NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2246 8.1633 120.2902 54.5839 32.6385 174.4291 2 K 4.0275 8.4998 126.7301 56.5066 32.4657 175.7735 3 G 3.9932 8.4960 113.1933 44.3522 0.0000 172.2673 4 D 4.5188 8.3998 119.6748 53.8350 41.9527 176.7478 5 K 3.8548 9.0521 126.6544 60.0374 32.1985 178.9601 6 I 3.7861 7.9421 119.3722 64.0661 36.9457 178.4984 7 V 3.7514 8.0598 118.7846 66.2172 31.5031 178.0097 8 I 3.7824 7.9336 119.5525 64.4014 36.8711 178.5122 9 Q 3.9358 8.0307 118.9673 59.1859 28.4554 178.4405 10 H 4.0963 8.1926 117.1371 58.8476 28.6964 177.6838 11 L 3.9979 8.3267 121.1313 58.1577 41.4852 179.4988 12 N 4.3265 8.3810 116.2974 55.9953 38.4340 177.4717 13 K 3.9244 8.0443 121.1531 59.5879 32.3032 179.0211 14 I 3.7386 8.0219 120.3361 64.2188 37.0199 178.0694 15 L 4.0438 8.2700 121.5641 58.1610 41.7420 179.3030 16 G 3.6247 8.1398 105.6352 47.7675 0.0000 175.4312 17 N 4.3230 7.9262 118.3237 56.2096 38.5225 177.2898 18 E 3.9716 8.3050 119.9474 59.5230 29.4270 179.5211 19 L 3.9455 8.0087 118.9015 57.6508 41.5401 179.7163 20 I 3.6149 7.5595 119.5182 64.1452 36.9680 178.2265 21 A 3.3102 7.8332 121.5237 54.9240 18.1637 179.4009 22 I 3.5568 7.7310 118.5756 64.8737 37.2553 178.4270 23 N 4.3294 7.7846 116.6764 56.2749 38.4088 177.2870 24 Q 3.8869 8.0413 121.0695 59.5704 29.0871 178.1199 25 Y 4.5128 8.0075 117.8968 60.9456 37.8827 177.9667 26 F 4.1288 8.4488 121.9406 60.9820 39.4212 177.0822 27 L 3.9462 8.2091 120.0891 58.5220 41.8877 178.5881 28 H 3.9042 8.2810 115.9426 58.6380 28.5729 177.5611 29 A 4.1665 8.3865 122.9189 55.5281 18.3062 180.0273 30 R 3.7999 7.6901 116.1890 59.1281 30.1474 179.2984 31 M 3.5127 7.7434 119.0317 58.1099 31.7468 178.1942 32 Y 4.4471 7.7079 117.3816 61.2530 38.1241 178.6952 33 E 3.9860 8.2157 118.4729 59.4688 29.3913 178.6174 34 D 4.3350 7.8009 118.1348 56.3217 41.3244 177.2550 35 W 4.9622 7.7656 116.7631 56.4905 29.5453 177.0018 36 G 3.9682 8.2579 108.1922 45.8046 0.0000 174.2893 37 L 4.7980 8.0209 121.8257 52.5680 40.4787 176.6700 38 E 3.9376 8.5235 123.5905 59.6866 30.0211 179.4834 39 K 3.9459 7.9723 117.9804 59.3837 32.1181 179.2424 40 L 4.0191 7.8218 120.2774 57.9594 42.0087 179.0828 41 G 3.7109 8.3259 105.9748 47.6618 0.0000 175.6445 42 K 3.9124 8.3774 122.5756 59.3190 32.1314 178.4223 43 H 3.8682 8.0991 118.4272 59.3450 29.7159 177.0547 44 E 3.8177 8.1811 120.3574 59.4121 29.2573 178.7786 45 Y 4.0136 8.0926 119.4606 61.1768 38.9182 177.9380 46 H 4.0845 8.2337 117.0776 58.7838 28.7280 177.4723 47 E 3.7326 8.2088 121.4372 59.0551 29.3565 178.7817 48 S 4.2426 8.2014 113.5411 61.4567 62.4244 176.2561 49 I 3.5893 7.4421 122.4816 64.4555 36.8235 178.1487 50 D 4.2510 8.1244 119.7435 57.3876 40.4937 178.7625 51 E 3.9331 8.1603 119.1231 59.4479 29.3450 179.2409 52 M 4.0138 7.8685 118.8713 58.4169 32.0206 178.9817 53 K 3.9810 8.1065 118.6293 59.5323 32.1249 179.2756 54 H 4.2207 8.2398 116.3904 58.8176 28.5962 177.4704 55 A 3.9803 8.2423 122.8686 55.3346 18.2004 179.0334 56 D 4.2652 8.2722 116.4384 57.6467 41.2731 178.7841 57 K 4.0427 8.0854 118.8505 59.2716 31.9164 179.4673 58 L 3.9932 7.9858 119.3671 57.8798 41.6182 179.4180 59 I 3.7148 8.0072 120.0004 64.4423 37.0563 178.6926 60 K 4.0207 8.1537 119.1714 59.3710 31.8086 179.4308 61 R 4.0203 8.0571 118.9876 59.4809 29.9586 178.4830 62 I 3.7106 8.1189 119.9448 64.4646 37.1067 178.2909 63 L 3.9883 7.9823 119.6055 57.8986 41.2705 179.4021 64 F 4.3399 8.1256 119.1290 61.2616 39.6346 176.4557 65 L 4.5468 8.1162 117.3634 53.9169 40.9935 177.1136 66 E 3.5517 7.9688 117.4825 57.4213 27.2271 174.5630 67 G 3.9495 8.1134 108.0444 44.0196 0.0000 173.6468 68 L 4.5548 8.0098 118.8282 51.8800 42.5859 175.2489 69 P 4.2769 0.0000 0.0000 63.0138 31.6159 176.0760 70 N 4.6696 8.9066 122.3760 52.3152 38.0189 174.1022 71 