NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4217 8.3044 118.1948 55.2958 32.5454 174.4393 1 V 4.1674 7.8247 118.3400 60.9414 33.9465 172.9471 2 L 4.2116 8.2800 127.8187 54.2642 43.3260 177.0694 3 S 4.5512 8.7303 117.4576 57.6070 65.3862 175.1152 4 E 4.3054 8.8049 122.1479 59.4011 29.4126 178.8807 5 G 3.6345 8.1022 105.3730 47.7764 0.0000 175.3231 6 E 3.9095 7.9706 120.5704 59.0346 29.4034 179.4813 7 W 4.3436 8.0215 118.8701 59.9517 29.0514 178.6013 8 Q 4.1225 8.5268 118.2741 59.0172 28.0375 178.8209 9 L 4.1002 7.9242 119.5965 57.7435 41.6111 179.7893 10 V 3.7580 8.0272 118.2864 65.9309 31.5883 177.6774 11 L 4.4826 8.4926 117.6459 56.4748 41.4973 178.6765 12 H 4.3072 8.3854 119.5798 59.2385 29.9482 177.4639 13 V 3.5173 7.8213 120.6127 64.1604 31.4211 178.1388 14 W 3.9362 8.4396 129.1596 60.1021 30.2535 177.8100 15 A 4.0408 7.9494 120.2646 54.7450 18.0330 179.5597 16 K 3.9377 7.3360 116.9232 59.5612 32.1230 179.5651 17 V 2.8517 7.1561 118.4458 65.8085 31.0172 177.5922 18 E 3.8856 7.5356 115.9139 58.0877 29.2852 178.5793 19 A 4.3007 7.6120 120.8202 53.6526 19.4356 177.1179 20 D 4.5256 8.0326 116.7529 51.9134 42.1286 175.6364 21 V 3.4995 8.1032 123.9741 65.3749 31.9018 177.0777 22 A 4.0983 7.9611 120.2379 54.7986 18.2764 179.7912 23 G 3.7035 8.2142 105.8776 47.7415 0.0000 175.8189 24 H 4.1525 8.2254 119.0720 58.3775 28.6605 178.0357 25 G 3.6783 8.4237 107.9462 47.8727 0.0000 175.7570 26 Q 3.8572 8.1776 120.2403 58.9313 28.8414 178.3264 27 D 4.3290 7.9671 119.7857 57.6409 40.7569 179.3196 28 I 3.7197 7.8068 119.9892 64.3792 37.1201 178.5598 29 L 3.4903 7.7481 119.8257 57.4898 41.3361 179.6537 30 I 3.8022 7.7616 120.0287 64.1645 36.9592 178.3955 31 R 3.8936 7.9685 119.7206 59.1038 29.8667 178.4076 32 L 3.8900 7.9159 120.4630 58.2479 41.8554 179.0589 33 F 4.7963 8.0730 118.0295 60.3475 38.5614 177.8810 34 K 4.0720 8.4179 118.1386 59.2259 31.9670 179.1703 35 S 4.3589 8.0878 114.9109 60.0314 64.1490 174.2228 36 H 4.6502 8.4510 119.0871 52.2043 29.3437 171.9869 37 P 4.7907 0.0000 0.0000 64.4113 31.3161 177.5451 38 E 4.1191 8.2739 116.4895 59.4011 29.3783 179.1021 39 T 3.7711 8.4335 111.3575 64.3727 68.7822 176.2823 40 L 3.6824 7.9538 122.9031 57.8471 41.7505 178.6159 41 E 4.0706 7.8414 117.6354 58.8194 29.4129 178.7591 42 K 4.3286 8.0310 117.2058 56.9471 32.7994 177.0914 43 F 4.3099 7.8565 119.1451 55.4786 37.9958 176.0123 44 D 4.3252 8.3587 126.3307 57.2055 40.9061 178.8371 45 R 4.1983 7.7843 116.9697 58.6242 30.5971 177.0813 46 F 5.1212 7.6889 114.5862 55.7488 37.9347 176.1996 47 K 4.1470 8.2354 121.3365 59.8193 33.0740 177.3541 48 H 4.3729 8.1926 114.4588 57.2717 28.9611 175.7186 49 L 3.9862 7.1866 120.5300 55.4574 41.7481 177.0171 50 K 4.2920 9.4582 123.1859 57.2076 33.4302 176.6005 51 T 4.7113 7.4781 107.7725 59.1609 73.0879 174.1633 52 E 3.9681 8.5624 119.8404 59.1199 29.3657 178.2289 53 A 4.0288 7.8907 119.9126 55.1077 18.6709 178.9931 54 E 4.0464 8.1692 116.9380 59.6066 29.4419 179.5249 55 M 4.0009 8.0595 118.9733 58.3005 31.8679 178.8871 56 K 4.0568 8.3920 117.2463 58.2380 32.2796 178.1351 57 A 4.5411 7.2294 119.1273 50.9646 19.9864 177.1729 58 S 4.2015 7.3852 113.8908 57.6654 63.6810 174.3435 59 E 3.9359 8.7098 129.6885 59.3647 29.6172 178.3530 60 D 4.4156 8.0128 118.5916 57.2541 40.8588 178.3674 61 L 2.9988 7.4976 120.8026 57.6258 41.9702 178.9535 62 K 3.8494 7.7078 119.1596 59.3468 32.1117 179.0053 63 K 3.9868 8.1153 118.8813 59.3671 31.9352 178.9972 64 Q 4.1907 8.3295 120.0424 59.2644 28.9606 178.6313 65 G 3.6420 8.3462 106.9448 47.9195 0.0000 175.7918 66 V 3.6405 7.8496 120.6389 66.0240 31.6306 178.2823 67 T 3.9185 8.0606 115.5946 66.5681 68.2884 176.9109 68 V 3.6894 8.1114 120.2602 66.1153 31.5736 178.2071 69 L 4.3137 8.2445 118.7532 57.9517 41.5637 