NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2265 8.1633 120.2788 54.7280 33.3219 174.2600 2 K 4.0496 8.4884 126.1261 56.1065 32.5178 175.6878 3 G 3.9682 8.5790 113.5972 44.7310 0.0000 172.0935 4 D 4.5863 8.4503 119.5498 54.2880 41.9729 177.1032 5 T 3.8713 8.8617 122.7664 66.8442 68.5457 176.6719 6 K 3.8492 8.1681 120.9616 59.1337 32.1953 178.8244 7 V 3.8996 8.7107 119.0998 66.1906 31.4061 177.9050 8 I 3.7261 7.7489 119.3271 64.7241 36.8937 178.1540 9 N 4.2885 8.2118 117.0929 56.3328 38.2936 177.1345 10 Y 4.0775 8.0738 118.1383 61.0999 38.0492 178.3935 11 L 3.9216 8.6867 120.2166 58.1648 41.7142 179.5293 12 N 4.3808 8.5141 116.5516 55.9708 38.4068 177.5092 13 K 3.8644 8.1958 121.3771 59.3799 32.3397 178.8569 14 L 3.8097 8.1822 119.6247 57.6684 41.4168 179.0176 15 L 3.9429 7.9133 120.5844 58.2768 41.9348 179.2753 16 G 3.6045 8.1281 105.5243 47.8517 0.0000 175.3535 17 N 4.3498 8.0467 118.8590 56.1866 38.5675 177.3165 18 E 4.0908 8.3202 119.8877 59.5872 29.0989 179.5011 19 L 4.1972 8.2641 118.7877 57.3455 41.5422 180.0088 20 V 3.6397 7.7431 112.2761 64.1794 31.4239 178.1121 21 A 3.8584 8.1165 120.5646 55.2503 18.2057 179.5860 22 I 3.7596 8.1948 118.4982 64.8309 37.1939 178.4957 23 N 4.4033 7.8237 115.9515 56.4360 38.4496 177.4248 24 Q 3.8462 8.3935 121.3563 59.2379 29.0934 177.9281 25 Y 4.3259 8.2636 118.0928 60.9149 37.9680 177.7443 26 F 3.7669 8.4442 121.6288 61.1124 39.4442 176.8177 27 L 3.9120 8.2384 119.8871 58.5246 41.8748 178.3433 28 H 3.7523 8.0972 115.7720 58.8767 28.6173 177.0835 29 A 4.1471 8.3694 122.5594 55.8551 18.1001 180.0205 30 R 3.7814 7.7207 115.3938 58.7299 30.0944 179.3506 31 M 3.3980 7.8468 119.4356 58.1610 31.8968 178.4984 32 F 4.6317 7.6319 118.2366 60.5396 39.0570 177.7148 33 K 3.9412 8.3003 119.2865 59.5042 31.8335 178.0376 34 N 4.2286 7.8952 116.1080 56.7793 38.9094 176.2295 35 W 4.7689 7.8448 116.5960 57.4144 29.3034 177.2941 36 G 4.0230 8.3087 107.9365 45.8507 0.0000 175.2106 37 L 4.4789 8.0036 121.8402 53.1939 38.0508 177.1399 38 K 3.8646 7.9611 122.6125 59.7813 32.5575 177.5798 39 R 3.9287 8.3027 119.1529 59.2635 30.0144 178.4360 40 L 4.1371 7.7648 118.3446 57.2884 41.5881 178.7672 41 N 4.4440 8.1083 116.8520 56.7428 38.9605 176.4912 42 D 4.3245 7.9896 120.2672 57.4535 40.9954 179.1233 43 V 3.3217 7.6265 118.2985 66.1029 31.5063 177.9537 44 E 3.7572 8.2904 118.3490 59.2627 29.2676 178.6017 45 Y 3.8947 8.1356 119.7388 61.2075 38.8827 178.1635 46 H 4.2045 8.2220 116.3892 58.2846 28.6781 177.5930 47 E 3.6731 7.7364 120.9373 58.6494 29.1629 178.7272 48 S 4.0961 8.0143 113.7546 61.6066 62.3544 176.2617 49 I 3.5465 7.2644 122.1310 64.4683 36.8224 177.8552 50 D 4.2722 7.8053 119.5014 57.7713 40.6415 179.1406 51 E 4.1904 8.3102 118.6324 59.4473 29.3766 179.3552 52 M 4.0632 8.1707 119.0626 58.2958 31.9986 178.8085 53 K 3.9429 8.1331 118.7684 59.6867 32.1812 179.0977 54 H 4.0982 8.2076 116.1757 58.8098 28.6076 177.5325 55 A 4.2482 8.3157 122.7421 55.3889 18.1383 178.9671 56 D 4.3084 8.2490 116.4037 57.7287 41.2408 178.8032 57 R 3.8510 7.9238 118.3074 59.4665 30.0396 178.5987 58 Y 4.3109 7.8227 116.4131 61.2575 37.8519 178.8768 59 I 3.7910 8.2428 120.9558 64.6043 37.2069 178.4641 60 E 4.0452 8.5419 119.6065 59.0544 29.2340 179.5048 61 R 4.0003 8.1241 118.9565 59.5432 30.2053 178.2920 62 I 3.7428 8.4110 119.9405 64.7063 37.1624 178.3326 63 L 4.0135 8.1748 119.5204 57.7468 41.2117 179.4436 64 F 4.3629 8.1729 119.6375 61.2807 39.7246 176.6361 65 L 4.3094 8.3402 117.3020 53.9909 40.9539 177.1657 66 E 3.6402 7.9752 117.4692 57.4393 27.2449 174.5276 67 G 3.9651 8.1313 108.6889 44.0373 0.0000 173.5404 68 L 4.5255 8.0379 119.2009 52.0385 42.0678 175.1577 69 P 4.3723 0.0000 0.0000 62.6091 31.7515 175.9403 70 N 4.7075 9.6337 122.3391 52.4160 38.6954 173.8876 71 L 4.5984 8.2886 124.2190 