NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4133 8.3044 120.3274 55.4557 33.3046 174.9742 2 D 4.4735 8.2801 118.7998 51.9355 41.4141 171.4406 3 I 4.2364 8.1902 124.9594 59.0919 39.7217 174.5547 4 D 4.6865 8.5087 125.9431 52.1680 41.2559 175.0713 5 P 4.4138 0.0000 0.0000 65.0523 31.4004 176.8600 6 Y 4.5145 8.3082 116.9164 59.6945 38.7236 177.5000 7 K 4.2205 8.5203 122.8370 58.8107 31.9931 178.1658 8 E 4.0351 8.0920 115.2794 57.9587 29.5802 177.6605 9 F 4.8726 8.1383 117.9757 56.8063 39.5695 176.0612 10 G 3.9154 8.1086 106.2883 45.6739 0.0000 172.8007 11 A 4.8489 7.8187 122.0687 49.7686 21.9673 175.2007 12 T 4.7773 7.6050 107.6339 59.1242 73.2201 174.7979 13 V 3.5183 8.8136 120.6966 66.4042 31.3298 178.0280 14 E 3.9264 8.0421 117.5585 59.3556 29.1734 178.7459 15 L 3.8159 7.7666 119.3524 57.9330 42.2293 178.8614 16 L 4.1675 7.1373 117.7658 57.4849 41.6942 179.2781 17 S 4.1628 8.0066 112.2304 60.5645 63.0793 175.5785 18 F 3.9554 8.1844 124.4711 60.2965 39.2302 175.2822 19 L 3.9488 7.2494 117.4003 53.0681 42.1493 174.8201 20 P 4.4741 0.0000 0.0000 62.7087 32.3798 177.9190 21 S 4.3682 8.7325 115.6589 62.1119 62.9118 176.5318 22 D 4.4962 8.2698 118.0432 56.7751 40.8907 177.9109 23 F 4.0028 7.6742 121.2661 60.7488 39.4372 175.6612 24 F 3.9380 7.7793 119.5607 56.1143 39.0045 173.8198 25 P 4.4096 0.0000 0.0000 62.0018 32.1038 176.5261 26 S 4.3615 8.2922 114.9574 58.1849 64.8145 175.3557 27 V 3.3421 8.1099 121.1789 66.1157 31.1039 177.9805 28 R 3.8842 7.8594 117.9093 59.4731 29.9264 178.1063 29 D 4.3759 8.0043 118.2923 57.2477 40.7794 178.7791 30 L 4.0066 7.8598 119.3080 57.7142 41.6590 179.3864 31 L 3.9869 8.0782 119.0981 58.1244 41.5474 179.3617 32 D 4.3830 8.1565 118.5509 57.7020 40.6397 179.0342 33 T 3.7931 8.2277 116.1531 66.5651 68.3723 176.5222 34 A 4.1117 8.5089 122.8360 55.1710 18.4329 179.3361 35 A 3.9051 8.2753 119.0871 55.0971 18.2944 179.3329 36 A 3.8558 7.8450 118.3661 55.4705 18.5447 179.2944 37 L 3.9312 7.7253 115.0485 55.8260 41.8530 177.2372 38 Y 4.8892 7.8492 113.4177 56.5556 40.1726 176.7769 39 R 3.9609 8.3580 121.9983 59.9303 29.7506 177.8526 40 D 4.2948 8.0545 115.8706 57.3674 41.3385 177.8640 41 A 4.1768 8.1482 120.5662 55.5002 18.0969 179.5111 42 L 4.0181 8.3990 116.1545 57.9988 41.8869 179.1028 43 E 4.2704 8.4703 116.0193 56.5566 29.7319 177.1237 44 S 4.5318 7.3135 114.1986 56.8523 64.3101 172.2381 45 P 4.5682 0.0000 0.0000 62.9146 31.5835 175.5857 46 E 4.4497 7.5746 118.7128 55.2984 30.8519 175.8445 47 H 4.2120 8.6655 119.8922 58.3825 29.0972 176.1074 48 C 4.0948 8.9120 119.9809 59.7450 26.4549 173.5888 49 S 4.6079 7.1410 110.8743 56.1034 65.8373 174.7406 50 P 4.3425 0.0000 0.0000 66.0755 30.9707 178.6180 51 H 3.8586 8.3102 114.5622 59.1636 28.5871 177.3505 52 H 4.0582 7.9594 117.9186 59.0604 28.6060 178.0567 53 T 3.8689 8.1565 117.2730 66.5359 68.3304 176.5882 54 A 3.9751 8.2876 122.9859 55.1578 18.3635 179.3080 55 L 3.8739 8.2801 119.1117 58.3831 41.9951 179.4454 56 R 3.9476 8.2086 117.9951 59.3596 29.9523 179.0378 57 Q 4.0121 8.0173 117.0832 58.8250 28.7406 178.6990 58 A 4.2066 8.0754 121.6892 55.4409 18.5432 179.6875 59 I 3.7929 8.0073 118.3410 64.7470 37.2236 178.7748 60 L 4.1469 8.2510 119.7257 57.4447 41.3772 179.1959 61 C 4.2895 8.5938 119.5049 62.1710 31.5694 175.2430 62 W 3.7518 8.3079 130.1122 60.3903 30.2596 177.9626 63 G 3.7191 8.1622 105.5039 48.0579 0.0000 175.3008 64 D 4.3474 8.1133 121.0375 57.0213 40.7256 178.9422 65 L 3.8053 7.7710 119.4440 57.9796 41.5654 179.4032 66 M 3.7683 7.7537 118.9556 58.5551 31.8440 179.0167 67 T 3.8324 8.1914 116.2169 66.4554 68.6261 176.4407 68 L 3.9192 7.9899 122.0271 58.2169 42.1452 178.9534 69 A 4.0451 8.2614 121.0101 55.4217 18.2254 179.8260 70 T 3.8589 8.6237 114.7101 66.4558 68.5434 176.8429 71 W 4.0457 8.3727 130.3796 60.3008 30.7410 178.2016 72 V 3.7347 8.2374 118.4247 65.9811 30.9137 177.8549 73 G 4.2403 7.9490 106.6844 47.7968 0.0000 175.5916 74 T 3.7927 7.9204 117.9063 66.0485 68.6737 176.2037 75 N 4.3683 7.4502 115.6625 53.9925 38.7631 175.8766 76 L 4.6483 7.9778 117.7750 53.8877 43.2215 175.6474 77 E 4.7603 7.5555 118.1464 