NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3872 8.3049 120.3524 55.4292 32.8777 174.2580 2 K 4.3782 8.5173 117.6325 52.8697 33.8777 174.5743 3 T 4.2262 8.5229 114.6796 60.7187 70.7482 174.3401 4 F 4.0437 8.3699 125.0335 59.0360 40.0772 173.6727 5 T 3.5150 5.7900 111.0290 61.3184 69.4301 173.6095 6 A 4.2558 8.7052 133.4066 50.7989 16.9000 176.1751 7 K 3.8578 8.0443 120.3170 56.0979 33.1365 176.5011 8 P 4.1695 0.0000 0.0000 65.9525 31.7276 177.5831 9 E 4.0097 8.2450 118.5832 59.0977 29.6559 177.4323 10 T 4.2908 6.9557 116.4609 62.2269 66.9512 173.8735 11 V 4.6301 7.7720 118.6570 59.2189 35.5900 174.1320 12 K 4.0596 8.3129 119.1014 53.6771 33.5861 175.1713 13 R 3.6512 8.3972 135.0000 56.9665 27.7866 175.1885 14 D 5.1690 8.0745 123.5992 52.4104 44.7537 174.6528 15 W 5.8924 8.1285 117.0895 54.7519 32.8693 174.4814 16 Y 5.2783 8.6982 120.2533 56.4145 42.3784 174.2008 17 V 4.8703 8.5254 122.0806 61.6316 34.4920 175.3109 18 V 4.4602 8.4524 126.2786 60.4186 34.3154 173.2350 19 D 4.6736 8.9449 126.4618 53.3778 41.5867 176.5244 20 A 4.7402 8.3468 132.5814 52.0912 18.7696 177.2995 21 T 4.4041 6.7121 119.3492 65.9349 69.7442 177.9993 22 G 3.6185 8.1570 113.0308 48.6522 0.0000 173.7580 23 K 4.0736 7.7406 117.8626 56.1702 32.6602 177.1090 24 T 4.1087 8.4450 118.6350 63.5671 69.0256 171.8537 25 L 3.6939 8.3920 129.0991 55.2718 43.0429 173.6952 26 G 4.3629 8.7931 117.7309 46.9836 0.0000 175.7306 27 R 4.1139 7.7103 116.0605 57.3819 30.6269 177.9406 28 L 4.1518 7.7293 120.4646 57.4317 42.4390 177.8502 29 A 3.9851 8.1038 120.3268 55.5442 18.1237 179.4690 30 T 3.8216 7.5922 111.2105 65.1139 67.3662 175.6226 31 E 4.2234 7.9359 117.2193 57.0621 29.4016 177.3879 32 L 4.1942 7.6417 118.2628 57.8582 42.1854 178.2110 33 A 4.3541 8.2563 120.8728 55.4823 18.1653 179.6848 34 R 3.8122 8.0380 116.1874 59.8201 30.1266 179.4084 35 R 4.1287 7.7240 116.5058 58.5718 30.0844 178.7676 36 L 3.9071 9.1132 118.4083 56.8774 41.6133 178.3943 37 R 4.2864 7.6849 116.6813 55.8826 30.6227 177.0112 38 G 3.7357 7.5818 106.8016 45.8936 0.0000 174.8761 39 K 3.9755 8.0985 117.1644 57.5900 31.7247 176.6274 40 H 4.8778 8.4119 111.1817 55.1950 28.8268 173.0343 41 K 4.6102 7.5118 119.0804 54.6195 35.7038 176.1281 42 A 4.3177 8.1369 120.4262 52.8353 16.3378 178.6114 43 E 4.1994 7.7927 115.6770 56.0814 29.8213 174.6590 44 Y 3.9634 8.0272 120.3325 59.9676 38.6273 175.9440 45 T 4.8743 7.8340 135.0000 61.9166 68.3838 171.4604 46 P 4.3137 0.0000 0.0000 65.1088 32.0943 177.6937 47 H 4.5958 7.1619 113.0258 56.3022 29.3415 174.7254 48 V 4.4493 8.0366 117.8484 60.6735 34.4025 173.6984 49 D 4.8228 8.5078 121.4767 51.9624 40.5548 176.1285 50 T 4.4775 8.3466 113.8096 61.0603 69.2558 174.0097 51 G 3.8989 7.6434 108.5617 46.4962 0.0000 173.9913 52 D 4.7161 8.4775 122.2716 53.8575 42.3507 175.8125 53 Y 3.9491 8.3045 120.0342 57.7756 38.6034 174.5644 54 I 5.1977 8.6180 125.2486 58.9291 41.6762 173.9279 55 I 5.1343 8.6693 122.3190 58.2086 40.0533 176.1420 56 V 4.1031 8.4201 120.3789 61.0128 32.7234 174.0059 57 L 4.5718 8.5767 120.8858 56.1974 44.0009 176.3571 58 N 5.0838 8.0675 115.1705 51.7422 37.6147 176.0832 59 A 4.0748 7.8212 122.8529 54.9009 19.3377 179.0889 60 D 4.4712 8.3234 115.4807 56.0082 39.6238 177.9529 61 K 4.4904 7.7885 118.6978 55.6313 32.5568 176.0303 62 V 4.2756 8.0435 117.9854 60.4734 32.2914 175.2310 63 A 4.3836 8.0988 127.0458 51.4995 19.1825 177.8227 64 V 3.4929 8.3656 122.8272 62.3222 32.0835 174.5524 65 T 3.1744 7.9614 