54.5506 42.3706 177.6021 72 Q 4.1082 8.6228 122.3330 58.3018 29.2927 175.9747 73 D 4.7026 8.0275 116.6369 52.8230 42.0408 175.3038 74 L 4.5822 8.2571 125.0568 52.7356 44.1059 176.5755 75 G 3.8055 8.4662 115.4122 44.8399 0.0000 171.7572 76 K 4.1033 8.3118 120.6972 55.7358 32.4508 176.5939 77 L 4.0910 8.3855 126.8703 54.3865 42.2664 176.0813 78 N 4.8191 8.6570 121.6958 51.9869 39.8276 174.2488 79 I 3.8858 8.4963 126.5855 63.9609 37.7803 177.9212 80 G 4.3499 8.1736 103.1278 45.5051 0.0000 172.8642 81 E 4.7299 8.7593 117.6499 56.0224 31.2038 176.0905 82 D 4.9194 7.6663 118.1297 50.3130 43.9746 175.8989 83 V 4.0381 8.5600 119.4529 66.6000 31.3308 177.6549 84 E 3.8462 8.1749 117.9640 59.4517 29.4463 178.0933 85 E 4.0092 8.4957 119.5070 59.4917 29.5981 178.6708 86 M 4.1157 8.2922 117.0424 58.1298 31.5001 178.5049 87 L 4.1575 8.4741 120.5557 57.7118 41.8276 179.5353 88 R 3.8955 8.4973 118.9919 59.3063 29.9358 178.5885 89 S 4.1213 8.1138 113.2437 61.2848 62.3909 175.7064 90 D 4.2217 8.2098 121.6965 57.2832 40.5133 178.4812 91 L 4.0059 8.2508 120.6069 58.3342 42.0251 178.9721 92 A 3.9915 8.0760 120.5940 54.9457 18.2580 179.4009 93 L 3.8858 7.9443 119.0583 58.2555 42.0697 179.1298 94 E 4.0455 8.4135 118.5935 59.4780 29.5854 179.1711 95 L 4.0170 8.2229 119.2678 58.1461 41.7068 179.4789 96 D 4.5209 8.5373 119.0359 57.1990 40.6378 179.0923 97 G 3.6295 8.3269 106.2616 47.6110 0.0000 175.7256 98 A 4.0202 8.3790 123.4558 54.6493 18.4474 179.3812 99 K 3.8058 7.9685 117.9166 60.0296 32.3102 178.5462 100 N 4.3805 8.1338 116.4065 56.4127 38.4616 177.4057 101 L 3.9997 8.1236 120.3527 57.9221 41.6346 179.6824 102 R 3.9176 8.3621 118.3910 59.2560 29.9235 178.8138 103 E 3.8725 8.0703 118.3128 59.2198 29.7002 178.7394 104 A 2.8090 7.7721 120.7829 54.7206 18.3402 179.7154 105 I 3.7625 7.8675 118.5935 64.4361 36.9457 178.9068 106 G 3.5946 7.6140 105.4383 47.8265 0.0000 174.8935 107 Y 4.1076 7.6974 121.2772 60.2296 38.8774 177.1687 108 A 3.7940 8.3598 122.1994 55.4712 18.5330 179.0827 109 D 4.0836 7.9328 116.3668 57.2626 41.0654 178.2791 110 S 4.2115 7.4788 113.0438 59.8335 63.3888 175.6971 111 V 3.9849 6.8420 114.0554 60.7379 31.5942 175.4988 112 H 2.7714 6.9671 113.7318 56.7312 26.9102 176.4480 113 D 4.5209 7.3501 121.2516 53.4900 37.7738 176.1926 114 Y 4.2745 7.4420 121.1342 60.6336 38.3854 178.0562 115 V 3.7826 7.8476 113.1593 64.1163 31.8236 178.4104 116 S 4.1595 8.3240 114.9837 61.5572 62.6032 176.5770 117 R 3.8788 8.1470 121.3057 59.5405 29.8275 177.9411 118 D 4.3050 8.4484 117.9723 57.6802 41.3113 177.7150 119 M 3.9706 8.2704 118.8242 59.1285 32.0615 178.1470 120 M 4.1235 8.2208 118.7819 58.3871 32.1551 178.7677 121 I 3.7220 8.0992 120.3097 64.3005 37.3450 178.3241 122 E 3.9587 8.1618 119.4211 59.4400 29.3281 179.3943 123 I 3.5409 7.5720 119.6532 64.2663 37.0743 178.1028 124 L 3.9520 8.1952 121.4487 58.2667 41.9985 178.8985 125 R 3.8748 8.0712 118.4806 59.6965 29.9771 178.2513 126 D 4.3566 7.9640 118.2974 57.3406 40.7382 178.6303 127 E 3.9952 8.2212 119.2429 59.2894 29.3782 178.9820 128 E 4.1128 8.6104 119.9010 59.0179 29.6975 178.9932 129 G 3.6962 8.0006 105.4565 48.2385 0.0000 175.2467 130 H 4.4294 8.2086 118.8900 58.7020 28.6753 177.8616 131 I 3.8108 8.3330 121.9368 64.4973 36.9436 177.7808 132 D 4.3835 8.4482 118.9805 57.2094 41.0216 178.2845 133 W 4.1206 8.4263 128.6098 60.4435 30.7267 177.7915 134 L 3.7550 8.4395 119.0602 57.9482 41.1502 179.3457 135 E 3.9084 8.4584 118.5901 59.7441 29.3282 179.6803 136 T 3.7882 7.9415 115.5816 66.5529 68.5476 176.4300 137 E 3.7532 7.6356 120.3333 59.4884 29.2915 179.3946 138 L 3.7837 7.7885 118.8816 58.0088 41.5610 179.5077 139 D 4.3825 8.1279 118.6648 57.2298 40.6559 178.7072 140 L 3.9623 8.1999 119.9518 57.7960 41.5654 179.5303 141 I 3.4197 7.4722 119.6878 64.4369 36.7342 178.5415 