121.8243 55.0889 18.3972 179.8103 135 W 3.8956 8.5977 117.2272 59.6547 29.1006 178.6482 136 A 4.1321 8.4210 120.9919 55.1079 17.5340 179.8328 137 K 3.9870 7.6570 116.2757 59.1571 32.3880 179.1497 138 L 3.9326 7.5221 120.7570 58.0660 41.9910 178.9264 139 V 3.7608 8.2240 118.3439 66.2648 31.4254 177.7865 140 A 4.4300 8.1190 121.5799 54.5241 17.8775 179.8318 141 V 3.4240 7.4207 116.3625 65.9927 31.7644 178.1898 142 V 3.4856 7.4645 117.5583 65.9860 31.3316 177.7506 143 Q 3.8615 8.2230 117.7048 58.9804 28.3234 178.8234 144 A 4.0384 7.8439 120.2672 54.0577 18.4570 178.3820 145 A 4.3618 7.8182 117.5651 52.1129 19.5704 177.0563 146 L 4.1495 7.5546 122.6804 54.6262 41.8999 176.3803 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 2 S 8.18 4.46 0.00 3.90 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 3 V 8.28 3.47 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 0.60 0.00 0.00 0.70 0.00 0.00 4 Y 8.60 4.01 0.00 2.98 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 5 D 8.16 4.41 0.00 2.83 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 6 A 7.93 3.96 1.30 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 0.00 0.00 7 A 8.04 3.87 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 8 A 7.55 4.07 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 9 Q 7.86 4.19 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.31 0.00 0.00 0.00 0.00 0.00 2.62 2.52 0.00 10 L 7.33 4.23 0.00 1.70 1.53 0.76 0.63 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 11 T 7.62 4.20 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 1.24 0.00 0.00 12 A 8.51 3.94 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 13 D 7.95 4.26 0.00 2.67 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 14 V 7.44 3.52 2.21 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 0.99 0.00 0.00 0.88 0.00 0.00 15 K 8.24 3.86 0.00 1.93 1.79 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.55 7.81 16 K 7.90 3.96 0.00 1.96 2.02 0.00 1.59 0.00 0.00 1.69 0.00 0.00 3.08 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.47 1.59 7.81 17 D 8.09 4.58 0.00 2.84 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 18 L 8.07 3.77 0.00 1.66 1.28 0.56 -0.53 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 19 R 8.30 4.05 0.00 2.03 2.06 0.00 3.17 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 20 D 8.56 4.48 0.00 3.00 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 21 S 8.29 3.28 0.00 3.66 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 22 W 8.86 4.38 0.00 3.76 3.26 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 23 K 7.95 3.74 0.00 1.93 2.08 0.00 1.89 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.44 7.81 24 V 6.91 3.81 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 1.01 0.00 0.00 1.08 0.00 0.00 25 I 7.47 3.60 1.59 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.29 0.64 0.00 0.00 26 G 6.88 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 0.00 0.00 0.00 0.00 0.00 0.00 27 S 7.30 4.31 0.00 3.93 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 28 D 7.17 4.60 0.00 2.44 2.39 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 29 K 8.12 3.87 0.00 1.76 1.72 0.00 1.24 0.00 0.00 0.68 0.00 0.00 2.25 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.27 1.38 7.81 30 K 7.98 4.01 0.00 1.84 1.79 0.00 1.73 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.52 7.81 31 G 8.03 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.38 4.48 0.00 2.80 2.73 0.00 0.00 6.98 7.39 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 33 G 8.24 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 V 7.86 3.59 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 1.08 0.00 0.00 0.96 0.00 0.00 35 A 7.81 3.90 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 36 L 7.80 3.64 0.00 1.82 1.45 0.99 0.47 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 37 M 7.72 3.56 0.00 1.74 1.98 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.81 0.00 38 T 7.97 3.98 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 1.27 0.00 0.00 39 T 7.82 3.79 4.14 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 0.00 0.00 0.00 1.11 0.00 0.00 40 L 7.45 3.72 0.00 1.37 1.26 0.90 0.85 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 41 F 7.56 4.63 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 42 A 7.89 4.04 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 43 D 8.18 4.58 0.00 2.61 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 44 N 8.41 5.18 0.00 2.92 3.06 0.00 0.00 6.37 7.62 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 45 Q 8.44 4.36 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.94 0.00 0.00 0.00 0.00 0.00 2.45 2.32 0.00 46 E 8.27 