NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5908 8.3049 120.3324 55.5964 33.4605 174.3024 2 Q 4.3663 8.0894 117.6901 52.0833 32.6688 172.6360 3 P 4.5241 0.0000 0.0000 62.1762 33.4179 174.7918 4 N 4.6434 8.2912 116.8556 53.0635 40.0517 174.2712 5 D 4.7488 8.6197 121.4091 56.0508 41.8197 176.8227 6 I 4.5844 7.6822 116.5874 59.7980 41.3268 173.8034 7 T 4.7330 7.6917 118.2661 60.6140 71.4597 173.6840 8 F 4.4028 8.9390 117.5937 56.7927 43.4640 174.1513 9 F 4.4823 9.1367 126.9505 57.5602 40.7029 175.8121 10 Q 4.0249 8.5492 123.6601 59.7135 27.9028 179.5183 11 R 3.7160 6.4408 119.4431 58.7665 30.1310 178.7151 12 F 4.0791 8.2349 119.8348 61.2713 39.3677 177.0236 13 Q 4.0810 9.2389 119.0413 58.9523 28.3351 178.1091 14 D 4.3022 8.2947 118.1016 57.5588 41.7259 177.4522 15 D 4.4477 8.2342 118.4044 57.3807 41.0288 178.3562 16 I 3.8383 8.0427 120.7186 64.2790 36.9612 178.3197 17 L 3.8125 8.0769 119.3915 58.4203 40.0927 178.2017 18 A 4.3952 7.5675 119.3119 50.3481 18.9605 178.0738 19 G 3.7158 9.1191 111.8153 45.3517 0.0000 177.5720 20 R 3.4120 9.1434 122.2989 55.8519 27.2957 174.4580 21 K 3.8734 8.0773 121.6291 57.2865 33.4166 176.2413 22 T 4.5945 7.3856 114.8430 62.5105 73.3336 173.0236 23 I 4.7895 8.2576 124.2689 60.5125 39.3568 174.6483 24 T 5.0121 9.1588 114.0983 60.0898 72.7017 172.5495 25 I 5.1904 8.2492 120.8815 59.8869 40.8841 175.1552 26 R 4.3942 10.3436 124.4359 54.3527 35.1407 173.4361 27 D 4.6011 7.7963 118.6668 52.0170 43.1287 176.0136 28 E 3.8031 9.2893 127.5042 59.5758 29.5892 178.7620 29 S 4.3544 9.0350 111.6080 60.3445 62.4548 174.1936 30 E 4.4850 8.5563 119.1692 55.9401 30.0566 174.8567 31 S 3.9613 7.9920 115.8250 58.5147 62.9687 174.1205 32 H 4.7915 8.2245 132.5162 54.8755 27.5639 175.4339 33 F 4.1094 8.4276 117.1083 57.3807 38.7334 172.5006 34 K 4.6668 8.3702 119.1407 55.9483 35.5680 175.9221 35 T 4.1009 8.4223 115.4551 64.6242 68.9171 175.1642 36 G 4.0587 8.7503 109.1939 46.4700 0.0000 172.7669 37 D 5.1638 7.4493 119.1934 52.3083 44.5569 174.6704 38 V 4.4533 7.5728 117.9990 61.7031 33.7946 176.1788 39 L 4.5274 9.4553 126.5173 52.4117 44.6922 175.7953 40 R 4.4555 8.8618 126.3949 56.5948 31.0590 175.7461 41 V 5.0304 8.8207 127.1162 60.6462 34.2809 175.2317 42 G 4.4698 8.4524 106.0225 45.8153 0.0000 172.6322 43 R 4.8706 8.0679 122.6210 54.9981 30.9057 177.4467 44 F 4.2550 9.0252 127.0769 61.0710 39.9644 175.9114 45 E 4.2219 8.6063 119.8464 57.6941 29.3420 178.4890 46 D 5.7197 6.9663 128.7829 54.4798 40.6135 176.7726 47 D 4.5570 8.3096 115.2387 54.9471 43.3760 176.1065 48 G 3.9896 8.3958 108.3843 46.2561 0.0000 173.1743 49 Y 4.0533 8.3947 118.0304 58.5539 36.8632 170.4179 50 F 4.6496 9.1497 125.2058 59.8844 41.3978 175.5176 51 C 5.0297 8.0879 113.7282 58.5424 33.1870 172.7088 52 T 5.0530 8.4902 115.6191 61.9377 70.4664 173.6582 53 I 4.6860 8.3136 117.3988 59.1917 42.0009 173.5445 54 E 4.5260 8.0831 120.8612 54.3195 32.8427 176.5306 55 V 4.2950 8.5924 123.5883 63.5800 32.1102 175.3260 56 T 4.6007 9.0942 116.8350 63.3803 69.9198 173.2014 57 A 4.8016 7.6691 120.1603 51.5153 23.3253 174.8767 58 T 5.1583 8.3236 114.0359 62.7482 73.4388 173.3554 59 S 4.7224 9.8495 119.0345 57.8811 67.2605 173.1425 60 T 4.4646 8.1779 110.4248 60.3560 69.9695 173.2867 61 V 4.3317 8.3224 125.4413 62.0583 36.1106 174.1304 62 T 4.5251 8.1368 119.4839 63.4531 68.0593 173.6085 63 L 4.5937 7.9490 119.7035 58.2733 42.2774 177.6581 64 D 4.2391 7.9974 119.9477 55.6228 41.5832 178.3288 65 T 4.2543 8.0060 107.6744 63.6074 69.1276 173.2793 66 L 4.3324 7.6449 123.4274 55.4987 46.3737 175.5778 67 T 4.0791 8.6870 114.3934 61.9397 69.3336 173.9677 68 E 3.6411 9.1437 124.5683 59.4831 29.3806 179.4020 69 K 3.9312 8.3382 119.1891 59.8542 31.9450 177.9720 70 H 4.7897 9.2374 120.0486 58.8601 