L 4.4866 8.0707 123.1509 54.4498 42.7253 177.9989 72 Q 4.0251 8.1385 120.4645 58.8967 29.2695 175.9850 73 E 4.2309 8.4401 117.1774 55.3854 30.1525 175.7118 74 L 4.5631 8.3271 125.1694 52.9094 44.1818 176.5085 75 G 3.8695 8.4156 115.4831 44.2284 0.0000 172.1195 76 K 3.9826 8.3914 120.5837 56.3742 32.4637 176.2779 77 L 4.3815 8.3675 126.3482 53.9852 42.6362 177.0768 78 L 4.5176 8.3252 124.1468 53.2488 40.7558 174.6911 79 I 4.2126 7.9714 122.9163 60.1163 38.1967 176.4903 80 G 4.0663 8.6649 114.1994 44.7474 0.0000 172.8966 81 E 4.7371 9.6767 118.3008 56.6210 31.2343 176.4873 82 H 5.0092 7.7041 113.5294 53.1384 32.9018 173.6178 83 T 4.2543 8.7442 117.3917 67.3051 68.3885 176.0027 84 K 3.7809 8.2493 120.3051 59.9230 32.0790 178.2708 85 E 3.9145 7.8959 118.6547 59.5147 29.6475 178.4245 86 M 4.0171 8.4148 119.1364 58.3554 31.9662 178.7537 87 L 4.1547 8.3257 119.3364 57.9048 41.7055 179.4628 88 E 4.0274 8.1765 118.2510 59.5379 29.3819 179.1904 89 C 4.2211 8.5468 117.2430 63.0250 28.2359 175.9494 90 D 4.6973 8.4189 120.5332 57.1355 40.3670 178.6539 91 L 3.9961 8.0108 121.1121 57.9220 41.9623 178.9320 92 K 3.9060 8.3649 118.8301 59.5239 32.1684 178.7780 93 L 4.1305 7.9198 120.2819 58.5514 41.7987 179.0271 94 E 4.1447 8.2114 116.7526 58.9795 29.4847 179.1200 95 Q 4.1885 8.0856 118.0563 58.7012 29.0082 177.9073 96 A 4.0700 8.8318 121.5375 55.2262 18.4997 179.3785 97 G 3.7470 8.0907 103.3427 46.9407 0.0000 175.8518 98 L 3.9973 8.0378 121.8852 57.8172 41.6601 177.8595 99 P 4.2541 0.0000 0.0000 65.6026 31.1072 178.4730 100 D 4.3393 8.2072 117.7284 57.4633 40.7692 178.7173 101 L 4.0107 7.8781 118.8812 57.8473 41.7045 179.6908 102 K 3.9754 8.4037 118.3982 59.3825 31.9306 179.3540 103 A 4.0426 8.5033 121.3466 54.9743 18.1968 179.5981 104 A 3.7204 8.4000 119.8068 55.2631 18.4555 179.9526 105 I 3.6418 8.1025 118.3945 64.3675 37.2095 178.5093 106 A 3.9920 8.0823 121.6621 55.3809 18.1339 179.1103 107 Y 3.8875 8.0937 119.4456 60.4115 38.8180 177.8706 108 C 4.0337 8.4020 117.9637 62.6062 28.1725 175.9077 109 E 3.9230 8.1262 120.4159 59.5431 29.1529 179.5428 110 S 4.1087 7.8306 113.8735 60.7032 62.5014 175.8641 111 V 4.2329 6.7509 113.0455 60.0298 31.7309 175.9495 112 G 3.0234 7.3436 106.0277 46.6736 0.0000 175.6716 113 D 4.4491 7.3013 120.8727 52.7744 38.0634 176.0612 114 Y 4.2803 7.1572 120.9425 60.4880 38.4676 177.8063 115 A 4.0509 8.0229 121.5732 55.2886 18.6310 179.6542 116 S 4.1137 8.4086 113.7750 61.6375 62.8133 176.7875 117 R 3.9156 7.9692 121.2763 59.7028 29.8505 178.4846 118 E 4.0272 8.2626 118.2327 59.1527 29.3877 179.1506 119 L 4.1094 7.8439 120.4676 58.2103 42.1440 179.0800 120 L 4.0483 8.1409 118.9976 57.6145 41.4071 179.3006 121 E 3.9745 8.5172 119.0984 59.4535 29.5454 178.9688 122 D 4.5054 8.0036 118.7324 57.6408 40.8575 179.0481 123 I 3.5536 7.5160 119.6470 64.1448 37.0660 178.2283 124 L 3.9526 8.2245 121.5539 58.2935 42.0131 178.8389 125 E 4.0006 8.4630 118.7603 59.5292 29.3632 179.4015 126 S 4.1924 8.0393 112.6994 61.3935 62.4988 176.0366 127 E 4.0966 8.6043 121.7092 59.5362 29.2108 179.1512 128 E 4.1194 8.4545 118.1591 58.7551 29.4121 178.8111 129 D 4.4158 7.6501 118.0187 57.3473 41.4245 177.6549 130 H 4.3682 8.3532 118.8420 59.3299 29.8489 177.2606 131 I 3.7525 8.0419 121.7340 64.2972 36.8776 177.7687 132 D 4.3281 7.9513 118.4515 57.2150 41.0617 178.0829 133 W 4.1050 8.3437 128.7443 60.5068 30.7467 177.8854 134 L 3.8797 8.3966 118.8355 57.9449 41.1338 179.3721 135 E 3.9435 8.6463 118.8801 59.5813 29.3266 179.6682 136 T 3.7612 7.9640 115.9043 66.6347 68.4691 176.6743 137 Q 3.6393 7.5818 119.9684 58.8601 28.7435 179.1227 138 L 3.7366 7.5195 119.6953 57.8306 41.7647 179.3512 139 D 4.4504 8.0624 118.8125 57.1086 40.6440 178.8746 140 L 3.9417 8.1055 120.0782 57.7713 41.6170 179.3944 141 