119.0805 63.5455 64.7878 171.6903 66 G 3.8757 7.5636 112.1028 45.1763 0.0000 169.6575 67 N 4.7299 8.2721 119.7222 53.7524 38.4736 175.8876 68 K 4.4462 7.7046 113.7109 55.8383 33.5108 177.5714 69 R 3.8724 7.8964 121.3382 59.3318 30.0297 177.3019 70 T 4.7036 7.7834 103.1907 61.2621 70.2174 173.4917 71 D 4.9408 7.7211 119.9697 54.2144 41.8268 177.3109 72 K 4.3162 7.9535 119.6026 56.2958 33.0823 174.6164 73 V 3.8309 7.6755 108.3220 62.7961 34.0247 176.1878 74 Y 3.5659 6.8821 114.0359 59.3689 34.6061 170.3375 75 Y 5.1374 7.5253 119.6110 56.9555 40.8040 174.1855 76 H 4.7165 8.1007 112.2178 55.4550 32.3546 172.7132 77 H 5.6793 9.1584 119.5996 53.6862 31.5306 172.6225 78 T 3.9649 9.0238 117.1566 65.6811 68.6347 174.2877 79 G 3.2483 7.3559 110.4108 44.4105 0.0000 172.2386 80 H 4.7617 8.4367 116.9748 54.9580 34.6515 177.8265 81 I 2.9682 8.0654 117.5620 60.6744 38.3875 176.4334 82 G 3.6745 9.6871 116.0908 48.6948 0.0000 174.3301 83 G 3.2767 7.2683 107.9195 46.1198 0.0000 171.7496 84 I 4.3031 7.3597 129.6001 60.8805 38.1192 174.4096 85 K 4.5699 9.0911 128.5553 54.8484 34.2946 175.8118 86 Q 4.6619 8.7677 124.1006 53.7034 32.0562 174.4287 87 A 5.1500 7.7732 130.3457 52.3181 21.1234 176.2634 88 T 4.3590 7.7536 117.9273 61.5825 68.7941 175.1956 89 F 3.9421 9.2522 128.8548 61.8829 39.0650 177.3350 90 E 4.1349 7.7878 116.3230 59.2039 29.0879 177.9718 91 E 4.2444 8.5486 117.7432 57.9117 29.7863 178.0348 92 M 4.0178 8.1129 119.0184 57.3625 31.8276 178.3919 93 I 3.6137 7.2063 118.8461 63.0040 38.7399 176.5229 94 A 4.2432 6.9952 123.4940 49.4226 16.9406 175.6601 95 R 4.0735 8.9154 114.2065 55.5836 30.5786 178.0149 96 R 3.4465 7.9813 118.9378 57.1161 26.1676 175.0445 97 P 4.6301 0.0000 0.0000 64.2394 30.8514 179.0358 98 E 3.9302 8.2231 119.0422 59.1130 29.2177 178.2702 99 R 4.2322 7.6774 116.0645 56.4944 31.0536 178.6160 100 V 3.5767 7.3075 118.8471 66.0392 31.4135 177.9053 101 I 3.9290 7.7207 117.3265 63.4141 37.0333 177.3376 102 E 4.2746 7.6632 120.8180 58.5918 29.6494 177.8646 103 I 4.1538 8.2868 112.3713 62.7549 37.2152 177.6847 104 A 4.1745 8.2327 122.7673 53.9427 17.6419 178.7613 105 V 4.1239 7.6127 115.6180 61.8297 31.7018 176.8974 106 K 4.4849 7.3366 121.0192 58.1604 32.9357 177.4783 107 G 3.8701 7.7310 107.7804 48.8023 0.0000 174.5931 108 M 4.2123 7.4136 115.7077 57.5179 32.3308 177.3184 109 L 4.2174 7.2875 117.0413 53.9440 42.8133 175.5974 110 P 4.7619 0.0000 0.0000 63.0312 34.6081 175.6525 111 K 3.5997 8.5404 117.7626 58.0976 30.0354 174.2871 112 G 4.2921 7.9015 108.9530 46.4679 0.0000 172.9021 113 P 4.3734 0.0000 0.0000 64.2797 31.4482 178.4943 114 L 4.0960 7.8523 118.8298 58.2558 42.0760 179.5621 115 G 4.2062 8.0671 105.8882 47.3012 0.0000 175.0566 116 R 4.1888 7.8473 118.9766 58.6049 29.8264 178.3485 117 A 4.0806 7.8528 120.7083 55.3361 18.2052 179.4643 118 M 3.9751 8.3954 117.3557 58.0594 31.9200 178.7949 119 F 3.9057 8.0356 121.0644 61.2589 39.4179 177.1879 120 R 4.2574 7.4795 116.4935 58.9726 30.2117 177.1763 121 K 4.5031 7.7094 116.8968 56.3431 33.1811 175.8277 122 L 5.4222 8.4108 123.3300 52.2538 43.9521 175.7724 123 K 4.8457 8.8065 124.7534 54.9938 35.5571 176.4867 124 V 4.0408 7.9679 118.5061 63.4819 33.4135 176.5220 125 Y 3.4695 7.8303 116.2148 57.7290 36.7649 170.1065 126 A 4.8103 8.4797 112.9231 50.7551 21.0587 177.2649 127 G 4.6077 9.4094 110.1674 46.6285 0.0000 171.4471 128 N 4.0508 8.4993 127.5430 53.0920 36.2133 176.4693 129 E 4.3773 7.3729 111.6598 56.1102 30.5956 174.6432 