4.22 0.00 2.23 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 0.00 2.47 2.38 0.00 47 T 8.24 4.62 4.78 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 1.45 0.00 0.00 48 I 7.90 3.94 1.92 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 1.11 1.09 0.73 0.00 0.00 49 G 8.16 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 0.00 0.00 0.00 50 Y 7.84 4.17 0.00 2.67 2.46 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 51 F 8.23 4.94 0.00 3.09 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 52 K 8.36 3.83 0.00 1.93 2.08 0.00 1.49 0.00 0.00 1.90 0.00 0.00 2.83 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.45 7.81 53 R 8.04 3.93 0.00 1.81 2.06 0.00 3.26 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 54 L 8.05 4.19 0.00 1.85 1.77 1.06 1.26 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 55 G 7.81 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 56 N 8.40 4.53 0.00 2.83 2.73 0.00 0.00 6.95 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 57 V 7.89 3.83 1.77 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 0.66 0.00 0.00 0.40 0.00 0.00 58 S 7.90 4.29 0.00 4.05 3.97 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 59 Q 8.17 4.16 0.00 2.24 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.83 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 60 G 8.47 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 61 M 9.14 3.92 0.00 1.97 2.13 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.63 0.00 62 A 7.60 4.00 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 N 8.25 4.43 0.00 2.80 2.93 0.00 0.00 7.09 8.10 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 64 D 8.77 4.40 0.00 2.74 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 65 K 8.09 4.04 0.00 1.99 1.91 0.00 1.70 0.00 0.00 1.86 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.56 1.52 7.81 66 L 8.57 4.04 0.00 1.81 1.87 1.10 1.27 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 67 R 8.53 4.02 0.00 2.16 2.08 0.00 3.16 0.00 0.00 3.38 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 68 G 8.26 3.63 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 0.00 0.00 0.00 69 H 8.59 4.28 0.00 3.38 3.56 0.00 5.79 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 70 S 8.46 4.11 0.00 4.06 3.97 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 71 I 7.57 3.80 1.97 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.70 1.16 0.00 0.00 72 T 7.96 4.21 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 1.28 0.00 0.00 73 L 8.27 3.99 0.00 1.72 1.88 0.97 1.09 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 74 M 7.93 4.24 0.00 2.08 2.16 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.95 0.00 75 Y 7.96 3.98 0.00 3.23 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 76 A 7.77 3.74 1.10 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 0.00 0.00 77 L 7.37 3.36 0.00 1.44 1.20 1.01 1.05 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 78 Q 7.77 3.39 0.00 2.41 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.80 0.00 0.00 0.00 0.00 0.00 2.50 2.62 0.00 79 N 7.78 4.22 0.00 2.86 2.74 0.00 0.00 7.24 7.81 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 80 F 7.34 4.33 0.00 2.88 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.59 3.63 1.51 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.06 0.82 0.00 0.00 82 D 8.01 4.45 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 83 Q 7.68 4.38 0.00 2.06 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.73 0.00 0.00 0.00 0.00 0.00 2.70 2.54 0.00 84 L 7.45 3.92 0.00 1.55 1.67 0.79 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 85 D 7.92 4.48 0.00 2.66 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 N 8.13 4.84 0.00 2.71 2.64 0.00 0.00 6.81 6.98 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 87 P 0.00 4.15 0.00 2.41 2.32 0.00 3.76 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.11 0.00 88 D 8.07 4.53 0.00 2.95 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 89 D 8.16 4.37 0.00 2.79 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 90 L 8.07 3.82 0.00 1.83 1.66 0.71 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 91 V 7.74 3.28 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 0.52 0.00 0.00 0.08 0.00 0.00 92 C 7.76 4.14 0.00 3.13 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 93 V 7.84 3.78 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 0.82 0.00 0.00 1.11 0.00 0.00 94 V 7.83 3.41 1.96 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 0.76 0.00 0.00 0.28 0.00 0.00 95 E 8.29 3.98 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 2.49 0.00 96 K 7.76 4.04 0.00 1.76 2.15 0.00 1.72 0.00 0.00 1.65 0.00 0.00 