NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3019 0.0000 0.0000 62.2060 32.5874 175.6691 3 R 3.7389 8.6042 122.7825 55.9220 30.1680 174.9710 4 A 4.5594 8.9921 131.1101 49.2176 19.3339 174.4083 5 K 3.8458 8.1717 119.8093 56.9655 31.5386 178.1423 6 T 4.2626 8.5809 110.3030 61.9530 68.4674 174.4672 7 G 3.8271 8.5516 112.0538 47.5706 0.0000 173.6961 8 I 3.4949 8.2712 112.0394 61.1284 36.5623 174.5366 9 V 4.2177 7.4104 120.2987 63.7271 33.7236 177.8297 10 R 3.8124 7.5417 118.7714 59.6963 29.7815 177.3117 11 R 3.5968 8.1056 116.4067 60.2025 29.5245 177.7498 12 R 3.8524 7.9004 120.5324 59.3486 30.2026 178.8183 13 R 4.0406 7.4930 117.7412 59.6055 30.1680 177.9994 14 H 3.8054 8.2443 116.2573 58.9324 28.6520 177.6365 15 K 3.8819 8.2321 120.4103 59.8611 31.8855 179.2387 16 K 4.0006 7.8184 117.8752 59.3564 31.8928 179.6083 17 V 3.6880 7.7006 117.8936 66.1300 31.5023 177.6418 18 L 4.1082 8.1828 117.7519 57.8525 41.5718 179.2447 19 K 4.0420 8.2632 118.4307 59.8013 32.5040 178.3603 20 R 4.0741 8.4499 118.3232 59.3618 29.9681 178.6674 21 A 3.9007 8.8569 120.4398 53.9377 18.8112 181.4653 22 K 4.1425 8.0584 120.1785 57.3289 33.9101 176.9034 23 G 4.2975 8.3889 114.6473 45.3631 0.0000 173.7978 24 F 5.0817 6.9670 117.5865 56.8561 38.3460 178.1132 25 W 4.9963 9.1960 135.0000 58.1323 34.1459 173.6606 26 G 4.1121 7.8393 113.7831 46.9004 0.0000 176.7771 27 S 4.3068 8.9403 117.6517 60.8785 63.6899 176.3023 28 R 4.0166 7.9619 119.9493 59.3604 29.8527 177.7328 29 S 4.8855 7.7930 107.3583 58.1838 62.4073 174.2643 30 K 4.5078 7.7898 116.2475 57.4818 35.3169 176.6427 31 Q 4.5820 9.0102 118.0195 54.6212 30.3769 176.2068 32 Y 4.2691 8.6675 121.7374 60.9417 39.8459 177.7938 33 R 3.2798 8.3579 114.4163 59.6995 29.4320 178.8046 34 N 3.9619 8.6611 119.4116 57.0521 39.2266 175.7443 35 A 4.0412 8.3158 117.7656 55.3975 18.3966 178.8494 36 F 3.9636 8.0993 122.5226 60.6185 40.2098 177.2109 37 Q 3.8751 8.6939 119.0375 59.5754 28.6898 178.0052 38 T 3.6978 8.7861 117.5468 66.7908 68.3463 176.1467 39 L 3.9566 7.4476 119.5653 57.9540 41.6020 179.2939 40 L 3.5402 7.2355 118.5462 58.2926 41.5134 179.6778 41 N 3.9247 7.6216 114.4390 55.9589 38.3254 177.1914 42 A 4.0568 8.5938 123.0950 55.6677 18.2331 178.4343 43 A 4.1622 7.5919 119.7111 54.8084 17.7539 179.8701 44 T 3.7288 7.4976 111.4265 66.5045 68.6949 176.0869 45 Y 4.3317 7.4688 117.7717 61.6444 37.8444 177.3570 46 E 4.0881 9.4226 120.6507 58.9259 29.6658 179.0692 47 Y 3.4835 8.5741 112.8372 61.0517 38.9955 178.3196 48 R 4.1811 6.0318 122.8175 58.5839 31.3610 177.2247 49 D 4.5657 8.7964 118.5591 56.3291 40.9704 178.0954 50 R 3.8371 7.4312 119.2486 60.0080 30.2249 179.0450 51 R 4.2951 7.7262 110.7480 56.4478 29.1828 176.6145 52 N 4.8248 9.6816 117.4509 54.7458 42.1664 176.3053 53 K 3.9026 9.4350 118.2491 59.6083 32.1957 179.1054 54 K 4.0126 7.9247 119.6296 59.6587 32.0534 178.7718 55 R 3.8955 7.7304 116.9390 59.0516 30.2048 178.2921 56 D 4.3130 8.8739 116.6940 55.8827 40.3664 179.5318 57 F 3.9394 5.8583 123.0858 60.7634 39.7707 177.3137 58 R 3.5509 7.8373 118.1133 59.4045 29.9073 178.7191 59 R 3.7766 10.0620 117.4574 59.2467 30.0811 178.0973 60 L 4.7482 7.8889 120.6112 57.6593 42.1939 178.4763 61 W 4.4638 9.3321 119.7973 60.1644 28.9633 178.5052 62 I 3.6901 8.0537 119.1134 64.8971 36.5018 178.5164 63 Q 3.8831 7.9948 118.7214 59.4382 27.9898 179.8258 64 R 4.0475 8.2597 118.8528 58.9342 30.1481 179.3121 65 I 3.8972 8.1914 120.1338 63.9060 37.2464 177.1361 66 N 4.8591 8.7576 117.0563 54.1419 