NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 K 4.0241 8.3149 120.0509 56.1177 33.2606 175.0847 7 R 3.0771 7.9715 119.4203 55.2388 30.9181 175.6103 8 T 4.6399 8.0432 113.3817 61.7555 71.0183 174.1452 9 K 4.3981 7.8151 117.1013 57.8469 34.0673 175.7617 10 F 4.3639 7.1739 116.9109 57.8115 41.2163 170.7354 11 R 4.2255 7.5154 130.3334 55.7278 34.9535 173.6580 12 K 4.5339 7.5954 121.7119 58.6388 40.2936 175.1648 13 Q 4.1425 7.3981 121.1070 55.3942 25.6026 172.6173 14 F 5.3215 7.2298 114.7709 56.4485 43.4598 174.6741 15 R 4.3186 8.0010 123.1898 55.8460 34.6881 173.8748 16 G 4.0063 8.2371 114.6722 46.7183 0.0000 171.8568 17 R 4.6735 7.8539 117.7172 54.8202 32.2367 174.4693 18 M 4.4418 7.9112 122.1178 56.2775 34.6935 175.1285 19 T 4.6254 7.4591 116.1287 62.4868 72.6911 173.6324 20 G 3.8499 8.9582 112.6956 45.9722 0.0000 173.6341 21 D 3.9941 8.0699 117.8088 51.2624 40.2121 175.4885 22 A 4.1192 7.8631 126.3333 52.1744 18.6165 175.1697 23 K 4.4259 7.8884 118.3531 57.6565 34.9999 177.7943 24 G 3.9350 8.2514 107.2674 45.7860 0.0000 174.2013 25 G 3.8643 8.4614 112.7659 43.2403 0.0000 175.0234 26 D 4.7005 8.0575 126.7718 54.1282 42.3908 173.1979 27 Y 4.6202 8.5327 116.1142 57.4613 41.5037 175.3951 28 V 3.4025 7.6515 120.2734 63.1768 29.6807 174.9127 29 A 4.5428 7.6952 128.0504 51.3516 22.4536 175.4501 30 F 3.9423 8.6630 123.6215 57.4604 37.5239 174.9590 31 G 4.5512 7.4522 106.8740 44.2098 0.0000 170.8167 32 D 4.7574 8.8380 116.5722 54.6113 43.2820 176.5478 33 Y 5.1345 7.8597 114.0449 56.2995 41.4666 175.3423 34 G 4.8383 8.9618 107.0891 45.2252 0.0000 171.0041 35 L 5.3201 9.5602 123.2291 53.0201 45.2511 175.2684 36 I 4.8292 8.7302 125.2162 59.0883 41.1306 175.0620 37 A 4.3977 8.2148 127.7231 52.4685 19.5544 178.3216 38 M 4.8253 8.2975 115.8668 55.5982 34.8837 174.8476 39 E 4.7581 7.8281 117.1319 54.3303 33.8588 173.7149 40 P 4.6275 0.0000 0.0000 62.7408 31.6197 175.5199 41 A 4.9938 7.4793 119.4798 49.7014 22.5869 177.6819 42 W 4.7052 8.8101 118.9919 56.9691 30.4289 176.2374 43 I 4.7081 8.2365 120.9807 59.4010 39.9685 175.8509 44 K 4.1837 9.0584 127.5731 56.3118 32.3054 176.9618 45 S 4.1619 8.4179 116.9949 59.3578 62.3424 176.8144 46 N 4.0741 8.0341 118.9445 55.1388 38.5154 176.9310 47 Q 4.0590 8.2714 119.9193 58.0323 28.7163 178.5265 48 I 3.9841 9.8090 120.6651 64.0385 37.4867 177.8674 49 E 4.0908 8.2775 116.8515 58.6241 29.8307 178.4618 50 A 4.3962 8.1807 120.9276 54.3079 19.6939 178.8899 51 C 3.8503 7.9090 115.3209 63.2703 28.1782 175.7331 52 R 3.7577 8.5962 120.0909 59.6995 29.3819 178.1482 53 I 3.6252 7.3440 117.3618 65.3418 37.2158 177.3793 54 V 3.5041 7.9209 117.9468 65.3301 30.7136 177.8761 55 M 3.3651 7.8027 120.0402 58.1234 32.8275 178.6039 56 S 3.3267 9.4761 106.0676 61.8685 62.8825 177.4455 57 R 3.6774 6.0955 119.3149 59.2950 30.4446 177.0659 58 H 3.9717 7.6086 118.5316 59.0548 30.0828 175.7069 59 F 5.0471 8.4211 117.5866 62.0876 40.0124 181.3353 60 R 2.7817 7.8052 115.0895 55.7080 31.6343 177.4235 61 R 4.5692 9.7661 121.8918 55.4829 32.8578 174.4910 62 G 3.4797 10.2387 114.3372 45.8222 0.0000 175.7176 63 G 4.0956 8.0139 107.2714 45.8272 0.0000 174.1251 64 K 4.2463 7.3843 118.8296 56.1254 31.1521 177.0341 65 I 4.3974 7.4940 120.0896 61.0174 38.6766 177.0689 66 Y 4.4976 8.3701 124.4591 56.2053 37.9742 174.2386 67 I 4.2076 8.1765 121.8551 60.0964 37.1566 175.4170 68 R 4.6206 8.0282 125.4788 55.8232 30.0602 176.9226 69 I 