29.7056 177.0205 71 A 3.9801 8.0709 120.7105 55.1548 18.0642 178.8158 72 E 3.9870 8.8333 118.0934 59.4712 29.5707 178.4692 73 Q 4.0696 8.1469 118.7170 58.8651 28.9679 177.4843 74 E 4.6517 7.7250 117.3267 56.0814 30.6908 176.2486 75 N 4.9238 7.7308 114.9531 54.7422 44.3416 175.6158 76 M 4.3339 8.9494 117.2570 54.5255 33.9315 175.8082 77 T 4.3874 7.8644 113.5947 61.1871 70.5108 174.5525 78 L 4.0214 8.2725 120.1825 58.0071 41.4650 179.4707 79 T 3.8382 7.8836 115.2438 66.8521 68.4673 176.1250 80 E 3.9648 8.1495 119.6494 59.5415 29.4674 179.2648 81 L 4.0248 7.9719 118.9043 57.7808 41.6059 179.5704 82 K 3.9141 8.4445 119.8907 58.8114 32.0477 179.0132 83 K 3.8296 8.0858 120.4133 59.5483 32.2055 179.2635 84 V 2.9248 8.0198 113.0227 64.2786 31.3777 178.5640 85 I 3.4016 7.8745 119.5641 64.3787 36.7053 178.3378 86 A 3.5060 7.7566 120.4406 54.6600 18.2572 178.7240 87 D 4.2506 7.5250 116.0181 56.4666 41.1887 177.8968 88 I 3.5670 7.6893 119.1010 60.5655 38.5826 175.0846 89 Y 4.9022 6.4879 123.2958 55.8031 40.1679 170.2926 90 P 4.4587 0.0000 0.0000 62.8350 32.5404 174.2089 91 G 3.9530 8.9868 109.7983 46.3094 0.0000 174.0975 92 Q 4.7846 8.4609 127.8882 55.8025 29.1578 174.6472 93 T 4.6133 7.1841 106.9085 59.2970 72.1119 173.7827 94 Q 3.8046 7.8634 120.7011 55.7405 29.7349 176.6009 95 F 5.0244 8.3141 117.6738 57.2985 44.3518 172.2510 96 Y 4.5525 8.8643 117.5598 57.7696 39.0973 175.2889 97 V 5.3947 9.2148 124.0773 60.5176 34.7699 174.1644 98 I 5.1194 8.1623 126.3884 58.5326 40.4858 174.1716 99 E 5.0383 9.8719 129.5624 55.1716 31.3246 174.5896 100 F 5.5574 8.1677 119.0227 55.6214 41.1779 172.9245 101 K 4.7162 9.0791 117.3960 55.4180 36.4061 175.3707 102 C 4.5847 8.8268 122.5663 57.7642 31.4131 173.4461 103 L 4.1387 8.6564 126.7044 56.3265 39.6111 177.1663 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 4.59 0.00 2.08 2.11 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 2.54 2.63 0.00 2 Q 8.09 4.37 0.00 1.99 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.01 0.00 0.00 0.00 0.00 0.00 2.23 2.45 0.00 3 P 0.00 4.52 0.00 2.16 2.07 0.00 3.71 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.92 0.00 4 N 8.29 4.64 0.00 2.79 2.81 0.00 0.00 7.00 8.52 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 5 D 8.62 4.75 0.00 2.81 2.90 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 6 I 7.68 4.58 1.89 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 -0.14 0.15 1.18 0.00 0.00 7 T 7.69 4.73 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 1.41 0.00 0.00 8 F 8.94 4.40 0.00 3.05 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 F 9.14 4.48 0.00 3.02 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 Q 8.55 4.02 0.00 2.02 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.77 0.00 0.00 0.00 0.00 0.00 2.01 1.16 0.00 11 R 6.44 3.72 0.00 1.93 2.00 0.00 3.34 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 1.47 1.17 0.00 12 F 8.23 4.08 0.00 3.32 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 13 Q 9.24 4.08 0.00 2.30 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.59 0.00 0.00 0.00 0.00 0.00 2.53 2.80 0.00 14 D 8.29 4.30 0.00 2.58 2.90 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 15 D 8.23 4.45 0.00 2.97 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 I 8.04 3.84 2.15 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.23 0.87 0.00 0.00 17 L 8.08 3.81 0.00 1.79 2.05 0.94 0.80 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 18 A 7.57 4.40 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 19 G 9.12 3.72 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 0.00 0.00 0.00 20 R 9.14 3.41 0.00 1.85 1.86 0.00 3.41 0.00 0.00 3.25 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.51 0.00 21 K 8.08 3.87 0.00 1.95 1.82 