NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4352 8.2893 120.3538 53.5099 34.8698 175.2540 2 K 4.3639 7.7364 114.3280 54.0854 33.9215 173.1266 3 T 4.0355 8.3216 113.4012 61.8804 70.4998 174.9566 4 F 3.9951 8.5779 124.3324 58.3581 39.8171 175.3449 5 T 3.4230 5.7900 112.6360 60.2552 67.9933 170.5593 6 A 3.5867 6.7613 125.7028 52.0547 19.3502 177.6227 7 K 4.3679 7.9479 121.3735 54.3711 33.3331 176.2590 8 P 4.4285 0.0000 0.0000 64.2405 31.4630 176.5951 9 E 4.4596 8.2157 118.3164 57.5851 30.6667 176.5270 10 T 4.4975 7.6402 107.8729 61.5679 69.5850 174.4720 11 V 4.2826 7.6838 121.4592 62.4795 33.1386 175.1330 12 K 4.1458 8.7798 125.9960 57.9025 33.0535 176.0154 13 R 4.7211 7.8250 119.3817 53.6622 28.9337 173.8541 14 D 5.2517 7.9846 117.7115 54.3820 40.7640 173.4219 15 W 5.3224 8.3848 121.2823 55.6717 31.6695 174.4369 16 Y 5.6219 9.2708 119.2416 56.9345 43.1110 173.9356 17 V 5.0233 8.2904 118.8630 62.0384 35.1645 173.4041 18 V 4.7242 8.5029 124.5456 60.9751 34.9823 171.1389 19 D 5.2311 8.7105 121.6007 51.8311 43.3928 176.6392 20 A 4.3910 8.1775 130.8349 51.7665 17.2179 177.4147 21 T 4.3918 6.8667 120.9700 64.4807 69.7663 177.3886 22 G 4.0897 7.8144 108.7200 45.6908 0.0000 173.1470 23 K 4.6043 7.7509 118.8077 54.5005 34.0858 177.1922 24 T 4.0982 8.4490 110.7704 61.3042 68.8014 172.1202 25 L 3.5294 8.4238 128.6959 55.5317 42.6375 172.4230 26 G 4.1301 8.3317 113.7817 46.9524 0.0000 176.0275 27 R 3.9843 7.8950 120.2977 57.6925 30.3118 178.4003 28 L 4.2597 7.7618 118.9178 58.0644 40.9631 178.1779 29 A 4.0035 7.9840 121.9123 55.1962 18.0905 179.0021 30 T 3.8115 7.8567 107.8347 65.5767 68.4905 175.8557 31 E 3.8908 8.0616 122.1657 58.8502 29.7332 177.7857 32 L 3.8418 8.7690 119.4694 57.7208 41.3582 178.9348 33 A 3.9405 9.2081 123.0779 55.5732 18.8341 179.1050 34 R 3.9787 8.2620 117.3288 59.9896 29.9963 178.7341 35 R 3.8785 7.9821 117.2604 59.2353 30.0265 178.8837 36 L 4.0719 8.0027 117.9433 56.4019 41.4033 178.2363 37 R 4.4853 7.6745 118.0545 54.8559 31.0207 175.7435 38 G 4.2268 8.8248 103.0847 45.1074 0.0000 175.3293 39 K 3.8276 7.7793 122.1470 59.7134 32.2903 177.6844 40 H 4.4560 8.3419 112.8290 58.3613 29.4976 177.4719 41 K 4.2164 7.1846 120.0938 55.7887 31.8406 178.1321 42 A 4.6765 8.2747 120.1608 51.8953 18.7096 177.8917 43 E 3.8616 8.1656 122.5088 58.6295 30.3667 174.4939 44 Y 4.5699 7.7858 121.7090 57.1097 38.9232 175.8354 45 T 4.8043 8.2934 135.0000 61.1264 69.6551 171.6204 46 P 4.2104 0.0000 0.0000 66.3263 31.7968 178.4436 47 H 4.5048 7.8204 107.8142 55.9013 27.9225 174.7738 48 V 4.4124 7.5671 118.2633 61.6922 34.4396 175.0862 49 D 4.5454 8.3940 124.9471 54.0709 39.4700 175.8281 50 T 4.2560 8.0807 119.0039 62.9317 69.3317 175.2347 51 G 4.0488 7.6937 111.5477 45.4266 0.0000 171.8008 52 D 5.8500 7.8178 118.3429 53.2685 42.2980 177.2026 53 Y 4.1981 8.6263 111.9500 56.9062 38.7292 173.8519 54 I 5.0012 7.7090 122.6908 59.2135 41.2819 173.8935 55 I 4.8894 8.1159 120.0732 59.3719 41.0001 175.2864 56 V 5.2725 8.3415 125.1092 61.3664 33.6439 175.7537 57 L 4.8102 8.2727 121.7978 53.7085 42.7604 178.1499 58 N 4.7609 10.2913 122.6263 55.4292 39.1792 175.1362 59 A 4.1563 9.2702 125.1491 53.3743 18.1654 179.6435 60 D 4.3740 8.0885 112.5653 55.6305 39.3214 177.0693 61 K 4.5869 7.8785 119.7891 55.9920 32.8410 175.9623 62 V 4.5655 7.9820 117.3848 59.5235 32.9536 176.6338 63 A 4.4021 8.6253 125.4179 53.5659 19.3348 176.1683 64 V 4.0557 8.5166 116.0575 61.0768 34.5609 173.2049 65 T 3.3089 8.1699 117.3195 61.4711 68.2200 172.3004 66 G 