NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5103 8.1633 120.6170 54.9850 32.8153 173.9383 2 K 4.2710 8.0427 122.2954 55.5211 34.0231 170.5443 3 V 4.6681 9.2386 123.2495 61.6960 36.0611 173.0270 4 I 4.6471 8.5951 128.8378 60.4241 38.4358 176.3325 5 L 4.6356 8.2671 128.9623 54.5401 43.0565 176.7794 6 L 3.9843 8.5786 123.0803 55.1485 46.7599 176.0777 7 E 3.9673 8.9228 131.0023 56.3326 28.6610 174.8154 8 P 4.2633 0.0000 0.0000 63.0367 31.5937 175.0977 9 L 4.8852 7.8168 118.6616 52.6510 45.1211 175.4474 10 E 4.1535 8.5449 119.6509 57.0398 30.1460 175.6442 11 N 4.6665 8.8302 122.3758 52.9615 37.2625 173.8652 12 L 5.4049 6.7106 123.7726 55.6125 42.9390 172.0246 13 G 4.0543 7.9955 117.4904 45.2103 0.0000 168.1447 14 D 4.1557 8.7367 127.3485 54.3217 39.2959 173.5148 15 V 3.5833 7.6364 116.7098 60.5092 32.7284 176.3867 16 G 4.0726 8.6124 106.3222 46.4260 0.0000 172.7818 17 Q 4.3264 7.9212 121.0391 55.1496 30.5884 174.6947 18 V 4.7606 8.3329 126.5676 61.9599 32.9039 175.4468 19 V 4.6197 8.7330 127.5878 60.1278 34.6852 173.8624 20 D 5.1238 8.8306 124.9394 52.8710 40.8323 175.9433 21 V 4.7152 8.2997 114.6371 59.7959 35.8120 174.6581 22 K 4.3928 8.6538 119.5917 55.5008 32.7870 175.4590 23 P 4.1576 0.0000 0.0000 65.9049 31.2112 178.7168 24 G 4.0943 8.0722 103.4447 48.3144 0.0000 174.5815 25 Y 4.3506 8.1109 121.2695 60.4785 39.0671 177.8134 26 A 3.8778 8.0566 121.5970 55.1813 18.3134 179.6059 27 R 3.9357 8.7896 117.2454 58.6925 30.1835 176.9986 28 N 4.9748 8.1041 112.9316 53.0331 39.0183 173.8807 29 Y 4.6444 7.2576 118.6788 57.7982 42.5526 176.8267 30 L 3.6929 7.5538 118.7254 56.4114 41.5031 179.3059 31 L 3.9975 6.8559 120.5112 58.1184 42.1874 177.4794 32 P 4.2171 0.0000 0.0000 65.8086 31.4498 178.2009 33 R 4.1898 7.9363 113.4628 54.9847 31.2428 176.8775 34 G 3.9115 7.6412 108.1186 46.4981 0.0000 173.3702 35 L 4.8121 8.6727 115.4297 53.3322 44.7240 176.4431 36 A 4.4930 7.3098 120.7809 52.6171 21.3754 175.9693 37 V 4.4811 8.0529 117.7136 61.1206 35.8704 174.1301 38 L 4.3098 8.4636 123.8166 53.9910 41.7297 178.8039 39 A 4.5173 7.8622 130.1707 51.9020 15.6117 177.6319 40 T 4.1221 7.6126 112.7788 60.9632 70.6572 175.8374 41 E 3.8762 8.9807 122.9156 60.0148 29.3829 179.3253 42 S 4.0727 8.1673 112.1582 62.1010 62.3967 176.0907 43 N 4.4343 8.2832 118.6793 55.7617 38.4393 177.4666 44 L 3.9620 8.7500 123.4960 57.9567 42.2446 179.1503 45 K 4.0994 8.3881 118.8819 59.8158 32.5571 178.9314 46 A 4.0759 7.6696 120.4189 54.8082 18.3139 178.6275 47 L 3.9891 7.7801 119.5016 57.3296 42.1261 178.1333 48 E 3.7674 8.1300 117.3385 59.7324 29.5176 179.3032 49 A 4.0912 8.1523 120.2472 54.3842 18.1146 178.4229 50 R 4.4148 8.5875 115.5284 57.0641 30.8481 177.3399 51 I 4.0545 8.2542 119.5366 64.2222 37.2893 177.9301 52 R 3.8734 7.7994 118.0449 59.4733 30.3941 178.6943 53 A 4.3633 7.3814 113.8912 53.0511 17.8612 177.3898 54 Q 4.4222 8.2717 117.9554 56.6900 31.5513 177.6811 55 A 3.8881 8.0552 120.5322 54.9307 18.7214 178.9863 56 K 4.1297 8.1114 114.5022 57.9837 32.3749 177.3467 57 R 4.2510 7.7838 116.7633 57.3101 30.6277 175.8287 58 L 4.5928 7.3249 116.9792 55.3699 43.7294 176.3265 59 A 4.6871 8.0528 121.0428 52.7967 18.7000 177.7768 60 E 4.5551 8.3920 120.2825 57.9863 32.0731 177.1709 61 R 4.3863 7.8872 115.2606 56.7565 30.7679 176.1221 62 K 4.6466 7.7766 118.5309 55.8266 33.0061 176.3848 63 A 4.5023 8.0811 118.2426 52.9696 22.7376 177.5888 64 E 4.1969 8.1135 115.2862 58.0331 30.2623 177.8160 65 A 4.0477 7.9258 119.7332 53.9665 18.5583 177.4345 66 E 4.5524 7.9639 114.0129 56.0128 30.0015 176.5070 67 R 4.3169 7.8263 122.0555 