53.7476 32.9263 175.5772 78 D 4.5197 8.2785 119.5684 52.6232 40.5899 175.4225 79 P 4.1261 0.0000 0.0000 65.9618 31.4368 178.7052 80 A 4.0604 8.0174 118.9035 54.5561 18.6454 177.9594 81 S 4.7779 8.0609 111.6246 58.3108 63.5104 176.3694 82 R 3.9330 7.9076 124.0601 59.6238 30.0567 177.5017 83 D 4.7960 7.9780 115.3628 54.1070 41.0067 177.5589 84 L 3.9547 7.8078 123.7601 58.6249 42.0847 179.4277 85 V 3.7479 7.7489 117.3415 65.6465 31.5483 177.9444 86 V 3.5615 7.7776 117.8243 66.0978 31.4165 178.0502 87 S 4.1877 8.2418 114.8937 61.7015 62.5864 175.9718 88 Y 4.0879 7.9473 121.9722 60.5820 38.5157 178.3331 89 V 3.2666 7.9230 119.0091 66.1135 31.7405 177.5230 90 N 4.6576 8.2154 116.1047 56.9923 38.2004 177.6104 91 T 3.9238 7.6544 115.8346 66.5344 68.6990 176.3122 92 N 4.4339 8.0185 118.1601 55.8935 39.4328 175.8880 93 V 4.5618 8.3100 110.3579 60.1297 33.9090 177.4225 94 G 3.8822 8.4382 108.9741 47.9826 0.0000 175.7455 95 L 3.9057 7.9263 122.5760 57.6839 42.1438 178.7527 96 K 3.9967 8.0344 119.0362 59.5860 32.1202 178.6297 97 F 3.9611 8.2412 117.6635 60.4186 38.8190 177.8219 98 R 3.9788 8.3266 118.1914 59.2581 29.7511 179.2296 99 Q 3.4502 7.8561 117.7474 58.5804 28.7356 178.2528 100 L 4.1852 7.5688 122.2261 57.7029 42.1642 179.0029 101 L 4.0638 8.4213 119.2003 57.6473 41.5987 179.3829 102 W 4.1992 8.5252 128.3105 60.3122 30.5968 177.6378 103 F 4.0636 9.2544 121.0859 61.8621 38.8482 176.9443 104 H 3.7298 8.1721 115.5430 58.7535 28.5227 177.8595 105 I 3.5004 7.6790 121.5630 64.4554 36.8670 178.7027 106 S 3.9484 7.5707 115.9679 61.5123 62.5392 176.4752 107 C 4.0142 7.6669 119.6956 62.3771 27.4340 176.1683 108 L 3.6783 7.4617 120.3300 57.9355 41.1662 179.3862 109 T 3.9585 7.3003 115.8070 65.2203 68.5180 176.1474 110 F 4.6440 8.4430 116.6674 55.6050 40.8727 175.3956 111 G 4.0472 7.8270 109.5574 45.8332 0.0000 174.2213 112 R 3.7311 8.6455 123.1183 59.7134 29.9987 178.8684 113 E 4.2264 8.2113 117.4605 59.6740 29.3195 179.4118 114 T 3.9803 7.8991 115.5733 66.3317 68.4556 176.8809 115 V 3.6417 7.6243 119.8953 65.8794 31.6208 177.8538 116 L 4.1601 8.4651 119.2347 58.3282 41.5673 179.6046 117 E 4.3397 8.1785 117.7745 59.0959 29.3330 178.8521 118 Y 4.0961 7.9930 120.0361 60.5143 38.8985 177.7047 119 L 3.8600 8.4605 120.2350 57.9352 41.8223 179.6401 120 V 3.5389 8.3260 118.3867 66.1775 31.3190 178.0994 121 S 4.2224 7.9903 114.6590 60.8156 62.6707 176.4346 122 F 3.7878 8.1164 123.8672 61.0198 39.0741 177.3772 123 G 3.3870 8.0362 105.4234 47.6665 0.0000 175.6197 124 V 3.5492 7.5797 119.7098 66.1243 31.7544 177.0699 125 W 4.1617 8.5915 127.1656 61.7373 30.0983 177.6620 126 I 3.4771 8.8620 122.3647 63.8944 36.8659 177.7304 127 R 4.4655 7.5414 117.0483 55.1245 30.4430 175.8192 128 T 4.5486 7.1510 109.6135 58.7777 70.8744 172.4070 129 P 4.2779 0.0000 0.0000 61.8413 31.8653 176.1751 130 P 4.2614 0.0000 0.0000 62.6479 31.2199 176.7565 131 A 4.5716 10.2670 119.8452 51.4904 20.5253 177.5068 132 A 4.5337 7.9369 115.5689 51.3170 20.1024 175.9544 133 R 4.3244 7.6238 113.7135 53.7909 29.5270 174.4127 134 P 4.3870 0.0000 0.0000 62.3301 31.6338 176.6732 135 P 4.3581 0.0000 0.0000 65.7166 32.2186 174.9145 136 N 4.3538 7.8421 118.6349 52.5340 37.9522 174.6785 137 A 2.7681 7.4255 120.5827 51.2042 19.2909 176.3293 138 P 4.2934 0.0000 0.0000 62.5528 32.0642 175.7438 139 I 4.6921 7.9380 119.8755 59.1216 40.9642 175.1867 140 L 3.8026 7.9012 127.6135 53.8435 40.9361 175.4033 141 S 4.4869 7.9168 117.7663 58.3956 65.2904 174.6130 142 T 3.7760 8.8160 122.0639 64.2004 67.8929 171.8032 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 8.30 4.41 0.00 2.03 2.10 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.54 0.00 2 D 8.28 4.47 0.00 2.64 2.54 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 3 I 8.19 4.24 1.87 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 1.30 0.73 0.91 0.00 0.00 4 D 8.51 4.69 0.00 2.70 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 5 P 0.00 4.41 0.00 1.86 2.02 0.00 3.81 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.74 0.00 6 Y 8.31 4.51 0.00 3.20 2.77 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 7 K 