NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.6449 8.3044 120.2871 55.3301 33.9685 174.0664 3 V 4.0751 8.7954 122.3211 59.6985 32.8412 173.4091 4 W 4.5439 9.0749 135.0000 57.2185 31.6677 174.8870 5 T 3.9460 7.9442 122.2086 61.5767 67.1148 172.2175 6 P 4.6134 0.0000 0.0000 62.8057 32.1912 175.3215 7 V 4.1011 7.4253 119.5590 62.5749 33.0698 175.2552 8 N 4.2879 8.6439 125.0993 55.0560 36.0136 173.7990 9 N 4.9133 7.6709 108.8378 52.8046 40.1570 174.1282 10 K 4.0415 8.3199 116.1050 56.6480 32.6673 176.5800 11 M 4.9110 8.4078 121.3318 53.9139 35.2032 175.3364 12 F 4.5962 8.1305 115.8298 57.1759 40.7827 176.0041 13 E 3.5318 8.0886 121.9218 56.9517 27.9690 174.6630 14 T 3.7068 8.3934 119.5210 66.5474 68.8244 173.9701 15 F 4.4862 9.0579 124.1057 57.6825 36.7620 176.6335 16 S 4.4438 8.3593 115.0366 60.5520 63.0057 174.5884 17 Y 4.3054 8.2628 117.1024 58.2846 38.1797 175.1069 18 L 4.6642 7.5508 119.8783 52.3029 43.5037 174.5000 19 P 4.5006 0.0000 0.0000 61.5967 31.8235 174.8792 20 P 4.2037 0.0000 0.0000 63.0463 31.6809 176.5249 21 L 4.1837 8.3716 122.9505 54.7638 42.2486 177.8070 22 S 4.5536 8.8430 118.6062 57.4501 65.6627 175.1992 23 D 4.3283 8.4908 121.6786 57.4893 40.4333 178.7813 24 E 3.9113 8.0540 119.2847 59.4649 29.8694 178.7898 25 Q 3.8946 7.9776 117.9904 58.7689 28.6875 178.8721 26 I 3.6262 7.9958 120.9374 64.3367 37.1274 178.2317 27 A 4.0535 8.4102 121.8051 55.1709 18.1366 179.5208 28 A 3.9538 8.2102 119.3297 55.4815 18.4265 179.9393 29 Q 4.1047 7.9854 116.3916 59.0584 28.7820 179.1054 30 V 3.7800 8.0612 119.4667 66.1197 31.5211 177.8802 31 D 4.4357 8.5751 119.0554 57.3744 40.4808 178.0940 32 Y 4.2031 8.1379 120.2189 60.6850 38.8432 178.1901 33 I 3.9971 8.0393 120.7274 64.5632 37.3116 178.6408 34 V 3.5574 7.9393 118.7603 65.9929 31.1718 177.8809 35 A 3.9254 8.1240 119.6937 54.5965 18.2214 178.3129 36 N 4.1053 7.1007 112.5070 52.1311 38.5808 175.6561 37 G 3.7433 7.4166 108.2084 46.0821 0.0000 174.1303 38 W 4.9922 7.6275 118.9181 55.9156 30.8674 176.3718 39 I 4.4634 8.9996 123.4260 59.3561 37.7456 173.9787 40 P 4.8829 0.0000 0.0000 63.1830 32.9844 174.8435 41 C 4.9558 8.8465 120.0189 58.5882 35.5611 172.3955 42 L 5.2843 8.6832 123.9360 53.2453 44.4602 175.1893 43 E 5.5699 9.2317 120.7667 54.9659 34.2954 174.4576 44 F 5.6419 9.1479 116.6418 55.9404 42.3985 172.8403 45 A 4.3715 8.1334 117.8965 50.6869 22.7369 176.3792 46 E 4.4196 8.3544 118.8332 55.6549 31.1550 178.0338 47 S 4.4209 8.9418 115.3569 62.2328 62.8441 176.8750 48 D 4.6019 8.1625 117.0288 56.1013 40.7030 176.9796 49 K 4.6182 7.8239 117.1779 56.0135 32.6845 176.9958 50 A 3.8230 7.7949 124.1191 54.2874 18.4595 178.3162 51 Y 4.7131 7.4596 111.1057 55.6565 40.4554 176.1075 52 V 4.4958 8.4930 115.3911 61.5824 32.3167 175.5328 53 S 4.7547 8.3778 115.8033 57.6303 66.2610 173.7722 54 N 5.0540 8.4591 113.9540 52.9555 39.5236 176.4906 55 E 3.8871 8.3725 119.7952 60.0106 29.5060 179.6921 56 S 3.9542 8.9531 114.7293 61.0904 62.7448 176.3713 57 A 2.5800 7.6643 123.3082 53.9125 17.7366 179.1074 58 I 3.5341 6.9954 116.4973 63.2514 38.0709 177.0369 59 R 4.3529 7.4563 116.6973 55.5137 30.5966 176.2196 60 F 4.9940 7.3125 118.3129 56.3719 41.1446 176.6010 61 G 4.0937 8.1861 115.1971 46.1569 0.0000 175.6118 62 S 4.6236 8.4347 113.8795 58.7781 62.2980 174.4114 63 V 4.4596 7.2301 107.0714 61.1626 33.0620 177.7578 64 S 4.4254 8.2506 115.2672 59.7654 63.5493 173.3384 65 C 3.9058 8.1020 118.7277 61.5220 27.9127 