3.09 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.57 7.81 97 F 8.60 4.28 0.00 3.47 3.46 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 98 A 8.32 3.83 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 V 7.34 3.46 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 0.99 0.00 0.00 1.01 0.00 0.00 100 N 7.98 4.28 0.00 2.58 2.69 0.00 0.00 7.00 8.16 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 0.00 101 H 7.49 4.17 0.00 3.19 3.27 0.00 5.81 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 I 8.02 3.73 1.99 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.01 0.88 0.00 0.00 103 T 7.75 3.96 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 1.26 0.00 0.00 104 R 7.22 4.25 0.00 1.88 1.90 0.00 3.17 0.00 0.00 3.04 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 105 K 7.80 3.79 0.00 2.01 1.99 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.58 7.81 106 I 7.64 3.97 1.95 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.60 0.96 0.00 0.00 107 S 8.38 4.48 0.00 4.08 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 0.00 108 A 8.51 4.01 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 0.00 109 A 7.94 4.03 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 0.00 110 E 8.21 4.15 0.00 2.35 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 0.00 2.44 2.59 0.00 111 F 8.77 4.16 0.00 3.29 3.27 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 0.00 112 G 8.45 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 0.00 0.00 0.00 113 K 8.25 4.24 0.00 1.99 1.92 0.00 1.79 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.52 1.63 7.81 114 F 8.20 4.04 0.00 2.99 2.87 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 0.00 115 N 8.31 4.55 0.00 3.04 2.91 0.00 0.00 6.72 7.61 0.00 0.00 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 G 7.66 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 0.00 117 P 0.00 4.03 0.00 1.33 1.78 0.00 3.45 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.91 0.00 118 I 7.33 3.45 2.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.70 0.62 0.00 0.00 119 K 7.99 3.90 0.00 1.85 1.94 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.52 7.81 120 K 8.14 3.90 0.00 1.87 1.77 0.00 1.63 0.00 0.00 1.52 0.00 0.00 2.85 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.56 7.81 121 V 7.56 3.52 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 0.68 0.00 0.00 0.85 0.00 0.00 122 L 8.04 4.03 0.00 1.91 1.94 0.91 0.63 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 0.00 123 A 8.26 4.17 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 0.00 124 S 7.96 4.20 0.00 4.03 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 K 7.99 4.44 0.00 2.11 2.04 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.63 1.55 7.81 126 N 8.36 4.20 0.00 2.62 2.77 0.00 0.00 6.75 7.02 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 0.00 127 F 8.19 4.33 0.00 3.00 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 0.00 128 G 8.56 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 0.00 0.00 0.00 129 D 8.90 4.51 0.00 2.83 2.79 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 0.00 130 K 8.18 3.91 0.00 1.74 1.57 0.00 1.61 0.00 0.00 1.57 0.00 0.00 2.86 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.33 1.42 7.81 131 Y 8.11 4.18 0.00 3.48 3.27 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 0.00 132 A 8.20 4.26 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 0.00 133 N 8.84 4.34 0.00 2.95 2.90 0.00 0.00 6.86 7.16 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 0.00 134 A 7.93 3.97 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 0.00 135 W 8.60 3.90 0.00 3.64 3.40 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 0.00 136 A 8.42 4.13 1.48 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 0.00 0.00 137 K 7.66 3.99 0.00 1.85 1.83 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.61 7.81 138 L 7.52 3.93 0.00 1.46 1.74 0.65 0.37 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 0.00 139 V 8.22 3.76 2.40 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 1.35 0.00 0.00 1.25 0.00 0.00 140 A 8.12 4.43 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 0.00 141 V 7.42 3.42 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 0.58 0.00 0.00 0.85 0.00 0.00 142 V 7.46 3.49 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 0.43 0.00 0.00 0.60 0.00 0.00 143 Q 8.22 3.86 0.00 2.30 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.65 2.71 0.00 144 A 7.84 4.04 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.82 4.36 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 L 7.55 4.15 0.00 1.68 1.51 0.57 0.41 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