NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 G 3.8744 8.3549 109.7362 45.6785 0.0000 171.9150 9 Q 4.3174 8.0105 118.3643 54.4989 30.8988 173.0792 10 L 4.3005 7.5935 116.3618 54.5269 45.6596 174.5251 11 S 4.3031 8.5480 120.6646 58.1423 63.8504 174.6637 12 V 3.7582 8.2938 121.9163 65.2687 31.7584 176.2658 13 C 5.2345 7.7043 115.4749 54.9649 42.3204 173.4756 14 D 4.7801 9.4009 124.0952 53.9200 41.4757 175.7735 15 S 5.4485 8.6284 117.5697 56.4016 66.7687 173.2322 16 I 4.6494 8.5003 113.1040 59.4560 40.6815 174.6096 17 S 4.9488 8.3264 120.3927 57.3316 65.5582 172.8054 18 E 4.5049 8.0218 120.1929 55.0646 33.3916 174.0401 19 W 5.1683 8.7315 125.8549 56.1524 30.5602 175.8262 20 V 4.6577 9.6113 124.8652 61.3661 34.0759 174.9586 21 T 4.8832 9.0022 118.0317 60.6015 70.6362 175.8877 22 A 4.2531 8.9521 124.1511 55.2176 18.0374 180.1483 23 A 4.0219 7.9656 118.5516 55.4327 18.6065 179.0842 24 D 4.4759 7.8557 116.4512 57.1829 40.9951 178.6843 25 K 3.9896 8.0428 119.4579 59.8163 32.5574 176.8723 26 K 4.2310 9.0666 123.2517 55.7141 31.4383 176.1808 27 T 5.3173 7.1289 107.7171 60.3840 72.4295 171.7035 28 A 4.5401 8.6335 122.3428 51.5281 23.6980 175.2541 29 V 4.8642 8.1798 112.3173 59.8595 34.3248 176.6621 30 D 5.2512 9.0546 125.5960 52.3579 41.1117 176.5583 31 M 4.2803 8.4200 117.1282 57.1172 31.7860 176.5370 32 S 4.5940 8.0761 111.9909 58.4119 64.6659 174.6032 33 G 4.1101 8.2587 108.2194 45.0667 0.0000 174.5491 34 G 3.8568 8.0686 107.4428 46.2855 0.0000 173.2787 35 T 4.9374 8.4497 120.6556 62.9627 69.5474 174.5365 36 V 4.6455 9.2320 125.7574 59.9867 35.3030 174.4718 37 T 4.8540 8.7349 113.8506 60.7505 70.7062 173.7240 38 V 4.3446 8.5361 126.6571 61.6033 32.1867 175.8225 39 L 4.1840 8.0446 128.7897 54.7671 42.3342 177.3717 40 E 4.2664 8.8139 122.1350 58.8260 30.6269 176.9926 41 K 5.2251 7.9173 116.6420 54.4019 36.4863 176.2329 42 V 4.3967 8.5092 123.2765 59.1044 34.0080 173.1142 43 P 4.7264 0.0000 0.0000 62.9538 31.6541 175.9459 44 V 4.7162 8.5237 121.2531 59.6415 33.9614 174.6685 45 S 4.0922 8.3926 113.6768 62.3782 62.5153 175.4846 46 K 4.1191 7.4659 124.2182 57.5408 34.0156 178.4147 47 G 4.2872 7.1805 106.0263 46.0817 0.0000 173.8689 48 Q 5.1750 9.0069 123.5597 54.0346 31.3612 173.6602 49 L 4.7148 8.2772 119.4268 52.6810 45.4287 176.2336 50 K 4.3714 8.8765 126.2239 56.5991 33.2430 175.7318 51 Q 4.3824 9.4723 129.8750 55.3732 29.9723 173.9803 52 Y 5.1164 7.6973 123.3790 55.5533 41.9480 173.9651 53 F 5.1571 9.7533 117.4268 55.9540 43.7098 173.5558 54 Y 4.8714 8.9616 122.4703 56.1743 39.9795 174.5192 55 E 4.8904 8.7664 126.6251 54.7523 33.0914 175.2612 56 T 5.0534 8.1634 119.2646 61.7811 71.8604 173.3111 57 K 4.5880 8.6173 122.8926 55.4828 36.8314 174.3686 58 C 4.7055 8.5451 118.9827 56.8720 35.0731 173.6035 59 N 4.4166 9.5108 123.6627 52.7666 38.4169 173.8497 60 P 4.3928 0.0000 0.0000 65.1949 31.5508 176.6868 61 M 4.6744 7.9888 118.5688 54.8319 32.5125 175.9476 62 G 4.1149 7.5417 107.3319 44.0828 0.0000 174.5159 63 Y 4.4170 8.7951 117.3839 61.1974 37.8577 177.6713 64 T 4.4831 7.8722 109.3422 61.8500 68.9172 175.3157 65 K 4.2077 8.1700 123.8200 58.6716 32.7910 176.3799 66 E 4.5758 7.6740 114.0521 56.5282 31.5285 175.7425 67 G 3.9751 7.3311 105.1817 45.0718 0.0000 173.5854 68 C 4.6269 8.3713 118.0699 56.2469 40.9605 173.4427 69 R 4.3134 8.5055 122.3026 56.8327 30.3197 176.5302 70 G 3.8881 8.9971 112.6772 45.8630 0.0000 172.6010 71 I 4.1521 7.4828 119.9539 59.8027 38.3075 176.9000 72 D 4.7597 8.5763 125.4160 53.8240 38.5303 176.3302 73 K 4.3649 8.2130 121.8372 57.7471 32.6440 178.7655 74 R 3.9240 7.9501 117.4179 59.4463 30.2593 177.1763 75 H 4.5440 7.8908 112.8244 55.7720 29.7553 174.5027 76 W 5.8052 8.2011 118.1311 55.0555 33.4974 173.9393 77 N 5.3435 9.2673 120.5215 51.9413 40.9315 174.0010 78 S 5.5507 8.0786 115.0189 56.8703 66.9809 172.6071 79 Q 4.5102 8.1065 116.2385 55.6826 31.9338 172.8987 80 C 5.2847 8.9797 123.9505 56.0302 37.1937 173.1675 81 R 4.8247 8.8940 119.0384 54.6524 33.0568 174.2280 82 