NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 I 3.6829 7.8827 121.3761 65.9670 38.6284 179.8868 12 N 3.3390 6.5848 117.2376 54.8780 40.8743 173.2215 13 K 3.9958 7.9687 121.0026 58.6858 33.0170 178.6271 14 A 4.0203 7.7417 120.8460 55.2264 18.2295 179.2278 15 Y 4.1027 7.3113 114.7210 61.2347 37.8681 177.7803 16 E 4.2793 8.4439 120.4957 59.5539 29.6338 179.1344 17 V 3.5903 8.2537 118.4429 66.3254 31.6746 177.9054 18 T 3.8938 8.1372 112.8504 65.3786 67.1125 175.9556 19 M 4.1864 8.3518 120.6315 58.4950 31.9953 178.8488 20 K 4.1308 8.6885 118.9431 59.5805 32.1638 179.4130 21 I 3.7098 8.0584 120.1542 64.6467 36.9908 178.5907 22 Q 4.0157 8.2651 118.7977 58.7552 28.5136 178.8868 23 I 3.3907 7.9491 121.0501 64.3682 37.0972 178.5228 24 I 3.6494 7.7832 120.8043 64.3033 36.8270 178.3852 25 S 4.2324 8.3444 114.2744 61.3258 62.1739 176.6191 26 G 3.5932 8.1839 108.4790 47.8999 0.0000 175.7611 27 F 4.4901 8.6324 121.0391 60.5238 38.8612 177.5591 28 D 4.5804 8.7564 118.9306 57.3088 40.6127 178.8016 29 R 4.0046 8.4313 119.5051 59.5128 30.0632 178.5689 30 Q 4.1200 8.1783 117.9322 58.9633 28.7503 178.6861 31 L 3.7496 8.2025 121.5727 58.1964 42.1324 179.0592 32 T 4.0226 8.4625 110.0734 64.7803 68.1809 176.2714 33 A 4.0511 8.2868 123.6935 54.6576 18.4322 179.3988 34 W 3.9959 8.5664 126.9277 60.7437 30.8381 178.2339 35 L 4.1084 8.8423 119.2102 57.7923 40.7706 179.7081 36 R 4.0582 7.7252 116.9669 58.6840 29.9510 178.8819 37 V 3.6669 6.9488 116.9508 65.4702 31.4568 177.0523 38 H 4.4743 7.7484 113.8306 55.5550 28.9796 176.8654 39 G 3.6529 8.2729 109.1829 46.6261 0.0000 175.8438 40 R 3.9178 7.0373 118.0938 59.4523 29.2974 178.4965 41 R 4.0379 7.8545 115.9046 57.8178 30.4450 176.7296 42 L 4.7285 7.3104 117.2332 53.5848 43.1185 177.2236 43 T 4.2329 9.8395 114.0445 61.1957 71.0455 175.3676 44 N 4.2719 8.6354 119.4507 57.0499 38.7889 176.6796 45 N 4.0880 8.0369 117.4183 56.2132 38.7106 177.2124 46 Q 4.0145 8.0566 119.5574 58.7359 28.8430 178.9665 47 K 3.9687 8.1699 119.5140 59.5572 32.1187 179.4973 48 K 4.0786 7.9711 118.6122 59.7669 31.6955 179.4357 49 T 4.1787 8.0204 116.1680 66.8712 68.3739 176.6270 50 L 4.0569 7.9462 120.7549 57.6051 41.3972 179.5481 51 F 4.1272 8.2239 117.9112 60.2324 38.7045 177.2933 52 F 4.4576 8.7219 121.9303 60.8473 39.1770 177.1339 53 V 3.3819 8.2735 118.0439 66.1282 31.2015 177.6285 54 N 4.3821 8.1171 115.9666 56.6420 38.4488 177.6303 55 R 4.0272 7.8169 119.3955 59.1975 30.0472 179.1792 56 R 4.0223 7.8706 120.1945 58.9179 29.8906 177.8130 57 Y 3.8356 8.5994 119.7586 60.8286 38.4825 177.8642 58 M 4.6164 8.3293 118.1161 58.9927 32.2514 177.7670 59 Q 4.2312 8.3668 118.4968 59.2985 28.7851 178.7903 60 T 4.1472 8.0252 107.9998 63.3127 69.3280 175.2524 61 H 4.7314 7.5614 119.7864 54.1577 29.2642 175.3951 62 W 4.3076 7.7467 132.5421 60.9359 30.4064 177.8680 63 Q 3.9787 8.1190 117.1739 59.0766 28.0740 178.4361 64 N 4.3254 7.8561 116.9644 56.5521 38.6553 176.9433 65 Y 4.4346 7.7139 118.2157 61.3470 37.8752 178.5679 66 M 4.0264 7.9883 119.9616 57.8235 31.7683 178.2021 67 L 3.9128 8.2458 121.1090 58.1448 42.2585 179.0397 68 W 4.1054 8.2098 127.8364 60.4849 30.6962 178.1195 69 V 3.0883 8.5206 118.6511 65.7008 30.8336 177.7361 70 K 3.8329 8.5606 119.7073 59.6749 31.9989 178.7838 71 R 3.9332 7.4594 117.7956 58.5672 29.8300 179.0427 72 K 3.7003 7.1943 117.7888 59.0048 32.1372 179.2819 73 I 3.5602 7.5120 120.0628 64.2684 36.7942 178.2478 74 K 3.7685 7.5514 119.2308 59.7028 31.7525 178.2451 75 A 4.2951 7.3209 116.6108 52.7976 18.4017 178.8033 76 L 4.0545 8.3692 119.4841 55.1801 42.0380 177.0849 77 G 3.9928 7.5263 106.2359 45.6227 0.0000 172.9242 78 R 4.4327 