173.3175 66 L 3.5633 8.4940 123.9440 55.7558 38.9209 173.3946 67 Y 4.4179 7.4291 118.5571 55.7945 40.7657 174.3823 68 Y 4.9397 7.0678 122.7654 56.7311 42.3768 174.3544 69 D 4.6063 9.1748 123.4287 54.8786 42.1220 177.0569 70 N 4.5836 8.8680 116.3305 54.2189 35.9187 175.9533 71 R 4.0367 7.9646 119.0255 59.0833 30.5023 177.0508 72 Y 4.4294 7.7376 114.4759 57.6501 38.5353 174.5032 73 W 5.0756 8.6755 122.9626 55.1989 33.1530 174.3812 74 T 4.2927 8.2624 117.2968 62.7628 69.3853 174.6531 75 M 4.7287 8.5440 126.1371 55.2553 33.3426 175.1127 76 W 4.9421 9.3237 135.0000 55.9050 31.5644 176.8689 77 K 3.4302 8.5772 128.5876 57.4108 30.6650 178.1982 78 L 4.9037 8.2827 125.1915 52.8411 45.4921 173.8049 79 P 4.2454 0.0000 0.0000 63.2495 32.3327 177.6887 80 M 4.3392 8.7502 123.5024 53.8007 30.4755 176.2005 81 F 4.4612 7.3104 117.8372 59.1328 40.0190 176.5597 82 G 3.9733 9.1610 112.4842 45.6418 0.0000 172.9202 83 C 4.2945 7.9560 120.6769 59.5376 31.7811 173.3095 84 R 4.5397 8.6302 123.6801 55.4882 31.4491 174.4929 85 D 4.7799 7.7773 118.2169 51.3619 42.6706 174.1622 86 P 4.3177 0.0000 0.0000 66.1202 31.2816 178.3715 87 M 4.1049 8.4147 117.3650 58.5609 31.8402 178.7667 88 Q 4.0568 8.1528 118.2269 58.7955 28.8388 179.1178 89 V 3.5899 7.7113 118.8044 66.0907 31.8945 177.9132 90 L 4.0144 7.8768 118.6568 57.6893 41.3612 179.5374 91 R 3.8985 8.1313 118.6401 59.6299 30.0935 178.5361 92 E 4.1146 8.2334 118.2846 59.3884 29.4269 179.3599 93 I 3.5669 7.8803 120.0381 64.1664 37.1214 178.6547 94 V 3.4493 7.6513 118.4009 65.8315 31.4428 177.8666 95 A 3.9408 7.9949 120.5341 55.2561 18.1923 179.0914 96 C 2.0000 7.7662 117.4440 62.1114 31.0878 175.9268 97 T 3.6448 7.4299 111.2475 64.5739 67.9346 176.2634 98 K 3.8940 7.7488 121.5381 59.1292 32.2781 178.4461 99 A 4.0192 7.6913 120.2681 53.5209 19.7522 177.7031 100 F 4.6243 7.8576 116.1573 54.7791 38.9538 174.1064 101 P 4.3601 0.0000 0.0000 64.3257 31.7571 177.9642 102 D 4.6908 8.1046 116.4480 53.7758 41.1641 175.2170 103 A 4.8201 7.3926 121.0975 50.2378 21.9525 176.5261 104 Y 4.2789 8.8403 117.3633 57.6026 39.6166 175.3094 105 V 5.3043 8.9391 122.9246 61.1991 35.2772 174.3282 106 R 4.9376 9.4433 123.5582 54.2845 33.2267 173.5970 107 L 4.8406 7.9759 123.2305 53.7590 44.0298 175.6382 108 V 4.7714 8.7465 118.1586 59.5815 36.5876 174.0710 109 A 4.8425 7.9764 121.9164 50.5567 22.7761 175.2746 110 F 5.2753 9.2851 120.0388 55.7311 42.6137 174.3034 111 D 5.4622 8.8308 122.2990 52.6601 42.5187 176.4274 112 N 4.7406 9.1969 123.2837 54.2205 38.3272 176.3737 113 Q 4.1880 8.7948 118.9697 58.8835 29.0247 177.4032 114 K 4.1241 8.3704 113.8978 56.4142 32.9029 176.5219 115 Q 3.4405 7.9271 117.6057 55.3400 26.8391 172.2922 116 V 4.3232 7.8190 117.3646 60.2504 34.8378 173.1405 117 Q 4.5365 8.8164 123.2611 56.3542 29.3091 175.6692 118 I 4.1686 7.7821 117.7093 60.8051 38.4406 174.7200 119 M 4.4855 6.7877 121.0950 54.9603 35.5642 173.2742 120 G 4.6528 8.4095 107.9002 46.8563 0.0000 172.5007 121 F 5.0456 7.2316 116.6577 55.2902 41.0215 173.0085 122 L 4.5049 8.8187 123.2741 55.6145 42.1510 176.8002 123 V 4.5310 9.0003 117.4153 61.2058 33.9792 175.5919 124 Q 4.4569 7.6611 121.2778 54.7295 32.4721 172.9875 125 R 4.1127 8.1068 125.8090 52.9656 33.1940 173.2009 126 P 4.2141 0.0000 0.0000 62.6189 31.7668 177.4751 127 K 4.0452 8.5238 120.0708 59.5881 32.1236 178.5751 128 S 4.2670 7.9895 111.2862 59.6226 63.3960 174.3371 129 A 4.2817 7.7213 125.0195 53.0147 18.4038 