4.6455 7.3302 109.4552 60.5134 37.9401 174.9108 70 F 3.8113 8.6106 121.6073 59.2425 39.5039 172.2639 71 P 4.3634 0.0000 0.0000 63.6724 31.1537 176.2484 72 D 5.2722 8.3033 127.4870 52.4554 40.4876 176.3768 73 K 4.4704 8.4581 116.7037 55.0524 36.7774 172.4574 74 P 4.0990 0.0000 0.0000 61.6320 32.6784 175.1220 75 V 4.6925 7.8627 123.4705 61.4622 34.8028 173.0037 76 T 4.9546 8.0961 110.3340 60.2231 71.9861 171.7249 77 K 4.3948 7.9095 121.3836 56.0155 35.3719 174.3438 78 K 4.6617 8.1356 118.3140 54.3859 35.7510 174.7208 79 P 4.4103 0.0000 0.0000 62.1542 30.0322 178.1886 80 A 3.8217 8.0303 118.5323 52.3601 17.9195 177.3074 81 E 4.6958 7.8309 110.5113 57.0807 33.8444 176.1241 82 T 3.3283 9.0009 107.6369 63.8465 67.0180 169.9674 83 R 4.5306 7.1952 122.7620 57.5383 33.9517 175.7126 84 M 4.3515 8.1496 118.9254 54.4561 31.2857 174.1438 85 G 4.0915 7.3099 106.1400 44.9990 0.0000 172.0204 86 K 4.3681 7.7520 117.9142 55.2777 34.7817 176.9592 87 G 3.6332 7.5324 108.2682 44.7191 0.0000 173.6173 88 K 4.0957 7.9657 127.2642 57.3345 34.7834 178.1338 89 G 4.1276 8.8851 114.3374 47.3269 0.0000 175.5440 90 A 3.3166 7.7596 115.0408 51.8819 19.9887 181.3508 91 V 3.7486 8.7928 116.5659 61.5524 31.6354 176.2486 92 E 4.0622 9.0243 121.5103 57.2782 29.8657 176.0994 93 Y 4.8167 7.1901 115.4836 56.6915 40.2821 171.7975 94 W 5.0510 8.2512 120.0695 55.8034 32.3704 175.4972 95 V 4.6205 8.7836 114.8171 60.8896 36.3266 173.7862 96 S 4.5376 8.6528 116.2111 57.3528 65.1598 173.8763 97 V 3.8483 8.4082 121.1661 62.4625 31.7889 176.2064 98 V 4.3636 7.5277 124.5101 61.5221 34.5493 174.2597 99 K 4.3933 8.4993 118.4958 54.8552 35.3373 171.9866 100 P 4.2753 0.0000 0.0000 64.1174 31.9633 175.5812 101 G 4.1515 9.6784 118.9325 45.9791 0.0000 173.7522 102 R 3.5649 7.5581 120.7821 55.1981 29.9847 175.0945 103 V 3.7609 7.5364 126.3138 63.3841 31.3008 175.0628 104 M 3.8326 8.9234 129.0171 57.4092 32.7753 175.9137 105 F 5.1880 7.5063 115.2164 54.9374 43.3982 173.5941 106 E 6.3000 8.0896 119.3352 56.8045 31.5768 176.3269 107 V 5.1957 8.3919 116.4700 59.5526 36.1109 174.2169 108 A 4.7750 8.9279 124.0694 51.3007 21.5572 175.4545 109 G 4.2300 9.1051 108.6862 45.7953 0.0000 175.1549 110 V 3.7308 7.1106 110.9529 60.5308 32.6813 175.5607 111 T 4.5387 8.3370 111.5323 60.7807 71.0146 176.3080 112 E 2.5725 7.7803 115.5567 57.1786 32.1223 178.3306 113 E 3.4868 8.7127 120.6478 59.1600 30.8015 178.1765 114 Q 4.1378 7.6465 114.4068 57.2891 29.0628 176.4845 115 A 4.9329 8.5831 119.2819 52.7980 24.0343 178.4665 116 K 3.5630 8.4796 118.2614 58.7914 32.6814 177.7954 117 E 4.1112 8.0922 118.1147 57.9663 30.4117 177.1152 118 A 3.8673 7.6188 118.5243 53.8211 18.7468 178.1592 119 F 4.8601 8.2355 114.8020 60.6573 39.8948 178.2343 120 R 3.4897 7.8066 113.5856 59.2161 29.9236 178.3265 121 L 3.8267 8.1645 116.9895 58.7436 41.9472 179.2825 122 A 4.0876 7.6932 122.9543 54.8300 18.7358 179.2077 123 G 3.7186 8.5697 104.5912 47.0524 0.0000 175.4300 124 H 4.4389 8.4040 116.3107 56.9269 28.5996 176.0000 125 K 4.5450 7.6169 119.0348 55.8221 33.0010 175.1433 126 L 4.6923 7.9846 120.6392 52.3157 42.9254 175.9506 127 P 4.4163 0.0000 0.0000 64.6181 32.1143 176.1079 128 I 4.6612 7.4101 112.1397 60.0269 38.9071 173.9467 129 Q 4.8819 9.1070 119.2672 55.0976 32.1712 174.8420 130 T 4.9180 7.9445 108.9565 61.0722 71.7849 172.3526 131 K 4.8001 8.7509 118.9881 56.0338 36.5086 174.7551 132 M 5.4389 8.6240 119.5137 54.5813 