179.6291 70 T 3.9971 8.3350 115.9678 66.5335 68.3364 176.7122 71 A 4.0772 8.0816 122.5061 54.7439 18.3485 179.3767 72 L 3.8152 8.0447 119.2957 57.8415 42.1326 179.3131 73 G 3.3195 8.4953 105.9324 47.4305 0.0000 175.6264 74 A 4.0463 7.7040 121.8844 54.7280 18.6714 179.4999 75 I 3.8324 7.3186 118.4082 64.4021 37.2582 178.5395 76 L 3.9784 7.7780 119.9317 57.5265 41.1794 179.5057 77 K 3.9916 7.7549 117.1421 58.5224 32.1665 178.9569 78 K 3.9295 7.7808 118.6060 56.4351 32.1162 176.9536 79 K 2.0000 8.1669 117.5637 56.5419 29.6524 176.1951 80 G 4.0055 8.1387 107.1811 45.7765 0.0000 174.6675 81 H 4.7366 7.5741 119.2091 54.8844 27.2901 174.5725 82 H 5.3245 7.2124 111.7780 54.2424 29.7018 176.3218 83 E 3.9772 8.6113 121.0294 60.2897 28.9462 179.0523 84 A 4.0260 7.9117 118.2078 55.4636 18.3659 179.1642 85 E 4.0615 8.2472 116.3209 59.3684 29.3955 179.2890 86 L 4.2644 8.0545 118.9762 57.4749 41.7702 178.4158 87 K 3.8965 7.9456 118.9042 59.1006 31.9190 176.8855 88 P 4.2617 0.0000 0.0000 66.2769 31.0998 178.1491 89 L 3.9855 7.4876 116.4050 57.9368 42.0791 178.9176 90 A 4.2560 8.4266 120.9861 55.0561 18.2919 179.4536 91 Q 3.9445 8.1495 118.6804 59.3686 29.1358 178.5197 92 S 4.1107 8.2032 115.2680 61.4335 63.1481 175.9758 93 H 4.1690 8.6082 119.3877 57.8067 28.3032 177.0614 94 A 2.9193 7.8138 121.6367 53.3616 18.9724 178.5506 95 T 4.0273 7.4924 112.5879 64.2125 69.8375 175.7384 96 K 4.1130 7.4307 119.7586 58.6434 33.0838 177.1321 97 H 4.2397 7.7551 114.4765 56.6620 29.3609 175.2069 98 K 3.1078 7.4888 116.2808 56.7285 27.9614 175.8379 99 I 4.2575 8.0319 119.2242 58.5722 38.0646 174.8662 100 P 4.6770 0.0000 0.0000 61.8826 31.9124 177.5976 101 I 3.6716 8.3582 120.4367 64.4570 36.8915 178.5916 102 K 3.9286 7.8494 120.0332 59.4900 31.9515 178.3012 103 Y 4.1782 7.9620 117.3338 60.8437 37.7969 178.0462 104 L 4.2189 7.8895 119.5921 57.6693 41.7619 179.2072 105 E 4.0330 8.0742 118.8409 59.2921 29.3781 179.2563 106 F 4.5152 7.8165 117.8900 60.8614 38.9458 177.6522 107 I 3.9060 8.0676 117.9535 63.8732 37.7350 178.0893 108 S 4.2299 8.0229 116.1015 61.5006 62.6506 176.1349 109 E 4.0330 8.5015 121.9168 59.2497 29.4261 178.7766 110 A 4.0810 8.1421 120.9483 54.9871 18.3244 179.7466 111 I 3.7100 8.2312 118.8168 64.7794 37.2390 178.7848 112 I 3.8361 8.0325 120.6057 64.4676 36.8801 178.1236 113 H 4.1448 8.3979 119.3316 59.2422 29.6801 177.6014 114 V 3.5912 7.9226 120.0744 65.9044 31.2905 177.9511 115 L 3.8144 7.9486 118.9555 57.9146 41.0946 178.8381 116 H 4.2986 7.8594 117.0150 59.4802 29.8443 177.2372 117 S 4.1784 7.8211 115.5339 61.7761 62.8637 176.6026 118 R 4.0724 7.9958 118.7453 57.5796 30.7796 176.3388 119 H 5.0186 8.3672 116.8884 53.7716 29.6063 173.3801 120 P 4.2663 0.0000 0.0000 66.0725 31.2184 178.9124 121 G 3.6514 8.1625 106.2550 47.4202 0.0000 173.6777 122 N 5.0398 8.0564 115.6006 52.8688 39.4247 175.1922 123 F 4.9872 7.7551 118.0562 56.3080 39.7404 174.6303 124 G 3.9008 7.6130 109.4162 44.3898 0.0000 171.7232 125 A 3.8903 8.4125 120.5393 55.2668 18.3619 179.8594 126 D 4.1930 7.9443 116.8258 57.3179 40.9390 178.6716 127 A 3.9182 7.7442 120.9084 54.9581 18.3348 179.3382 128 Q 3.1859 7.8343 118.5718 58.7947 29.0453 178.5097 129 G 3.4976 8.1930 106.9261 47.6402 0.0000 175.5771 130 A 3.8675 8.0892 123.3797 54.9685 18.3378 179.3286 131 M 3.9768 8.3102 117.1006 58.8274 32.2636 177.9221 132 N 4.3041 8.4977 117.5142 56.6032 39.0898 176.6309 133 K 3.8179 8.0943 120.7633 59.5654 32.2425 178.6380 134 A 3.8738 8.0093 121.0329 54.8988 18.1723 179.5945 135 L 4.1667 8.2453 117.8323 57.8063 41.7061 179.4078 136 E 4.0028 8.6071 119.1486 59.1448 29.3344 179.0484 137 L 3.9706 8.1696 120.6022 58.1288 42.1565 178.8367 138 F 4.1945 8.4578 120.5947 61.4410 39.2572 177.3724 139 R 3.3455 8.3590 118.1352 58.8196 