57.4120 31.0969 178.1797 68 L 3.9561 7.7000 119.0797 57.0936 41.7638 177.2719 69 K 3.9669 6.5848 119.8044 59.6314 32.8246 177.2473 70 E 4.4313 7.7312 121.5751 54.8017 28.5991 175.9716 71 I 4.5754 6.7480 121.6464 61.8984 46.7181 175.1585 72 L 4.8439 7.0846 124.4794 56.8706 41.7379 178.0257 73 E 5.2163 8.5069 115.7132 58.4982 31.5911 177.8303 74 N 4.4265 8.1549 117.3759 55.0506 37.8232 176.7513 75 L 3.9345 8.1638 115.1358 55.9250 41.6082 176.8387 76 T 2.9813 7.6977 110.6002 62.4778 68.4714 170.9619 77 L 4.4271 8.1105 127.7671 54.8662 42.6582 176.9762 78 T 4.4357 8.2116 123.0315 61.5839 68.2228 171.3808 79 I 4.2401 7.6289 124.2159 59.1495 38.6586 174.5522 80 P 4.7432 0.0000 0.0000 61.4155 29.8725 175.3887 81 V 3.9729 7.3150 123.2415 62.2072 33.9285 177.5421 82 R 4.5726 8.5789 119.6613 54.6700 31.6067 174.6751 83 A 4.3172 7.6807 126.0360 50.6431 23.3664 174.7473 84 G 4.5481 7.4893 99.1116 46.9580 0.0000 173.3760 85 E 3.7930 9.5111 132.6229 55.6275 28.2586 175.6428 86 T 4.4749 9.2013 108.1096 58.5203 68.0051 172.3758 87 K 4.3764 7.9985 128.2034 55.3208 33.6103 173.7084 88 I 3.4204 7.5553 127.1847 61.8044 38.4038 176.4844 89 Y 4.7692 8.9170 121.7168 54.9451 36.1812 176.4138 90 G 4.5841 9.1541 118.3510 45.1657 0.0000 172.4202 91 S 3.5168 7.5830 118.8289 57.8487 63.9814 175.0732 92 V 4.8438 7.8467 129.7087 62.9869 32.9973 169.2419 93 T 4.4212 7.5471 116.0670 59.7190 71.0664 173.3943 94 A 3.8495 8.6124 122.0782 55.6670 17.7324 179.8463 95 K 3.4773 8.3163 116.4037 58.7021 32.3001 177.5344 96 D 4.8089 7.6452 116.2349 56.7034 42.7821 177.7030 97 I 3.7163 9.2063 121.2173 63.3786 36.6341 177.8081 98 A 3.9781 7.9840 125.2894 55.8458 18.9979 178.5706 99 E 3.6372 9.5623 116.3401 58.8266 29.2033 178.4986 100 A 3.9773 7.2111 119.7084 55.8320 19.0976 179.8723 101 L 3.6859 8.4161 117.3948 58.1925 41.6060 179.9879 102 S 4.8328 8.4417 116.5267 61.2995 62.6030 176.9374 103 R 3.9144 8.6464 119.9055 59.5845 29.8386 178.4538 104 Q 3.9409 6.7337 118.7158 57.8043 29.3003 178.1775 105 H 5.2652 8.1395 118.8819 56.2190 30.3124 174.1483 106 G 3.5875 8.6646 105.7876 47.0243 0.0000 174.1605 107 V 4.2408 7.0847 118.0078 61.2954 33.1807 174.7199 108 T 4.4745 8.3467 124.5146 63.6069 69.2453 174.5633 109 I 4.5057 7.7997 123.9947 60.5816 40.6902 172.6850 110 D 5.0076 8.2060 120.0897 52.5500 44.7048 173.7121 111 P 4.4782 0.0000 0.0000 65.3374 31.5992 177.2349 112 K 4.5505 7.6733 112.8359 55.6723 35.3770 176.7477 113 R 4.3801 7.8187 119.4505 55.0338 27.9660 174.9494 114 L 4.5559 6.5139 117.2154 54.2466 49.5387 176.7986 115 A 4.3632 7.6705 120.7556 51.5469 20.4092 176.1753 116 L 3.9391 7.9002 121.3888 57.0091 42.7759 176.0231 117 E 4.6852 7.9463 117.1214 56.2353 33.9154 175.6430 118 K 3.8172 8.7533 121.6385 56.7082 32.4236 174.8522 119 P 5.2316 0.0000 0.0000 62.4071 30.9753 178.2354 120 I 2.9019 8.2951 121.9906 62.2580 40.8927 175.9088 121 K 3.9476 7.5194 117.6587 56.1642 29.3198 175.2021 122 E 4.8714 7.3442 117.1801 55.4233 32.6106 175.2920 123 L 4.0142 9.0170 129.5163 53.9993 42.9850 176.8242 124 G 3.6176 7.0441 112.1036 45.9454 0.0000 170.2930 125 E 4.3111 8.0048 119.7950 54.6178 31.7556 174.8849 126 Y 5.1727 8.0760 120.3791 56.3071 41.7420 174.9009 127 V 4.6706 8.1131 120.0094 61.7645 34.8589 174.0189 128 L 4.7759 8.4445 124.4234 53.7873 46.5116 175.5908 129 T 4.6478 8.4236 118.9847 62.2853 71.1866 173.6452 130 Y 4.8425 8.8217 126.0269 57.8752 40.0267 174.5163 131 K 4.7838 9.0378 116.9772 56.6791 34.6198 173.5900 132 P 5.1725 0.0000 0.0000 63.5449 33.1785 174.8426 133 H 3.9829 8.5415 101.3600 56.8597 26.4940 171.9668 134 P 4.5033 