130 H 3.5930 8.2411 119.3009 53.5270 31.2174 173.1613 131 N 4.7096 8.3193 118.4085 53.6261 38.6438 175.2131 132 H 4.9830 8.0748 114.3148 54.8356 29.4219 175.4270 133 A 4.2120 7.9129 120.5913 53.2154 18.3637 178.8196 134 A 4.2196 7.6434 117.7838 52.7618 19.2964 177.9444 135 Q 3.8306 7.6402 114.8877 54.7092 29.3742 176.1188 136 Q 3.2622 7.7656 115.1277 56.1664 25.9696 172.5987 137 P 4.5989 0.0000 0.0000 62.7239 32.8769 177.2259 138 Q 4.4991 8.2640 125.9344 54.3587 29.8379 175.4593 139 V 3.9743 8.4484 119.9584 62.0864 32.8522 175.9676 140 L 4.5152 8.3097 124.6984 54.0617 44.7165 174.9180 141 D 4.3831 8.8303 127.2978 54.0526 40.2107 176.3789 142 I 3.5569 8.4051 123.2260 61.8544 37.1794 173.4098 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 8.30 4.39 0.00 2.01 1.99 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 2 K 8.52 4.38 0.00 1.84 1.70 0.00 1.79 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.50 7.81 3 T 8.52 4.23 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 1.38 0.00 0.00 4 F 8.37 4.04 0.00 2.77 2.60 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 5 T 5.79 3.51 3.98 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 0.87 0.00 0.00 6 A 8.71 4.26 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 K 8.04 3.86 0.00 1.75 1.74 0.00 1.60 0.00 0.00 1.72 0.00 0.00 2.65 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.32 7.81 8 P 0.00 4.17 0.00 2.19 2.19 0.00 3.75 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 9 E 8.25 4.01 0.00 1.96 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 2.31 2.35 0.00 10 T 6.96 4.29 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 11 V 7.77 4.63 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 0.90 0.00 0.00 1.04 0.00 0.00 12 K 8.31 4.06 0.00 1.76 1.66 0.00 1.96 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.38 1.40 7.81 13 R 8.40 3.65 0.00 2.07 2.01 0.00 3.22 0.00 0.00 2.91 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 14 D 8.07 5.17 0.00 2.64 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 0.00 0.00 0.00 0.00 15 W 8.13 5.89 0.00 3.19 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 8.70 5.28 0.00 2.92 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.53 4.87 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.86 0.00 0.00 18 V 8.45 4.46 2.23 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 0.72 0.00 0.00 0.94 0.00 0.00 19 D 8.94 4.67 0.00 2.72 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 20 A 8.35 4.74 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 21 T 6.71 4.40 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 22 G 8.16 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 23 K 7.74 4.07 0.00 1.95 1.76 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.55 7.81 24 T 8.45 4.11 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 25 L 8.39 3.69 0.00 1.82 1.83 0.84 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.79 4.36 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 0.00 27 R 7.71 4.11 0.00 1.78 1.98 0.00 3.35 0.00 0.00 3.14 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 28 L 7.73 4.15 0.00 1.82 1.62 0.92 1.31 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 29 A 8.10 3.99 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 30 T 7.59 3.82 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 1.23 0.00 0.00 31 E 7.94 4.22 0.00 1.94 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 0.00 2.23 2.37 0.00 32 L 