NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4471 8.3044 118.1948 55.4152 32.5581 174.4589 1 V 4.2056 7.7879 118.4657 61.2188 34.3419 172.6140 2 L 4.1884 8.2883 127.5511 54.3462 43.2363 176.8688 3 S 4.6124 8.3437 117.1772 57.4351 65.7079 175.1168 4 E 4.3591 8.7507 121.8897 59.2802 29.3163 178.8555 5 G 3.5974 8.0801 105.6080 47.5920 0.0000 175.4858 6 E 3.9191 7.8180 119.6741 58.8365 29.4211 179.2231 7 W 4.4099 7.7288 118.7205 59.9297 29.1710 178.2768 8 Q 4.1425 8.4754 118.1409 59.2458 28.3571 179.2217 9 L 4.0574 7.9053 119.6094 57.8265 41.5909 179.8029 10 V 3.7204 8.1052 118.1153 66.3006 31.6059 178.2334 11 L 4.2217 8.9480 118.9668 57.6648 41.4049 179.1977 12 H 4.2326 8.5372 118.7374 59.2719 29.8756 177.5196 13 V 3.6333 7.8843 119.7995 65.7663 31.4172 177.4689 14 W 3.9989 8.7645 128.3234 60.7214 30.1411 177.7226 15 A 4.0077 7.9196 119.7088 54.8813 18.0566 179.5951 16 K 3.9128 7.4147 115.6826 59.5134 32.1537 179.4270 17 V 2.7792 7.2477 118.4977 66.0589 30.9537 177.8017 18 E 3.8936 7.4105 115.8178 58.4324 29.2630 178.7088 19 A 4.2248 7.4382 120.4334 53.9995 19.6024 177.6243 20 D 4.6278 7.8299 116.3863 52.1138 43.0915 175.5326 21 V 3.4801 8.1045 123.2017 65.3794 31.9235 176.4315 22 A 4.0410 8.1134 120.0838 55.4357 18.1680 179.6658 23 G 3.6151 8.3367 105.0473 47.7509 0.0000 175.5641 24 H 4.1811 8.2128 118.5903 58.2288 28.6438 177.8131 25 G 3.7765 8.5785 107.9610 48.1374 0.0000 175.4411 26 Q 3.8989 8.2820 121.2905 58.6373 28.7457 178.8044 27 D 4.2948 7.9525 119.6356 57.5697 40.7664 178.9163 28 I 3.6343 7.7729 120.0071 64.4933 37.0928 178.4231 29 L 3.4486 7.7946 119.5245 57.7925 41.4071 179.8748 30 I 3.6610 7.8218 119.9653 64.0092 36.8681 178.4968 31 R 3.7405 7.9158 119.7692 59.3683 29.9283 177.7926 32 L 3.8832 7.9226 120.3607 58.7667 41.8211 178.9749 33 F 4.6240 7.8545 117.3076 60.6545 38.6330 178.0356 34 K 4.0341 7.9149 117.3135 59.5428 32.0674 179.3666 35 S 4.2136 8.1258 114.5577 60.4083 64.2402 174.5233 36 H 4.7537 8.3074 118.0177 51.9857 28.9005 171.8385 37 P 4.5465 0.0000 0.0000 64.9452 31.7119 177.8327 38 E 4.1034 8.2224 115.8393 59.3796 29.4599 179.1669 39 T 3.8558 8.2388 111.4690 64.5031 68.7282 176.2316 40 L 3.7216 7.9216 123.1288 58.0237 41.7184 178.8296 41 E 4.0083 7.7432 116.4521 59.1728 29.4110 179.1385 42 K 4.3456 8.1467 117.7515 57.7124 32.7546 177.7803 43 F 4.3907 8.2838 119.3635 55.4344 38.1078 175.5840 44 D 3.9965 8.4419 124.0203 56.9916 40.9093 178.2775 45 R 4.3165 7.5795 112.3122 56.5242 30.3158 176.6008 46 F 5.0988 8.8936 117.3263 57.3980 41.3779 177.1018 47 K 3.8840 8.4573 119.5086 59.8448 31.8227 176.9436 48 H 4.5003 8.1670 110.9326 56.0279 28.9974 174.9810 49 L 4.2301 7.5295 122.0210 54.5474 41.7607 176.9190 50 K 4.1945 9.4441 124.8381 58.2113 32.7359 177.6486 51 T 4.7289 7.3152 107.2718 58.8986 73.1465 174.1935 52 E 3.8515 8.6855 121.2768 59.3933 29.3367 178.7588 53 A 3.8864 7.8584 119.5898 55.1167 18.7774 179.0387 54 E 4.0278 7.8606 116.2868 59.7264 29.5615 179.2084 55 M 3.9068 8.1576 118.9496 58.6655 31.8867 179.0708 56 K 3.9112 8.4837 117.1979 58.8566 32.2524 178.3348 57 A 4.5144 7.5654 118.8648 51.4172 19.6114 177.1356 58 S 4.1030 7.3763 113.4561 58.1804 62.8810 174.5316 59 E 4.0391 8.7943 128.4581 58.9085 29.5130 178.0931 60 D 4.5250 8.0694 118.8237 56.9272 40.9359 178.2190 61 L 3.3306 7.7602 121.1073 57.6228 42.0491 178.7392 62 K 3.8257 7.6588 119.7019 59.5934 32.1728 178.8783 63 K 4.1318 8.1622 118.7700 59.2598 32.0265 179.4747 64 G 3.9651 8.2338 106.2713 47.9955 0.0000 175.9877 65 G 3.6241 8.3297 108.6747 47.3334 0.0000 175.9620 66 V 3.6404 7.8181 120.6347 65.9871 31.5459 178.2149 67 T 3.8880 7.9095 115.3333 66.6407 68.2707 176.6013 68 V 3.6738 7.7528 119.7333 66.1140 31.5998 178.0576 69 L 4.1964 8.1154 118.5012 58.2946 41.6689 179.5804 