29.7955 178.9740 140 K 3.8349 8.3457 119.9558 59.5622 32.1823 178.7104 141 D 4.3585 8.2110 119.2787 57.1980 40.6906 178.8313 142 I 3.4589 7.5537 120.3427 64.0229 36.9561 178.2934 143 A 3.7143 7.8551 121.6106 54.9572 18.2762 179.5861 144 A 3.9797 7.9367 119.3530 55.1205 18.3921 180.0593 145 K 4.0411 8.0041 117.2575 59.5542 32.0955 179.0895 146 Y 4.4399 8.3540 117.6752 61.1856 37.8881 178.6511 147 K 3.9979 8.2269 120.4145 59.6916 32.0507 178.7005 148 E 4.0462 7.8770 117.4497 59.1969 29.4947 178.7187 149 L 4.3004 7.9224 117.1304 55.6066 41.8595 177.8945 150 G 4.0190 8.0302 107.3204 45.0651 0.0000 172.3841 151 Y 4.5724 8.0804 120.1838 56.6970 41.1023 175.5730 152 Q 2.5200 8.2511 124.5445 57.2346 29.4737 173.9895 153 G 3.6657 7.8222 106.8674 45.7740 0.0000 172.4975 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 4.42 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.53 0.00 1 V 7.82 4.17 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 0.84 0.00 0.00 0.95 0.00 0.00 2 L 8.28 4.21 0.00 0.91 0.74 0.59 -0.31 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 3 S 8.73 4.55 0.00 4.05 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 4 E 8.80 4.31 0.00 2.20 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 2.43 2.52 0.00 5 G 8.10 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 6 E 7.97 3.91 0.00 1.93 1.71 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 2.21 2.26 0.00 7 W 8.02 4.34 0.00 3.57 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 8.53 4.12 0.00 2.29 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.71 2.61 0.00 9 L 7.92 4.10 0.00 1.90 1.75 0.89 0.73 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 10 V 8.03 3.76 2.45 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 1.19 0.00 0.00 0.92 0.00 0.00 11 L 8.49 4.48 0.00 1.85 1.81 0.95 1.34 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 8.39 4.31 0.00 3.44 3.53 0.00 5.78 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.82 3.52 2.40 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 1.05 0.00 0.00 0.88 0.00 0.00 14 W 8.44 3.94 0.00 3.65 3.15 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 15 A 7.95 4.04 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 16 K 7.34 3.94 0.00 1.67 1.66 0.00 1.65 0.00 0.00 1.49 0.00 0.00 2.72 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.47 7.81 17 V 7.16 2.85 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 0.00 0.00 -0.04 0.00 0.00 0.41 0.00 0.00 18 E 7.54 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 2.22 2.14 0.00 19 A 7.61 4.30 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 20 D 8.03 4.53 0.00 2.69 2.53 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 21 V 8.10 3.50 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 1.07 0.00 0.00 0.84 0.00 0.00 22 A 7.96 4.10 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 23 G 8.21 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 0.00 0.00 0.00 24 H 8.23 4.15 0.00 3.28 3.23 0.00 5.83 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 8.42 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.18 3.86 0.00 2.21 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.69 0.00 0.00 0.00 0.00 0.00 2.29 2.48 0.00 27 D 7.97 4.33 0.00 2.85 2.67 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 0.00 0.00 0.00 28 I 7.81 3.72 1.92 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 1.53 0.71 0.91 0.00 0.00 29 L 7.75 3.49 0.00 1.48 1.19 0.88 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 30 I 7.76 3.80 1.89 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.57 0.90 0.00 0.00 31 R 7.97 3.89 0.00 1.86 2.12 0.00 2.90 0.00 0.00 2.93 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 32 L 7.92 3.89 0.00 1.71 1.44 1.06 1.24 