0.00 1.62 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.39 7.81 22 T 7.39 4.59 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 1.25 0.00 0.00 23 I 8.26 4.79 1.94 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 1.48 0.37 1.05 0.00 0.00 24 T 9.16 5.01 4.42 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 1.92 0.00 0.00 25 I 8.25 5.19 2.11 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.68 1.06 0.00 0.00 26 R 10.34 4.39 0.00 1.50 1.48 0.00 3.10 0.00 0.00 3.10 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.59 0.00 27 D 7.80 4.60 0.00 1.83 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 E 9.29 3.80 0.00 2.33 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.42 0.00 29 S 9.04 4.35 0.00 3.85 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 30 E 8.56 4.49 0.00 1.76 1.74 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 2.14 2.12 0.00 31 S 7.99 3.96 0.00 3.66 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 H 8.22 4.79 0.00 3.28 3.04 0.00 5.55 0.00 0.00 0.00 0.00 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.43 4.11 0.00 2.76 2.89 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 34 K 8.37 4.67 0.00 1.74 1.74 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.43 7.81 35 T 8.42 4.10 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 36 G 8.75 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 37 D 7.45 5.16 0.00 2.98 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 38 V 7.57 4.45 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 0.47 0.00 0.00 0.87 0.00 0.00 39 L 9.46 4.53 0.00 1.43 1.50 1.05 0.74 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 40 R 8.86 4.46 0.00 2.26 2.00 0.00 2.99 0.00 0.00 2.89 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.67 0.00 41 V 8.82 5.03 1.83 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 0.82 0.00 0.00 0.50 0.00 0.00 42 G 8.45 4.47 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 0.00 43 R 8.07 4.87 0.00 1.75 1.74 0.00 3.09 0.00 0.00 3.12 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.58 0.00 44 F 9.03 4.25 0.00 2.99 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 E 8.61 4.22 0.00 2.01 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.46 0.00 46 D 6.97 5.72 0.00 2.79 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 47 D 8.31 4.56 0.00 2.24 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 0.00 0.00 0.00 48 G 8.40 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 Y 8.39 4.05 0.00 2.96 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 50 F 9.15 4.65 0.00 3.07 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 51 C 8.09 5.03 0.00 2.89 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.49 5.05 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 1.14 0.00 0.00 53 I 8.31 4.69 1.59 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.74 0.64 0.00 0.00 54 E 8.08 4.53 0.00 2.06 1.83 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 2.34 2.13 0.00 55 V 8.59 4.30 2.22 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 0.90 0.00 0.00 1.02 0.00 0.00 56 T 9.09 4.60 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 1.28 0.00 0.00 57 A 7.67 4.80 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 T 8.32 5.16 4.34 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 1.50 0.00 0.00 59 S 9.85 4.72 0.00 3.76 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 T 8.18 4.46 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 0.31 0.00 0.00 61 V 8.32 4.33 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 0.82 0.00 0.00 0.93 0.00 0.00 62 T 8.14 4.53 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 63 L 7.95 4.59 0.00 2.00 2.08 0.97 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 