I 3.5329 7.4533 119.7763 64.6002 36.7685 178.2562 142 D 4.3210 7.6407 118.0401 57.1158 40.6555 178.5363 143 K 4.2068 7.7335 118.1115 57.8911 32.3758 178.2253 144 I 4.3535 8.0485 110.3359 59.2851 39.2166 176.4386 145 G 4.0652 7.8989 107.9359 46.0586 0.0000 174.3023 146 L 3.9893 8.5300 122.6933 58.0969 42.0871 179.2796 147 E 3.9616 8.1941 117.8844 59.7107 29.4576 179.0913 148 N 4.3585 8.0991 115.8695 56.2342 38.4856 176.6698 149 Y 3.9658 7.9014 120.0042 60.8247 39.2081 177.9830 150 L 4.0503 8.3213 120.1268 57.7276 41.5467 179.2235 151 Q 3.9466 8.0364 119.5622 59.2977 28.8026 178.2593 152 S 4.2649 7.7835 113.9784 60.0380 63.1787 175.2961 153 Q 4.3602 7.4306 120.2520 55.9005 28.6990 177.2304 154 M 4.3281 7.6579 123.0364 57.4913 31.9368 176.1156 155 D 4.5449 7.8414 121.6167 54.3797 41.4600 176.3164 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 4.22 0.00 1.30 1.85 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.43 0.00 2 K 8.50 4.03 0.00 1.70 1.70 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.16 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.41 1.41 7.81 3 G 8.50 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 0.00 0.00 0.00 4 D 8.40 4.52 0.00 2.77 2.63 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 5 K 9.05 3.85 0.00 1.85 1.80 0.00 1.75 0.00 0.00 1.79 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.52 7.81 6 I 7.94 3.79 1.89 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.73 -0.12 0.00 0.00 7 V 8.06 3.75 2.32 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 1.24 0.00 0.00 1.14 0.00 0.00 8 I 7.93 3.78 1.99 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.54 0.90 0.00 0.00 9 Q 8.03 3.94 0.00 2.17 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.57 0.00 10 H 8.19 4.10 0.00 3.36 3.33 0.00 5.63 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 11 L 8.33 4.00 0.00 1.87 1.75 0.96 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.38 4.33 0.00 2.95 2.85 0.00 0.00 6.70 6.67 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 13 K 8.04 3.92 0.00 1.80 2.00 0.00 1.59 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.46 7.81 14 I 8.02 3.74 2.02 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 1.65 0.72 0.92 0.00 0.00 15 L 8.27 4.04 0.00 1.83 1.87 0.96 1.07 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 16 G 8.14 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 17 N 7.93 4.32 0.00 3.01 2.88 0.00 0.00 7.02 8.21 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 18 E 8.31 3.97 0.00 2.12 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 2.58 2.53 0.00 19 L 8.01 3.95 0.00 1.80 1.67 0.89 0.56 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 20 I 7.56 3.61 1.98 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.75 0.89 0.00 0.00 21 A 7.83 3.31 1.08 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 0.00 0.00 22 I 7.73 3.56 1.95 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.87 0.85 0.00 0.00 23 N 7.78 4.33 0.00 2.70 2.82 0.00 0.00 6.74 8.80 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 24 Q 8.04 3.89 0.00 2.05 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.48 2.28 0.00 25 Y 8.01 4.51 0.00 3.00 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 26 F 8.45 4.13 0.00 3.31 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 27 L 8.21 3.95 0.00 1.87 1.78 0.89 0.91 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 28 H 8.28 3.90 0.00 3.40 3.11 0.00 5.70 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 8.39 4.17 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 30 R 7.69 3.80 0.00 1.66 1.82 0.00 3.32 0.00 0.00 2.84 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.56 0.00 31 M 7.74 3.51 0.00 0.90 1.67 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 