0.0000 0.0000 62.7420 32.5367 177.1949 135 E 4.0748 8.0038 112.6975 56.1640 30.0303 173.3181 136 V 4.7002 7.8204 110.6509 58.8364 35.4581 173.9622 137 P 5.2546 0.0000 0.0000 62.5615 32.6999 174.7282 138 I 4.5697 7.7064 118.1877 60.7759 41.6246 173.6693 139 Q 5.0913 8.4350 128.3659 55.5716 29.0322 174.6064 140 L 4.3928 7.8894 122.7557 55.4245 44.7200 175.4482 141 K 4.5178 8.2224 122.6728 54.5940 33.1832 176.7642 142 V 3.8556 8.4034 127.3362 61.4720 29.7869 175.3148 143 S 4.4404 7.2841 120.2690 58.8766 63.9293 174.5128 144 V 4.5657 8.0091 118.1145 62.1319 34.6673 175.3824 145 V 4.1087 8.3767 117.4357 61.4690 31.2987 175.9379 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 8.16 4.51 0.00 2.22 2.08 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.55 0.00 2 K 8.04 4.27 0.00 1.81 1.73 0.00 1.73 0.00 0.00 1.80 0.00 0.00 2.84 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.54 1.45 7.81 3 V 9.24 4.67 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 0.99 0.00 0.00 1.03 0.00 0.00 4 I 8.60 4.65 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 1.23 0.58 0.91 0.00 0.00 5 L 8.27 4.64 0.00 1.55 1.66 0.99 0.79 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 6 L 8.58 3.98 0.00 1.64 1.14 0.87 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 7 E 8.92 3.97 0.00 1.93 1.96 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 2.32 2.41 0.00 8 P 0.00 4.26 0.00 2.18 2.19 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.04 0.00 9 L 7.82 4.89 0.00 1.92 1.69 1.10 0.92 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 10 E 8.54 4.15 0.00 1.99 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 0.00 2.37 2.24 0.00 11 N 8.83 4.67 0.00 2.85 2.84 0.00 0.00 6.99 7.78 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 12 L 6.71 5.40 0.00 1.79 1.88 1.08 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.00 0.00 13 G 8.00 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 14 D 8.74 4.16 0.00 3.04 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 15 V 7.64 3.58 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 0.99 0.00 0.00 0.93 0.00 0.00 16 G 8.61 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 17 Q 7.92 4.33 0.00 2.36 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.84 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 18 V 8.33 4.76 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 0.87 0.00 0.00 0.94 0.00 0.00 19 V 8.73 4.62 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 0.77 0.00 0.00 0.97 0.00 0.00 20 D 8.83 5.12 0.00 2.78 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 21 V 8.30 4.72 2.30 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 0.86 0.00 0.00 1.10 0.00 0.00 22 K 8.65 4.39 0.00 1.86 1.75 0.00 1.68 0.00 0.00 1.81 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.45 7.81 23 P 0.00 4.16 0.00 2.18 2.08 0.00 3.67 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 2.14 2.22 0.00 24 G 8.07 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 25 Y 8.11 4.35 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 26 A 8.06 3.88 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 27 R 8.79 3.94 0.00 1.87 2.00 0.00 3.23 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 28 N 8.10 4.97 0.00 2.98 2.84 0.00 0.00 6.73 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 29 Y 7.26 4.64 0.00 2.89 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 30 L 7.55 3.69 0.00 1.74 1.37 0.87 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 31 L 6.86 4.00 0.00 1.83 1.71 0.96 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.22 