NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2817 8.3049 118.1929 53.3469 33.3903 176.3945 2 L 3.4250 7.8986 119.1117 52.9254 40.0617 170.5555 3 T 4.2984 7.7477 106.8560 61.5030 72.1011 172.5545 4 D 4.6621 7.6382 127.5996 50.9640 42.0988 175.2702 5 P 4.7625 0.0000 0.0000 65.0899 31.2372 178.6217 6 I 3.6907 7.8675 117.7389 64.2080 36.5873 177.7332 7 A 3.9645 8.5200 122.2712 55.5862 18.2852 179.5607 8 D 4.3487 7.8288 116.6071 56.3126 39.4335 178.4361 9 M 3.9338 7.9337 119.9634 58.7421 32.3966 178.0424 10 L 3.9592 8.2798 119.4484 58.2524 41.7102 179.8975 11 T 3.8943 7.5218 114.9274 66.2756 68.2993 176.7652 12 R 3.8834 7.8643 120.1508 59.4936 30.1031 178.8326 13 I 3.6169 7.4270 118.6632 64.6123 37.1283 178.0287 14 R 3.8215 7.9193 119.0953 59.8590 29.6356 178.0846 15 N 4.2479 8.4934 115.5909 56.1855 38.8934 177.1566 16 A 4.1193 8.1859 122.3573 55.4300 18.6049 179.5612 17 T 3.9685 8.5116 108.6625 65.3792 68.3558 176.4394 18 R 3.6709 7.8102 119.6531 58.2120 30.1474 178.3456 19 V 4.1174 7.3842 108.9290 59.8232 33.6494 174.8558 20 Y 3.3827 6.9593 115.3303 57.9915 34.8091 169.2839 21 K 4.4999 7.6455 119.3231 54.9796 34.6785 177.4808 22 E 4.2039 8.9075 121.6789 59.0371 29.7744 176.3853 23 S 4.9984 7.3555 109.1767 58.4178 65.3178 175.0329 24 T 4.7433 8.0984 115.4254 62.2801 73.0882 173.2558 25 D 5.8500 8.5117 123.1232 52.4267 44.0875 176.0925 26 V 4.2867 8.4989 114.2653 60.3327 34.0212 169.9881 27 P 3.5791 0.0000 0.0000 62.0662 31.5902 175.7868 28 A 4.2658 8.4673 127.5467 52.2523 19.0695 176.9475 29 S 4.5598 8.4683 114.6296 55.7386 65.9976 174.9368 30 R 3.8687 8.8695 122.5447 60.0802 29.6314 178.6382 31 F 4.0342 8.2129 119.5117 61.2172 39.4249 176.9547 32 K 3.8503 8.1192 117.9844 59.4010 31.6894 179.0167 33 E 3.5136 7.9111 118.2205 59.4202 29.4805 178.9045 34 E 3.8031 7.6433 118.3180 59.6536 29.5139 179.5500 35 I 3.4825 7.4672 119.5033 64.6217 37.3426 178.6154 36 L 4.0559 7.8703 119.6709 57.3357 41.3045 179.4410 37 R 3.9528 8.4426 120.0755 59.7214 29.9980 178.5040 38 I 3.9639 7.7660 119.0006 63.5001 37.3659 177.3413 39 L 4.3180 8.4459 119.8237 56.2969 41.7472 177.6261 40 A 4.5479 7.8493 119.0727 53.7982 20.4966 178.3408 41 R 3.8517 7.7334 116.9131 59.6583 30.1965 177.7048 42 E 4.0770 8.1208 115.4896 57.4387 29.9291 176.7530 43 G 3.7979 8.2089 106.7182 46.1199 0.0000 172.6598 44 F 4.8155 8.8832 118.3156 56.6078 41.1113 175.3458 45 I 4.7406 7.4845 113.4044 58.4843 40.1951 176.6754 46 K 4.1397 9.0114 122.5220 57.7558 32.6219 178.0734 47 G 3.9635 6.3964 102.0718 46.6903 0.0000 170.4569 48 Y 6.0624 7.7793 116.4169 57.7814 40.6376 173.2933 49 E 4.6834 8.3803 114.8494 55.2920 32.4935 175.0621 50 R 4.7407 8.8017 121.3496 56.4547 30.8701 176.0593 51 V 4.7425 8.3202 123.4595 61.2613 35.4953 172.7369 52 D 4.9420 8.7175 117.6783 52.8221 43.7380 176.8112 53 V 4.1150 7.9293 124.7381 61.6802 31.6519 174.0176 54 D 4.3691 8.7535 124.8631 55.1176 37.8066 174.2207 55 G 3.8652 8.7186 101.0822 46.1565 0.0000 172.6376 56 K 4.3918 7.4721 119.3936 53.2685 33.3075 173.4413 57 P 4.5201 0.0000 0.0000 63.9152 32.2999 175.0485 58 Y 4.9331 8.4397 125.3543 56.3365 41.8658 174.5649 59 L 4.7731 8.4414 119.6430 54.0897 46.0258 176.4601 60 R 4.1319 8.8225 124.7918 55.5453 30.9584 176.4458 61 V 4.3227 8.5458 126.7295 61.7251 32.6820 174.5701 62 Y 4.6353 8.6597 127.4823 57.3880 38.7144 175.5258 63 L 4.4859 8.5692 125.1330 54.2244 42.8200 176.3633 64 K 4.6292 8.2030 122.4306 55.1547 34.7945 174.5416 65 Y 4.9131 8.3825 122.2753 56.8489 42.8281 173.4146 66 G 4.4344 8.5681 107.8534 44.0515 0.0000 171.6954 67 P 4.6793 0.0000 0.0000 62.2161 32.7350 176.0018 68 R 4.0916 8.4946 121.3272 56.7364 30.8561 175.6368 69 R 4.6881 8.3681 123.5337 54.7039 32.7431 176.0862 70 Q 4.1661 8.6253 122.0312 56.1206 30.4301 176.1051 71 G 3.8689 8.6101 107.7536 43.9616 0.0000 171.3184 72 P 3.9730 0.0000 0.0000 64.1516 31.3744 175.1382 73 D 4.2795 8.7851 124.1507 53.6696 38.5737 171.0020 74 P 4.8569 0.0000 0.0000 62.3728 28.6879 174.5416 75 R 4.3080 7.8909 123.8270 54.9570 30.9261 