7.4049 114.8510 54.1441 32.8999 171.9111 79 P 4.3465 0.0000 0.0000 62.0966 31.8723 176.0311 80 A 4.1203 8.6042 126.7246 51.8930 19.0854 176.5640 81 A 4.7497 9.8726 127.4351 50.5413 20.9061 178.5374 82 V 3.9537 8.6501 119.9928 65.1148 31.2792 178.8795 83 G 3.7277 8.2340 105.4474 47.2359 0.0000 175.3103 84 D 4.1907 8.0806 121.4767 57.6308 40.7686 178.1757 85 Y 3.9385 7.6913 116.6506 61.2434 37.8747 178.5954 86 T 3.9343 8.1736 116.6320 66.9426 68.6472 176.8467 87 R 3.9624 7.9667 119.7222 59.2661 30.1257 179.1390 88 L 4.2563 8.3986 119.4063 57.7245 41.5016 179.8885 89 G 3.6087 8.4924 105.7994 47.6304 0.0000 175.7182 90 A 4.0163 8.1875 123.1507 54.8227 18.3587 179.6757 91 E 3.8863 8.3225 117.1107 59.6985 29.7459 179.4123 92 I 3.4864 7.7554 119.9194 64.4285 36.8888 178.7313 93 G 3.6696 8.0732 105.4493 46.8927 0.0000 174.8285 94 R 4.5178 7.6767 115.6617 56.5291 30.6972 177.5946 95 R 4.3548 7.6823 116.9823 55.1796 30.9606 176.2549 96 V 3.7503 7.1027 119.6708 62.3205 32.3445 176.7064 97 D 4.4960 8.1597 127.2717 53.6876 39.1469 176.1984 98 M 3.4567 8.3202 124.3175 56.8940 32.0967 178.1058 99 V 3.1186 7.5016 118.4659 65.5238 31.6554 177.3521 100 F 4.0301 8.5268 120.6305 61.3945 39.1737 176.8697 101 F 3.6745 7.3674 118.5483 61.4185 39.0050 176.7083 102 Y 3.9363 7.1632 116.6204 60.9694 37.3141 178.2744 103 N 4.4979 7.9967 117.6459 56.0868 38.5366 177.3346 104 F 3.6166 7.7967 122.2198 60.9747 39.4643 176.8097 105 L 3.7961 7.5886 120.1428 58.3017 41.8831 179.2035 106 S 4.2866 8.3531 114.4454 61.3236 62.8426 176.6270 107 G 3.5366 8.2180 108.8834 46.9527 0.0000 174.9353 108 R 4.1114 7.6667 117.8339 54.9071 30.4891 176.2723 109 K 3.9226 7.8883 117.1731 58.2221 30.0427 175.4266 110 M 4.7656 7.9410 114.7350 54.9458 33.0084 176.2790 111 I 3.8855 7.9663 120.6464 60.4268 37.3907 174.6319 112 P 4.5428 0.0000 0.0000 61.5324 31.8902 174.3756 113 P 4.3494 0.0000 0.0000 62.7075 32.1338 175.5383 114 Y 4.2367 8.5850 121.8410 57.6702 39.0288 174.7401 115 S 4.8492 7.5874 122.6377 56.1182 65.9870 174.9385 116 A 3.8081 8.4224 124.1036 55.6713 17.7604 179.8002 117 Y 4.0231 7.8569 115.5311 60.3673 38.0309 178.4533 118 M 3.2251 6.6504 120.3459 57.7264 31.8548 178.4028 119 A 4.3961 7.0498 121.7340 54.3255 18.2577 179.3523 120 K 3.8375 7.9392 117.6074 59.6986 32.4695 178.5099 121 L 4.1973 7.7773 120.5921 58.3030 41.9785 178.6699 122 N 4.5046 8.6113 116.0939 55.8339 38.2591 176.7401 123 A 4.2895 7.7851 120.7677 52.8065 19.0669 177.8035 124 L 4.2139 6.9622 117.5072 54.0565 42.6246 177.4027 125 R 4.1179 8.3218 120.3681 55.6228 31.0383 176.0959 126 P 4.2239 0.0000 0.0000 65.9438 31.0596 178.8739 127 A 4.0646 8.0412 117.9665 54.5611 18.3688 178.1683 128 D 4.6778 7.7592 114.8738 52.9870 41.5452 176.9941 129 V 3.5650 6.9580 120.6193 62.4675 31.8511 173.8218 130 P 4.3345 0.0000 0.0000 62.3825 31.8708 176.0316 131 V 4.2822 7.7282 114.7901 59.2968 35.2232 175.8222 132 K 4.1784 8.3219 119.4741 56.7176 32.4166 176.4041 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 11 I 7.88 3.68 0.91 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 1.17 0.89 0.65 0.00 0.00 12 N 6.58 3.34 0.00 2.79 2.73 0.00 0.00 7.07 6.37 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 13 K 7.97 4.00 0.00 1.73 1.79 0.00 1.72 0.00 0.00 1.84 0.00 0.00 3.18 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.41 7.81 14 A 7.74 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 15 Y 7.31 4.10 0.00 2.79 1.98 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 16 E 8.44 4.28 0.00 2.25 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 2.32 2.42 0.00 17 V 8.25 3.59 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 