70 T 3.9876 8.5173 115.8440 66.5898 68.4241 176.4919 71 A 3.9929 8.2027 122.5753 55.0172 18.3762 179.4467 72 L 3.6555 8.2834 119.2741 58.1533 42.1931 179.0684 73 G 3.4616 8.6362 105.7785 48.0400 0.0000 175.3762 74 A 4.0384 7.6320 121.4094 54.6797 18.4704 179.5870 75 I 3.7937 7.3791 118.0785 64.4589 37.1204 178.6364 76 L 3.9249 7.8004 120.0483 57.6274 41.2306 179.6015 77 K 3.8504 7.6271 116.9756 58.8080 32.1941 179.0027 78 K 3.9370 7.7246 118.8831 56.5673 31.9492 177.1408 79 K 2.0000 8.3651 117.5286 56.7788 29.7715 176.1069 80 G 4.0290 8.1749 107.0472 45.9406 0.0000 174.9697 81 H 4.7693 7.6176 118.6998 54.2774 27.1916 174.6382 82 H 5.2179 7.1611 111.3670 54.1433 29.2250 176.2933 83 E 3.9364 8.4073 120.1811 60.4966 28.9310 178.7990 84 A 4.0448 7.9950 118.8422 55.6838 17.8327 179.1738 85 E 4.0976 8.1666 116.2518 59.4295 29.5976 179.4418 86 L 4.2602 7.8617 119.3100 57.7056 41.6994 178.8933 87 K 3.8834 7.9241 118.8022 59.3617 32.0357 177.2651 88 P 4.2879 0.0000 0.0000 65.9846 31.3484 178.2264 89 L 4.0278 7.5364 116.6750 57.9454 41.9890 178.8542 90 A 4.2612 8.6694 121.2174 55.0028 18.3156 179.4617 91 Q 3.8390 8.2868 118.4245 59.4326 29.2507 178.6789 92 S 4.0029 8.1469 115.3179 61.7600 63.0487 176.1316 93 H 4.1272 8.3466 119.1997 58.2157 28.2004 177.4979 94 A 2.6449 7.9565 122.0838 53.7473 18.5558 178.0584 95 T 3.9002 7.3878 110.0216 62.7264 68.1915 175.1340 96 K 4.0745 7.1151 121.2861 58.6379 32.9665 177.1618 97 H 4.2040 8.4183 117.1467 56.7204 29.3993 175.7465 98 K 3.2184 7.4348 116.9909 56.9210 28.3844 174.8819 99 I 4.2774 8.2450 119.1011 58.6020 38.0868 174.7821 100 P 4.6724 0.0000 0.0000 62.2592 32.1592 177.2997 101 I 3.4977 8.3194 121.9565 64.7993 36.9600 178.3541 102 K 3.5530 7.9633 119.5490 59.9928 31.8192 178.1566 103 Y 4.2671 7.9458 116.6366 60.7179 37.7268 178.2090 104 L 4.1758 8.0683 120.4945 57.6510 41.6499 179.2570 105 E 3.9909 7.9735 118.1677 59.3038 29.4673 179.0252 106 F 4.4740 7.6722 117.7869 60.9439 38.9754 177.6585 107 I 3.8164 8.0161 118.0128 64.1959 37.7484 178.0264 108 S 4.2241 8.2988 116.2867 61.4159 62.5773 176.2021 109 E 4.0123 8.4012 121.8522 59.4231 29.3917 178.8643 110 A 4.0565 8.0432 120.7797 54.9837 18.3677 179.6555 111 I 3.6895 8.2005 118.8245 64.7587 37.2561 178.7250 112 I 3.9206 8.0301 120.6022 64.4908 36.8837 177.9019 113 H 4.0905 8.5223 119.2311 59.4093 29.7091 177.5039 114 V 3.5634 8.0289 120.0108 66.0030 31.3548 177.9514 115 L 3.7719 7.8922 118.8203 57.7536 41.0292 178.8857 116 H 4.3461 7.7787 117.2435 59.5068 29.9031 177.2504 117 S 4.1643 7.8830 115.5701 61.7075 62.7868 176.5297 118 R 4.0408 8.0376 119.4926 57.5693 31.5191 176.6704 119 H 5.0102 8.3236 115.2311 53.2735 29.0646 172.3534 120 P 4.2891 0.0000 0.0000 65.9403 31.5446 179.5168 121 G 3.6908 8.0982 105.9654 47.1839 0.0000 173.6261 122 N 5.0455 8.1154 115.2189 52.9962 39.7955 175.1029 123 F 5.0315 7.7793 119.2565 56.1680 39.6802 173.6559 124 G 3.9376 7.7306 110.3485 43.5698 0.0000 171.4942 125 A 3.8924 8.5050 120.7949 55.6064 18.0215 179.3082 126 D 4.2219 8.0602 115.7330 57.6747 41.0306 179.0861 127 A 3.9206 7.8377 120.4182 55.1408 18.3554 179.3255 128 Q 3.0631 8.0009 118.6201 58.6926 28.9927 178.4391 129 G 3.5221 8.2744 107.0687 47.7948 0.0000 175.5143 130 A 3.8719 8.0909 123.5000 54.9622 18.3551 179.4632 131 M 3.9812 8.1331 116.8051 58.5398 32.2550 177.8675 132 N 4.2703 8.2794 117.3827 56.6794 39.1072 176.6317 133 K 3.7289 8.0613 120.6495 59.5608 32.2540 178.5702 134 A 3.9117 8.0260 121.1132 55.0088 18.2348 179.6378 135 L 4.1437 8.3848 118.0410 57.8632 41.7766 179.4045 136 E 4.0385 8.9945 119.5566 59.2373 29.3847 179.1405 137 L 3.9559 8.4052 120.8686 58.0038 42.1195 178.3496 138 F 4.2022 8.3373 120.5938 61.7765 39.2150 177.3271 139 R 3.3807 8.4258 117.4624 58.8961 29.9056 178.8324 140 