37.8392 177.0719 67 A 4.1847 9.2420 123.3565 54.5244 18.5443 179.3170 68 G 3.5963 7.9289 103.5938 47.3634 0.0000 175.6044 69 A 4.1692 8.0167 123.6623 55.3727 18.1603 180.0466 70 R 4.0167 8.3964 115.9695 58.8038 29.9312 178.5666 71 L 4.2137 8.2182 119.4706 57.1174 42.1356 176.7266 72 H 4.7385 8.4814 112.4002 55.0435 30.9071 173.0131 73 G 3.6812 6.9959 106.9180 45.3062 0.0000 173.8989 74 M 4.1727 10.4064 120.7639 54.6079 30.9947 177.6201 75 N 5.0681 9.6269 122.3739 51.7105 38.5919 175.1364 76 Y 4.0438 8.6742 121.4365 61.1285 38.9294 177.9772 77 S 4.0525 8.3841 111.1035 61.6420 61.8714 176.1332 78 T 3.7851 7.2979 116.6805 67.2363 69.0182 174.8518 79 F 3.9304 9.1667 118.7584 61.9374 39.0454 177.5549 80 I 3.1268 7.3430 118.4532 65.1595 37.4178 176.6458 81 N 4.1756 8.5852 117.1437 57.1133 38.3162 176.3946 82 G 3.5801 8.6791 109.6012 48.2255 0.0000 174.6609 83 L 4.1989 8.7011 122.5820 57.8477 41.9127 178.9720 84 K 4.0348 9.4265 118.8841 59.1187 32.1883 178.1842 85 R 4.1593 8.5760 119.3979 58.2246 30.3641 175.7929 86 A 4.4019 7.5341 121.2757 50.0312 17.8115 176.8638 87 N 4.1452 8.6627 120.4776 56.6676 39.3284 175.9052 88 I 3.8020 7.7561 116.7867 63.4143 38.3402 175.2273 89 D 5.0121 9.7656 118.6911 52.8386 43.0946 176.4558 90 L 4.4660 7.7438 120.3264 54.3020 42.9516 175.2688 91 N 4.2691 8.3806 120.2205 57.0893 38.7826 181.8203 92 R 3.1031 7.3491 112.2323 57.7708 31.9507 176.4593 93 K 4.2314 8.4515 132.1306 60.9501 31.1593 175.7272 94 V 3.3384 9.9593 126.9497 60.2104 29.8466 170.9022 95 L 3.3477 7.9027 118.2195 57.1402 43.8304 177.4492 96 A 3.9975 10.6000 124.1434 55.0838 18.5688 179.1969 97 D 4.1462 7.6961 116.6224 57.3942 40.6139 179.1658 98 I 3.6702 7.5535 119.9053 64.3920 37.1332 178.0967 99 A 3.7544 7.4026 119.0754 54.4148 18.0581 179.4493 100 A 3.9864 7.9300 119.6194 54.8120 18.6984 179.1438 101 R 4.4822 7.6451 110.3397 55.4051 32.4666 175.5734 102 E 4.6935 8.2344 121.3430 54.0620 29.4860 174.4594 103 P 4.3538 0.0000 0.0000 65.9855 31.6590 177.9327 104 E 3.9360 8.3057 115.5144 60.4159 29.2622 178.8679 105 A 4.0197 8.4206 120.6959 54.4152 18.1554 179.4356 106 F 3.9853 7.9821 119.1565 60.8360 40.3577 177.2836 107 K 3.1597 8.9403 114.1219 60.0822 31.6217 177.8535 108 A 3.7894 8.5784 119.0257 55.9236 18.9222 180.0117 109 L 3.5896 7.2635 115.7784 57.4500 41.8881 179.8185 110 V 2.6380 7.6373 118.3417 65.1881 31.4938 177.0006 111 D 4.1420 7.7211 116.6265 57.6025 40.7909 178.0094 112 A 3.9057 8.6413 121.1166 55.8839 18.2743 179.5977 113 S 3.9489 7.5073 111.1248 61.5772 62.4930 176.1907 114 R 3.8885 8.0073 121.6374 59.7669 29.5347 177.2943 115 N 4.1727 8.8916 112.5756 55.6625 38.7130 176.9000 116 A 3.9569 7.9777 125.2260 55.4586 19.9847 178.9422 117 R 3.9061 7.2811 116.2210 56.9089 30.1371 176.3600 118 Q 4.2307 7.6611 121.8518 56.0515 28.8349 175.7196 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 P 0.00 4.30 0.00 2.19 2.12 0.00 3.73 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 1.88 1.96 0.00 3 R 8.60 3.74 0.00 1.87 1.89 0.00 3.20 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 4 A 8.99 4.56 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 5 K 8.17 3.85 0.00 1.84 1.81 0.00 1.66 0.00 0.00 1.86 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.47 7.81 6 T 8.58 4.26 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 1.19 0.00 0.00 7 G 8.55 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 8 I 8.27 3.49 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 1.28 0.52 0.89 