3.8173 8.3002 111.2947 47.1797 0.0000 173.8399 67 N 4.9816 8.4700 120.7684 52.5304 40.2961 175.5756 68 K 3.7979 7.6527 118.3467 59.9066 32.6357 178.6352 69 R 4.4567 8.3784 118.8573 59.3788 29.8380 177.1848 70 T 4.6560 8.4364 103.7568 61.1110 69.9995 173.4722 71 D 4.9852 7.9392 120.7048 53.9583 42.6330 175.7383 72 K 4.6323 7.7460 127.6931 56.2508 31.9970 176.5607 73 V 4.0588 8.4214 118.6783 59.7637 39.4035 171.0054 74 Y 3.4333 8.4721 132.4538 58.4924 35.0919 166.9316 75 Y 5.5199 8.1219 120.5606 56.2581 40.1039 175.1235 76 H 4.8315 9.3586 119.7819 53.8653 30.6926 171.6831 77 H 4.7339 8.8026 125.3953 56.0588 30.2809 176.2327 78 T 3.9014 8.5261 116.4780 63.5317 68.8272 175.2009 79 G 4.1631 7.9451 106.1248 45.4663 0.0000 172.2068 80 H 5.0181 7.3984 116.5601 53.5404 31.7302 172.5714 81 I 2.9398 7.9149 114.3874 65.8418 37.9116 177.3553 82 G 3.7516 7.9576 112.0981 45.5348 0.0000 177.3114 83 G 3.4031 7.7302 109.8036 44.8691 0.0000 176.6355 84 I 3.2063 7.5107 111.1575 61.3129 35.2598 171.8370 85 K 4.8381 8.0328 124.9562 54.1163 34.9302 175.3267 86 Q 5.8232 8.8962 119.9380 53.8469 32.0631 175.0708 87 A 4.5981 8.4525 122.0636 51.0294 21.7172 176.4942 88 T 3.8350 8.8037 117.3741 62.0703 68.2929 174.2442 89 F 4.0632 8.5329 125.7755 61.7975 38.9129 176.6912 90 E 3.6925 8.1413 118.9807 59.3814 29.6610 179.1328 91 E 4.0214 7.8025 117.9330 59.5362 29.7209 178.5019 92 M 3.9262 7.7520 118.5845 58.8306 31.8742 178.7653 93 I 3.5275 7.0793 117.3860 64.5643 37.2542 177.9151 94 A 4.2576 7.5561 120.7239 53.3271 18.2809 178.0420 95 R 4.3127 7.3371 113.2795 55.5147 32.0492 175.4666 96 R 4.2420 8.5889 122.1815 55.7978 27.1631 175.3717 97 P 4.0570 0.0000 0.0000 65.3292 32.5983 179.3324 98 E 3.9123 8.3936 117.9062 59.7544 29.7446 179.3395 99 R 4.1300 7.7185 117.3869 59.6777 29.8466 178.8846 100 V 3.7277 8.3654 117.2864 65.8539 31.5313 177.6740 101 I 4.1602 8.1862 119.3598 63.6624 36.9715 177.5944 102 E 4.2884 8.2190 119.0197 59.6364 29.2665 179.1765 103 I 3.7940 8.5113 111.8194 62.6093 37.3043 177.1270 104 A 4.3486 7.6444 121.6067 53.8080 19.8084 178.7294 105 V 3.9539 7.9769 110.8693 63.2896 32.3299 178.4682 106 K 3.6552 9.2281 120.4333 59.2811 32.0161 178.2223 107 G 3.9015 7.3524 104.7933 46.4559 0.0000 173.6356 108 M 4.4130 7.9693 119.3453 55.7400 33.7952 176.7711 109 L 4.2306 7.2323 116.9045 53.6414 42.6591 174.8802 110 P 4.5381 0.0000 0.0000 61.8428 33.0453 176.7934 111 K 3.9486 8.3579 117.5325 56.7022 30.5399 172.8673 112 G 4.0175 7.6902 102.0470 46.6375 0.0000 173.2793 113 P 4.0498 0.0000 0.0000 65.0039 31.2382 178.3394 114 L 3.9779 7.8613 119.3279 57.3898 42.3159 178.7283 115 G 3.8262 7.8951 106.4534 47.5112 0.0000 175.1724 116 R 4.0764 8.9469 123.0258 59.2485 29.6924 178.2410 117 A 4.1224 7.3584 119.1119 55.1409 18.4203 179.2235 118 M 4.0906 8.3997 117.5361 57.8369 31.9366 178.8483 119 F 4.1030 8.7988 121.8759 61.0671 39.5615 177.3398 120 R 3.4960 7.5235 113.0804 58.2677 29.0329 178.2997 121 K 3.9838 7.0393 119.0236 58.2242 32.5596 177.3664 122 L 4.5145 7.0979 119.4999 54.0555 42.7175 176.2077 123 K 4.5006 8.1128 124.3741 55.1241 34.4897 174.3973 124 V 4.2579 6.3051 110.1559 58.5215 37.9206 175.4750 125 Y 4.1177 7.5604 116.6907 58.0075 37.6145 169.7768 126 A 4.1660 8.8805 123.8035 53.2860 18.7876 178.1262 127 G 4.8786 8.6351 111.2389 46.6186 0.0000 170.9656 128 N 4.3461 8.6907 124.2475 53.5486 36.6891 177.7748 129 E 4.0227 9.0988 121.5084 57.8086 29.8205 176.4366 130 H 3.8463 7.9018 109.2848 54.9589 30.9582 174.9976 131 N 4.8022 8.5402 