K 3.7437 7.9736 119.2526 59.7646 32.1687 178.4772 141 D 4.3002 8.0551 118.8263 57.4511 40.6685 178.8109 142 I 3.4805 7.5170 120.1116 64.2253 36.8587 178.3415 143 A 3.6479 8.1237 121.7484 54.8966 17.9963 179.5812 144 A 3.9436 7.8643 119.3803 55.1970 18.2219 180.0885 145 K 3.9702 7.8931 116.0561 59.6723 32.4305 178.5847 146 Y 4.5587 8.3511 117.4888 61.3507 37.6276 178.9025 147 K 3.9481 7.9856 119.7811 59.8377 32.0957 178.6893 148 E 4.0198 7.8053 117.2398 58.9783 29.4554 178.5711 149 L 4.3743 7.8449 117.1283 54.9107 41.9813 177.4863 150 G 4.1183 7.8072 107.8578 45.4887 0.0000 172.4575 151 Y 4.6769 7.8426 119.9850 56.1849 41.5731 176.1320 152 Q 2.7253 9.2706 123.8856 55.1929 29.9911 173.9885 153 G 3.4206 8.9837 106.7825 44.6484 0.0000 173.0624 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 0 M 8.30 4.45 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 1 V 7.79 4.21 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 0.81 0.00 0.00 0.95 0.00 0.00 2 L 8.29 4.19 0.00 0.90 0.60 0.58 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 3 S 8.34 4.61 0.00 4.07 3.97 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 4 E 8.75 4.36 0.00 2.21 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 0.00 2.44 2.52 0.00 5 G 8.08 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 6 E 7.82 3.92 0.00 1.94 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.24 0.00 7 W 7.73 4.41 0.00 3.56 3.19 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 8 Q 8.48 4.14 0.00 2.37 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.78 0.00 0.00 0.00 0.00 0.00 2.47 2.69 0.00 9 L 7.91 4.06 0.00 1.91 1.76 0.89 0.88 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 10 V 8.11 3.72 2.41 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 1.30 0.00 0.00 0.94 0.00 0.00 11 L 8.95 4.22 0.00 1.88 1.83 0.94 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 12 H 8.54 4.23 0.00 3.42 3.54 0.00 5.78 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.88 3.63 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 0.97 0.00 0.00 1.36 0.00 0.00 14 W 8.76 4.00 0.00 3.64 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 A 7.92 4.01 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 16 K 7.41 3.91 0.00 1.41 1.68 0.00 1.61 0.00 0.00 1.44 0.00 0.00 2.67 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.44 7.81 17 V 7.25 2.78 0.95 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 0.03 0.00 0.00 0.44 0.00 0.00 18 E 7.41 3.89 0.00 2.00 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 2.20 2.15 0.00 19 A 7.44 4.22 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 20 D 7.83 4.63 0.00 2.71 2.49 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 21 V 8.10 3.48 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 0.79 0.00 0.00 0.85 0.00 0.00 22 A 8.11 4.04 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 23 G 8.34 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 24 H 8.21 4.18 0.00 3.11 3.24 0.00 5.84 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.58 3.78 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 0.00 0.00 0.00 26 Q 8.28 3.90 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.71 0.00 0.00 0.00 0.00 0.00 2.31 2.53 0.00 27 D 7.95 4.29 0.00 2.62 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 28 I 7.77 3.63 1.96 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 1.52 0.76 0.90 0.00 0.00 29 L 7.79 3.45 0.00 1.44 1.16 0.82 0.64 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 30 I 7.82 3.66 1.89 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.58 0.88 0.00 0.00 31 R 7.92 3.74 0.00 1.95 2.03 0.00 3.04 0.00 0.00 2.89 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 32 L 7.92 3.88 0.00 1.63 1.37 1.09 