1.03 0.00 0.00 0.98 0.00 0.00 18 T 8.14 3.89 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 1.45 0.00 0.00 19 M 8.35 4.19 0.00 2.31 2.56 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 3.05 2.95 0.00 20 K 8.69 4.13 0.00 1.80 1.85 0.00 1.46 0.00 0.00 1.04 0.00 0.00 2.85 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.25 1.63 7.81 21 I 8.06 3.71 2.05 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.75 0.93 0.00 0.00 22 Q 8.27 4.02 0.00 2.09 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.61 2.78 0.00 23 I 7.95 3.39 1.76 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 1.31 0.57 0.13 0.00 0.00 24 I 7.78 3.65 1.96 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.00 1.01 0.00 0.00 25 S 8.34 4.23 0.00 3.95 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 26 G 8.18 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 0.00 0.00 0.00 27 F 8.63 4.49 0.00 2.96 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 28 D 8.76 4.58 0.00 3.07 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 29 R 8.43 4.00 0.00 1.99 2.19 0.00 3.21 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.79 0.00 30 Q 8.18 4.12 0.00 2.44 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.59 0.00 0.00 0.00 0.00 0.00 2.44 2.66 0.00 31 L 8.20 3.75 0.00 1.32 1.41 -0.18 -1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 32 T 8.46 4.02 4.37 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 1.52 0.00 0.00 33 A 8.29 4.05 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.57 4.00 0.00 3.66 3.38 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 35 L 8.84 4.11 0.00 1.90 1.76 0.98 1.08 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 36 R 7.73 4.06 0.00 1.92 1.97 0.00 3.18 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.92 0.00 37 V 6.95 3.67 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 0.39 0.00 0.00 0.84 0.00 0.00 38 H 7.75 4.47 0.00 1.40 2.38 0.00 5.67 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 39 G 8.27 3.65 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 40 R 7.04 3.92 0.00 2.07 2.04 0.00 3.18 0.00 0.00 3.12 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 41 R 7.85 4.04 0.00 1.81 2.01 0.00 3.30 0.00 0.00 3.17 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.53 0.00 42 L 7.31 4.73 0.00 1.63 1.62 1.14 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 43 T 9.84 4.23 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 1.22 0.00 0.00 44 N 8.64 4.27 0.00 2.76 2.83 0.00 0.00 6.89 6.71 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 45 N 8.04 4.09 0.00 2.77 2.87 0.00 0.00 7.16 8.05 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 46 Q 8.06 4.01 0.00 2.36 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 47 K 8.17 3.97 0.00 2.00 2.00 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.52 1.71 7.81 48 K 7.97 4.08 0.00 0.97 0.89 0.00 1.24 0.00 0.00 1.34 0.00 0.00 2.86 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.27 1.39 7.81 49 T 8.02 4.18 4.53 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 1.45 0.00 0.00 50 L 7.95 4.06 0.00 1.58 1.21 0.71 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 51 F 8.22 4.13 0.00 3.32 3.13 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 52 F 8.72 4.46 0.00 3.27 3.43 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 53 V 8.27 3.38 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 0.96 0.00 0.00 1.28 0.00 0.00 54 N 8.12 4.38 0.00 3.15 3.15 0.00 0.00 7.04 7.82 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 55 R 7.82 4.03 0.00 1.88 1.99 0.00 3.42 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.91 