125.6111 53.1627 36.7124 175.0684 132 H 4.6477 7.3454 110.6597 55.2872 32.5786 175.6519 133 A 3.8228 7.4309 124.5104 55.0707 18.1341 179.7241 134 A 3.9760 7.8343 116.8577 54.1687 18.3955 177.6468 135 Q 3.9768 7.5229 113.0601 54.5075 30.5206 175.4389 136 Q 3.2707 8.1865 116.8438 56.2175 26.7944 172.7205 137 P 4.5913 0.0000 0.0000 62.2866 32.5671 178.2066 138 Q 4.2159 8.6254 122.9404 56.0246 29.8127 176.3036 139 V 4.3608 8.3762 115.1429 61.9801 32.6103 175.2476 140 L 4.6555 8.5988 124.1016 53.9550 45.4842 174.7135 141 D 4.5980 8.8508 125.7207 53.1586 41.5535 176.0540 142 I 3.5991 8.3664 126.6011 61.9360 37.2698 173.8935 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 8.29 4.44 0.00 2.03 2.01 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 2.50 2.56 0.00 2 K 7.74 4.36 0.00 1.94 1.77 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.21 1.52 7.81 3 T 8.32 4.04 4.79 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 1.33 0.00 0.00 4 F 8.58 4.00 0.00 2.97 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 5 T 5.79 3.42 3.88 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 0.00 0.00 0.89 0.00 0.00 6 A 6.76 3.59 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 7 K 7.95 4.37 0.00 1.88 1.67 0.00 1.59 0.00 0.00 1.60 0.00 0.00 2.71 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.34 1.50 7.81 8 P 0.00 4.43 0.00 2.03 2.11 0.00 3.63 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 9 E 8.22 4.46 0.00 1.93 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 2.27 2.27 0.00 10 T 7.64 4.50 4.30 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 1.24 0.00 0.00 11 V 7.68 4.28 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 0.98 0.00 0.00 1.03 0.00 0.00 12 K 8.78 4.15 0.00 2.14 1.97 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.44 7.81 13 R 7.83 4.72 0.00 2.30 2.27 0.00 3.43 0.00 0.00 3.45 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.84 0.00 14 D 7.98 5.25 0.00 3.15 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 15 W 8.38 5.32 0.00 3.05 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 16 Y 9.27 5.62 0.00 2.95 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 17 V 8.29 5.02 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 0.98 0.00 0.00 1.05 0.00 0.00 18 V 8.50 4.72 2.31 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 0.79 0.00 0.00 0.98 0.00 0.00 19 D 8.71 5.23 0.00 2.70 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 20 A 8.18 4.39 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 21 T 6.87 4.39 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 1.26 0.00 0.00 22 G 7.81 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 23 K 7.75 4.60 0.00 1.81 1.72 0.00 1.69 0.00 0.00 1.88 0.00 0.00 2.94 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.46 1.36 7.81 24 T 8.45 4.10 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 1.22 0.00 0.00 25 L 8.42 3.53 0.00 1.96 1.71 0.88 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.33 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 27 R 7.89 3.98 0.00 1.79 2.03 0.00 3.20 0.00 0.00 3.27 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 28 L 7.76 4.26 0.00 1.86 1.91 0.94 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 29 A 7.98 4.00 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 30 T 7.86 3.81 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 1.19 0.00 0.00 31 E 8.06 3.89 0.00 2.11 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 2.33 2.38 0.00 32 L 8.77 3.84 