NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3510 8.2493 123.5817 50.6121 21.0901 176.3707 2 K 4.2278 7.4095 111.7196 55.1481 35.2840 174.4079 3 K 4.4151 8.3664 122.8468 54.7050 34.6803 176.6157 4 V 4.4416 7.8290 122.3291 59.1227 33.8144 176.2948 5 Q 4.0512 8.2570 120.1365 56.9441 29.2451 175.4459 6 A 3.7804 8.3820 122.9959 54.0840 19.3326 177.1734 7 Y 3.3302 8.1186 123.6612 58.1196 36.4519 168.9575 8 V 4.2842 8.0489 116.7300 59.6058 34.3869 175.2487 9 K 5.0908 7.9455 121.1328 54.7913 35.8000 175.6102 10 L 4.2933 8.2957 120.3836 55.1739 44.1158 173.7419 11 Q 4.9120 8.7846 121.0232 54.6375 29.8018 175.1033 12 V 4.5231 7.9819 123.5302 59.0891 34.6199 175.2381 13 A 4.0676 8.7341 123.5661 52.3499 18.5460 176.4450 14 A 3.8475 8.3590 121.4163 53.9321 19.1823 179.2169 15 G 4.3817 7.2415 106.7499 41.0000 0.0000 171.9960 16 M 4.2380 7.4642 115.8649 55.3286 35.3356 173.3092 17 A 4.2119 8.5129 126.4094 52.5180 21.6715 175.4622 18 N 4.6402 9.0869 117.3767 52.9048 38.3225 173.0605 19 P 4.3659 0.0000 0.0000 62.7201 32.0479 176.8800 20 S 4.0073 8.6198 116.9430 61.1995 62.7525 173.6033 21 P 4.3979 0.0000 0.0000 65.3433 31.3430 176.2159 22 P 4.4460 0.0000 0.0000 65.2230 32.8329 177.3060 23 V 4.2058 7.4617 113.7131 61.2844 32.8546 181.0833 24 G 3.8257 9.5096 108.6975 45.3868 0.0000 173.2087 25 P 4.3561 0.0000 0.0000 66.1641 31.2058 175.7301 26 A 3.9098 7.8278 118.6742 55.4225 18.4276 178.9193 27 L 4.0865 7.5512 116.6481 57.4526 40.8462 179.2430 28 G 3.6852 8.3802 107.5247 48.0094 0.0000 175.6042 29 Q 3.9940 7.5594 119.3293 59.0370 28.8341 178.5792 30 Q 4.1444 7.6079 117.8888 57.7100 28.6726 177.4680 31 G 4.1278 7.2667 106.6509 45.2560 0.0000 174.1979 32 V 3.5244 7.4403 118.6106 62.4682 32.3237 176.2468 33 N 4.7933 8.4604 122.2660 52.0837 38.9545 175.7491 34 I 3.5784 8.3385 125.7553 65.0268 37.2524 177.2084 35 M 3.9630 8.1046 117.6388 59.0881 32.1052 177.8024 36 E 4.0038 8.4304 118.4590 59.6003 29.5052 178.5844 37 F 4.4030 8.5178 120.1252 61.4362 39.5070 176.1628 38 C 4.1767 8.4227 118.5976 62.7840 31.2176 175.9171 39 K 3.9341 8.1726 119.3374 59.2209 31.2596 179.2523 40 A 4.0384 8.4425 121.4411 55.2573 18.3861 179.2230 41 F 3.8707 8.5639 119.9536 61.5943 39.4582 177.0570 42 N 4.6954 8.3199 116.5955 54.9905 38.1147 177.0928 43 A 4.0863 7.4366 123.9795 54.7582 18.5477 179.8502 44 K 3.9608 7.6866 116.4166 59.3483 32.1329 179.5442 45 T 3.7982 7.5311 109.5905 63.7489 68.4172 176.2131 46 D 4.2977 7.6853 122.5525 57.5863 40.7105 178.5359 47 S 4.1599 7.8348 113.5363 60.7689 63.3202 175.1210 48 I 3.7855 6.8522 119.9046 60.2920 38.3308 175.1181 49 E 3.8523 8.7154 123.7588 57.1534 29.6151 177.3884 50 K 4.2111 8.5246 123.1963 56.9096 33.1529 177.5001 51 G 3.9436 8.9895 110.2859 45.0357 0.0000 172.8312 52 L 4.8202 7.4386 120.3877 51.7900 44.1643 173.9827 53 P 4.5810 0.0000 0.0000 63.0649 31.8396 175.4553 54 I 4.6835 8.3520 125.3394 58.1043 39.8597 173.1183 55 P 4.7964 0.0000 0.0000 62.7731 32.7418 175.5785 56 V 4.7576 9.1426 122.7292 59.8945 35.3429 174.6268 57 V 4.2437 8.2795 123.5903 61.3723 33.2001 174.2963 58 I 4.6699 8.0314 129.8629 60.5500 39.0535 175.0146 59 T 4.5195 8.8824 121.3264 60.2860 69.7276 173.2015 60 V 4.3420 8.2854 128.2506 61.7517 33.3402 174.0750 61 Y 4.8960 8.2890 122.1398 55.7160 40.5623 176.7610 62 A 4.2040 8.7310 122.8092 55.4833 18.4756 178.6136 63 D 4.3923 8.1456 114.2931 55.8936 41.3287 177.4004 64 R 4.2298 8.6381 116.3600 56.0644 28.8645 176.0159 65 S 4.5819 7.8997 113.3966 58.2095 63.2491 171.8084 66 F 5.1293 7.4980 116.1619 56.3849 40.2027 172.6951 67 T 5.0462 8.6277 109.3217 60.5542 72.7202 172.3727 68 F 5.7987 7.7938 114.4634 56.6562 40.6825 173.6482 69 V 4.4379 8.5790 114.2461 60.0492 34.0697 174.3362 70 T 4.6239 8.6862 120.2125 60.8092 68.1227 174.0147 71 K 4.6547 8.2455 131.0514 56.3358 32.9330 175.5215 72 T 4.5905 8.3707 118.4641 60.2891 69.0809 173.5448 73 P 4.5191 0.0000 0.0000 62.0638 32.0012 174.9338 74 P 4.3372 0.0000 0.0000 62.9440 33.1389 177.5137 75 A 3.9667 8.5788 122.2926 55.2469 18.4457 179.9674 76 A 3.9293 8.0105 118.7973 55.3475 18.4745 179.8268 77 V 3.5054 7.7160 115.9639 