0.00 0.00 9 V 7.41 4.22 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 0.93 0.00 0.00 0.97 0.00 0.00 10 R 7.54 3.81 0.00 1.83 1.68 0.00 2.99 0.00 0.00 3.01 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.54 0.00 11 R 8.11 3.60 0.00 1.84 1.77 0.00 3.23 0.00 0.00 3.29 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 12 R 7.90 3.85 0.00 1.78 2.00 0.00 3.45 0.00 0.00 3.14 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 13 R 7.49 4.04 0.00 1.94 1.99 0.00 3.12 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 14 H 8.24 3.81 0.00 3.05 2.93 0.00 5.72 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 15 K 8.23 3.88 0.00 1.72 1.90 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.64 7.81 16 K 7.82 4.00 0.00 2.10 1.91 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.63 7.81 17 V 7.70 3.69 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 1.53 0.00 0.00 1.37 0.00 0.00 18 L 8.18 4.11 0.00 1.83 1.80 1.09 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 19 K 8.26 4.04 0.00 1.88 2.06 0.00 1.83 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.48 7.81 20 R 8.45 4.07 0.00 2.16 2.06 0.00 3.31 0.00 0.00 3.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 2.04 0.00 21 A 8.86 3.90 1.65 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 22 K 8.06 4.14 0.00 1.31 1.24 0.00 1.57 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.26 1.18 7.81 23 G 8.39 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 0.00 0.00 0.00 0.00 24 F 6.97 5.08 0.00 3.10 2.42 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 25 W 9.20 5.00 0.00 3.38 2.91 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 26 G 7.84 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 0.00 0.00 0.00 0.00 27 S 8.94 4.31 0.00 4.08 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 28 R 7.96 4.02 0.00 2.40 2.14 0.00 3.14 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 29 S 7.79 4.89 0.00 4.12 3.94 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 30 K 7.79 4.51 0.00 1.77 1.80 0.00 1.84 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.72 1.38 7.81 31 Q 9.01 4.58 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 32 Y 8.67 4.27 0.00 2.94 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 33 R 8.36 3.28 0.00 1.81 1.69 0.00 3.26 0.00 0.00 3.36 8.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 34 N 8.66 3.96 0.00 2.77 2.85 0.00 0.00 6.68 7.54 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 35 A 8.32 4.04 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 36 F 8.10 3.96 0.00 2.75 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 37 Q 8.69 3.88 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.42 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 38 T 8.79 3.70 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 0.59 0.00 0.00 39 L 7.45 3.96 0.00 1.72 1.67 1.05 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 40 L 7.24 3.54 0.00 1.45 1.58 0.78 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 41 N 7.62 3.92 0.00 2.68 2.26 0.00 0.00 6.88 7.67 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 42 A 8.59 4.06 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 43 A 7.59 4.16 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 44 T 7.50 3.73 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 1.21 0.00 0.00 45 Y 7.47 4.33 0.00 3.14 2.90 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 46 E 9.42 4.09 0.00 2.01 