0.00 1.80 1.61 0.93 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 33 A 9.21 3.94 1.29 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 34 R 8.26 3.98 0.00 1.96 2.10 0.00 3.12 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 35 R 7.98 3.88 0.00 2.09 1.83 0.00 2.88 0.00 0.00 3.00 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.48 0.00 36 L 8.00 4.07 0.00 1.73 1.67 0.79 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.67 4.49 0.00 1.92 1.90 0.00 3.23 0.00 0.00 3.17 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.51 0.00 38 G 8.82 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 0.00 0.00 0.00 0.00 39 K 7.78 3.83 0.00 1.66 2.02 0.00 1.69 0.00 0.00 1.76 0.00 0.00 3.16 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.48 7.81 40 H 8.34 4.46 0.00 3.27 3.38 0.00 5.78 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 7.18 4.22 0.00 1.83 1.64 0.00 1.86 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.35 0.93 7.81 42 A 8.27 4.68 1.23 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 0.00 0.00 0.00 43 E 8.17 3.86 0.00 2.14 2.07 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 2.33 2.56 0.00 44 Y 7.79 4.57 0.00 3.07 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 45 T 8.29 4.80 4.12 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 1.29 0.00 0.00 46 P 0.00 4.21 0.00 2.10 2.15 0.00 3.76 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 2.09 2.34 0.00 47 H 7.82 4.50 0.00 3.22 3.41 0.00 5.68 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 7.57 4.41 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 0.74 0.00 0.00 0.95 0.00 0.00 49 D 8.39 4.55 0.00 2.62 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 50 T 8.08 4.26 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 1.25 0.00 0.00 51 G 7.69 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 52 D 7.82 5.85 0.00 2.68 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 53 Y 8.63 4.20 0.00 1.98 1.43 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 54 I 7.71 5.00 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.30 0.85 0.00 0.00 55 I 8.12 4.89 2.16 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 1.59 0.76 1.23 0.00 0.00 56 V 8.34 5.27 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 0.99 0.00 0.00 1.02 0.00 0.00 57 L 8.27 4.81 0.00 1.71 0.91 0.99 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 58 N 10.29 4.76 0.00 2.98 3.05 0.00 0.00 7.27 7.35 0.00 0.00 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 A 9.27 4.16 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 60 D 8.09 4.37 0.00 2.75 2.82 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 61 K 7.88 4.59 0.00 1.83 1.83 0.00 1.66 0.00 0.00 1.87 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.39 7.81 62 V 7.98 4.57 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 1.21 0.00 0.00 1.09 0.00 0.00 63 A 8.63 4.40 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 64 V 8.52 4.06 2.37 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 0.83 0.00 0.00 0.55 0.00 0.00 65 T 8.17 3.31 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 1.20 0.00 0.00 66 G 8.30 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 67 N 8.47 4.98 0.00 2.69 2.73 0.00 0.00 6.89 6.75 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 68 K 7.65 3.80 0.00 1.66 1.70 0.00 1.80 0.00 0.00 1.45 0.00 0.00 2.83 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.52 7.81 69 R 8.38 4.46 0.00 1.99 2.03 0.00 3.39 0.00 0.00 3.46 