0.00 56 R 7.87 4.02 0.00 1.15 1.62 0.00 3.23 0.00 0.00 3.31 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.48 0.00 57 Y 8.60 3.84 0.00 2.95 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 58 M 8.33 4.62 0.00 2.40 2.29 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.05 2.99 0.00 59 Q 8.37 4.23 0.00 2.33 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.63 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 60 T 8.03 4.15 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 1.17 0.00 0.00 61 H 7.56 4.73 0.00 2.75 2.37 0.00 5.84 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 W 7.75 4.31 0.00 3.53 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 63 Q 8.12 3.98 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.68 0.00 0.00 0.00 0.00 0.00 2.54 2.55 0.00 64 N 7.86 4.33 0.00 2.63 2.80 0.00 0.00 7.13 7.48 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 65 Y 7.71 4.43 0.00 2.76 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 66 M 7.99 4.03 0.00 1.95 2.07 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 1.74 0.00 67 L 8.25 3.91 0.00 1.88 1.90 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 68 W 8.21 4.11 0.00 3.47 3.39 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 69 V 8.52 3.09 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 0.89 0.00 0.00 1.13 0.00 0.00 70 K 8.56 3.83 0.00 2.05 1.83 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.51 7.81 71 R 7.46 3.93 0.00 1.73 1.83 0.00 3.40 0.00 0.00 3.17 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 72 K 7.19 3.70 0.00 1.12 1.32 0.00 1.11 0.00 0.00 0.61 0.00 0.00 2.54 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.56 0.21 7.81 73 I 7.51 3.56 1.71 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 1.22 0.71 0.78 0.00 0.00 74 K 7.55 3.77 0.00 1.94 1.82 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.46 7.81 75 A 7.32 4.30 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 76 L 8.37 4.05 0.00 1.58 1.65 0.74 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 77 G 7.53 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 78 R 7.40 4.43 0.00 1.84 1.70 0.00 3.21 0.00 0.00 3.24 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.54 0.00 79 P 0.00 4.35 0.00 2.24 2.07 0.00 3.81 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 1.99 1.96 0.00 80 A 8.60 4.12 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 81 A 9.87 4.75 1.28 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 0.00 0.00 82 V 8.65 3.95 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 0.96 0.00 0.00 1.14 0.00 0.00 83 G 8.23 3.73 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 0.00 0.00 0.00 84 D 8.08 4.19 0.00 2.33 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 0.00 0.00 0.00 0.00 85 Y 7.69 3.94 0.00 3.11 3.01 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 86 T 8.17 3.93 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 1.25 0.00 0.00 87 R 7.97 3.96 0.00 1.96 1.96 0.00 3.10 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 88 L 8.40 4.26 0.00 1.61 1.81 0.45 0.37 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 89 G 8.49 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.19 4.02 1.39 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 0.00 0.00 91 E 8.32 3.89 0.00 2.36 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 0.00 2.38 2.64 0.00 92 I 7.76 3.49 1.69 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 1.02 0.02 0.00 0.00 93 G 8.07 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.68 4.52 0.00 1.93 2.07 0.00 3.07 0.00 0.00 3.24 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.63 