35.8030 174.8242 133 V 4.7450 8.7246 115.3217 59.6987 36.5795 174.3237 134 K 4.8155 8.8333 120.9684 58.1258 33.3035 176.9174 135 R 4.4335 8.1529 115.4697 55.0430 29.4736 175.8114 136 E 4.2662 9.1656 125.6122 57.6184 27.6839 173.0756 137 V 4.0479 6.6824 115.8941 60.8620 33.2070 175.3080 138 Y 4.6774 8.2717 120.9504 59.1850 40.0556 177.1506 139 D 4.0074 6.6715 116.2611 55.7202 41.8334 177.6922 140 E 4.5865 7.5948 120.0176 55.2912 32.3282 176.2564 141 A 4.1354 8.1152 121.5035 52.9835 19.0299 176.2591 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 6 K 8.31 4.02 0.00 1.58 1.66 0.00 1.68 0.00 0.00 1.87 0.00 0.00 2.86 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.27 1.52 7.81 7 R 7.97 3.08 0.00 1.09 0.66 0.00 3.03 0.00 0.00 3.06 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.49 0.00 8 T 8.04 4.64 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 1.34 0.00 0.00 9 K 7.82 4.40 0.00 1.83 1.93 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.39 1.35 7.81 10 F 7.17 4.36 0.00 2.83 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 11 R 7.52 4.23 0.00 1.78 1.72 0.00 3.51 0.00 0.00 3.18 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.43 0.00 12 K 7.60 4.53 0.00 1.71 1.72 0.00 1.85 0.00 0.00 1.73 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.44 7.81 13 Q 7.40 4.14 0.00 1.81 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.50 0.00 0.00 0.00 0.00 0.00 1.64 1.82 0.00 14 F 7.23 5.32 0.00 2.98 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 15 R 8.00 4.32 0.00 1.85 1.43 0.00 3.13 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 1.51 1.60 0.00 16 G 8.24 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 0.00 0.00 0.00 17 R 7.85 4.67 0.00 2.08 2.07 0.00 3.28 0.00 0.00 3.35 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.72 0.00 18 M 7.91 4.44 0.00 2.10 2.06 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 2.38 2.32 0.00 19 T 7.46 4.63 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 1.26 0.00 0.00 20 G 8.96 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 0.00 0.00 0.00 21 D 8.07 3.99 0.00 2.88 2.93 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 0.00 0.00 0.00 22 A 7.86 4.12 1.47 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 0.00 0.00 23 K 7.89 4.43 0.00 1.75 1.56 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.40 7.81 24 G 8.25 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 0.00 0.00 0.00 25 G 8.46 3.86 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 0.00 0.00 0.00 26 D 8.06 4.70 0.00 2.74 2.66 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 0.00 0.00 0.00 0.00 27 Y 8.53 4.62 0.00 2.76 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 28 V 7.65 3.40 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 0.85 0.00 0.00 1.16 0.00 0.00 29 A 7.70 4.54 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 30 F 8.66 3.94 0.00 2.57 1.53 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 0.00 31 G 7.45 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.84 4.76 0.00 2.34 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 0.00 0.00 0.00 0.00 33 Y 7.86 5.13 0.00 2.90 2.61 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 34 G 8.96 4.84 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 0.00 0.00 0.00 35 L 9.56 5.32 0.00 0.27 1.23 0.75 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 36 I 8.73 4.83 1.78 