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 33 F 8.07 4.80 0.00 3.06 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 34 K 8.42 4.07 0.00 1.70 1.84 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.63 7.81 35 S 8.09 4.36 0.00 3.77 3.55 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 36 H 8.45 4.65 0.00 2.97 2.81 0.00 5.62 0.00 0.00 0.00 0.00 6.82 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 4.79 0.00 2.16 2.11 0.00 3.83 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.99 0.00 38 E 8.27 4.12 0.00 2.29 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 0.00 2.34 2.55 0.00 39 T 8.43 3.77 4.35 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 0.68 0.00 0.00 40 L 7.95 3.68 0.00 1.31 1.75 0.35 0.85 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 41 E 7.84 4.07 0.00 2.18 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 2.36 2.37 0.00 42 K 8.03 4.33 0.00 1.65 1.57 0.00 1.78 0.00 0.00 1.68 0.00 0.00 3.14 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.62 1.89 7.81 43 F 7.86 4.31 0.00 2.50 1.71 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 44 D 8.36 4.33 0.00 2.62 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 45 R 7.78 4.20 0.00 1.82 2.19 0.00 3.28 0.00 0.00 3.30 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.78 0.00 46 F 7.69 5.12 0.00 3.08 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 47 K 8.24 4.15 0.00 1.85 2.14 0.00 1.68 0.00 0.00 1.72 0.00 0.00 2.83 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.41 1.43 7.81 48 H 8.19 4.37 0.00 3.31 3.51 0.00 5.55 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.19 3.99 0.00 1.62 1.61 0.84 0.59 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 50 K 9.46 4.29 0.00 1.76 1.85 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.53 7.81 51 T 7.48 4.71 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 8.56 3.97 0.00 2.05 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 2.36 2.36 0.00 53 A 7.89 4.03 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 8.17 4.05 0.00 2.18 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 2.32 2.33 0.00 55 M 8.06 4.00 0.00 2.06 2.31 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.57 0.00 56 K 8.39 4.06 0.00 1.66 1.84 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.43 1.52 7.81 57 A 7.23 4.54 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 58 S 7.39 4.20 0.00 3.89 3.67 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 0.00 0.00 0.00 59 E 8.71 3.94 0.00 2.03 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 2.35 2.33 0.00 60 D 8.01 4.42 0.00 2.81 2.98 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 0.00 0.00 0.00 0.00 61 L 7.50 3.00 0.00 0.83 1.42 0.76 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.71 3.85 0.00 1.79 1.86 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.44 7.81 63 K 8.12 3.99 0.00 2.03 1.89 0.00 2.06 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.45 7.81 64 Q 8.33 4.19 0.00 2.52 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.55 2.60 0.00 65 G 8.35 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 66 V 7.85 3.64 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 1.12 0.00 0.00 0.96 0.00 0.00 67 T 8.06 3.92 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 68 V 8.11 3.69 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 1.13 0.00 0.00 1.17 0.00 0.00 69 L 8.24 4.31 0.00 1.82 1.88 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.34 4.00 4.32 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 1.26 0.00 0.00 71 A 8.08 4.08 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 72 L 8.04 3.82 0.00 1.69 1.67 0.31 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.50 3.32 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 