T 4.7494 8.5348 118.1637 63.6229 69.3277 174.1263 83 T 4.6656 8.8189 116.7601 60.0741 71.9143 173.3573 84 Q 5.0040 8.4223 121.0546 54.4825 32.0212 174.0729 85 S 4.5304 8.8065 114.6379 57.0575 66.9560 171.8141 86 Y 5.2493 8.4110 119.8690 56.6825 38.8614 175.8755 87 V 4.8405 8.9798 117.8717 59.3937 35.4286 175.2720 88 R 4.3675 8.7450 123.8900 56.3918 30.9945 175.2716 89 A 5.0707 8.8449 125.2956 50.6272 23.2380 174.8978 90 L 3.6565 9.1152 123.5972 54.5053 43.4886 176.0678 91 T 4.7331 8.7016 115.6528 60.7210 73.2783 171.8930 92 M 5.1823 8.8007 120.3296 54.2490 35.5419 174.7007 93 D 4.8735 8.5958 127.4825 52.6474 41.8898 175.9798 94 S 4.2919 8.6315 111.8412 61.1906 63.1871 174.3775 95 K 4.4398 8.6302 120.6090 56.4100 32.0646 176.6695 96 K 4.4540 7.9716 114.8789 57.3716 29.9879 174.7851 97 R 4.5533 7.5953 116.2284 55.0371 32.0103 175.7736 98 I 4.6336 8.0601 124.3247 60.0058 38.8388 175.1640 99 G 3.9492 8.7390 112.5569 45.3651 0.0000 172.2651 100 W 4.8380 8.8214 120.7144 56.5468 29.7685 176.3326 101 R 4.7779 9.0308 122.5667 54.6395 35.1229 173.8085 102 F 5.2409 8.7534 119.3996 56.3924 40.7395 175.2005 103 I 5.1882 9.0360 116.9152 59.1462 41.1596 174.4525 104 R 4.8857 8.4124 122.7597 55.2653 31.0781 176.1684 105 I 4.6387 8.5066 116.3831 58.7411 41.8800 174.3282 106 D 4.9329 8.6121 124.1520 55.0180 41.4563 176.5654 107 T 4.6984 8.4131 111.2079 61.0111 70.4824 172.9617 108 S 4.4918 7.4682 115.6663 58.1022 66.2375 174.1257 109 C 5.2423 8.7202 121.7621 55.0872 45.5377 173.1036 110 V 4.5889 9.0856 119.8017 59.5725 35.1151 173.9243 111 C 5.0829 8.5636 122.4258 55.7630 44.5615 172.7482 112 T 4.7324 8.8514 122.7461 61.7119 71.1420 173.0539 113 L 5.3981 8.3906 125.1967 53.1543 44.5436 175.8787 114 T 4.9062 8.7057 111.5775 59.7746 72.2398 173.1873 115 I 3.9846 8.6495 125.7397 60.9185 37.8506 175.8765 116 K 4.2012 8.2002 127.3445 56.7049 31.6362 176.4370 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 8 G 8.35 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 9 Q 8.01 4.32 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.66 0.00 0.00 0.00 0.00 0.00 2.29 2.40 0.00 10 L 7.59 4.30 0.00 1.50 1.46 0.86 0.88 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 11 S 8.55 4.30 0.00 4.17 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 12 V 8.29 3.76 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 1.02 0.00 0.00 0.95 0.00 0.00 13 C 7.70 5.23 0.00 2.80 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 14 D 9.40 4.78 0.00 2.53 2.53 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 15 S 8.63 5.45 0.00 3.82 3.75 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 16 I 8.50 4.65 1.80 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 1.18 0.81 0.87 0.00 0.00 17 S 8.33 4.95 0.00 3.52 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 18 E 8.02 4.50 0.00 1.83 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.25 0.00 19 W 8.73 5.17 0.00 3.25 3.17 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 0.00 0.00 0.00 0.00 20 V 9.61 4.66 2.32 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 1.03 0.00 0.00 0.98 0.00 0.00 21 T 9.00 4.88 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 1.17 0.00 0.00 22 A 8.95 4.25 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.97 4.02 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 24 D 7.86 4.48 0.00 2.86 2.78 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 0.00 25 K 8.04 3.99 0.00 1.93 1.93 0.00 1.74 0.00 0.00 1.53 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.59 1.47 7.81 26 K 9.07 4.23 0.00 1.99 1.96 0.00 1.68 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.34 1.51 7.81 27 T 7.13 5.32 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 28 A 8.63 4.54 1.18 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 0.00 0.00 29 V 8.18 4.86 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 0.87 0.00 0.00 0.95 0.00 0.00 30 D 9.05 5.25 0.00 2.99 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 31 M 8.42 