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.36 0.85 0.00 0.00 37 A 8.21 4.40 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 38 M 8.30 4.83 0.00 1.97 2.01 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.58 0.00 39 E 7.83 4.76 0.00 1.90 1.79 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 2.21 2.31 0.00 40 P 0.00 4.63 0.00 2.08 2.08 0.00 3.66 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 41 A 7.48 4.99 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 42 W 8.81 4.71 0.00 3.17 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 43 I 8.24 4.71 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 1.30 1.50 1.00 0.00 0.00 44 K 9.06 4.18 0.00 1.91 1.91 0.00 1.72 0.00 0.00 2.06 0.00 0.00 3.17 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.79 1.62 7.81 45 S 8.42 4.16 0.00 3.99 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 46 N 8.03 4.07 0.00 3.06 3.14 0.00 0.00 5.97 7.44 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 47 Q 8.27 4.06 0.00 2.18 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.88 0.00 0.00 0.00 0.00 0.00 2.51 2.53 0.00 48 I 9.81 3.98 1.98 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.97 0.98 0.00 0.00 49 E 8.28 4.09 0.00 2.06 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 0.00 2.29 2.32 0.00 50 A 8.18 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 51 C 7.91 3.85 0.00 3.16 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 52 R 8.60 3.76 0.00 1.79 1.87 0.00 3.27 0.00 0.00 3.14 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.83 0.00 53 I 7.34 3.63 1.83 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.46 0.88 0.00 0.00 54 V 7.92 3.50 2.06 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 0.92 0.00 0.00 0.89 0.00 0.00 55 M 7.80 3.37 0.00 1.78 2.07 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.64 0.00 56 S 9.48 3.33 0.00 3.87 3.69 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 57 R 6.10 3.68 0.00 1.94 1.86 0.00 3.19 0.00 0.00 3.08 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 2.00 0.00 58 H 7.61 3.97 0.00 2.81 3.03 0.00 5.93 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 F 8.42 5.05 0.00 3.10 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 60 R 7.81 2.78 0.00 1.90 2.09 0.00 3.23 0.00 0.00 3.24 7.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 61 R 9.77 4.57 0.00 1.80 1.85 0.00 3.21 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 62 G 10.24 3.48 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 0.00 63 G 8.01 4.10 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 0.00 0.00 0.00 64 K 7.38 4.25 0.00 2.14 1.88 0.00 1.62 0.00 0.00 1.88 0.00 0.00 2.88 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.50 1.48 7.81 65 I 7.49 4.40 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.42 0.96 0.00 0.00 66 Y 8.37 4.50 0.00 3.39 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 67 I 8.18 4.21 1.91 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 1.57 0.53 0.97 0.00 0.00 68 R 8.03 4.62 0.00 1.89 1.91 0.00 3.13 0.00 0.00 3.32 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.55 0.00 69 I 7.33 4.65 1.79 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 1.09 0.66 0.75 0.00 0.00 70 F 8.61 3.81 0.00 3.00 2.85 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 71 P 0.00 4.36 0.00 1.82 2.02 0.00 2.62 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.99 0.00 72 