0.00 74 A 7.70 4.05 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 75 I 7.32 3.83 1.79 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 1.50 0.91 0.82 0.00 0.00 76 L 7.78 3.98 0.00 1.39 1.56 -0.11 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.75 3.99 0.00 1.65 1.80 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.16 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.46 1.53 7.81 78 K 7.78 3.93 0.00 1.87 1.78 0.00 1.74 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.57 1.84 7.81 79 K 8.17 2.00 0.00 1.34 0.74 0.00 1.46 0.00 0.00 1.44 0.00 0.00 2.73 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.39 0.82 7.81 80 G 8.14 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 81 H 7.57 4.74 0.00 3.13 3.21 0.00 5.80 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.21 5.32 0.00 3.31 3.45 0.00 5.68 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.61 3.98 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 2.43 2.50 0.00 84 A 7.91 4.03 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 8.25 4.06 0.00 2.24 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 8.05 4.26 0.00 1.98 1.73 0.96 0.82 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 87 K 7.95 3.90 0.00 1.77 1.83 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.64 7.81 88 P 0.00 4.26 0.00 2.30 2.36 0.00 3.83 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 2.07 0.00 89 L 7.49 3.99 0.00 1.89 1.93 0.97 1.33 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 90 A 8.43 4.26 1.49 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 0.00 0.00 91 Q 8.15 3.94 0.00 2.18 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.76 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 92 S 8.20 4.11 0.00 3.97 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 93 H 8.61 4.17 0.00 3.66 3.67 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 7.81 2.92 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 95 T 7.49 4.03 4.18 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 1.11 0.00 0.00 96 K 7.43 4.11 0.00 1.55 1.65 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.15 1.34 7.81 97 H 7.76 4.24 0.00 3.01 3.14 0.00 5.82 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 98 K 7.49 3.11 0.00 1.78 1.78 0.00 1.58 0.00 0.00 1.59 0.00 0.00 2.84 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.08 1.18 7.81 99 I 8.03 4.26 2.11 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.95 1.14 0.00 0.00 100 P 0.00 4.68 0.00 1.94 2.07 0.00 3.19 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 1.45 0.00 101 I 8.36 3.67 1.80 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.74 0.81 0.00 0.00 102 K 7.85 3.93 0.00 1.71 1.60 0.00 1.54 0.00 0.00 1.77 0.00 0.00 2.49 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.42 0.75 7.81 103 Y 7.96 4.18 0.00 3.16 3.08 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 0.00 104 L 7.89 4.22 0.00 1.80 1.80 0.72 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 105 E 8.07 4.03 0.00 2.08 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 2.32 2.30 0.00 106 F 7.82 4.52 0.00 3.16 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 0.00 107 I 8.07 3.91 2.02 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 1.14 0.00 0.00 108 S 8.02 4.23 0.00 4.22 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 8.50 4.03 0.00 2.31 2.37 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 2.39 2.42 0.00 110 A 8.14 4.08 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 111 I 8.23 3.71 2.13 0.00 0.00 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 1.63 0.79 1.06 0.00 0.00 112 I 8.03 3.84 2.01 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.85 1.13 0.00 0.00 113 H 8.40 4.14 0.00 