NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 G 3.9550 8.3544 109.7433 44.8645 0.0000 171.9832 0 S 4.3671 7.7151 115.2649 57.1391 65.2850 174.1955 1 M 4.3881 9.5794 127.6636 55.8551 33.5779 174.7448 2 Y 4.8470 8.4607 118.2773 56.6924 41.5317 174.4012 3 Q 4.8118 8.8155 120.4991 54.7122 30.8505 174.5302 4 L 4.9976 8.5290 125.5295 53.3352 44.2942 174.9198 5 Q 4.5343 8.7669 128.3913 54.5252 30.6185 174.2863 6 F 4.7497 8.8156 126.0693 57.2537 40.2304 175.5119 7 I 4.0455 8.9952 124.8888 59.6141 39.4209 174.2301 8 N 5.2350 9.0969 126.0876 51.5369 39.3222 174.3329 9 L 4.7715 8.9319 125.4436 54.5481 43.1772 176.5767 10 V 4.8359 8.5061 117.5577 59.7956 33.1867 174.9940 11 Y 4.8281 7.9217 122.0826 55.8508 40.6389 174.7124 12 D 4.6458 8.7054 122.0876 53.3527 40.0503 177.0799 13 T 4.1067 8.5643 122.2405 66.9057 68.7492 175.8337 14 T 3.9903 7.9703 114.7061 64.6777 67.5089 174.6176 15 K 4.4966 8.6081 118.9941 55.9826 32.1159 176.0769 16 L 4.9836 7.5066 118.7204 52.6053 44.5081 177.0157 17 T 4.1717 8.4531 112.8977 61.9104 70.6983 175.4935 18 H 4.2595 8.6761 118.6091 58.7433 28.6289 177.7750 19 L 3.9141 7.9193 121.7823 58.1674 41.8959 178.5420 20 E 3.8704 8.1843 118.3875 59.6207 29.4585 179.4958 21 Q 3.9309 8.1084 117.6533 59.3942 28.6080 178.8335 22 T 3.8016 7.8936 115.6487 66.6693 68.8505 175.8313 23 N 4.3002 8.2045 118.8330 56.6665 39.0716 176.9139 24 I 3.7583 7.7885 121.2928 64.7019 37.0421 178.0783 25 N 4.3567 8.1577 116.9524 56.3903 38.0548 177.2259 26 L 3.6404 7.2111 119.0541 57.0654 41.5571 178.5505 27 F 4.6820 7.6683 115.4369 56.9098 39.6996 176.3314 28 I 4.0564 7.2263 120.8614 60.1765 37.4662 176.6112 29 G 3.9002 7.4353 112.2648 44.4044 0.0000 170.4514 30 N 5.4279 7.5208 116.3268 51.2590 41.7373 174.2329 31 W 5.8696 9.3861 121.8356 55.5678 34.2992 174.2142 32 S 5.4195 9.7351 117.8462 57.1030 67.5615 172.4640 33 N 5.0347 8.9521 121.4562 52.1953 40.2098 175.1938 34 H 4.9324 9.0097 123.4474 58.4159 29.4202 177.8995 35 Q 4.0193 8.1119 117.5291 58.7264 28.6350 177.2045 36 L 4.0694 8.5424 115.8316 54.7823 42.5238 176.4315 37 Q 2.0000 6.9198 116.6286 56.6865 26.8249 173.1178 38 K 5.2026 7.4773 115.1327 54.8165 36.2325 176.8446 39 S 5.5051 9.3392 117.2112 56.7236 66.5074 172.5784 40 I 4.9339 9.4018 118.6184 59.2230 40.9195 173.9160 41 C 5.0984 8.7192 125.2528 57.9319 33.6667 171.9755 42 I 4.8947 8.7918 127.9634 59.9481 38.6989 175.4624 43 R 4.9829 8.8572 124.7048 54.5595 35.2043 174.2707 44 H 4.7869 8.9979 121.4349 56.1961 29.6550 174.8019 45 G 4.1696 8.7706 118.8335 45.9026 0.0000 169.5297 46 D 4.7549 8.6355 119.4729 52.2986 42.3216 175.3687 47 D 4.4643 8.7508 118.0809 57.1331 40.7367 177.5183 48 T 4.3007 7.5570 106.8462 61.6912 69.8039 175.3186 49 S 4.1513 7.5299 118.2315 58.9691 63.2908 173.2901 50 H 4.5333 8.3046 119.5905 54.8139 30.9149 174.4429 51 N 4.1889 8.4494 114.3542 54.7096 36.1749 174.4297 52 Q 4.7255 7.2564 115.7732 55.8168 30.9364 176.2939 53 Y 5.2902 8.7379 119.2675 56.6553 42.5554 173.7981 54 H 5.3476 9.8689 124.3513 55.3805 31.6551 174.0869 55 I 4.3582 8.5518 126.9388 61.5152 37.0471 175.7243 56 L 4.3114 9.1416 128.4259 57.1169 42.5945 177.3925 57 F 5.0065 7.9907 118.9816 57.0724 43.0417 172.7847 58 I 4.2254 7.7243 126.3294 59.8213 38.7353 175.2851 59 D 4.4266 8.9769 129.3167 52.3296 39.9489 176.6979 60 T 4.0117 8.1143 114.9789 63.9310 69.4335 177.3051 61 A 3.9707 8.1810 124.2000 54.6864 18.4670 177.5464 62 H 4.7734 8.2242 109.1956 54.9367 30.1105 174.2815 63 Q 4.2374 7.6503 117.0934 55.4847 26.1925 172.4221 64 R 5.4737 8.3550 118.3313 55.0441 34.7778 174.3581 65 I 5.1026 8.5858 116.8135 59.0494 41.5151 174.0176 66 K 5.2866 8.9584 123.2431 54.8305 35.2273 175.2242 67 F 5.4768 8.7205 118.2078 56.1887 41.8902 173.0838 68 S 5.4606 9.4010 114.7553 56.6611 67.7638 174.1980 69 S 4.1839 8.9106 116.4381 57.8163 63.6285 175.2280 70 F 4.1566 8.5223 121.7720 60.4926 38.7426 176.1201 71 D 4.7161 7.9778 116.5738 53.0582 40.0776 176.3253 72 N 4.7142 8.0433 119.8058 52.9168 39.6986 174.2411 73 E 4.3094 8.5641 122.7015 57.7086 30.4660 177.6407 74 E 4.2802 8.3895 118.8745 57.3621 30.7101 