2.47 2.17 0.00 32 Y 7.71 4.45 0.00 3.22 3.11 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 33 E 8.22 3.99 0.00 2.17 2.17 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 2.33 2.24 0.00 34 D 7.80 4.34 0.00 2.62 2.58 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 0.00 35 W 7.77 4.96 0.00 3.72 3.11 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 36 G 8.26 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 37 L 8.02 4.80 0.00 2.12 1.63 1.01 1.33 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 38 E 8.52 3.94 0.00 2.18 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 0.00 2.32 2.39 0.00 39 K 7.97 3.95 0.00 1.95 1.89 0.00 1.85 0.00 0.00 1.55 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.43 7.81 40 L 7.82 4.02 0.00 1.47 0.94 1.09 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.33 3.71 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 0.00 0.00 0.00 42 K 8.38 3.91 0.00 1.84 1.78 0.00 1.62 0.00 0.00 1.58 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.23 1.35 7.81 43 H 8.10 3.87 0.00 3.16 3.05 0.00 5.84 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 44 E 8.18 3.82 0.00 2.31 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 0.00 2.69 3.11 0.00 45 Y 8.09 4.01 0.00 3.07 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 46 H 8.23 4.08 0.00 3.20 3.15 0.00 5.69 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 47 E 8.21 3.73 0.00 1.81 1.75 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 1.47 2.01 0.00 48 S 8.20 4.24 0.00 4.15 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 49 I 7.44 3.59 1.85 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.24 0.81 0.00 0.00 50 D 8.12 4.25 0.00 2.78 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 51 E 8.16 3.93 0.00 2.14 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.56 0.00 52 M 7.87 4.01 0.00 2.04 2.24 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.53 0.00 53 K 8.11 3.98 0.00 1.93 1.85 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.62 7.81 54 H 8.24 4.22 0.00 3.44 3.32 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 8.24 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 56 D 8.27 4.27 0.00 2.89 2.86 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 57 K 8.09 4.04 0.00 2.02 1.85 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.73 7.81 58 L 7.99 3.99 0.00 1.88 1.72 0.96 0.84 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 59 I 8.01 3.71 2.03 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 1.52 1.05 0.92 0.00 0.00 60 K 8.15 4.02 0.00 1.97 1.86 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.47 1.60 7.81 61 R 8.06 4.02 0.00 1.99 2.11 0.00 3.36 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.81 0.00 62 I 8.12 3.71 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 1.54 0.75 0.94 0.00 0.00 63 L 7.98 3.99 0.00 1.91 1.77 0.94 0.80 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 64 F 8.13 4.34 0.00 2.96 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 L 8.12 4.55 0.00 2.02 1.60 0.83 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.97 3.55 0.00 2.03 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 2.17 2.26 0.00 67 G 8.11 3.95 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 0.00 0.00 0.00 68 L 8.01 4.55 0.00 1.61 1.60 0.91 0.99 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 69 P 0.00 4.28 0.00 2.03 2.01 0.00 3.72 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 2.04 2.09 0.00 70 N 8.91 4.67 0.00 2.65 2.73 0.00 0.00 7.17 7.36 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 71 L 8.07 4.49 0.00 1.65 1.65 0.90 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.14 4.03 0.00 1.97 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.90 