8.52 4.22 0.00 1.88 1.90 0.00 1.69 0.00 0.00 1.80 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.33 7.81 8 E 8.09 4.04 0.00 1.80 1.84 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 1.76 1.47 0.00 9 F 8.14 4.87 0.00 3.55 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 10 G 8.11 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 11 A 7.82 4.85 1.08 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 0.00 0.00 12 T 7.60 4.78 4.40 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 1.21 0.00 0.00 13 V 8.81 3.52 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 1.12 0.00 0.00 1.17 0.00 0.00 14 E 8.04 3.93 0.00 2.08 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 2.41 2.43 0.00 15 L 7.77 3.82 0.00 1.51 1.68 0.83 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 16 L 7.14 4.17 0.00 1.39 1.42 1.24 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 17 S 8.01 4.16 0.00 3.95 3.92 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 0.00 0.00 0.00 18 F 8.18 3.96 0.00 3.21 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 19 L 7.25 3.95 0.00 1.32 0.70 -0.63 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 20 P 0.00 4.47 0.00 2.24 2.19 0.00 2.96 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.07 0.00 21 S 8.73 4.37 0.00 3.96 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 22 D 8.27 4.50 0.00 2.70 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 23 F 7.67 4.00 0.00 2.59 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.78 3.94 0.00 3.16 2.92 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 0.00 0.00 0.00 25 P 0.00 4.41 0.00 2.08 1.99 0.00 3.82 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.01 0.00 26 S 8.29 4.36 0.00 4.04 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 27 V 8.11 3.34 1.78 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 0.01 0.00 0.00 0.11 0.00 0.00 28 R 7.86 3.88 0.00 2.00 1.92 0.00 3.34 0.00 0.00 3.39 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.80 0.00 29 D 8.00 4.38 0.00 2.92 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 30 L 7.86 4.01 0.00 1.83 1.76 1.18 0.80 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 31 L 8.08 3.99 0.00 1.84 1.75 1.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.16 4.38 0.00 2.70 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 33 T 8.23 3.79 4.42 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 1.19 0.00 0.00 34 A 8.51 4.11 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 35 A 8.28 3.91 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 36 A 7.85 3.86 1.31 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 0.00 0.00 37 L 7.73 3.93 0.00 0.34 0.28 0.69 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 7.85 4.89 0.00 3.11 2.87 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 39 R 8.36 3.96 0.00 1.95 1.96 0.00 3.11 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 40 D 8.05 4.29 0.00 2.70 2.73 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 41 A 8.15 4.18 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.40 4.02 0.00 1.80 1.79 1.01 1.05 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 43 E 8.47 4.27 0.00 1.91 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 2.37 2.55 0.00 44 S 7.31 4.53 0.00 3.99 4.18 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 45 P 0.00 4.57 0.00 2.17 2.18 0.00 3.74 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 1.93 1.96 0.00 46 E 7.57 4.45 0.00 1.94 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 2.26 2.23 0.00 47 H 8.67 4.21 0.00 3.14 3.36 0.00 5.82 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 48 C 8.91 4.09 0.00 2.76 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.14 4.61 0.00 4.06 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 50 P 0.00 4.34 0.00 2.39 2.18 0.00 3.68 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.19 0.00 51 H 8.31 3.86 0.00 3.06 3.12 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 H 7.96 4.06 0.00 3.43 3.33 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 T 8.16 3.87 4.43 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 