177.3005 130 R 4.6667 8.7560 119.7585 55.9338 32.0310 175.2293 131 D 4.8952 8.5427 116.7129 52.6149 39.6686 175.4238 132 W 5.6100 7.6698 114.6644 53.9667 31.4148 174.0233 133 Q 4.3267 8.4420 117.0697 53.0204 31.4906 174.1499 134 P 4.5929 0.0000 0.0000 62.0805 32.4104 176.9938 135 A 4.0121 8.8604 123.2398 55.6742 18.1549 178.7932 136 N 4.5590 8.0722 109.8481 54.1299 37.9548 175.6257 137 K 4.4234 8.2292 118.5694 56.2750 32.9154 177.9405 138 R 3.6485 7.6255 120.6156 58.1014 30.8636 176.4614 139 S 5.0195 7.2398 109.1714 56.3411 66.5074 174.8760 140 V 4.0792 8.7389 114.0814 61.6593 32.3511 175.5302 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 M 8.30 4.64 0.00 1.98 2.16 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.58 0.00 3 V 8.80 4.08 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 0.89 0.00 0.00 0.97 0.00 0.00 4 W 9.07 4.54 0.00 3.43 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 5 T 7.94 3.95 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 0.99 0.00 0.00 6 P 0.00 4.61 0.00 2.24 2.19 0.00 3.78 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.96 0.00 7 V 7.43 4.10 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 0.77 0.00 0.00 0.91 0.00 0.00 8 N 8.64 4.29 0.00 2.86 2.85 0.00 0.00 6.53 6.92 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 9 N 7.67 4.91 0.00 2.53 2.70 0.00 0.00 7.29 6.68 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 10 K 8.32 4.04 0.00 2.01 1.71 0.00 1.07 0.00 0.00 1.50 0.00 0.00 2.67 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.48 1.18 7.81 11 M 8.41 4.91 0.00 2.09 2.13 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.65 0.00 12 F 8.13 4.60 0.00 3.08 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 13 E 8.09 3.53 0.00 2.16 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 0.00 2.21 2.15 0.00 14 T 8.39 3.71 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 0.03 0.00 0.00 15 F 9.06 4.49 0.00 3.29 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 16 S 8.36 4.44 0.00 4.12 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 17 Y 8.26 4.31 0.00 3.06 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 18 L 7.55 4.66 0.00 1.81 1.62 0.82 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.50 0.00 2.05 2.01 0.00 3.73 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 20 P 0.00 4.20 0.00 2.06 2.04 0.00 3.73 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 2.14 2.24 0.00 21 L 8.37 4.18 0.00 1.58 1.46 0.48 0.48 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 22 S 8.84 4.55 0.00 4.02 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 23 D 8.49 4.33 0.00 2.70 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 24 E 8.05 3.91 0.00 2.01 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 2.34 2.38 0.00 25 Q 7.98 3.89 0.00 2.21 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.59 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 26 I 8.00 3.63 2.07 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 1.54 1.07 1.12 0.00 0.00 27 A 8.41 4.05 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 28 A 8.21 3.95 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 29 Q 7.99 4.10 0.00 2.43 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.76 0.00 0.00 0.00 0.00 0.00 2.37 1.93 0.00 30 V 8.06 3.78 2.33 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 1.10 0.00 0.00 1.14 0.00 0.00 31 D 8.58 4.44 0.00 2.96 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 