142 Q 3.9298 7.3494 116.1968 58.8266 28.6504 178.5591 143 K 4.1270 8.1400 118.8980 59.1116 32.2666 178.5491 144 M 4.3722 8.4000 114.8624 54.1965 32.4158 177.4043 145 G 4.0749 7.5774 105.1246 45.7633 0.0000 174.3862 146 L 3.9621 8.3701 120.7621 57.9910 42.1587 179.2514 147 Q 3.9906 8.0254 117.4546 59.2782 28.8244 178.4409 148 N 4.3521 8.1844 116.8278 56.4043 38.3461 176.6730 149 Y 3.9434 7.8593 120.0397 60.6647 39.1364 177.8453 150 L 4.0911 8.3458 120.2067 57.9520 41.5902 179.2746 151 Q 3.9029 8.1796 119.1485 59.0664 28.7210 177.8730 152 A 4.0961 7.6350 119.8725 53.6129 18.6179 178.2520 153 Q 4.3263 7.8590 115.9996 55.6128 29.1467 177.5708 154 I 3.8884 7.3643 121.9613 63.3619 37.4315 176.6327 155 R 4.6522 7.5529 118.0214 53.7094 32.3434 175.6004 156 E 4.1270 8.7270 118.8806 56.6658 29.5919 176.6510 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.16 4.23 0.00 1.52 1.76 0.00 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.47 0.00 2 K 8.49 4.05 0.00 1.71 1.71 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.47 7.81 3 G 8.58 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 4 D 8.45 4.59 0.00 2.77 2.62 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 5 T 8.86 3.87 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 6 K 8.17 3.85 0.00 1.71 1.95 0.00 1.42 0.00 0.00 0.97 0.00 0.00 2.53 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.82 1.02 7.81 7 V 8.71 3.90 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 1.16 0.00 0.00 1.16 0.00 0.00 8 I 7.75 3.73 2.05 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 1.55 0.67 0.92 0.00 0.00 9 N 8.21 4.29 0.00 2.59 2.69 0.00 0.00 7.08 7.10 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 10 Y 8.07 4.08 0.00 3.30 2.92 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 11 L 8.69 3.92 0.00 2.03 1.80 1.11 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.51 4.38 0.00 2.79 2.82 0.00 0.00 6.71 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 13 K 8.20 3.86 0.00 1.81 1.97 0.00 1.59 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.43 1.45 7.81 14 L 8.18 3.81 0.00 1.00 1.11 0.95 0.52 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 15 L 7.91 3.94 0.00 1.67 1.83 1.06 1.12 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 16 G 8.13 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 17 N 8.05 4.35 0.00 2.97 2.91 0.00 0.00 7.05 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 18 E 8.32 4.09 0.00 2.25 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 2.74 2.89 0.00 19 L 8.26 4.20 0.00 1.66 1.73 0.94 0.99 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 20 V 7.74 3.64 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 0.82 0.00 0.00 0.94 0.00 0.00 21 A 8.12 3.86 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 22 I 8.19 3.76 2.04 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 1.55 1.07 0.90 0.00 0.00 23 N 7.82 4.40 0.00 2.80 2.87 0.00 0.00 6.74 7.89 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 24 Q 8.39 3.85 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.83 0.00 0.00 0.00 0.00 0.00 2.19 2.07 0.00 25 Y 8.26 4.33 0.00 3.21 2.85 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 26 F 8.44 3.77 0.00 3.42 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 27 L 8.24 3.91 0.00 1.96 1.58 0.89 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.10 3.75 0.00 3.54 3.20 0.00 5.72 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 29 A 8.37 4.15 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 30 R 7.72 3.78 0.00 1.72 1.87 0.00 3.24 0.00 0.00 3.06 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.60 0.00 31 M 7.85 3.40 0.00 0.89 1.63 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.11 0.00 32 F 7.63 4.63 0.00 3.31 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.30 