1.24 0.00 0.00 54 A 8.29 3.98 1.08 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 0.00 0.00 55 L 8.28 3.87 0.00 1.72 1.79 0.94 0.97 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 56 R 8.21 3.95 0.00 2.07 2.00 0.00 3.22 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.98 0.00 57 Q 8.02 4.01 0.00 2.13 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.64 2.56 0.00 58 A 8.08 4.21 1.49 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 59 I 8.01 3.79 2.07 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.03 0.99 0.00 0.00 60 L 8.25 4.15 0.00 1.86 1.75 0.95 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 61 C 8.59 4.29 0.00 3.25 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 62 W 8.31 3.75 0.00 3.22 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 63 G 8.16 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 0.00 0.00 0.00 64 D 8.11 4.35 0.00 2.86 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 65 L 7.77 3.81 0.00 1.15 1.28 0.51 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 66 M 7.75 3.77 0.00 1.84 1.88 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 1.77 0.00 67 T 8.19 3.83 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 1.20 0.00 0.00 68 L 7.99 3.92 0.00 1.69 1.80 0.87 1.01 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 69 A 8.26 4.05 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 70 T 8.62 3.86 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 1.23 0.00 0.00 71 W 8.37 4.05 0.00 3.53 3.35 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 72 V 8.24 3.73 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 0.87 0.00 0.00 1.23 0.00 0.00 73 G 7.95 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 0.00 0.00 0.00 0.00 74 T 7.92 3.79 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 1.09 0.00 0.00 75 N 7.45 4.37 0.00 1.54 2.20 0.00 0.00 6.90 7.88 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 76 L 7.98 4.65 0.00 1.55 1.57 0.60 0.89 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 77 E 7.56 4.76 0.00 2.04 1.78 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 2.18 2.43 0.00 78 D 8.28 4.52 0.00 2.80 2.77 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 79 P 0.00 4.13 0.00 2.17 2.15 0.00 3.57 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 2.10 2.09 0.00 80 A 8.02 4.06 1.27 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 0.00 0.00 81 S 8.06 4.78 0.00 3.87 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 82 R 7.91 3.93 0.00 1.85 2.14 0.00 3.07 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 83 D 7.98 4.80 0.00 2.81 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 84 L 7.81 3.95 0.00 1.86 1.68 0.94 0.65 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 85 V 7.75 3.75 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 1.01 0.00 0.00 0.93 0.00 0.00 86 V 7.78 3.56 2.23 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 1.02 0.00 0.00 0.92 0.00 0.00 87 S 8.24 4.19 0.00 4.14 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 88 Y 7.95 4.09 0.00 3.14 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 89 V 7.92 3.27 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 0.45 0.00 0.00 0.96 0.00 0.00 90 N 8.22 4.66 0.00 3.00 2.99 0.00 0.00 7.15 6.42 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 91 T 7.65 3.92 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 1.21 0.00 0.00 92 N 8.02 4.43 0.00 2.09 2.36 0.00 0.00 7.06 7.38 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 93 V 8.31 4.56 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 0.92 0.00 0.00 1.18 0.00 0.00 94 G 8.44 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 0.00 0.00 0.00 0.00 95 L 7.93 3.91 0.00 1.77 1.67 0.81 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 96 K 8.03 4.00 0.00 1.80 1.79 0.00 1.59 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.06 1.26 7.81 97 F 8.24 3.96 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 98 R 8.33 3.98 0.00 1.98 1.99 0.00 3.37 0.00 0.00 3.04 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 99 Q 7.86 3.45 