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 2.43 2.67 0.00 47 Y 8.57 3.48 0.00 3.07 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 48 R 6.03 4.18 0.00 1.86 2.11 0.00 3.26 0.00 0.00 3.26 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.79 0.00 49 D 8.80 4.57 0.00 3.12 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 50 R 7.43 3.84 0.00 1.86 1.79 0.00 2.97 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 1.59 1.57 0.00 51 R 7.73 4.30 0.00 1.98 1.99 0.00 3.02 0.00 0.00 3.48 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 52 N 9.68 4.82 0.00 2.95 2.88 0.00 0.00 6.95 6.82 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 53 K 9.44 3.90 0.00 2.21 2.16 0.00 1.38 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.68 1.59 7.81 54 K 7.92 4.01 0.00 1.80 1.82 0.00 1.67 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.70 7.81 55 R 7.73 3.90 0.00 1.83 2.00 0.00 3.19 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 56 D 8.87 4.31 0.00 2.77 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 0.00 0.00 0.00 0.00 57 F 5.86 3.94 0.00 3.01 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 58 R 7.84 3.55 0.00 2.05 1.89 0.00 3.03 0.00 0.00 2.96 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.69 0.00 59 R 10.06 3.78 0.00 2.10 1.92 0.00 3.06 0.00 0.00 3.05 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 60 L 7.89 4.75 0.00 1.72 1.96 1.08 1.30 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 61 W 9.33 4.46 0.00 3.49 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 62 I 8.05 3.69 1.78 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.92 -0.17 0.00 0.00 63 Q 7.99 3.88 0.00 2.29 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.79 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 64 R 8.26 4.05 0.00 1.96 1.84 0.00 3.08 0.00 0.00 3.10 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.87 0.00 65 I 8.19 3.90 2.23 0.00 0.00 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 1.69 1.22 0.98 0.00 0.00 66 N 8.76 4.86 0.00 3.24 3.40 0.00 0.00 6.78 7.64 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 67 A 9.24 4.18 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 68 G 7.93 3.60 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 0.00 0.00 0.00 0.00 69 A 8.02 4.17 1.76 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 0.00 0.00 70 R 8.40 4.02 0.00 1.97 2.06 0.00 3.20 0.00 0.00 3.16 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.94 0.00 71 L 8.22 4.21 0.00 1.80 2.09 0.96 1.07 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 72 H 8.48 4.74 0.00 3.04 3.25 0.00 5.93 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 G 7.00 3.68 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 0.00 0.00 0.00 74 M 10.41 4.17 0.00 2.03 1.69 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 75 N 9.63 5.07 0.00 3.09 3.18 0.00 0.00 5.54 7.57 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 76 Y 8.67 4.04 0.00 3.14 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 77 S 8.38 4.05 0.00 4.05 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 78 T 7.30 3.79 4.54 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 1.24 0.00 0.00 79 F 9.17 3.93 0.00 3.04 3.10 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 0.00 0.00 0.00 0.00 80 I 7.34 3.13 1.34 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 0.42 -0.36 0.59 0.00 0.00 81 N 8.59 4.18 0.00 2.79 3.03 0.00 0.00 7.16 7.92 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 82 G 8.68 