3.94 0.00 1.97 1.88 0.00 1.57 0.00 0.00 1.60 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.42 7.81 34 N 7.90 4.23 0.00 2.67 2.69 0.00 0.00 7.35 8.64 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 35 W 7.84 4.77 0.00 3.75 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.31 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 37 L 8.00 4.48 0.00 2.20 1.67 1.06 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 38 K 7.96 3.86 0.00 1.99 1.82 0.00 1.59 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.57 7.81 39 R 8.30 3.93 0.00 2.00 2.02 0.00 3.47 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.79 0.00 40 L 7.76 4.14 0.00 1.68 1.09 1.13 0.31 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 41 N 8.11 4.44 0.00 3.13 2.99 0.00 0.00 7.10 8.93 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 42 D 7.99 4.32 0.00 2.88 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 43 V 7.63 3.32 1.76 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 -0.55 0.00 0.00 0.75 0.00 0.00 44 E 8.29 3.76 0.00 2.21 2.16 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 2.65 3.13 0.00 45 Y 8.14 3.89 0.00 2.96 3.04 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 0.00 0.00 0.00 46 H 8.22 4.20 0.00 3.23 3.22 0.00 5.66 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 47 E 7.74 3.67 0.00 1.16 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 1.93 2.02 0.00 48 S 8.01 4.10 0.00 3.95 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 49 I 7.26 3.55 1.85 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.53 0.85 0.00 0.00 50 D 7.81 4.27 0.00 2.83 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 51 E 8.31 4.19 0.00 2.17 2.20 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 2.69 2.79 0.00 52 M 8.17 4.06 0.00 2.04 2.23 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.55 0.00 53 K 8.13 3.94 0.00 1.88 1.82 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.64 7.81 54 H 8.21 4.10 0.00 3.56 3.48 0.00 5.65 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 55 A 8.32 4.25 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 56 D 8.25 4.31 0.00 2.92 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 57 R 7.92 3.85 0.00 1.81 1.76 0.00 3.14 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.72 0.00 58 Y 7.82 4.31 0.00 3.24 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 59 I 8.24 3.79 2.04 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.78 0.95 0.00 0.00 60 E 8.54 4.05 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.65 0.00 61 R 8.12 4.00 0.00 2.15 2.21 0.00 3.36 0.00 0.00 3.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.85 0.00 62 I 8.41 3.74 1.94 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 1.59 0.82 0.99 0.00 0.00 63 L 8.17 4.01 0.00 2.09 1.80 0.95 0.89 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 64 F 8.17 4.36 0.00 3.01 3.31 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 65 L 8.34 4.31 0.00 1.67 1.62 0.99 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.98 3.64 0.00 2.05 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 2.17 2.28 0.00 67 G 8.13 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 68 L 8.04 4.53 0.00 1.62 1.63 0.92 0.98 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 69 P 0.00 4.37 0.00 2.06 2.03 0.00 3.66 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.12 0.00 70 N 9.63 4.71 0.00 2.60 2.82 0.00 0.00 7.11 8.42 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 71 L 8.29 4.60 0.00 1.64 1.65 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.62 4.11 0.00 1.97 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.54 6.71 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 73 D 8.03 4.70 0.00 2.68 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.26 