64 D 8.00 4.24 0.00 2.77 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 T 8.01 4.25 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 1.23 0.00 0.00 66 L 7.64 4.33 0.00 1.75 1.75 1.01 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 67 T 8.69 4.08 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 1.29 0.00 0.00 68 E 9.14 3.64 0.00 1.94 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 2.09 1.47 0.00 69 K 8.34 3.93 0.00 1.83 1.87 0.00 1.72 0.00 0.00 1.89 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.57 1.51 7.81 70 H 9.24 4.79 0.00 3.57 3.46 0.00 5.70 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 71 A 8.07 3.98 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 72 E 8.83 3.99 0.00 2.16 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 2.32 2.32 0.00 73 Q 8.15 4.07 0.00 2.29 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.21 0.00 0.00 0.00 0.00 0.00 2.37 2.58 0.00 74 E 7.73 4.65 0.00 1.88 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.41 0.00 75 N 7.73 4.92 0.00 2.92 2.75 0.00 0.00 7.10 7.65 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 76 M 8.95 4.33 0.00 1.95 2.03 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.62 0.00 77 T 7.86 4.39 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 1.27 0.00 0.00 78 L 8.27 4.02 0.00 1.77 1.69 0.92 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 79 T 7.88 3.84 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 80 E 8.15 3.96 0.00 2.02 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 2.45 2.43 0.00 81 L 7.97 4.02 0.00 1.84 1.71 0.98 0.98 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 82 K 8.44 3.91 0.00 2.00 1.82 0.00 1.51 0.00 0.00 1.56 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.46 7.81 83 K 8.09 3.83 0.00 2.05 1.76 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.47 7.81 84 V 8.02 2.92 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 0.98 0.00 0.00 0.99 0.00 0.00 85 I 7.87 3.40 1.87 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.13 0.90 0.00 0.00 86 A 7.76 3.51 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 87 D 7.53 4.25 0.00 2.05 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 88 I 7.69 3.57 1.58 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 1.05 0.68 -0.55 0.00 0.00 89 Y 6.49 4.90 0.00 2.99 2.85 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 90 P 0.00 4.46 0.00 2.27 2.16 0.00 3.89 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 2.05 2.01 0.00 91 G 8.99 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 Q 8.46 4.78 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.73 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 93 T 7.18 4.61 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 1.14 0.00 0.00 94 Q 7.86 3.80 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.69 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 95 F 8.31 5.02 0.00 2.96 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 96 Y 8.86 4.55 0.00 3.09 2.85 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 97 V 9.21 5.39 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 1.22 0.00 0.00 1.08 0.00 0.00 98 I 8.16 5.12 2.08 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.57 1.13 0.00 0.00 99 E 9.87 5.04 0.00 1.98 1.85 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 2.15 2.26 0.00 100 F 8.17 5.56 0.00 3.36 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 0.00 101 K 9.08 4.72 0.00 1.86 1.92 0.00 1.33 0.00 0.00 1.60 0.00 0.00 2.81 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.36 1.43 7.81 102 C 8.83 4.58 0.00 3.02 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 0.00 103 L 8.66 4.14 0.00 1.77 1.70 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00