32 Y 8.14 4.20 0.00 3.23 3.36 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 33 I 8.04 4.00 2.17 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 1.72 1.27 1.09 0.00 0.00 34 V 7.94 3.56 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 1.01 0.00 0.00 0.98 0.00 0.00 35 A 8.12 3.93 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 36 N 7.10 4.11 0.00 1.44 1.42 0.00 0.00 7.02 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 7.42 3.74 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 0.00 0.00 0.00 38 W 7.63 4.99 0.00 3.49 3.09 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 39 I 9.00 4.46 2.12 0.00 0.00 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 1.52 1.13 0.77 0.00 0.00 40 P 0.00 4.88 0.00 2.12 2.20 0.00 3.92 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 41 C 8.85 4.96 0.00 3.05 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 42 L 8.68 5.28 0.00 1.84 1.58 0.84 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 43 E 9.23 5.57 0.00 2.06 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 0.00 2.36 2.30 0.00 44 F 9.15 5.64 0.00 2.95 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 45 A 8.13 4.37 -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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.35 4.42 0.00 2.19 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 2.30 2.28 0.00 47 S 8.94 4.42 0.00 4.02 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 48 D 8.16 4.60 0.00 2.69 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 49 K 7.82 4.62 0.00 1.51 1.66 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.32 1.41 7.81 50 A 7.79 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 Y 7.46 4.71 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 52 V 8.49 4.50 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 0.59 0.00 0.00 0.78 0.00 0.00 53 S 8.38 4.75 0.00 4.00 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 54 N 8.46 5.05 0.00 2.78 2.87 0.00 0.00 6.78 7.66 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 55 E 8.37 3.89 0.00 2.02 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 2.44 2.51 0.00 56 S 8.95 3.95 0.00 3.89 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 0.00 57 A 7.66 2.58 1.19 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 0.00 0.00 58 I 7.00 3.53 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 1.47 0.81 0.86 0.00 0.00 59 R 7.46 4.35 0.00 1.84 1.99 0.00 3.18 0.00 0.00 3.20 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 60 F 7.31 4.99 0.00 2.99 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 61 G 8.19 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 62 S 8.43 4.62 0.00 3.86 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 63 V 7.23 4.46 1.87 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 0.66 0.00 0.00 0.50 0.00 0.00 64 S 8.25 4.43 0.00 4.11 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 0.00 65 C 8.10 3.91 0.00 2.96 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 66 L 8.49 3.56 0.00 1.77 1.74 0.94 0.97 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 67 Y 7.43 4.42 0.00 2.90 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 68 Y 7.07 4.94 0.00 2.84 2.71 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 0.00 0.00 0.00 0.00 69 D 9.17 4.61 0.00 2.76 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 70 N 8.87 4.58 0.00 3.05 3.23 0.00 0.00 