4.28 0.00 1.89 1.67 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.23 0.00 32 S 8.08 4.59 0.00 3.96 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 33 G 8.26 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 0.00 0.00 0.00 34 G 8.07 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 35 T 8.45 4.94 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 1.21 0.00 0.00 36 V 9.23 4.65 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 0.81 0.00 0.00 0.93 0.00 0.00 37 T 8.73 4.85 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 38 V 8.54 4.34 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 0.94 0.00 0.00 39 L 8.04 4.18 0.00 1.68 1.52 0.88 0.74 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 40 E 8.81 4.27 0.00 1.93 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 2.42 2.35 0.00 41 K 7.92 5.23 0.00 1.56 1.64 0.00 1.69 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.41 7.81 42 V 8.51 4.40 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 0.84 0.00 0.00 1.11 0.00 0.00 43 P 0.00 4.73 0.00 1.99 2.06 0.00 3.63 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 44 V 8.52 4.72 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 0.78 0.00 0.00 0.99 0.00 0.00 45 S 8.39 4.09 0.00 3.98 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 46 K 7.47 4.12 0.00 1.74 1.79 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.42 1.38 7.81 47 G 7.18 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 0.00 0.00 0.00 0.00 48 Q 9.01 5.17 0.00 1.94 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.70 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 49 L 8.28 4.71 0.00 1.76 1.54 0.93 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 50 K 8.88 4.37 0.00 1.80 1.84 0.00 1.74 0.00 0.00 1.56 0.00 0.00 2.71 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.48 1.47 7.81 51 Q 9.47 4.38 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.39 0.00 0.00 0.00 0.00 0.00 1.99 2.10 0.00 52 Y 7.70 5.12 0.00 3.19 2.80 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 53 F 9.75 5.16 0.00 3.04 3.02 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 54 Y 8.96 4.87 0.00 2.69 2.80 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 55 E 8.77 4.89 0.00 1.74 1.75 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 2.21 2.29 0.00 56 T 8.16 5.05 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 57 K 8.62 4.59 0.00 1.74 1.80 0.00 1.28 0.00 0.00 1.75 0.00 0.00 2.82 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.24 1.37 7.81 58 C 8.55 4.71 0.00 2.87 3.06 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 59 N 9.51 4.42 0.00 2.65 2.77 0.00 0.00 6.59 8.01 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 60 P 0.00 4.39 0.00 2.21 2.17 0.00 3.75 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 61 M 7.99 4.67 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.45 0.00 62 G 7.54 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 0.00 0.00 0.00 63 Y 8.80 4.42 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 64 T 7.87 4.48 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 1.30 0.00 0.00 65 K 8.17 4.21 0.00 1.93 1.89 0.00 1.94 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.43 7.81 66 E 7.67 4.58 0.00 2.08 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 2.17 2.27 0.00 67 G 7.33 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 0.00 0.00 0.00 68 C 8.37 4.63 0.00 2.92 3.20 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 69 R 8.51 4.31 0.00 1.79 1.99 0.00 3.29 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 70 G 9.00 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 0.00 0.00 0.00 71 I 7.48 4.15 1.90 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.85 0.98 0.00 0.00 72 D 8.58 4.76 0.00 2.85 2.99 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 73 K 8.21 4.36 0.00 1.80 1.91 0.00 1.88 0.00 0.00 2.38 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.55 1.57 7.81 74 R 7.95 3.92 0.00 1.81 1.56 0.00 