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 33 F 7.85 4.62 0.00 3.08 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 34 K 7.91 4.03 0.00 1.71 1.83 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.71 7.81 35 S 8.13 4.21 0.00 3.64 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 36 H 8.31 4.75 0.00 3.07 2.86 0.00 5.65 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.55 0.00 2.14 2.13 0.00 3.81 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 2.09 2.30 0.00 38 E 8.22 4.10 0.00 2.26 2.27 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 2.23 2.46 0.00 39 T 8.24 3.86 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 40 L 7.92 3.72 0.00 1.32 1.77 0.04 1.07 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 41 E 7.74 4.01 0.00 2.22 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 2.38 2.47 0.00 42 K 8.15 4.35 0.00 2.02 1.66 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.21 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.79 1.98 7.81 43 F 8.28 4.39 0.00 3.20 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 44 D 8.44 4.00 0.00 2.57 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 45 R 7.58 4.32 0.00 1.84 1.87 0.00 2.75 0.00 0.00 3.28 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 1.52 0.00 46 F 8.89 5.10 0.00 2.70 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 47 K 8.46 3.88 0.00 1.78 1.96 0.00 1.76 0.00 0.00 1.92 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.69 7.81 48 H 8.17 4.50 0.00 3.30 3.43 0.00 5.52 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.53 4.23 0.00 1.55 1.55 0.73 0.63 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 50 K 9.44 4.19 0.00 1.78 1.84 0.00 1.64 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.36 7.81 51 T 7.32 4.73 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 52 E 8.69 3.85 0.00 2.04 1.97 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 2.35 2.36 0.00 53 A 7.86 3.89 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 54 E 7.86 4.03 0.00 2.19 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 2.33 0.00 55 M 8.16 3.91 0.00 2.01 2.26 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.54 0.00 56 K 8.48 3.91 0.00 1.89 1.85 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.10 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.44 1.46 7.81 57 A 7.57 4.51 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 58 S 7.38 4.10 0.00 3.82 3.78 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 59 E 8.79 4.04 0.00 2.13 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 0.00 2.39 2.47 0.00 60 D 8.07 4.52 0.00 2.99 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 61 L 7.76 3.33 0.00 1.01 1.50 0.70 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.66 3.83 0.00 1.78 1.77 0.00 1.67 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.47 7.81 63 K 8.16 4.13 0.00 1.95 1.91 0.00 1.77 0.00 0.00 1.69 0.00 0.00 3.19 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.68 7.81 64 G 8.23 3.97 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 0.00 0.00 0.00 65 G 8.33 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 66 V 7.82 3.64 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 1.01 0.00 0.00 0.98 0.00 0.00 67 T 7.91 3.89 4.49 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 1.30 0.00 0.00 68 V 7.75 3.67 2.31 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 1.21 0.00 0.00 1.15 0.00 0.00 69 L 8.12 4.20 0.00 1.88 1.84 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.52 3.99 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 71 A 8.20 3.99 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 72 L 8.28 3.66 0.00 1.62 1.68 0.25 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.64 3.46 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 