6.99 7.66 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 71 R 7.96 4.04 0.00 1.55 1.71 0.00 3.10 0.00 0.00 3.31 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 72 Y 7.74 4.43 0.00 3.04 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 73 W 8.68 5.08 0.00 3.05 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 74 T 8.26 4.29 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 0.91 0.00 0.00 75 M 8.54 4.73 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.78 0.00 76 W 9.32 4.94 0.00 3.64 3.29 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 77 K 8.58 3.43 0.00 1.65 0.74 0.00 1.73 0.00 0.00 1.53 0.00 0.00 2.73 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.77 0.21 7.81 78 L 8.28 4.90 0.00 1.59 1.56 1.00 1.03 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 79 P 0.00 4.25 0.00 0.57 1.77 0.00 3.67 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.17 0.00 80 M 8.75 4.34 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.54 0.00 81 F 7.31 4.46 0.00 3.11 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 82 G 9.16 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 0.00 0.00 0.00 83 C 7.96 4.29 0.00 3.10 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 84 R 8.63 4.54 0.00 1.80 1.86 0.00 3.21 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.78 0.00 85 D 7.78 4.78 0.00 2.72 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 86 P 0.00 4.32 0.00 2.22 2.14 0.00 3.67 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.22 0.00 87 M 8.41 4.10 0.00 2.06 2.46 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.75 0.00 88 Q 8.15 4.06 0.00 2.26 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.82 0.00 0.00 0.00 0.00 0.00 2.41 2.58 0.00 89 V 7.71 3.59 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 1.10 0.00 0.00 0.97 0.00 0.00 90 L 7.88 4.01 0.00 1.90 1.72 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.13 3.90 0.00 1.96 2.24 0.00 3.20 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.78 0.00 92 E 8.23 4.11 0.00 2.27 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 0.00 2.62 2.66 0.00 93 I 7.88 3.57 1.98 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.05 0.84 0.00 0.00 94 V 7.65 3.45 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 0.97 0.00 0.00 0.99 0.00 0.00 95 A 7.99 3.94 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 96 C 7.77 2.00 0.00 1.23 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 0.00 0.00 0.00 0.00 97 T 7.43 3.64 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 1.10 0.00 0.00 98 K 7.75 3.89 0.00 1.77 1.98 0.00 1.76 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.38 1.39 7.81 99 A 7.69 4.02 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 0.00 100 F 7.86 4.62 0.00 2.79 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 0.00 101 P 0.00 4.36 0.00 2.12 2.11 0.00 3.27 0.00 0.00 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.87 0.00 102 D 8.10 4.69 0.00 2.69 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 0.00 103 A 7.39 4.82 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 0.00 104 Y 8.84 4.28 0.00 2.52 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 0.00 105 V 8.94 5.30 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 0.95 0.00 0.00 0.91 0.00 0.00 106 R 9.44 4.94 0.00 1.76 1.82 0.00 2.26 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.32 0.00 107 L 7.98 4.84 0.00 1.49 0.71 0.86 