0.00 95 R 7.68 4.35 0.00 1.73 1.88 0.00 3.02 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 96 V 7.10 3.75 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 0.24 0.00 0.00 1.05 0.00 0.00 97 D 8.16 4.50 0.00 2.66 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 M 8.32 3.46 0.00 1.09 1.69 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.56 0.00 99 V 7.50 3.12 2.20 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 1.32 0.00 0.00 1.09 0.00 0.00 100 F 8.53 4.03 0.00 3.23 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 F 7.37 3.67 0.00 2.80 2.52 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 0.00 0.00 0.00 0.00 102 Y 7.16 3.94 0.00 1.43 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 0.00 103 N 8.00 4.50 0.00 2.80 2.82 0.00 0.00 6.67 8.72 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 0.00 104 F 7.80 3.62 0.00 2.11 2.43 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 0.00 105 L 7.59 3.80 0.00 1.59 1.53 0.91 0.87 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 0.00 106 S 8.35 4.29 0.00 4.23 4.32 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 0.00 107 G 8.22 3.54 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 0.00 108 R 7.67 4.11 0.00 1.55 1.78 0.00 3.16 0.00 0.00 2.56 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.01 0.00 109 K 7.89 3.92 0.00 1.88 1.87 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.34 7.81 110 M 7.94 4.77 0.00 1.98 1.99 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.83 0.00 111 I 7.97 3.89 1.92 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 1.51 0.50 0.98 0.00 0.00 112 P 0.00 4.54 0.00 2.25 2.16 0.00 3.90 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.13 0.00 113 P 0.00 4.35 0.00 2.23 2.13 0.00 3.82 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 114 Y 8.59 4.24 0.00 2.95 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 0.00 115 S 7.59 4.85 0.00 3.47 3.71 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 0.00 116 A 8.42 3.81 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 0.00 117 Y 7.86 4.02 0.00 3.18 3.13 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 0.00 118 M 6.65 3.23 0.00 1.19 1.20 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.81 0.00 119 A 7.05 4.40 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 0.00 120 K 7.94 3.84 0.00 1.75 2.08 0.00 1.84 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.50 1.47 7.81 121 L 7.78 4.20 0.00 2.01 2.12 0.99 0.81 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 0.00 122 N 8.61 4.50 0.00 3.18 2.98 0.00 0.00 6.92 6.98 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 0.00 123 A 7.79 4.29 1.39 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 0.00 0.00 124 L 6.96 4.21 0.00 1.72 1.62 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 125 R 8.32 4.12 0.00 1.87 1.85 0.00 3.14 0.00 0.00 3.34 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.66 0.00 126 P 0.00 4.22 0.00 2.16 2.13 0.00 3.61 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 127 A 8.04 4.06 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 0.00 128 D 7.76 4.68 0.00 2.75 2.69 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 0.00 129 V 6.96 3.56 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 0.71 0.00 0.00 0.99 0.00 0.00 130 P 0.00 4.33 0.00 2.02 1.91 0.00 3.64 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 2.01 2.07 0.00 131 V 7.73 4.28 0.67 0.00 0.00 0.00 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 -0.29 0.00 0.00 132 K 8.32 4.18 0.00 1.75 1.69 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.33 7.81