3.39 3.49 0.00 5.78 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 0.00 114 V 7.92 3.59 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 1.01 0.00 0.00 0.98 0.00 0.00 115 L 7.95 3.81 0.00 0.50 0.73 0.78 1.01 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 0.00 116 H 7.86 4.30 0.00 3.49 3.61 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 7.82 4.18 0.00 3.93 3.84 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 0.00 118 R 8.00 4.07 0.00 1.60 1.62 0.00 3.14 0.00 0.00 2.98 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 119 H 8.37 5.02 0.00 3.18 3.22 0.00 5.64 0.00 0.00 0.00 0.00 6.74 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 4.27 0.00 2.20 2.28 0.00 3.67 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.95 0.00 121 G 8.16 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 N 8.06 5.04 0.00 2.80 2.90 0.00 0.00 6.68 7.52 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 0.00 123 F 7.76 4.99 0.00 2.96 2.98 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 0.00 0.00 0.00 0.00 124 G 7.61 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 0.00 0.00 0.00 125 A 8.41 3.89 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 0.00 126 D 7.94 4.19 0.00 2.65 2.67 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 0.00 0.00 0.00 127 A 7.74 3.92 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 0.00 128 Q 7.83 3.19 0.00 1.20 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 129 G 8.19 3.50 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 0.00 130 A 8.09 3.87 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 0.00 131 M 8.31 3.98 0.00 2.46 2.39 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.92 0.00 132 N 8.50 4.30 0.00 2.88 2.98 0.00 0.00 6.88 6.60 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 0.00 133 K 8.09 3.82 0.00 1.98 1.66 0.00 1.59 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.32 1.38 7.81 134 A 8.01 3.87 1.24 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 0.00 0.00 0.00 135 L 8.25 4.17 0.00 1.77 1.84 1.02 0.79 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 0.00 136 E 8.61 4.00 0.00 2.13 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 2.34 2.59 0.00 137 L 8.17 3.97 0.00 1.84 1.95 1.03 0.97 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 0.00 138 F 8.46 4.19 0.00 3.08 3.18 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 0.00 139 R 8.36 3.35 0.00 1.90 1.79 0.00 3.13 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.93 0.00 140 K 8.35 3.83 0.00 1.74 1.96 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.43 7.81 141 D 8.21 4.36 0.00 2.78 2.69 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 0.00 142 I 7.55 3.46 1.24 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.03 0.04 0.00 0.00 143 A 7.86 3.71 1.25 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 0.00 0.00 144 A 7.94 3.98 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 0.00 145 K 8.00 4.04 0.00 2.03 1.93 0.00 1.57 0.00 0.00 1.79 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.54 7.81 146 Y 8.35 4.44 0.00 3.18 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 K 8.23 4.00 0.00 1.86 2.02 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.49 7.81 148 E 7.88 4.05 0.00 2.21 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 2.37 0.00 149 L 7.92 4.30 0.00 1.82 1.73 1.02 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 150 G 8.03 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.08 4.57 0.00 2.51 2.55 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 0.00 152 Q 8.25 2.52 0.00 1.37 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.61 0.00 0.00 0.00 0.00 0.00 1.99 2.10 0.00 153 G 7.82 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00