175.8476 75 I 4.6696 7.2932 120.1814 59.4204 39.4794 174.9715 76 I 4.4218 8.2919 128.3698 59.8151 39.2813 174.3890 77 Y 4.6793 8.7282 125.2549 56.5845 39.9413 174.6862 78 I 4.7857 8.9475 124.2532 59.5506 40.4250 174.3027 79 L 5.0818 8.8674 127.8868 52.9898 44.0431 175.2731 80 D 5.6018 9.0747 123.8050 52.6325 44.2775 174.6909 81 Y 4.3850 9.3017 124.8769 57.5198 39.5168 174.1783 82 D 4.4022 8.2548 126.4643 54.8279 42.8386 176.1196 83 D 4.4025 6.8096 115.3707 51.4557 42.7774 175.9522 84 T 4.5041 8.6058 108.1892 63.9742 68.7268 174.8411 85 Q 4.5667 8.1313 119.1223 56.0533 29.5058 174.4181 86 H 5.7918 8.9568 116.5478 54.5391 33.6175 172.6167 87 I 5.0254 8.9475 115.4821 59.0684 41.7220 173.8356 88 L 5.3187 9.1274 122.5024 53.1771 44.7274 175.2787 89 M 5.1185 9.2710 123.6718 53.7811 34.9770 174.1819 90 Q 5.0606 9.2353 126.5405 54.4504 33.1943 173.8349 91 T 4.9510 8.6435 113.8058 60.2634 72.4624 172.4760 92 S 4.8276 8.4862 116.5250 57.5440 66.6634 172.6589 93 S 5.0579 7.6897 113.9083 56.6004 64.4837 174.4748 94 K 4.1271 8.5461 122.5875 58.8657 31.9196 177.7313 95 Q 4.4858 8.2949 115.8190 55.4718 31.0363 175.1505 96 G 4.1475 7.7012 106.5993 43.7571 0.0000 172.0338 97 I 4.3695 9.1345 119.5618 58.4804 39.1699 173.4510 98 G 3.4911 7.8238 112.2433 44.3906 0.0000 172.0115 99 T 4.8195 7.8439 122.6266 61.2580 71.8408 174.1918 100 S 4.3338 8.7088 120.3923 57.6834 63.8072 173.9776 101 R 4.0651 8.2339 121.8209 55.7651 30.5379 174.4215 102 P 4.5375 0.0000 0.0000 63.0459 32.1606 175.4914 103 I 4.4713 8.6775 125.6287 59.3512 39.5575 175.1092 104 V 4.2784 8.4834 127.6710 63.0685 32.2308 174.4998 105 Y 4.9744 9.3599 126.3439 56.1430 40.7262 174.5255 106 E 5.3494 9.4041 122.6646 54.3096 32.4300 175.6315 107 R 4.1046 8.5959 122.7814 57.1947 30.8089 176.1594 108 L 4.2847 7.7874 123.0628 55.9424 43.4129 176.2980 109 V 3.6288 8.4032 111.7905 62.3867 31.0773 171.3629 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 G 8.35 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 0 S 7.72 4.37 0.00 3.89 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 1 M 9.58 4.39 0.00 2.12 2.04 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 2.64 2.55 0.00 2 Y 8.46 4.85 0.00 2.84 2.88 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 3 Q 8.82 4.81 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.76 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 4 L 8.53 5.00 0.00 1.54 1.47 0.64 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 5 Q 8.77 4.53 0.00 2.19 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.77 0.00 0.00 0.00 0.00 0.00 2.23 2.41 0.00 6 F 8.82 4.75 0.00 3.06 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 7 I 9.00 4.05 1.57 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.45 -0.05 0.00 0.00 8 N 9.10 5.24 0.00 2.97 2.78 0.00 0.00 6.83 6.15 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 9 L 8.93 4.77 0.00 1.80 1.72 0.73 0.25 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 10 V 8.51 4.84 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 0.70 0.00 0.00 1.37 0.00 0.00 11 Y 7.92 4.83 0.00 3.05 2.86 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 12 D 8.71 4.65 0.00 2.80 2.72 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 13 T 8.56 4.11 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 14 T 7.97 3.99 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 1.22 0.00 0.00 15 K 8.61 4.50 0.00 1.80 1.85 0.00 1.76 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.44 7.81 16 L 7.51 4.98 0.00 1.65 1.55 0.95 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 17 T 8.45 4.17 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 18 H 8.68 4.26 0.00 3.19 3.38 0.00 5.65 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 19 L 7.92 3.91 0.00 1.75 1.64 0.90 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.18 3.87 0.00 2.20 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 2.24 2.32 0.00 21 Q 8.11 3.93 0.00 2.18 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.75 0.00 0.00 0.00 0.00 0.00 2.43 2.70 0.00 22 T 7.89 3.80 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 