66.2805 31.7050 177.8861 78 L 4.0147 8.0550 118.7149 58.0255 41.4440 179.6756 79 L 4.0123 8.3784 119.1653 57.4976 41.4051 179.7398 80 K 3.9511 8.0097 118.5172 59.3462 31.9696 179.4339 81 K 3.9092 8.1231 118.3580 59.4562 31.8111 178.9974 82 A 4.0749 7.8994 119.2963 55.4838 18.3788 179.4174 83 A 4.2814 8.2806 118.0585 53.2291 18.3965 178.7657 84 G 3.8595 8.1854 104.9388 46.5558 0.0000 173.1826 85 I 4.4543 7.3561 111.5707 58.9390 39.6961 175.6544 86 K 4.1872 8.4908 120.7999 58.2073 32.5953 176.7912 87 S 4.6684 7.5928 110.3326 55.9114 65.8054 173.4548 88 G 3.9137 8.3190 111.9032 45.1719 0.0000 173.2055 89 S 4.3142 8.4279 111.9830 58.3364 63.7705 175.6508 90 G 4.1444 8.4957 114.2555 45.5838 0.0000 174.5205 91 K 4.5501 7.2663 120.0041 52.4707 32.1399 173.7896 92 P 4.9456 0.0000 0.0000 63.3055 32.3761 176.0899 93 N 4.8595 8.9286 120.8570 54.0008 37.5295 176.1737 94 K 4.0521 8.0207 117.4102 58.6250 32.5508 176.1943 95 D 4.8059 7.8406 116.7936 51.8976 43.4338 174.5813 96 K 4.5605 8.6256 125.9643 56.0915 33.6067 176.8015 97 V 3.9754 8.3066 117.7605 63.1132 32.7468 175.7417 98 G 4.2850 7.6394 106.0760 45.5117 0.0000 171.8112 99 K 5.3858 8.3883 117.6056 55.7005 36.0674 175.8459 100 I 4.9497 8.9422 121.4420 59.6605 41.7652 175.4352 101 S 5.4076 9.1235 120.2520 57.4814 63.8332 175.6277 102 R 3.9346 8.5684 120.3417 59.1488 29.7148 179.2456 103 A 4.1341 7.9339 120.3142 55.2596 18.4249 179.2797 104 Q 4.1631 7.7678 117.3586 58.6711 28.8600 179.2390 105 L 4.0105 7.6881 119.6576 58.1134 41.5338 179.7524 106 Q 4.0579 7.8658 117.6570 58.9354 28.3133 178.6527 107 E 3.9719 8.0728 119.6178 59.4806 29.4652 179.5260 108 I 3.8127 8.2423 120.0991 64.2397 37.1611 178.2699 109 A 4.0450 8.5152 122.0402 55.1946 17.9244 179.5313 110 Q 3.9093 8.1198 117.5932 59.4738 29.2132 178.2500 111 T 4.0253 7.6816 115.6895 66.7650 68.8456 176.7034 112 K 4.1519 8.7980 119.7057 58.4009 32.1398 179.5217 113 A 3.9186 7.7679 122.0927 55.1094 18.1462 179.1576 114 A 3.9725 8.0175 118.3926 55.5914 18.4270 178.5657 115 D 4.5681 8.2568 113.5721 56.1199 41.3633 176.8566 116 M 4.4655 7.3733 118.2176 54.3762 33.0917 176.4361 117 T 4.0257 8.7693 115.9977 64.4279 67.9842 175.0067 118 G 3.8565 7.7061 108.2744 44.6734 0.0000 173.4226 119 A 4.1126 8.8094 128.8551 54.3756 19.0353 177.1607 120 D 5.0583 7.6236 113.9615 50.6787 44.0035 176.5628 121 I 3.7144 8.2031 113.4426 64.2244 37.3443 178.0003 122 E 3.9086 8.2119 119.5313 59.0886 29.1344 178.8645 123 A 3.9970 8.5018 119.8080 55.4816 18.7411 179.3132 124 M 4.1447 7.9241 116.7764 58.9865 32.1182 178.8598 125 T 3.8641 8.4215 116.1055 67.0348 68.8189 176.3961 126 R 4.0576 8.2272 119.7490 58.8352 30.0707 178.6958 127 S 4.1568 7.9516 115.5251 61.6727 62.7942 176.5617 128 I 3.8711 7.6874 122.0727 64.3311 36.8546 178.1148 129 E 4.0811 8.3244 119.7129 59.3080 28.9995 179.5872 130 G 3.6392 7.7436 105.0824 47.9371 0.0000 175.5607 131 T 4.0630 7.5664 110.5048 64.4482 68.8919 176.7111 132 A 3.9901 8.1001 123.7277 55.0729 18.2462 179.8682 133 R 3.9494 8.0668 115.0872 58.8584 30.1668 178.7399 134 S 4.4127 7.7283 113.4002 60.1129 63.5429 175.2443 135 M 4.4048 7.8792 120.0840 54.5733 32.2612 176.7568 136 G 3.9236 8.0897 107.3862 46.1188 0.0000 172.4450 137 L 4.9087 7.8167 120.0329 52.5740 43.2089 176.9647 138 V 4.0089 8.5990 124.7389 62.3994 33.3319 174.8566 139 V 5.5900 8.4741 124.1499 60.1748 34.0223 174.1540 140 E 4.5972 8.6582 126.1417 54.4394 31.7546 175.6888 141 D 4.4588 8.6628 122.9119 54.3697 41.3796 175.5397 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 A 8.25 4.35 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 2 K 7.41 4.23 0.00 1.91 1.75 0.00 1.55 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.46 7.81 3 K 8.37 4.42 0.00 1.68 1.74 0.00 1.59 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.47 7.81 4 V 7.83 4.44 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 0.76 0.00 0.00 0.93 0.00 0.00 5 Q 8.26 4.05 0.00 2.