174.5543 76 P 4.3845 0.0000 0.0000 62.5902 31.7884 176.2103 77 E 4.0851 8.5827 122.5761 56.5815 30.2342 175.5711 78 Q 4.9548 8.4188 123.0584 54.2974 29.8862 176.0017 79 V 3.8213 8.7078 123.6498 65.8773 31.9320 176.8766 80 I 4.2979 7.3549 121.4604 59.3443 35.6247 174.4544 81 H 4.0454 8.3650 120.8232 58.8185 29.3267 175.4996 82 H 4.3000 7.9672 115.9909 55.0126 33.6942 172.6893 83 I 4.7066 7.6854 125.1793 58.8195 40.5543 173.8399 84 R 4.6120 9.0413 129.4304 54.3975 33.6538 174.5257 85 R 4.2840 8.6551 125.3685 56.4120 31.0923 174.9969 86 I 4.2002 8.1865 122.1991 63.0610 39.0332 177.3022 87 S 4.3779 7.6877 119.3392 57.4374 60.7268 173.4103 88 K 4.3790 8.2033 127.0967 54.1433 33.0321 176.7654 89 P 4.1999 0.0000 0.0000 65.5288 31.3571 178.2278 90 G 3.5320 8.1447 107.5181 47.8414 0.0000 174.0197 91 R 4.2591 7.3786 126.5642 53.3913 30.0783 174.2731 92 R 3.7044 8.2407 123.7246 56.0006 30.1742 177.0964 93 V 3.9192 8.1972 125.3089 61.8613 32.2565 173.9072 94 Y 5.1628 8.2147 125.9226 56.4301 39.6013 175.8471 95 V 4.5427 8.5738 116.9906 59.4658 35.5041 175.9027 96 G 4.0537 9.0845 112.7167 44.0895 0.0000 175.5286 97 V 3.7181 8.4055 118.4331 64.7479 31.4827 178.3877 98 K 4.3883 7.7039 119.2197 55.3114 31.7931 177.1783 99 E 4.6617 7.9676 115.4330 56.0940 33.5843 176.8681 100 I 3.6588 7.2473 118.2748 61.1668 37.4916 174.3105 101 P 4.4003 0.0000 0.0000 62.6037 31.7974 176.6611 102 R 4.3085 7.9891 119.6565 53.8424 30.0931 175.2586 103 V 3.2261 7.8306 124.1128 63.8120 32.4236 176.4434 104 R 3.3684 9.0396 130.0441 58.3283 28.4428 175.7959 105 R 4.0071 8.7477 111.4565 57.4128 28.2050 176.3796 106 G 4.2547 8.2946 105.7359 45.7856 0.0000 174.7785 107 L 4.0157 7.4550 118.2254 56.8730 41.7591 176.6823 108 G 4.4827 7.8974 104.7433 44.3538 0.0000 172.3546 109 I 5.2616 9.2710 118.2747 58.3281 40.7863 174.2754 110 A 5.0793 8.7230 129.6845 49.7917 20.2586 174.3584 111 I 4.1167 8.4164 121.6523 62.0696 38.0097 175.3111 112 L 5.1972 8.5397 127.1658 54.1382 44.8114 175.9362 113 S 4.9628 9.2456 116.6917 57.1226 62.5174 173.6710 114 T 4.8777 8.3417 117.6793 61.0385 69.6498 174.7091 115 S 4.4647 8.1818 114.5365 59.0672 63.2102 174.5413 116 K 4.6094 8.8271 119.9840 54.9527 34.2111 175.8890 117 G 3.8241 7.1085 105.1482 44.5703 0.0000 172.8763 118 V 4.8620 7.9995 123.9728 61.2291 34.2579 175.5007 119 L 5.1772 8.4237 126.4512 52.9510 46.6815 175.9415 120 T 4.4398 8.3348 111.4999 60.7784 70.2733 175.4110 121 D 4.3486 8.2536 119.0076 56.5754 38.8730 178.7719 122 R 4.1302 7.8109 118.1013 58.2966 30.7820 178.2296 123 E 3.9603 8.5410 118.5851 59.5913 29.4753 179.3999 124 A 4.0362 8.3561 120.9043 55.0325 18.5120 179.7522 125 R 3.8267 7.3966 114.4561 59.2338 29.9600 178.5179 126 K 3.8917 8.1703 118.7714 59.7309 32.3716 178.6602 127 L 4.1233 7.7717 117.2218 55.2918 42.5254 176.6416 128 G 3.6776 8.3837 105.5692 45.6533 0.0000 172.3733 129 V 4.5512 7.9031 109.6910 60.0702 36.8953 175.5910 130 G 4.2113 8.2068 108.1065 44.7049 0.0000 171.4677 131 G 4.2514 7.6999 103.0834 45.8444 0.0000 171.7412 132 E 4.6118 8.2394 121.4688 55.9976 30.6947 176.9026 133 L 4.4608 8.7531 130.3385 55.0458 40.9693 177.1076 134 I 3.8525 8.5325 125.5964 62.7307 38.0964 175.2898 135 C 4.9802 8.2246 114.4295 57.8720 32.9900 171.5279 136 E 5.2920 8.3096 117.0310 54.7391 32.7392 175.1991 137 V 4.6493 8.9668 120.3581 61.2181 35.6317 174.8389 138 W 4.7025 8.4652 123.8250 57.2819 28.2533 174.1205 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 M 8.30 4.28 0.00 2.13 2.26 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 2 L 7.90 3.42 0.00 1.86 1.72 0.93 0.47 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 3 T 7.75 4.30 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 1.19 0.00 0.00 4 D 7.64 4.66 0.00 2.71 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.76 0.00 2.18 2.07 0.00 3.88 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.01 0.00 6 I 7.87 3.69 2.11 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.02 0.98 0.00 0.00 7 A 8.52 3.96 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 