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.72 0.00 70 T 8.44 4.66 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 1.31 0.00 0.00 71 D 7.94 4.99 0.00 2.76 2.63 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 72 K 7.75 4.63 0.00 1.80 1.45 0.00 1.85 0.00 0.00 1.83 0.00 0.00 2.77 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.26 1.14 7.81 73 V 8.42 4.06 1.46 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 0.70 0.00 0.00 0.95 0.00 0.00 74 Y 8.47 3.43 0.00 3.30 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 75 Y 8.12 5.52 0.00 2.90 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 76 H 9.36 4.83 0.00 3.17 3.43 0.00 5.26 0.00 0.00 0.00 0.00 6.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.80 4.73 0.00 3.26 3.23 0.00 5.68 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.53 3.90 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 1.17 0.00 0.00 79 G 7.95 4.16 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 0.00 0.00 0.00 80 H 7.40 5.02 0.00 3.00 3.26 0.00 5.90 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.91 2.94 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.74 0.93 0.00 0.00 82 G 7.96 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 0.00 0.00 0.00 83 G 7.73 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 0.00 0.00 0.00 84 I 7.51 3.21 1.98 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.63 0.95 0.00 0.00 85 K 8.03 4.84 0.00 1.55 1.64 0.00 1.64 0.00 0.00 1.69 0.00 0.00 3.08 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.50 1.29 7.81 86 Q 8.90 5.82 0.00 1.93 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.22 0.00 87 A 8.45 4.60 1.25 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 88 T 8.80 3.83 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 1.25 0.00 0.00 89 F 8.53 4.06 0.00 2.93 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 90 E 8.14 3.69 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 2.26 2.30 0.00 91 E 7.80 4.02 0.00 2.14 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 0.00 2.36 2.36 0.00 92 M 7.75 3.93 0.00 2.00 2.07 0.00 0.00 0.00 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.56 0.00 93 I 7.08 3.53 1.57 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.08 0.77 0.00 0.00 94 A 7.56 4.26 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 95 R 7.34 4.31 0.00 1.84 1.87 0.00 3.26 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.74 0.00 96 R 8.59 4.24 0.00 2.06 2.01 0.00 3.43 0.00 0.00 3.32 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 97 P 0.00 4.06 0.00 2.17 2.04 0.00 3.64 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.24 0.00 98 E 8.39 3.91 0.00 2.09 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 2.40 2.60 0.00 99 R 7.72 4.13 0.00 1.83 2.07 0.00 3.18 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 2.06 0.00 100 V 8.37 3.73 2.34 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 1.17 0.00 0.00 1.24 0.00 0.00 101 I 8.19 4.16 1.97 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 1.81 0.86 0.96 0.00 0.00 102 E 8.22 4.29 0.00 2.13 2.28 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 2.69 2.51 0.00 103 I 8.51 3.79 1.69 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.88 0.92 0.00 0.00 104 A 7.64 4.35 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 0.00 105 V 7.98 3.95 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 0.79 0.00 0.00 1.25 0.00 0.00 106 K 9.23 3.66 0.00 0.83 1.55 0.00 0.77 0.00 0.00 1.28 0.00 0.00 2.82 