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.50 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 6 A 8.38 3.78 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 7 Y 8.12 3.33 0.00 3.11 2.99 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 0.00 0.00 0.00 8 V 8.05 4.28 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 0.63 0.00 0.00 0.68 0.00 0.00 9 K 7.95 5.09 0.00 1.54 1.61 0.00 1.89 0.00 0.00 1.79 0.00 0.00 3.07 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.25 1.35 7.81 10 L 8.30 4.29 0.00 1.60 1.56 0.71 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 11 Q 8.78 4.91 0.00 1.93 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.81 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 12 V 7.98 4.52 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 0.03 0.00 0.00 0.90 0.00 0.00 13 A 8.73 4.07 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 14 A 8.36 3.85 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 G 7.24 4.38 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 0.00 16 M 7.46 4.24 0.00 1.94 1.90 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.50 0.00 17 A 8.51 4.21 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 18 N 9.09 4.64 0.00 2.77 3.27 0.00 0.00 6.98 7.69 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 19 P 0.00 4.37 0.00 2.20 1.95 0.00 3.67 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 2.11 2.07 0.00 20 S 8.62 4.01 0.00 3.81 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 21 P 0.00 4.40 0.00 2.06 2.09 0.00 3.72 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 22 P 0.00 4.45 0.00 2.01 2.08 0.00 3.65 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.05 0.00 23 V 7.46 4.21 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 0.94 0.00 0.00 0.90 0.00 0.00 24 G 9.51 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 25 P 0.00 4.36 0.00 2.13 2.11 0.00 3.94 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 26 A 7.83 3.91 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.55 4.09 0.00 1.53 1.61 0.23 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 28 G 8.38 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 29 Q 7.56 3.99 0.00 1.93 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.93 0.00 0.00 0.00 0.00 0.00 2.28 2.71 0.00 30 Q 7.61 4.14 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.37 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 31 G 7.27 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 32 V 7.44 3.52 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 -0.33 0.00 0.00 0.59 0.00 0.00 33 N 8.46 4.79 0.00 3.21 2.94 0.00 0.00 6.85 7.23 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 34 I 8.34 3.58 1.89 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.97 0.93 0.00 0.00 35 M 8.10 3.96 0.00 2.18 2.12 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 2.72 2.72 0.00 36 E 8.43 4.00 0.00 2.22 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 2.48 2.44 0.00 37 F 8.52 4.40 0.00 3.23 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 C 8.42 4.18 0.00 3.11 3.12 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 39 K 8.17 3.93 0.00 1.85 1.85 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.61 7.81 40 A 8.44 4.04 1.62 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 41 F 8.56 3.87 0.00 1.51 2.34 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 42 N 8.32 4.70 0.00 2.83 2.79 0.00 0.00 6.50 7.95 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 43 A 7.44 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 44 K 7.69 3.96 0.00 1.73 1.82 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.45 7.81 45 T 7.53 3.80 3.90 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 -0.30 0.00 0.00 46 D 7.69 4.30 0.00 2.73 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 47 S 7.83 4.16 0.00 3.94 3.90 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 48 I 6.85 3.79 1.82 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 1.30 0.74 0.84 0.00 0.00 49 E 8.72 3.85 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 2.33 2.32 0.00 50 K 8.52 4.21 0.00 1.73 1.72 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.17 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.38 1.52 7.81 51 G 8.99 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 