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 73 E 8.44 4.23 0.00 1.97 1.85 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 2.31 2.22 0.00 74 L 8.33 4.56 0.00 1.52 1.49 0.89 1.03 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 75 G 8.42 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 76 K 8.39 3.98 0.00 1.72 1.74 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.47 7.81 77 L 8.37 4.38 0.00 1.64 1.56 0.87 0.97 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 78 L 8.33 4.52 0.00 1.83 1.67 0.96 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 79 I 7.97 4.21 1.91 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.77 0.95 0.00 0.00 80 G 8.66 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 81 E 9.68 4.74 0.00 2.04 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 0.00 2.33 2.44 0.00 82 H 7.70 5.01 0.00 3.20 3.24 0.00 5.49 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 T 8.74 4.25 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 1.46 0.00 0.00 84 K 8.25 3.78 0.00 1.85 1.91 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.71 1.48 7.81 85 E 7.90 3.91 0.00 1.81 1.80 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 2.36 2.38 0.00 86 M 8.41 4.02 0.00 1.73 2.28 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.37 0.00 87 L 8.33 4.15 0.00 1.84 1.71 0.77 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 88 E 8.18 4.03 0.00 2.22 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 0.00 2.32 2.58 0.00 89 C 8.55 4.22 0.00 3.21 3.22 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 90 D 8.42 4.70 0.00 2.97 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 8.01 4.00 0.00 1.91 1.87 0.94 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 92 K 8.36 3.91 0.00 2.01 1.89 0.00 1.77 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.79 7.81 93 L 7.92 4.13 0.00 1.91 1.99 0.86 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.21 4.14 0.00 2.19 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 2.69 2.38 0.00 95 Q 8.09 4.19 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 2.38 2.67 0.00 96 A 8.83 4.07 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 97 G 8.09 3.75 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 0.00 0.00 0.00 98 L 8.04 4.00 0.00 1.92 1.79 0.95 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 99 P 0.00 4.25 0.00 2.17 2.12 0.00 3.88 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 2.13 2.20 0.00 100 D 8.21 4.34 0.00 2.89 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 0.00 101 L 7.88 4.01 0.00 1.85 1.73 0.96 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 102 K 8.40 3.98 0.00 1.94 1.87 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.72 7.81 103 A 8.50 4.04 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 0.00 104 A 8.40 3.72 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 0.00 105 I 8.10 3.64 2.02 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 1.47 0.88 0.93 0.00 0.00 106 A 8.08 3.99 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 0.00 107 Y 8.09 3.89 0.00 3.07 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.40 4.03 0.00 3.13 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 0.00 109 E 8.13 3.92 0.00 2.26 1.98 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 2.38 2.50 0.00 110 S 7.83 4.11 0.00 3.92 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 0.00 111 V 6.75 4.23 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 0.34 0.00 0.00 0.67 0.00 0.00 112 G 7.34 3.02 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 0.00 113 D 7.30 4.45 0.00 2.61 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 7.16 4.28 0.00 3.08 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 0.00 115 A 8.02 4.05 1.38 