D 8.30 5.27 0.00 2.71 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 73 K 8.46 4.47 0.00 1.70 1.58 0.00 1.22 0.00 0.00 0.73 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.91 1.10 7.81 74 P 0.00 4.10 0.00 1.89 1.63 0.00 3.70 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.94 0.00 75 V 7.86 4.69 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 1.27 0.00 0.00 1.01 0.00 0.00 76 T 8.10 4.95 4.46 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 1.37 0.00 0.00 77 K 7.91 4.39 0.00 1.49 1.69 0.00 1.58 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.30 1.37 7.81 78 K 8.14 4.66 0.00 1.84 1.71 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.76 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.25 1.50 7.81 79 P 0.00 4.41 0.00 2.19 2.05 0.00 3.69 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 2.10 2.07 0.00 80 A 8.03 3.82 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.83 4.70 0.00 2.06 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 2.05 2.21 0.00 82 T 9.00 3.33 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 1.20 0.00 0.00 83 R 7.20 4.53 0.00 1.77 1.91 0.00 3.29 0.00 0.00 3.13 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.40 0.00 84 M 8.15 4.35 0.00 2.01 2.01 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 2.57 2.53 0.00 85 G 7.31 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 86 K 7.75 4.37 0.00 1.77 1.73 0.00 1.56 0.00 0.00 1.69 0.00 0.00 2.79 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.26 1.35 7.81 87 G 7.53 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 0.00 0.00 0.00 88 K 7.97 4.10 0.00 1.76 1.64 0.00 1.68 0.00 0.00 1.82 0.00 0.00 3.08 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.42 1.66 7.81 89 G 8.89 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 90 A 7.76 3.32 1.17 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 91 V 8.79 3.75 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 1.09 0.00 0.00 0.98 0.00 0.00 92 E 9.02 4.06 0.00 1.99 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 2.15 2.02 0.00 93 Y 7.19 4.82 0.00 3.12 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 94 W 8.25 5.05 0.00 3.34 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 95 V 8.78 4.62 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 0.55 0.00 0.00 0.68 0.00 0.00 96 S 8.65 4.54 0.00 3.87 3.70 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 97 V 8.41 3.85 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 0.28 0.00 0.00 0.85 0.00 0.00 98 V 7.53 4.36 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 0.70 0.00 0.00 0.96 0.00 0.00 99 K 8.50 4.39 0.00 1.87 1.57 0.00 1.73 0.00 0.00 1.85 0.00 0.00 2.92 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.45 1.49 7.81 100 P 0.00 4.28 0.00 2.14 1.99 0.00 3.64 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.27 0.00 101 G 9.68 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 0.00 102 R 7.56 3.56 0.00 1.94 1.94 0.00 3.11 0.00 0.00 3.07 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 103 V 7.54 3.76 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 0.74 0.00 0.00 0.52 0.00 0.00 104 M 8.92 3.83 0.00 1.34 1.62 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.81 0.00 105 F 7.51 5.19 0.00 2.78 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 0.00 106 E 8.09 6.30 0.00 2.33 2.24 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 