0.00 74 A 7.63 4.04 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 75 I 7.38 3.79 1.79 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 0.93 0.83 0.00 0.00 76 L 7.80 3.92 0.00 1.22 1.56 -0.05 1.30 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 77 K 7.63 3.85 0.00 1.65 1.80 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.21 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.49 1.54 7.81 78 K 7.72 3.94 0.00 1.82 1.82 0.00 1.76 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.57 1.81 7.81 79 K 8.37 2.00 0.00 1.26 0.74 0.00 1.46 0.00 0.00 1.45 0.00 0.00 2.76 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.30 0.90 7.81 80 G 8.17 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 0.00 0.00 0.00 0.00 81 H 7.62 4.77 0.00 3.18 3.23 0.00 5.75 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.16 5.22 0.00 3.30 3.43 0.00 5.68 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.41 3.94 0.00 2.09 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 0.00 2.42 2.49 0.00 84 A 8.00 4.04 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 85 E 8.17 4.10 0.00 2.25 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 2.40 2.47 0.00 86 L 7.86 4.26 0.00 2.05 1.75 1.05 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.92 3.88 0.00 1.95 1.85 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.62 7.81 88 P 0.00 4.29 0.00 2.29 2.34 0.00 3.72 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.06 0.00 89 L 7.54 4.03 0.00 1.78 1.93 0.97 1.31 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 90 A 8.67 4.26 1.50 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 0.00 0.00 91 Q 8.29 3.84 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.76 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 92 S 8.15 4.00 0.00 3.95 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 0.00 93 H 8.35 4.13 0.00 3.61 3.62 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 7.96 2.64 0.42 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 95 T 7.39 3.90 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 1.12 0.00 0.00 96 K 7.12 4.07 0.00 1.54 1.50 0.00 1.61 0.00 0.00 1.62 0.00 0.00 3.07 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.29 1.44 7.81 97 H 8.42 4.20 0.00 2.93 3.14 0.00 5.86 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 98 K 7.43 3.22 0.00 1.80 1.79 0.00 1.53 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.23 1.37 7.81 99 I 8.25 4.28 2.11 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 1.53 0.96 1.12 0.00 0.00 100 P 0.00 4.67 0.00 1.94 1.98 0.00 3.12 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 0.84 1.45 0.00 101 I 8.32 3.50 1.76 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.68 0.77 0.00 0.00 102 K 7.96 3.55 0.00 1.70 1.65 0.00 0.70 0.00 0.00 1.40 0.00 0.00 3.09 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.51 1.19 7.81 103 Y 7.95 4.27 0.00 3.09 3.14 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 0.00 0.00 0.00 0.00 104 L 8.07 4.18 0.00 1.90 1.71 0.66 0.89 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 0.00 105 E 7.97 3.99 0.00 2.01 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 106 F 7.67 4.47 0.00 3.13 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 0.00 107 I 8.02 3.82 2.02 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 1.08 0.00 0.00 108 S 8.30 4.22 0.00 4.14 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.40 4.01 0.00 2.28 2.41 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 2.40 2.43 0.00 110 A 8.04 4.06 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 0.00 111 I 8.20 3.69 2.12 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.63 1.07 0.00 0.00 112 I 8.03 3.92 2.14 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.14 