8 D 7.83 4.35 0.00 2.95 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 M 7.93 3.93 0.00 2.20 2.23 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.54 0.00 10 L 8.28 3.96 0.00 1.63 1.64 0.88 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.52 3.89 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 12 R 7.86 3.88 0.00 1.90 1.99 0.00 3.32 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.83 0.00 13 I 7.43 3.62 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 1.34 0.66 0.81 0.00 0.00 14 R 7.92 3.82 0.00 1.93 1.99 0.00 3.05 0.00 0.00 3.10 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 15 N 8.49 4.25 0.00 2.73 2.85 0.00 0.00 7.14 7.33 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 16 A 8.19 4.12 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 17 T 8.51 3.97 4.40 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 1.18 0.00 0.00 18 R 7.81 3.67 0.00 1.94 1.95 0.00 3.03 0.00 0.00 3.39 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 19 V 7.38 4.12 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 0.76 0.00 0.00 1.00 0.00 0.00 20 Y 6.96 3.38 0.00 3.00 2.51 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 21 K 7.65 4.50 0.00 1.82 1.79 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.38 7.81 22 E 8.91 4.20 0.00 2.12 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 2.48 2.52 0.00 23 S 7.36 5.00 0.00 3.61 3.73 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 24 T 8.10 4.74 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 1.21 0.00 0.00 25 D 8.51 5.85 0.00 2.54 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 26 V 8.50 4.29 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.88 0.00 0.00 27 P 0.00 3.58 0.00 1.74 1.76 0.00 3.54 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.70 0.00 28 A 8.47 4.27 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 29 S 8.47 4.56 0.00 3.98 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 30 R 8.87 3.87 0.00 1.98 2.07 0.00 3.26 0.00 0.00 3.30 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.82 0.00 31 F 8.21 4.03 0.00 3.13 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 32 K 8.12 3.85 0.00 1.99 1.77 0.00 1.79 0.00 0.00 1.60 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.52 7.81 33 E 7.91 3.51 0.00 2.22 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.57 0.00 34 E 7.64 3.80 0.00 1.62 1.69 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 2.23 2.36 0.00 35 I 7.47 3.48 1.92 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.74 0.81 0.00 0.00 36 L 7.87 4.06 0.00 0.98 1.40 0.49 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 37 R 8.44 3.95 0.00 1.92 2.04 0.00 3.09 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 38 I 7.77 3.96 1.83 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 1.39 0.46 0.93 0.00 0.00 39 L 8.45 4.32 0.00 1.92 1.64 0.82 0.81 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 40 A 7.85 4.55 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 41 R 7.73 3.85 0.00 2.05 2.13 0.00 3.27 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 42 E 8.12 4.08 0.00 2.18 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 2.40 2.50 0.00 43 G 8.21 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 44 F 8.88 4.82 0.00 3.21 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 45 I 7.48 4.74 1.96 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.16 1.03 0.00 0.00 46 K 9.01 4.14 0.00 2.00 1.94 0.00 1.93 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 3.37 0.00 0.00 0.00 0.00 1.51 1.46 7.81 47 G 6.40 3.96 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 0.00 0.00 0.00 48 Y 7.78 6.06 0.00 3.08 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 49 E 8.38 4.68 0.00 1.99 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 2.46 2.41 0.00 50 R 8.80 4.74 0.00 1.75 1.99 0.00 3.29 0.00 0.00 2.25 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 51 V 8.32 4.74 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.06 