7.64 4.19 0.00 1.89 1.59 0.89 0.72 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 33 A 8.26 4.35 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 34 R 8.04 3.81 0.00 1.82 1.97 0.00 3.26 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.85 0.00 35 R 7.72 4.13 0.00 1.81 1.84 0.00 2.87 0.00 0.00 2.89 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.54 0.00 36 L 9.11 3.91 0.00 1.59 1.61 0.74 0.77 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 37 R 7.68 4.29 0.00 1.80 2.05 0.00 3.26 0.00 0.00 3.19 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 38 G 7.58 3.74 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 0.00 0.00 0.00 39 K 8.10 3.98 0.00 1.73 1.89 0.00 1.60 0.00 0.00 1.83 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.41 7.81 40 H 8.41 4.88 0.00 3.15 3.28 0.00 5.75 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 7.51 4.61 0.00 1.67 1.75 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.17 1.23 7.81 42 A 8.14 4.32 1.16 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 0.00 0.00 43 E 7.79 4.20 0.00 2.08 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 2.27 2.17 0.00 44 Y 8.03 3.96 0.00 3.31 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 45 T 7.83 4.87 4.37 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 1.24 0.00 0.00 46 P 0.00 4.31 0.00 1.95 2.01 0.00 3.03 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.92 0.00 47 H 7.16 4.60 0.00 3.22 3.33 0.00 5.59 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 48 V 8.04 4.45 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 0.83 0.00 0.00 0.97 0.00 0.00 49 D 8.51 4.82 0.00 2.71 2.60 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 50 T 8.35 4.48 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 1.25 0.00 0.00 51 G 7.64 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 52 D 8.48 4.72 0.00 2.76 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 53 Y 8.30 3.95 0.00 1.43 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 54 I 8.62 5.20 1.91 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.39 0.87 0.00 0.00 55 I 8.67 5.13 2.11 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.79 1.17 0.00 0.00 56 V 8.42 4.10 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.10 0.00 0.00 57 L 8.58 4.57 0.00 1.84 1.44 1.07 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 58 N 8.07 5.08 0.00 2.90 2.79 0.00 0.00 7.50 7.54 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 59 A 7.82 4.07 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 60 D 8.32 4.47 0.00 2.83 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 61 K 7.79 4.49 0.00 1.82 1.85 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.36 7.81 62 V 8.04 4.28 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 1.08 0.00 0.00 63 A 8.10 4.38 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 64 V 8.37 3.49 1.12 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 0.54 0.00 0.00 0.47 0.00 0.00 65 T 7.96 3.17 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 1.19 0.00 0.00 66 G 7.56 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 N 8.27 4.73 0.00 2.68 2.79 0.00 0.00 6.72 6.68 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 68 K 7.70 4.45 0.00 1.87 1.94 0.00 1.45 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.22 7.81 69 R 7.90 3.87 0.00 1.90 2.01 0.00 3.26 0.00 0.00 3.48 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.84 0.00 70 T 7.78 4.70 4.28 