0.00 2.05 2.08 0.00 3.69 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 1.96 2.25 0.00 33 R 7.94 4.19 0.00 1.40 1.70 0.00 2.31 0.00 0.00 2.97 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.40 0.00 34 G 7.64 3.91 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 0.00 0.00 0.00 35 L 8.67 4.81 0.00 1.28 1.51 0.60 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 36 A 7.31 4.49 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 37 V 8.05 4.48 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 0.92 0.00 0.00 0.91 0.00 0.00 38 L 8.46 4.31 0.00 1.56 1.61 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 39 A 7.86 4.52 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 40 T 7.61 4.12 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 1.23 0.00 0.00 41 E 8.98 3.88 0.00 2.03 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 2.41 2.39 0.00 42 S 8.17 4.07 0.00 3.88 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 43 N 8.28 4.43 0.00 2.79 2.84 0.00 0.00 6.78 6.88 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 44 L 8.75 3.96 0.00 1.82 1.74 0.92 0.54 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 45 K 8.39 4.10 0.00 2.01 2.04 0.00 1.37 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.77 1.45 7.81 46 A 7.67 4.08 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 47 L 7.78 3.99 0.00 1.88 1.90 0.92 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 48 E 8.13 3.77 0.00 2.14 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 0.00 2.32 2.37 0.00 49 A 8.15 4.09 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 50 R 8.59 4.41 0.00 1.68 2.02 0.00 3.25 0.00 0.00 3.22 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 51 I 8.25 4.05 1.97 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 1.71 0.98 0.91 0.00 0.00 52 R 7.80 3.87 0.00 1.87 1.98 0.00 3.13 0.00 0.00 3.65 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.63 0.00 53 A 7.38 4.36 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 54 Q 8.27 4.42 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.79 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 55 A 8.06 3.89 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 56 K 8.11 4.13 0.00 1.72 1.97 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.37 7.81 57 R 7.78 4.25 0.00 1.88 1.96 0.00 3.38 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 1.57 1.60 0.00 58 L 7.32 4.59 0.00 1.89 1.74 0.89 0.88 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 59 A 8.05 4.69 1.32 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 0.00 0.00 60 E 8.39 4.56 0.00 1.95 1.85 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 2.18 2.25 0.00 61 R 7.89 4.39 0.00 1.85 1.98 0.00 3.37 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.55 0.00 62 K 7.78 4.65 0.00 1.77 1.85 0.00 1.91 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.31 1.55 7.81 63 A 8.08 4.50 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 64 E 8.11 4.20 0.00 2.03 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 0.00 2.24 2.26 0.00 65 A 7.93 4.05 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 66 E 7.96 4.55 0.00 1.89 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 2.10 2.13 0.00 67 R 7.83 4.32 0.00 1.86 2.03 0.00 3.37 0.00 0.00 3.09 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 68 L 7.70 3.96 0.00 1.67 1.75 0.94 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 69 K 6.58 3.97 0.00 1.73 1.78 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.68 1.40 7.81 70 E 7.73 4.43 0.00 2.00 1.93 