52 L 7.44 4.82 0.00 1.75 1.60 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 53 P 0.00 4.58 0.00 2.10 2.10 0.00 3.72 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 54 I 8.35 4.68 1.97 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.32 1.24 0.00 0.00 55 P 0.00 4.80 0.00 2.18 2.18 0.00 3.82 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.00 0.00 56 V 9.14 4.76 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 1.30 0.00 0.00 57 V 8.28 4.24 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 0.25 0.00 0.00 0.91 0.00 0.00 58 I 8.03 4.67 1.40 0.00 0.00 -1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 -0.00 0.55 0.00 0.00 59 T 8.88 4.52 4.20 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 1.14 0.00 0.00 60 V 8.29 4.34 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 0.99 0.00 0.00 0.77 0.00 0.00 61 Y 8.29 4.90 0.00 3.09 2.84 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 62 A 8.73 4.20 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 63 D 8.15 4.39 0.00 2.72 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 64 R 8.64 4.23 0.00 2.05 2.40 0.00 3.26 0.00 0.00 3.19 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.81 0.00 65 S 7.90 4.58 0.00 4.17 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 66 F 7.50 5.13 0.00 3.07 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 T 8.63 5.05 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 1.40 0.00 0.00 68 F 7.79 5.80 0.00 3.21 3.12 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 69 V 8.58 4.44 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 0.83 0.00 0.00 1.01 0.00 0.00 70 T 8.69 4.62 4.51 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 71 K 8.25 4.65 0.00 1.87 2.13 0.00 1.97 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.51 1.43 7.81 72 T 8.37 4.59 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 1.28 0.00 0.00 73 P 0.00 4.52 0.00 2.24 2.22 0.00 3.87 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 74 P 0.00 4.34 0.00 2.19 2.05 0.00 3.62 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 2.19 0.00 75 A 8.58 3.97 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 76 A 8.01 3.93 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 77 V 7.72 3.51 2.25 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 1.08 0.00 0.00 0.94 0.00 0.00 78 L 8.05 4.01 0.00 1.88 1.72 0.97 0.51 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 79 L 8.38 4.01 0.00 1.86 1.72 0.98 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 80 K 8.01 3.95 0.00 2.05 2.04 0.00 1.68 0.00 0.00 1.81 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.74 7.81 81 K 8.12 3.91 0.00 1.94 1.86 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.66 7.81 82 A 7.90 4.07 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 83 A 8.28 4.28 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 84 G 8.19 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 85 I 7.36 4.45 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 1.54 0.72 0.91 0.00 0.00 86 K 8.49 4.19 0.00 1.77 1.90 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.42 7.81 87 S 7.59 4.67 0.00 3.76 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 88 G 8.32 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 89 S 8.43 4.31 0.00 4.18 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 90 G 8.50 4.14 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 0.00 0.00 0.00 91 K 7.27 4.55 0.00 1.83 1.71 0.00 1.58 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.47 7.81 92 P 0.00 4.95 0.00 2.03 2.07 0.00 3.80 0.00 0.