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.75 4.77 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 0.48 0.00 0.00 0.48 0.00 0.00 109 A 7.98 4.84 1.15 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 0.00 0.00 110 F 9.29 5.28 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 0.00 111 D 8.83 5.46 0.00 2.32 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 0.00 112 N 9.20 4.74 0.00 2.94 3.06 0.00 0.00 6.32 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 0.00 113 Q 8.79 4.19 0.00 2.32 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.94 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 114 K 8.37 4.12 0.00 1.75 1.86 0.00 1.91 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.61 7.81 115 Q 7.93 3.44 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.82 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 116 V 7.82 4.32 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 0.56 0.00 0.00 0.92 0.00 0.00 117 Q 8.82 4.54 0.00 2.17 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.89 0.00 0.00 0.00 0.00 0.00 2.22 2.05 0.00 118 I 7.78 4.17 0.99 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.16 0.47 0.00 0.00 119 M 6.79 4.49 0.00 2.11 1.93 0.00 0.00 0.00 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.89 0.00 120 G 8.41 4.65 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 0.00 0.00 0.00 121 F 7.23 5.05 0.00 3.21 3.31 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 0.00 122 L 8.82 4.50 0.00 1.47 1.56 0.69 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 123 V 9.00 4.53 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 0.69 0.00 0.00 0.88 0.00 0.00 124 Q 7.66 4.46 0.00 1.98 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.86 0.00 0.00 0.00 0.00 0.00 2.14 2.22 0.00 125 R 8.11 4.11 0.00 1.35 1.31 0.00 2.22 0.00 0.00 2.67 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.19 0.00 126 P 0.00 4.21 0.00 2.13 2.07 0.00 2.20 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.55 0.00 127 K 8.52 4.05 0.00 1.76 1.93 0.00 1.78 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.41 1.36 7.81 128 S 7.99 4.27 0.00 4.01 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 0.00 129 A 7.72 4.28 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 0.00 0.00 0.00 0.00 0.00 130 R 8.76 4.67 0.00 1.80 1.87 0.00 3.32 0.00 0.00 3.26 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.54 0.00 131 D 8.54 4.90 0.00 2.90 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 0.00 132 W 7.67 5.61 0.00 3.66 3.21 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 0.00 133 Q 8.44 4.33 0.00 1.99 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 7.07 0.00 0.00 0.00 0.00 0.00 2.37 2.04 0.00 134 P 0.00 4.59 0.00 2.18 2.05 0.00 3.47 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.78 0.00 135 A 8.86 4.01 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 0.00 136 N 8.07 4.56 0.00 2.81 2.94 0.00 0.00 5.86 7.13 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 0.00 137 K 8.23 4.42 0.00 1.56 1.73 0.00 1.60 0.00 0.00 1.55 0.00 0.00 2.80 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.25 1.38 7.81 138 R 7.63 3.65 0.00 1.30 0.66 0.00 3.08 0.00 0.00 3.42 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 139 S 7.24 5.02 0.00 3.98 3.91 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 0.00 140 V 8.74 4.08 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 0.68 0.00 0.00 0.90 0.00 0.00