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 1.30 0.00 0.00 71 D 7.72 4.94 0.00 2.83 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 72 K 7.95 4.32 0.00 2.10 1.84 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.69 1.59 7.81 73 V 7.68 3.83 1.70 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 0.75 0.00 0.00 0.74 0.00 0.00 74 Y 6.88 3.57 0.00 3.28 2.91 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 75 Y 7.53 5.14 0.00 2.89 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 76 H 8.10 4.72 0.00 3.28 3.42 0.00 5.20 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 9.16 5.68 0.00 3.14 3.20 0.00 5.59 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 78 T 9.02 3.96 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 1.23 0.00 0.00 79 G 7.36 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 0.00 0.00 0.00 80 H 8.44 4.76 0.00 3.17 3.19 0.00 5.82 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 8.07 2.97 1.87 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 1.38 0.45 0.92 0.00 0.00 82 G 9.69 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 83 G 7.27 3.28 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 0.00 84 I 7.36 4.30 1.88 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 1.30 0.83 1.01 0.00 0.00 85 K 9.09 4.57 0.00 1.58 1.62 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.79 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.45 7.81 86 Q 8.77 4.66 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 7.12 0.00 0.00 0.00 0.00 0.00 2.19 2.22 0.00 87 A 7.77 5.15 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 88 T 7.75 4.36 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 1.26 0.00 0.00 89 F 9.25 3.94 0.00 3.26 3.28 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 90 E 7.79 4.13 0.00 2.49 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 2.34 2.40 0.00 91 E 8.55 4.24 0.00 2.14 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 2.27 2.33 0.00 92 M 8.11 4.02 0.00 1.46 1.70 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 2.15 2.63 0.00 93 I 7.21 3.61 1.63 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.08 0.82 0.00 0.00 94 A 7.00 4.24 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 95 R 8.92 4.07 0.00 1.95 2.15 0.00 3.00 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.55 0.00 96 R 7.98 3.45 0.00 1.92 2.22 0.00 3.10 0.00 0.00 3.36 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 97 P 0.00 4.63 0.00 2.14 2.33 0.00 3.84 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.91 0.00 98 E 8.22 3.93 0.00 1.97 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 2.39 2.35 0.00 99 R 7.68 4.23 0.00 2.02 1.88 0.00 3.10 0.00 0.00 3.06 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.73 0.00 100 V 7.31 3.58 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 1.46 0.00 0.00 0.50 0.00 0.00 101 I 7.72 3.93 1.90 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.96 0.93 0.00 0.00 102 E 7.66 4.27 0.00 2.35 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 2.46 2.68 0.00 103 I 8.29 4.15 2.02 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.91 1.08 0.00 0.00 104 A 8.23 4.17 1.52 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 0.00 105 V 7.61 4.12 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 0.76 0.00 0.00 0.85 0.00 0.00 106 K 7.34 4.48 0.00 2.34 2.06 0.00 2.19 0.00 0.00 1.79 0.00 0.00 3.35 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.49 