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.09 0.00 93 N 8.93 4.86 0.00 2.90 3.02 0.00 0.00 6.92 7.61 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 94 K 8.02 4.05 0.00 1.71 2.02 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.42 7.81 95 D 7.84 4.81 0.00 2.64 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 96 K 8.63 4.56 0.00 1.90 1.81 0.00 1.62 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.45 7.81 97 V 8.31 3.98 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 0.68 0.00 0.00 0.99 0.00 0.00 98 G 7.64 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 0.00 0.00 0.00 0.00 99 K 8.39 5.39 0.00 1.90 1.73 0.00 1.56 0.00 0.00 1.71 0.00 0.00 2.72 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.43 7.81 100 I 8.94 4.95 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 1.29 0.56 0.98 0.00 0.00 101 S 9.12 5.41 0.00 4.01 3.99 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 0.00 0.00 0.00 102 R 8.57 3.93 0.00 1.90 2.03 0.00 3.30 0.00 0.00 3.34 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.80 0.00 103 A 7.93 4.13 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 0.00 104 Q 7.77 4.16 0.00 2.35 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.70 0.00 0.00 0.00 0.00 0.00 2.39 2.28 0.00 105 L 7.69 4.01 0.00 1.80 1.73 0.92 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 106 Q 7.87 4.06 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.66 0.00 107 E 8.07 3.97 0.00 2.22 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 0.00 2.33 2.63 0.00 108 I 8.24 3.81 1.99 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 0.83 0.92 0.00 0.00 109 A 8.52 4.05 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 0.00 110 Q 8.12 3.91 0.00 2.16 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.89 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 111 T 7.68 4.03 4.39 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 1.22 0.00 0.00 112 K 8.80 4.15 0.00 1.74 1.87 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.62 1.61 7.81 113 A 7.77 3.92 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 0.00 114 A 8.02 3.97 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 0.00 115 D 8.26 4.57 0.00 2.80 2.76 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 0.00 116 M 7.37 4.47 0.00 2.05 1.99 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 2.71 2.48 0.00 117 T 8.77 4.03 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 1.22 0.00 0.00 118 G 7.71 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 0.00 119 A 8.81 4.11 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 0.00 120 D 7.62 5.06 0.00 2.98 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 I 8.20 3.71 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 1.64 1.06 0.91 0.00 0.00 122 E 8.21 3.91 0.00 2.23 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 0.00 2.40 2.45 0.00 123 A 8.50 4.00 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 0.00 124 M 7.92 4.14 0.00 2.12 2.26 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.59 0.00 125 T 8.42 3.86 4.41 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 1.29 0.00 0.00 126 R 8.23 4.06 0.00 1.98 2.05 0.00 3.10 0.00 0.00 3.17 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 127 S 7.95 4.16 0.00 4.09 3.90 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 0.00 128 I 7.69 3.87 2.04 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 1.65 0.75 0.92 0.00 0.00 129 E 8.32 4.08 0.00 2.18 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 0.00 2.33 2.55 0.00 130 G 7.74 3.64 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 0.00 0.00 0.00 131 T 7.57 4.06 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 0.00 132 A 8.10 3.99 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 0.00 133 R 8.07 3.95 0.00 1.79 2.01 0.00 3.16 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.96 0.00 134 S 7.73 4.41 0.00 4.05 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 0.00 135 M 7.88 4.40 0.00 2.05 2.21 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.59 0.00 136 G 8.09 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 L 7.82 4.91 0.00 1.64 1.61 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 138 V 8.60 4.01 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 0.82 0.00 0.00 0.93 0.00 0.00 139 V 8.47 5.59 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 0.97 0.00 0.00 0.93 0.00 0.00 140 E 8.66 4.60 0.00 2.03 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 0.00 2.27 2.22 0.00 141 D 8.66 4.46 0.00 2.64 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