4.58 0.00 1.52 1.50 0.95 1.04 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 75 G 8.47 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 K 8.31 4.10 0.00 1.72 1.73 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.45 7.81 77 L 8.39 4.09 0.00 1.64 1.56 0.95 0.97 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 78 N 8.66 4.82 0.00 2.64 2.70 0.00 0.00 7.23 7.97 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 79 I 8.50 3.89 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 1.34 0.92 0.93 0.00 0.00 80 G 8.17 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 0.00 0.00 0.00 0.00 81 E 8.76 4.73 0.00 2.00 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 2.28 2.31 0.00 82 D 7.67 4.92 0.00 2.77 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 83 V 8.56 4.04 2.20 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 1.25 0.00 0.00 1.24 0.00 0.00 84 E 8.17 3.85 0.00 2.02 1.91 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 2.32 2.26 0.00 85 E 8.50 4.01 0.00 2.26 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 0.00 2.35 2.35 0.00 86 M 8.29 4.12 0.00 2.35 1.76 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.95 0.00 87 L 8.47 4.16 0.00 2.01 1.78 1.24 0.60 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 88 R 8.50 3.90 0.00 2.10 1.94 0.00 3.09 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 89 S 8.11 4.12 0.00 4.07 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.21 4.22 0.00 3.13 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 8.25 4.01 0.00 1.81 1.89 0.98 1.10 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 92 A 8.08 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 93 L 7.94 3.89 0.00 1.88 1.81 0.90 0.83 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 94 E 8.41 4.05 0.00 2.28 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 2.62 2.72 0.00 95 L 8.22 4.02 0.00 2.02 1.75 0.96 1.44 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 96 D 8.54 4.52 0.00 2.69 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 G 8.33 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 98 A 8.38 4.02 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 99 K 7.97 3.81 0.00 2.05 2.03 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.51 7.81 100 N 8.13 4.38 0.00 2.98 2.92 0.00 0.00 7.14 6.76 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 0.00 101 L 8.12 4.00 0.00 2.00 1.74 0.98 1.19 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 0.00 102 R 8.36 3.92 0.00 1.95 1.99 0.00 3.14 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.96 0.00 103 E 8.07 3.87 0.00 2.07 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 2.38 2.38 0.00 104 A 7.77 2.81 1.03 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 0.00 105 I 7.87 3.76 2.03 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 0.88 0.91 0.00 0.00 106 G 7.61 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 Y 7.70 4.11 0.00 3.13 2.94 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 0.00 108 A 8.36 3.79 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 0.00 109 D 7.93 4.08 0.00 2.85 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 S 7.48 4.21 0.00 3.96 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 0.00 111 V 6.84 3.98 1.94 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 0.62 0.00 0.00 0.64 0.00 0.00 112 H 6.97 2.77 0.00 3.19 3.31 0.00 5.84 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.35 4.52 0.00 2.62 2.46 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 0.00 114 Y 7.44 4.27 0.00 3.10 2.94 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 0.00 115 V 7.85 3.78 2.14 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 0.93 0.00 0.00 0.97 0.00 0.00 116 S 8.32 4.16 0.00 4.16 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 