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 0.00 116 S 8.41 4.11 0.00 4.14 3.96 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 0.00 117 R 7.97 3.92 0.00 1.94 2.19 0.00 3.22 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.72 0.00 118 E 8.26 4.03 0.00 2.24 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 0.00 2.60 2.49 0.00 119 L 7.84 4.11 0.00 1.76 1.88 0.99 0.64 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 0.00 120 L 8.14 4.05 0.00 1.92 1.71 0.96 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 121 E 8.52 3.97 0.00 2.18 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 0.00 2.35 2.50 0.00 122 D 8.00 4.51 0.00 2.86 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 0.00 123 I 7.52 3.55 1.94 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 1.09 0.80 0.76 0.00 0.00 124 L 8.22 3.95 0.00 1.80 1.90 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 125 E 8.46 4.00 0.00 2.18 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 0.00 2.35 2.64 0.00 126 S 8.04 4.19 0.00 3.99 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 0.00 127 E 8.60 4.10 0.00 2.16 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 2.63 2.54 0.00 128 E 8.45 4.12 0.00 2.06 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 2.37 2.60 0.00 129 D 7.65 4.42 0.00 3.18 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 0.00 130 H 8.35 4.37 0.00 3.41 3.36 0.00 5.66 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 I 8.04 3.75 2.14 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 1.45 0.43 0.95 0.00 0.00 132 D 7.95 4.33 0.00 2.94 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 0.00 133 W 8.34 4.10 0.00 3.52 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 L 8.40 3.88 0.00 1.96 1.73 0.74 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.65 3.94 0.00 2.07 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.68 0.00 136 T 7.96 3.76 4.16 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 1.09 0.00 0.00 137 Q 7.58 3.64 0.00 1.65 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 138 L 7.52 3.74 0.00 1.74 1.60 0.87 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 139 D 8.06 4.45 0.00 2.88 2.64 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 0.00 140 L 8.11 3.94 0.00 1.83 1.65 0.89 0.79 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 0.00 141 I 7.45 3.53 1.77 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 -0.16 0.80 0.00 0.00 142 D 7.64 4.32 0.00 2.80 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 0.00 143 K 7.73 4.21 0.00 1.74 1.84 0.00 1.62 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.62 7.81 144 I 8.05 4.35 1.89 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 1.78 0.72 0.92 0.00 0.00 145 G 7.90 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 8.53 3.99 0.00 1.76 1.68 0.98 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 0.00 147 E 8.19 3.96 0.00 2.09 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 2.39 2.46 0.00 148 N 8.10 4.36 0.00 2.93 2.87 0.00 0.00 6.72 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 7.90 3.97 0.00 2.93 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 0.00 150 L 8.32 4.05 0.00 1.73 1.71 0.93 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 8.04 3.95 0.00 2.18 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.85 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 152 S 7.78 4.26 0.00 3.82 3.76 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 0.00 153 Q 7.43 4.36 0.00 1.89 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.82 0.00 0.00 0.00 0.00 0.00 1.78 2.04 0.00 154 M 7.66 4.33 0.00 2.00 2.18 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 2.87 2.44 0.00 155 D 7.84 4.54 0.00 2.62 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