1.16 0.00 0.00 113 H 8.52 4.09 0.00 3.40 3.50 0.00 5.78 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 0.00 114 V 8.03 3.56 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 0.99 0.00 0.00 0.98 0.00 0.00 115 L 7.89 3.77 0.00 0.27 0.67 0.93 0.67 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 0.00 116 H 7.78 4.35 0.00 3.55 3.67 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.88 4.16 0.00 3.81 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 0.00 118 R 8.04 4.04 0.00 1.54 1.59 0.00 3.05 0.00 0.00 2.94 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.52 0.00 119 H 8.32 5.01 0.00 3.09 3.16 0.00 5.64 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.29 0.00 2.21 2.28 0.00 3.75 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.94 0.00 121 G 8.10 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 0.00 0.00 0.00 122 N 8.12 5.05 0.00 2.78 2.87 0.00 0.00 6.66 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 0.00 123 F 7.78 5.03 0.00 2.87 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 0.00 124 G 7.73 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 0.00 125 A 8.50 3.89 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 0.00 126 D 8.06 4.22 0.00 2.66 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 A 7.84 3.92 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 0.00 128 Q 8.00 3.06 0.00 0.93 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.14 2.08 0.00 129 G 8.27 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 A 8.09 3.87 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 0.00 131 M 8.13 3.98 0.00 2.33 2.32 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.94 0.00 132 N 8.28 4.27 0.00 2.87 2.91 0.00 0.00 6.84 6.27 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 0.00 133 K 8.06 3.73 0.00 1.93 1.70 0.00 1.58 0.00 0.00 1.61 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.38 7.81 134 A 8.03 3.91 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 0.00 135 L 8.38 4.14 0.00 1.89 1.83 1.02 0.86 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 0.00 136 E 8.99 4.04 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.56 0.00 137 L 8.41 3.96 0.00 1.75 1.97 1.04 0.96 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 0.00 138 F 8.34 4.20 0.00 3.11 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 0.00 139 R 8.43 3.38 0.00 1.77 1.80 0.00 3.14 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.86 0.00 140 K 7.97 3.74 0.00 1.78 1.92 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.45 7.81 141 D 8.06 4.30 0.00 2.78 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 0.00 142 I 7.52 3.48 1.22 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 -0.00 0.17 0.00 0.00 143 A 8.12 3.65 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 A 7.86 3.94 1.35 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 0.00 0.00 145 K 7.89 3.97 0.00 1.91 1.95 0.00 1.64 0.00 0.00 1.83 0.00 0.00 3.15 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.55 7.81 146 Y 8.35 4.56 0.00 3.29 3.30 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 0.00 147 K 7.99 3.95 0.00 2.01 2.00 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.49 7.81 148 E 7.81 4.02 0.00 2.14 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 2.36 2.52 0.00 149 L 7.84 4.37 0.00 1.71 1.68 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 150 G 7.81 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 0.00 0.00 0.00 0.00 151 Y 7.84 4.68 0.00 2.55 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 0.00 152 Q 9.27 2.73 0.00 2.07 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.05 0.00 0.00 0.00 0.00 0.00 1.16 1.80 0.00 153 G 8.98 3.42 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 0.00