1.60 7.81 107 G 7.73 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 0.00 0.00 0.00 108 M 7.41 4.21 0.00 2.02 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 2.93 2.51 0.00 109 L 7.29 4.22 0.00 1.74 1.64 0.80 0.94 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 0.00 110 P 0.00 4.76 0.00 2.21 2.21 0.00 3.86 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 2.02 1.96 0.00 111 K 8.54 3.60 0.00 2.03 1.71 0.00 1.81 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.35 1.40 7.81 112 G 7.90 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 0.00 113 P 0.00 4.37 0.00 2.18 2.02 0.00 3.61 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 114 L 7.85 4.10 0.00 1.76 1.67 0.92 0.99 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 0.00 115 G 8.07 4.21 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 0.00 116 R 7.85 4.19 0.00 2.12 2.04 0.00 3.11 0.00 0.00 3.07 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 117 A 7.85 4.08 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 0.00 118 M 8.40 3.98 0.00 2.02 2.26 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.49 0.00 119 F 8.04 3.91 0.00 3.08 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 0.00 120 R 7.48 4.26 0.00 1.97 2.17 0.00 3.38 0.00 0.00 3.30 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.91 0.00 121 K 7.71 4.50 0.00 1.55 1.38 0.00 0.61 0.00 0.00 0.89 0.00 0.00 2.59 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.83 1.23 7.81 122 L 8.41 5.42 0.00 1.32 1.31 0.90 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 123 K 8.81 4.85 0.00 1.91 1.71 0.00 1.64 0.00 0.00 2.00 0.00 0.00 3.13 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.51 7.81 124 V 7.97 4.04 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 0.87 0.00 0.00 1.05 0.00 0.00 125 Y 7.83 3.47 0.00 3.21 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 A 8.48 4.81 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 0.00 127 G 9.41 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 N 8.50 4.05 0.00 2.84 2.84 0.00 0.00 7.03 7.66 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 0.00 129 E 7.37 4.38 0.00 1.86 1.84 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 2.12 2.48 0.00 130 H 8.24 3.59 0.00 3.08 3.02 0.00 5.51 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 N 8.32 4.71 0.00 2.73 2.81 0.00 0.00 6.81 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 H 8.07 4.98 0.00 3.29 3.09 0.00 5.89 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 0.00 133 A 7.91 4.21 1.12 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 0.00 134 A 7.64 4.22 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 Q 7.64 3.83 0.00 1.57 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.10 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 136 Q 7.77 3.26 0.00 2.04 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.93 0.00 0.00 0.00 0.00 0.00 2.18 2.21 0.00 137 P 0.00 4.60 0.00 2.12 2.17 0.00 3.72 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 138 Q 8.26 4.50 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 139 V 8.45 3.97 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 0.73 0.00 0.00 0.97 0.00 0.00 140 L 8.31 4.52 0.00 1.83 1.71 0.85 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 141 D 8.83 4.38 0.00 2.82 2.68 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 0.00 142 I 8.41 3.56 1.84 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 1.26 0.29 0.88 0.00 0.00