0.00 0.00 52 D 8.72 4.94 0.00 2.63 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 53 V 7.93 4.12 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 0.26 0.00 0.00 54 D 8.75 4.37 0.00 2.87 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 55 G 8.72 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 56 K 7.47 4.39 0.00 2.09 1.97 0.00 1.90 0.00 0.00 1.79 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.65 7.81 57 P 0.00 4.52 0.00 2.08 2.07 0.00 3.60 0.00 0.00 4.00 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 58 Y 8.44 4.93 0.00 2.86 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 8.44 4.77 0.00 1.73 1.60 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 60 R 8.82 4.13 0.00 1.71 1.17 0.00 2.94 0.00 0.00 2.91 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.66 0.00 61 V 8.55 4.32 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 0.96 0.00 0.00 0.91 0.00 0.00 62 Y 8.66 4.64 0.00 3.03 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 63 L 8.57 4.49 0.00 1.65 1.16 1.05 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.20 4.63 0.00 1.71 1.59 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.31 1.44 7.81 65 Y 8.38 4.91 0.00 3.04 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 66 G 8.57 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 P 0.00 4.68 0.00 2.13 2.20 0.00 3.75 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.98 0.00 68 R 8.49 4.09 0.00 1.80 1.84 0.00 3.16 0.00 0.00 3.19 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 69 R 8.37 4.69 0.00 1.85 1.79 0.00 3.34 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 70 Q 8.63 4.17 0.00 1.93 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.68 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 71 G 8.61 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 72 P 0.00 3.97 0.00 2.05 2.05 0.00 3.84 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 73 D 8.79 4.28 0.00 2.79 2.67 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 74 P 0.00 4.86 0.00 2.05 2.09 0.00 3.39 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 1.94 1.81 0.00 75 R 7.89 4.31 0.00 1.73 1.98 0.00 3.36 0.00 0.00 3.73 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.60 0.00 76 P 0.00 4.38 0.00 1.71 1.76 0.00 3.34 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.05 0.00 77 E 8.58 4.09 0.00 2.17 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 2.40 2.45 0.00 78 Q 8.42 4.95 0.00 2.03 2.03 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 2.48 2.26 0.00 79 V 8.71 3.82 2.25 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 0.87 0.00 0.00 0.96 0.00 0.00 80 I 7.35 4.30 1.78 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 1.35 0.73 0.65 0.00 0.00 81 H 8.36 4.05 0.00 3.08 3.14 0.00 5.93 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.97 4.30 0.00 2.53 1.50 0.00 5.74 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.69 4.71 1.56 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 1.64 0.71 0.00 0.00 84 R 9.04 4.61 0.00 1.79 1.81 0.00 3.17 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 85 R 8.66 4.28 0.00 1.79 1.78 0.00 3.24 0.00 0.00 3.20 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.91 0.00 86 I 8.19 4.20 2.05 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.07 0.90 0.00 0.00 87 S 7.69 4.38 0.00 3.81 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 K 8.20 4.38 0.00 1.77 1.66 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.50 7.81 89 P 0.00 4.20 0.00 2.13 2.15 0.00 3.72 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 90 G 8.14 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 91 R 7.38 4.26 0.00 1.76 1.76 0.00 3.06 0.00 0.00 3.13 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.51 0.00 92 R 8.24 3.70 0.00 1.58 1.36 0.00 3.52 0.00 0.00 3.10 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.56 0.00 93 V 8.20 3.92 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 0.91 0.00 0.00 0.97 0.00 0.00 94 Y 8.21 5.16 0.00 2.92 