3.12 0.00 0.00 3.19 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 75 H 7.89 4.54 0.00 2.23 2.68 0.00 5.56 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 W 8.20 5.81 0.00 3.38 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 77 N 9.27 5.34 0.00 2.93 2.77 0.00 0.00 6.48 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 78 S 8.08 5.55 0.00 3.77 3.76 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 79 Q 8.11 4.51 0.00 2.10 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 7.02 0.00 0.00 0.00 0.00 0.00 2.21 2.27 0.00 80 C 8.98 5.28 0.00 2.88 2.97 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 81 R 8.89 4.82 0.00 1.74 1.94 0.00 3.00 0.00 0.00 3.14 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.71 0.00 82 T 8.53 4.75 4.20 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 1.22 0.00 0.00 83 T 8.82 4.67 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 1.17 0.00 0.00 84 Q 8.42 5.00 0.00 1.77 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.84 0.00 0.00 0.00 0.00 0.00 2.33 2.24 0.00 85 S 8.81 4.53 0.00 3.77 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 86 Y 8.41 5.25 0.00 2.90 2.99 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 87 V 8.98 4.84 2.32 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 0.89 0.00 0.00 1.08 0.00 0.00 88 R 8.74 4.37 0.00 1.51 1.80 0.00 2.94 0.00 0.00 3.06 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.73 0.00 89 A 8.84 5.07 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 90 L 9.12 3.66 0.00 0.40 1.06 -0.01 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 91 T 8.70 4.73 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 1.23 0.00 0.00 92 M 8.80 5.18 0.00 2.03 1.83 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 2.45 2.45 0.00 93 D 8.60 4.87 0.00 2.80 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 94 S 8.63 4.29 0.00 4.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 K 8.63 4.44 0.00 1.94 1.84 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.40 7.81 96 K 7.97 4.45 0.00 1.84 1.84 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.38 7.81 97 R 7.60 4.55 0.00 1.80 1.82 0.00 3.11 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.76 0.00 98 I 8.06 4.63 1.82 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 1.21 0.49 0.82 0.00 0.00 99 G 8.74 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 0.00 100 W 8.82 4.84 0.00 3.20 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 0.00 101 R 9.03 4.78 0.00 1.71 1.79 0.00 3.11 0.00 0.00 3.38 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 102 F 8.75 5.24 0.00 2.95 3.08 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 0.00 103 I 9.04 5.19 1.85 0.00 0.00 0.54 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 0.77 0.94 0.00 0.00 104 R 8.41 4.89 0.00 1.68 1.86 0.00 3.07 0.00 0.00 3.33 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.59 0.00 105 I 8.51 4.64 1.76 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 1.20 1.28 0.55 0.00 0.00 106 D 8.61 4.93 0.00 2.57 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 0.00 107 T 8.41 4.70 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 1.29 0.00 0.00 108 S 7.47 4.49 0.00 3.85 3.66 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 0.00 109 C 8.72 5.24 0.00 3.00 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 0.00 110 V 9.09 4.59 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 0.63 0.00 0.00 0.89 0.00 0.00 111 C 8.56 5.08 0.00 2.92 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 0.00 112 T 8.85 4.73 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 0.00 113 L 8.39 5.40 0.00 1.01 1.05 -0.16 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 114 T 8.71 4.91 4.33 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 1.27 0.00 0.00 115 I 8.65 3.98 1.82 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.33 0.59 0.00 0.00 116 K 8.20 4.20 0.00 1.76 1.64 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.58 7.81