0.00 2.07 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.79 0.00 0.00 0.00 0.00 0.00 1.16 1.60 0.00 100 L 7.57 4.19 0.00 1.68 1.72 0.55 0.73 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 0.00 101 L 8.42 4.06 0.00 1.81 1.77 0.83 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 102 W 8.53 4.20 0.00 3.72 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 0.00 103 F 9.25 4.06 0.00 3.67 3.45 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 0.00 104 H 8.17 3.73 0.00 3.16 3.12 0.00 5.68 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 I 7.68 3.50 1.85 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.69 0.94 0.00 0.00 106 S 7.57 3.95 0.00 3.04 3.35 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 0.00 107 C 7.67 4.01 0.00 2.13 2.35 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 0.00 108 L 7.46 3.68 0.00 1.26 0.88 -0.13 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 109 T 7.30 3.96 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 0.24 0.00 0.00 110 F 8.44 4.64 0.00 2.93 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 0.00 111 G 7.83 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 0.00 112 R 8.65 3.73 0.00 1.94 2.02 0.00 3.32 0.00 0.00 3.72 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.92 0.00 113 E 8.21 4.23 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 2.46 2.47 0.00 114 T 7.90 3.98 4.60 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 0.00 0.00 0.00 1.21 0.00 0.00 115 V 7.62 3.64 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 1.21 0.00 0.00 0.82 0.00 0.00 116 L 8.47 4.16 0.00 1.93 1.83 1.06 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 117 E 8.18 4.34 0.00 2.04 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 2.37 2.65 0.00 118 Y 7.99 4.10 0.00 3.04 3.32 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 0.00 119 L 8.46 3.86 0.00 2.01 1.73 1.30 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 120 V 8.33 3.54 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 0.97 0.00 0.00 121 S 7.99 4.22 0.00 3.92 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 0.00 122 F 8.12 3.79 0.00 2.70 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 0.00 123 G 8.04 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 0.00 0.00 0.00 124 V 7.58 3.55 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 0.84 0.00 0.00 0.95 0.00 0.00 125 W 8.59 4.16 0.00 3.36 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 0.00 126 I 8.86 3.48 2.48 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.62 1.17 0.00 0.00 127 R 7.54 4.47 0.00 1.83 1.94 0.00 3.02 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 1.76 1.88 0.00 128 T 7.15 4.55 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 1.24 0.00 0.00 129 P 0.00 4.28 0.00 2.13 1.95 0.00 3.54 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 2.06 2.04 0.00 130 P 0.00 4.26 0.00 1.94 1.94 0.00 3.52 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.91 0.00 131 A 10.27 4.57 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 0.00 132 A 7.94 4.53 1.20 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 0.00 0.00 133 R 7.62 4.32 0.00 1.51 1.66 0.00 2.21 0.00 0.00 2.73 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.25 0.00 134 P 0.00 4.39 0.00 2.26 2.07 0.00 3.65 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.09 0.00 135 P 0.00 4.36 0.00 2.25 2.26 0.00 3.84 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 136 N 7.84 4.35 0.00 2.84 2.86 0.00 0.00 6.93 7.49 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 0.00 137 A 7.43 2.77 -0.09 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 0.00 138 P 0.00 4.29 0.00 1.78 1.94 0.00 2.73 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.95 0.00 139 I 7.94 4.69 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 0.95 0.88 0.00 0.00 140 L 7.90 3.80 0.00 0.27 1.06 0.23 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 141 S 7.92 4.49 0.00 3.79 3.63 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 0.00 142 T 8.82 3.78 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 1.24 0.00 0.00