1.12 0.00 0.00 23 N 8.20 4.30 0.00 2.94 2.88 0.00 0.00 7.22 8.04 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 24 I 7.79 3.76 1.67 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.67 0.60 0.00 0.00 25 N 8.16 4.36 0.00 2.93 2.85 0.00 0.00 7.09 6.03 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 26 L 7.21 3.64 0.00 0.56 0.61 0.37 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 27 F 7.67 4.68 0.00 3.12 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 28 I 7.23 4.06 1.95 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.84 1.01 0.00 0.00 29 G 7.44 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 30 N 7.52 5.43 0.00 2.44 2.60 0.00 0.00 6.60 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 31 W 9.39 5.87 0.00 3.29 3.27 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 32 S 9.74 5.42 0.00 3.79 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 33 N 8.95 5.03 0.00 1.80 2.13 0.00 0.00 7.37 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 34 H 9.01 4.93 0.00 3.33 3.43 0.00 6.15 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 35 Q 8.11 4.02 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.01 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 36 L 8.54 4.07 0.00 1.46 1.64 0.90 0.96 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 37 Q 6.92 2.00 0.00 1.89 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.73 0.00 0.00 0.00 0.00 0.00 1.97 2.03 0.00 38 K 7.48 5.20 0.00 1.75 1.87 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.54 7.81 39 S 9.34 5.51 0.00 4.02 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 40 I 9.40 4.93 1.74 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.30 0.75 0.00 0.00 41 C 8.72 5.10 0.00 2.79 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 42 I 8.79 4.89 2.23 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 1.08 0.85 0.89 0.00 0.00 43 R 8.86 4.98 0.00 1.93 1.78 0.00 3.32 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.76 0.00 44 H 9.00 4.79 0.00 3.22 3.19 0.00 5.74 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 G 8.77 4.17 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 0.00 0.00 0.00 46 D 8.64 4.75 0.00 2.77 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 47 D 8.75 4.46 0.00 2.68 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 48 T 7.56 4.30 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 1.18 0.00 0.00 49 S 7.53 4.15 0.00 3.74 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 50 H 8.30 4.53 0.00 3.09 3.23 0.00 5.85 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 51 N 8.45 4.19 0.00 2.98 3.27 0.00 0.00 6.84 7.72 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 52 Q 7.26 4.73 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.87 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 53 Y 8.74 5.29 0.00 2.86 3.03 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 0.00 54 H 9.87 5.35 0.00 3.23 3.33 0.00 5.77 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 I 8.55 4.36 1.92 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.75 0.91 0.00 0.00 56 L 9.14 4.31 0.00 1.70 1.77 0.96 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 57 F 7.99 5.01 0.00 3.00 2.86 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 58 I 7.72 4.23 1.61 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 1.05 0.58 0.75 0.00 0.00 59 D 8.98 4.43 0.00 2.72 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 60 T 8.11 4.01 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 1.13 0.00 0.00 61 A 8.18 3.97 1.21 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 62 H 8.22 4.77 0.00 3.28 3.35 0.00 6.05 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 7.65 4.24 0.00 2.46 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.68 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 64 R 8.36 5.47 0.00 2.08 1.81 0.00 3.32 0.00 0.00 3.28 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.75 0.00 65 I 8.59 5.10 1.79 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 0.49 1.11 0.86 0.00 0.00 66 K 8.96 5.29 