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 2.31 2.28 0.00 71 I 6.75 4.58 1.89 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 1.48 0.89 0.94 0.00 0.00 72 L 7.08 4.84 0.00 1.79 1.82 1.18 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 73 E 8.51 5.22 0.00 2.47 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 0.00 2.34 2.18 0.00 74 N 8.15 4.43 0.00 2.94 3.12 0.00 0.00 6.15 6.67 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 75 L 8.16 3.93 0.00 1.80 1.81 1.03 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 76 T 7.70 2.98 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 1.25 0.00 0.00 77 L 8.11 4.43 0.00 1.63 1.54 0.99 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.21 4.44 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 1.21 0.00 0.00 79 I 7.63 4.24 1.85 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 1.45 1.17 0.98 0.00 0.00 80 P 0.00 4.74 0.00 2.17 2.08 0.00 3.75 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 1.94 1.94 0.00 81 V 7.31 3.97 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 0.79 0.00 0.00 0.96 0.00 0.00 82 R 8.58 4.57 0.00 1.84 2.07 0.00 3.11 0.00 0.00 3.40 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00 83 A 7.68 4.32 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 84 G 7.49 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 85 E 9.51 3.79 0.00 2.10 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 2.15 2.22 0.00 86 T 9.20 4.47 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 87 K 8.00 4.38 0.00 1.88 1.92 0.00 1.90 0.00 0.00 1.76 0.00 0.00 2.88 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.25 1.31 7.81 88 I 7.56 3.42 1.85 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 1.30 0.59 0.91 0.00 0.00 89 Y 8.92 4.77 0.00 3.27 2.79 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 0.00 0.00 0.00 90 G 9.15 4.58 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 91 S 7.58 3.52 0.00 4.11 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 92 V 7.85 4.84 2.12 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 0.96 0.00 0.00 0.95 0.00 0.00 93 T 7.55 4.42 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 1.21 0.00 0.00 94 A 8.61 3.85 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 95 K 8.32 3.48 0.00 1.72 1.89 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.48 7.81 96 D 7.65 4.81 0.00 2.75 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 97 I 9.21 3.72 1.92 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 1.46 0.75 0.88 0.00 0.00 98 A 7.98 3.98 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 99 E 9.56 3.64 0.00 2.05 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 2.31 2.34 0.00 100 A 7.21 3.98 1.40 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 0.00 0.00 101 L 8.42 3.69 0.00 1.89 1.70 0.88 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 102 S 8.44 4.83 0.00 3.84 3.91 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 0.00 103 R 8.65 3.91 0.00 1.84 2.00 0.00 3.19 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 1.67 1.64 0.00 104 Q 6.73 3.94 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 7.71 0.00 0.00 0.00 0.00 0.00 2.10 2.30 0.00 105 H 8.14 5.27 0.00 3.27 3.39 0.00 5.78 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 0.00 106 G 8.66 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 0.00 107 V 7.08 4.24 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 1.04 0.00 0.00 0.93 0.00 0.00 108 T 8.35 4.47 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 1.25 0.00 0.00 109 I 7.80 4.51 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 