3.58 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 0.00 0.00 0.00 83 L 8.70 4.20 0.00 2.10 1.78 1.09 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 84 K 9.43 4.03 0.00 1.77 1.97 0.00 1.88 0.00 0.00 1.61 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.43 7.81 85 R 8.58 4.16 0.00 1.89 1.99 0.00 3.35 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.74 0.00 86 A 7.53 4.40 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 87 N 8.66 4.15 0.00 2.69 2.91 0.00 0.00 7.18 7.94 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 88 I 7.76 3.80 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 1.42 0.93 0.98 0.00 0.00 89 D 9.77 5.01 0.00 2.95 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 90 L 7.74 4.47 0.00 1.55 1.56 0.93 1.02 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 91 N 8.38 4.27 0.00 2.91 2.89 0.00 0.00 7.19 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 92 R 7.35 3.10 0.00 1.95 2.21 0.00 3.35 0.00 0.00 3.26 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 93 K 8.45 4.23 0.00 1.96 1.97 0.00 1.63 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.81 7.81 94 V 9.96 3.34 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 0.82 0.00 0.00 0.97 0.00 0.00 95 L 7.90 3.35 0.00 1.96 2.23 1.07 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 96 A 10.60 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 D 7.70 4.15 0.00 2.48 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 98 I 7.55 3.67 2.10 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 1.51 1.07 1.01 0.00 0.00 99 A 7.40 3.75 0.46 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 0.00 0.00 0.00 0.00 0.00 0.00 100 A 7.93 3.99 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 0.00 101 R 7.65 4.48 0.00 1.90 1.99 0.00 2.99 0.00 0.00 3.12 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 102 E 8.23 4.69 0.00 2.02 1.89 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 2.21 2.30 0.00 103 P 0.00 4.35 0.00 2.24 2.16 0.00 3.71 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 104 E 8.31 3.94 0.00 1.95 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 2.35 2.45 0.00 105 A 8.42 4.02 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 0.00 106 F 7.98 3.99 0.00 2.99 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 0.00 107 K 8.94 3.16 0.00 2.02 1.94 0.00 1.60 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.50 7.81 108 A 8.58 3.79 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 0.00 109 L 7.26 3.59 0.00 1.60 1.81 1.08 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 0.00 110 V 7.64 2.64 1.54 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 0.46 0.00 0.00 -0.95 0.00 0.00 111 D 7.72 4.14 0.00 2.72 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 0.00 112 A 8.64 3.91 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 0.00 113 S 7.51 3.95 0.00 3.96 3.85 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 0.00 114 R 8.01 3.89 0.00 1.82 2.00 0.00 3.14 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 115 N 8.89 4.17 0.00 2.80 2.67 0.00 0.00 7.07 7.34 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 0.00 116 A 7.98 3.96 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 0.00 117 R 7.28 3.91 0.00 1.76 1.96 0.00 3.27 0.00 0.00 3.23 7.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 118 Q 7.66 4.23 0.00 2.01 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.32 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00