0.00 1.84 1.76 0.00 1.77 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.36 1.47 7.81 67 F 8.72 5.48 0.00 3.32 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 68 S 9.40 5.46 0.00 3.90 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 69 S 8.91 4.18 0.00 3.55 3.47 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 70 F 8.52 4.16 0.00 2.84 3.18 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 71 D 7.98 4.72 0.00 2.78 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 72 N 8.04 4.71 0.00 2.76 2.74 0.00 0.00 6.93 7.24 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 73 E 8.56 4.31 0.00 2.13 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 2.27 2.33 0.00 74 E 8.39 4.28 0.00 2.04 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 0.00 2.31 2.42 0.00 75 I 7.29 4.67 1.80 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 1.13 0.55 0.34 0.00 0.00 76 I 8.29 4.42 1.74 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 1.19 0.95 0.82 0.00 0.00 77 Y 8.73 4.68 0.00 1.43 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 0.00 0.00 0.00 78 I 8.95 4.79 1.82 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.67 0.96 0.00 0.00 79 L 8.87 5.08 0.00 0.98 0.53 0.57 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 80 D 9.07 5.60 0.00 2.68 2.62 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 81 Y 9.30 4.38 0.00 2.66 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 82 D 8.25 4.40 0.00 2.60 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 83 D 6.81 4.40 0.00 2.87 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 84 T 8.61 4.50 4.35 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 1.35 0.00 0.00 85 Q 8.13 4.57 0.00 2.09 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.76 0.00 0.00 0.00 0.00 0.00 2.35 2.47 0.00 86 H 8.96 5.79 0.00 3.08 3.18 0.00 5.75 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 87 I 8.95 5.03 1.91 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.83 0.39 0.00 0.00 88 L 9.13 5.32 0.00 1.57 1.61 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 89 M 9.27 5.12 0.00 2.08 1.69 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.51 0.00 90 Q 9.24 5.06 0.00 2.09 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.46 0.00 0.00 0.00 0.00 0.00 2.18 2.42 0.00 91 T 8.64 4.95 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 1.06 0.00 0.00 92 S 8.49 4.83 0.00 3.81 3.59 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 93 S 7.69 5.06 0.00 3.89 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 94 K 8.55 4.13 0.00 1.93 2.03 0.00 1.91 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 1.40 7.81 95 Q 8.29 4.49 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.52 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 96 G 7.70 4.15 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 0.00 97 I 9.13 4.37 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.70 0.89 0.00 0.00 98 G 7.82 3.49 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 0.00 0.00 0.00 99 T 7.84 4.82 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 1.20 0.00 0.00 100 S 8.71 4.33 0.00 3.92 3.84 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 0.00 101 R 8.23 4.07 0.00 1.84 1.87 0.00 3.24 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 102 P 0.00 4.54 0.00 1.99 2.00 0.00 3.70 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 103 I 8.68 4.47 2.20 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 1.44 1.20 0.83 0.00 0.00 104 V 8.48 4.28 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 0.85 0.00 0.00 0.94 0.00 0.00 105 Y 9.36 4.97 0.00 2.97 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 0.00 106 E 9.40 5.35 0.00 2.08 2.15 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 2.49 2.36 0.00 107 R 8.60 4.10 0.00 1.60 1.83 0.00 3.04 0.00 0.00 2.98 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.50 0.00 108 L 7.79 4.28 0.00 1.58 1.60 0.84 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 109 V 8.40 3.63 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 0.51 0.00 0.00 0.81 0.00 0.00