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.99 1.16 7.81 107 G 7.35 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 0.00 108 M 7.97 4.41 0.00 1.94 2.19 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.58 0.00 109 L 7.23 4.23 0.00 1.68 1.60 1.06 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 110 P 0.00 4.54 0.00 2.20 2.16 0.00 3.84 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 2.02 1.97 0.00 111 K 8.36 3.95 0.00 1.89 1.87 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.35 1.41 7.81 112 G 7.69 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 0.00 0.00 0.00 113 P 0.00 4.05 0.00 2.28 2.34 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.04 0.00 114 L 7.86 3.98 0.00 1.78 1.69 0.92 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 115 G 7.90 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 0.00 0.00 0.00 116 R 8.95 4.08 0.00 1.88 2.08 0.00 3.22 0.00 0.00 3.19 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.81 0.00 117 A 7.36 4.12 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 0.00 118 M 8.40 4.09 0.00 2.16 2.23 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.65 0.00 119 F 8.80 4.10 0.00 2.96 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 0.00 120 R 7.52 3.50 0.00 1.94 2.05 0.00 3.13 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.62 0.00 121 K 7.04 3.98 0.00 1.51 1.32 0.00 1.00 0.00 0.00 1.54 0.00 0.00 2.83 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.27 1.43 7.81 122 L 7.10 4.51 0.00 1.49 1.53 0.92 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 123 K 8.11 4.50 0.00 1.76 1.21 0.00 1.65 0.00 0.00 1.87 0.00 0.00 3.19 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.43 1.27 7.81 124 V 6.31 4.26 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 0.90 0.00 0.00 0.74 0.00 0.00 125 Y 7.56 4.12 0.00 3.23 3.05 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 0.00 126 A 8.88 4.17 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.64 4.88 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 0.00 0.00 0.00 0.00 0.00 0.00 128 N 8.69 4.35 0.00 2.94 2.32 0.00 0.00 6.99 7.68 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 0.00 129 E 9.10 4.02 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 2.27 2.38 0.00 130 H 7.90 3.85 0.00 2.17 2.74 0.00 5.46 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 N 8.54 4.80 0.00 2.74 2.80 0.00 0.00 6.92 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 0.00 132 H 7.35 4.65 0.00 3.18 3.18 0.00 5.84 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 A 7.43 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 A 7.83 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 Q 7.52 3.98 0.00 1.28 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.59 0.00 0.00 0.00 0.00 0.00 1.16 1.43 0.00 136 Q 8.19 3.27 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.22 2.29 0.00 137 P 0.00 4.59 0.00 2.14 2.36 0.00 3.69 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.97 0.00 138 Q 8.63 4.22 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.03 0.00 0.00 0.00 0.00 0.00 2.25 2.44 0.00 139 V 8.38 4.36 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 0.70 0.00 0.00 0.98 0.00 0.00 140 L 8.60 4.66 0.00 1.88 1.53 0.42 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 141 D 8.85 4.60 0.00 2.66 2.59 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 0.00 0.00 0.00 0.00 142 I 8.37 3.60 1.86 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 1.28 0.54 0.90 0.00 0.00