2.35 2.01 0.00 107 V 8.39 5.20 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 1.23 0.00 0.00 1.20 0.00 0.00 108 A 8.93 4.77 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 G 9.11 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 0.00 110 V 7.11 3.73 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 -0.97 0.00 0.00 0.78 0.00 0.00 111 T 8.34 4.54 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 1.21 0.00 0.00 112 E 7.78 2.57 0.00 2.16 1.73 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 2.36 2.36 0.00 113 E 8.71 3.49 0.00 2.05 1.90 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 2.37 2.39 0.00 114 Q 7.65 4.14 0.00 2.15 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.51 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 115 A 8.58 4.93 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 0.00 116 K 8.48 3.56 0.00 1.88 1.99 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.48 7.81 117 E 8.09 4.11 0.00 2.28 1.94 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 2.31 2.24 0.00 118 A 7.62 3.87 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 0.00 119 F 8.24 4.86 0.00 3.17 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 0.00 120 R 7.81 3.49 0.00 2.02 1.90 0.00 3.19 0.00 0.00 3.57 8.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.76 0.00 121 L 8.16 3.83 0.00 1.40 1.58 0.79 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 122 A 7.69 4.09 1.03 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 0.00 0.00 123 G 8.57 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 0.00 124 H 8.40 4.44 0.00 3.19 3.34 0.00 5.80 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 0.00 125 K 7.62 4.55 0.00 1.67 1.76 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.32 7.81 126 L 7.98 4.69 0.00 1.84 1.60 1.07 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 127 P 0.00 4.42 0.00 2.06 2.15 0.00 3.66 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.13 0.00 128 I 7.41 4.66 2.06 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 1.30 0.94 0.92 0.00 0.00 129 Q 9.11 4.88 0.00 1.89 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.63 0.00 0.00 0.00 0.00 0.00 2.27 2.40 0.00 130 T 7.94 4.92 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 1.20 0.00 0.00 131 K 8.75 4.80 0.00 1.86 1.91 0.00 1.31 0.00 0.00 1.61 0.00 0.00 2.72 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.40 7.81 132 M 8.62 5.44 0.00 2.17 2.24 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.10 2.70 0.00 133 V 8.72 4.75 2.24 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 0.83 0.00 0.00 1.09 0.00 0.00 134 K 8.83 4.82 0.00 1.84 1.26 0.00 1.70 0.00 0.00 1.81 0.00 0.00 2.92 0.00 0.00 3.38 0.00 0.00 0.00 0.00 1.37 1.43 7.81 135 R 8.15 4.43 0.00 1.82 1.35 0.00 3.34 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 1.49 1.51 0.00 136 E 9.17 4.27 0.00 2.17 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 2.24 2.38 0.00 137 V 6.68 4.05 1.82 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 0.84 0.00 0.00 0.94 0.00 0.00 138 Y 8.27 4.68 0.00 3.03 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 0.00 139 D 6.67 4.01 0.00 2.67 2.57 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 0.00 0.00 0.00 0.00 140 E 7.59 4.59 0.00 1.94 1.88 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 2.23 2.28 0.00 141 A 8.12 4.14 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