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 95 V 8.57 4.54 2.11 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 0.91 0.00 0.00 1.07 0.00 0.00 96 G 9.08 4.05 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 0.00 0.00 0.00 97 V 8.41 3.72 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 0.82 0.00 0.00 0.94 0.00 0.00 98 K 7.70 4.39 0.00 1.77 1.85 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.41 1.45 7.81 99 E 7.97 4.66 0.00 2.09 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 0.00 2.25 2.28 0.00 100 I 7.25 3.66 1.88 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 1.32 0.81 0.98 0.00 0.00 101 P 0.00 4.40 0.00 2.03 1.97 0.00 3.64 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 2.03 2.10 0.00 102 R 7.99 4.31 0.00 1.70 1.84 0.00 3.25 0.00 0.00 3.14 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 103 V 7.83 3.23 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 0.96 0.00 0.00 1.00 0.00 0.00 104 R 9.04 3.37 0.00 1.06 1.52 0.00 3.11 0.00 0.00 2.25 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.29 0.00 105 R 8.75 4.01 0.00 1.89 1.90 0.00 3.39 0.00 0.00 3.18 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.50 0.00 106 G 8.29 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 0.00 0.00 0.00 0.00 107 L 7.45 4.02 0.00 1.81 1.84 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 108 G 7.90 4.48 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 0.00 109 I 9.27 5.26 2.01 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 1.16 2.01 1.10 0.00 0.00 110 A 8.72 5.08 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 0.00 111 I 8.42 4.12 1.85 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 0.66 0.84 0.00 0.00 112 L 8.54 5.20 0.00 1.82 1.73 0.98 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 113 S 9.25 4.96 0.00 4.30 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 0.00 114 T 8.34 4.88 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 115 S 8.18 4.46 0.00 4.09 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 0.00 116 K 8.83 4.61 0.00 1.73 1.76 0.00 1.83 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.34 1.51 7.81 117 G 7.11 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 0.00 0.00 0.00 118 V 8.00 4.86 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.83 0.00 0.00 119 L 8.42 5.18 0.00 1.58 1.57 0.96 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 120 T 8.33 4.44 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 121 D 8.25 4.35 0.00 2.87 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 0.00 122 R 7.81 4.13 0.00 1.89 2.01 0.00 3.15 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 123 E 8.54 3.96 0.00 2.11 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 124 A 8.36 4.04 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 0.00 125 R 7.40 3.83 0.00 1.97 2.09 0.00 3.11 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 126 K 8.17 3.89 0.00 1.76 2.00 0.00 1.86 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.49 7.81 127 L 7.77 4.12 0.00 1.68 1.73 0.93 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.38 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 0.00 129 V 7.90 4.55 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.95 0.00 0.00 130 G 8.21 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 0.00 0.00 0.00 0.00 131 G 7.70 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 0.00 0.00 0.00 0.00 132 E 8.24 4.61 0.00 2.25 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 2.28 2.22 0.00 133 L 8.75 4.46 0.00 1.79 1.55 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 134 I 8.53 3.85 2.11 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.17 1.04 0.00 0.00 135 C 8.22 4.98 0.00 3.01 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 0.00 136 E 8.31 5.29 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 137 V 8.97 4.65 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.71 0.00 0.00 138 W 8.47 4.70 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