1.34 0.34 0.76 0.00 0.00 110 D 8.21 5.01 0.00 2.69 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 0.00 0.00 0.00 0.00 111 P 0.00 4.48 0.00 2.17 2.17 0.00 3.72 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 112 K 7.67 4.55 0.00 1.68 1.80 0.00 1.63 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.49 7.81 113 R 7.82 4.38 0.00 2.26 1.98 0.00 3.24 0.00 0.00 3.29 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 114 L 6.51 4.56 0.00 1.46 1.28 0.69 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.67 4.36 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 0.00 116 L 7.90 3.94 0.00 1.56 1.62 0.90 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 117 E 7.95 4.69 0.00 1.89 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 2.04 2.10 0.00 118 K 8.75 3.82 0.00 1.67 1.71 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.43 7.81 119 P 0.00 5.23 0.00 2.22 2.06 0.00 3.43 0.00 0.00 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.90 0.00 120 I 8.30 2.90 2.01 0.00 0.00 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 1.59 1.02 1.01 0.00 0.00 121 K 7.52 3.95 0.00 2.13 2.02 0.00 1.81 0.00 0.00 1.66 0.00 0.00 3.12 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.51 7.81 122 E 7.34 4.87 0.00 2.02 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 2.09 2.11 0.00 123 L 9.02 4.01 0.00 1.65 1.56 0.83 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 124 G 7.04 3.62 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 0.00 0.00 0.00 125 E 8.00 4.31 0.00 1.78 1.74 0.00 0.00 0.00 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 2.13 0.00 126 Y 8.08 5.17 0.00 2.94 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 0.00 127 V 8.11 4.67 2.12 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 0.84 0.00 0.00 0.96 0.00 0.00 128 L 8.44 4.78 0.00 1.57 1.46 0.91 0.65 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 0.00 129 T 8.42 4.65 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 1.41 0.00 0.00 130 Y 8.82 4.84 0.00 3.19 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 K 9.04 4.78 0.00 1.81 1.87 0.00 1.22 0.00 0.00 0.68 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.33 7.81 132 P 0.00 5.17 0.00 2.22 2.07 0.00 3.97 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 2.12 1.97 0.00 133 H 8.54 3.98 0.00 3.36 3.50 0.00 5.51 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 4.50 0.00 2.18 2.19 0.00 3.97 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 1.98 1.91 0.00 135 E 8.00 4.07 0.00 2.48 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 0.00 2.16 2.29 0.00 136 V 7.82 4.70 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 0.71 0.00 0.00 1.07 0.00 0.00 137 P 0.00 5.25 0.00 2.14 2.19 0.00 4.13 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 2.17 1.82 0.00 138 I 7.71 4.57 1.90 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 1.24 1.30 0.91 0.00 0.00 139 Q 8.43 5.09 0.00 2.05 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 140 L 7.89 4.39 0.00 1.57 1.71 1.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 141 K 8.22 4.52 0.00 1.90 1.67 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.29 7.81 142 V 8.40 3.86 2.18 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 0.67 0.00 0.00 0.85 0.00 0.00 143 S 7.28 4.44 0.00 4.04 3.81 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 0.00 144 V 8.01 4.57 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 0.72 0.00 0.00 0.84 0.00 0.00 145 V 8.38 4.11 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 0.74 0.00 0.00 1.23 0.00 0.00