0.00 117 R 8.15 3.88 0.00 1.89 2.20 0.00 3.33 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 118 D 8.45 4.30 0.00 2.95 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 M 8.27 3.97 0.00 2.23 2.03 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.45 0.00 120 M 8.22 4.12 0.00 2.15 2.26 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 2.90 2.78 0.00 121 I 8.10 3.72 2.00 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 1.01 0.91 0.00 0.00 122 E 8.16 3.96 0.00 2.14 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 2.34 0.00 123 I 7.57 3.54 1.94 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.71 0.76 0.00 0.00 124 L 8.20 3.95 0.00 1.84 1.86 0.99 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 125 R 8.07 3.87 0.00 2.03 2.15 0.00 3.15 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 126 D 7.96 4.36 0.00 3.03 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 E 8.22 4.00 0.00 2.16 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 0.00 2.58 2.52 0.00 128 E 8.61 4.11 0.00 2.26 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 2.34 2.36 0.00 129 G 8.00 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 0.00 130 H 8.21 4.43 0.00 3.65 3.59 0.00 5.65 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 0.00 131 I 8.33 3.81 2.12 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.95 0.97 0.00 0.00 132 D 8.45 4.38 0.00 2.96 2.95 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 0.00 0.00 0.00 133 W 8.43 4.12 0.00 3.55 3.48 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 0.00 0.00 0.00 0.00 134 L 8.44 3.75 0.00 1.97 1.75 1.28 1.30 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 0.00 135 E 8.46 3.91 0.00 2.18 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 2.33 2.48 0.00 136 T 7.94 3.79 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 1.17 0.00 0.00 137 E 7.64 3.75 0.00 1.54 1.64 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 1.47 1.47 0.00 138 L 7.79 3.78 0.00 1.70 1.62 0.89 1.20 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 0.00 139 D 8.13 4.38 0.00 2.78 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 0.00 140 L 8.20 3.96 0.00 1.87 1.84 0.96 0.66 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 0.00 141 I 7.47 3.42 1.72 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.24 -0.29 0.69 0.00 0.00 142 Q 7.35 3.93 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.96 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 143 K 8.14 4.13 0.00 1.71 1.86 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.65 7.81 144 M 8.40 4.37 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.83 0.00 145 G 7.58 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 L 8.37 3.96 0.00 1.74 1.66 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 147 Q 8.03 3.99 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.66 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 148 N 8.18 4.35 0.00 2.97 2.89 0.00 0.00 6.66 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 0.00 149 Y 7.86 3.94 0.00 3.03 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 L 8.35 4.09 0.00 2.03 1.70 1.08 1.04 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 0.00 151 Q 8.18 3.90 0.00 2.12 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 152 A 7.64 4.10 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 7.86 4.33 0.00 1.95 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.76 0.00 0.00 0.00 0.00 0.00 2.19 2.20 0.00 154 I 7.36 3.89 2.04 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 1.31 0.46 0.91 0.00 0.00 155 R 7.55 4.65 0.00 1.75 1.80 0.00 3.20 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 156 E 8.73 4.13 0.00 2.11 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 2.26 2.29 0.00