NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 2.7852 8.2644 123.5159 50.8904 19.8811 176.1395 2 F 3.8265 7.6478 122.2116 57.2404 39.7648 169.2929 3 V 4.1843 8.4388 127.9282 60.4237 34.0941 175.0211 4 G 3.7660 8.6642 116.3242 45.8659 0.0000 172.0836 5 L 4.5706 7.9050 120.8887 53.0748 43.4243 177.4184 6 S 4.4634 9.0601 117.4090 57.4502 65.4492 174.9619 7 D 4.3198 8.5537 120.7314 57.6884 40.7603 178.3726 8 S 4.1428 8.0003 114.0685 61.4927 62.9620 176.0883 9 E 3.9315 8.0338 121.7966 59.0902 29.3371 178.9087 10 E 3.9420 8.3794 118.8537 59.6874 29.5965 179.7969 11 K 4.0842 7.9656 118.0454 59.2655 32.0746 179.5200 12 L 4.0141 8.1803 119.7035 57.6773 41.6520 179.4305 13 V 3.8833 8.0680 118.3557 66.3507 31.2300 178.0408 14 R 4.1048 7.6955 115.5834 59.7421 30.1488 178.5327 15 D 4.5360 8.3865 118.1883 57.2068 40.5773 178.4746 16 A 3.9233 8.5130 120.8611 54.9505 18.6581 178.9657 17 W 4.3361 8.3574 125.0657 58.8978 30.9056 178.0165 18 A 4.0405 7.6111 121.3005 55.1676 17.5579 177.6619 19 P 4.1176 0.0000 0.0000 65.7651 31.6598 178.6180 20 I 3.5520 7.1411 118.0805 64.3207 36.7714 177.5265 21 H 4.0984 7.6477 118.5926 59.1891 29.7239 176.8116 22 G 3.8004 7.7764 104.8170 45.4561 0.0000 173.3175 23 D 4.6871 7.7227 120.4016 52.0894 41.7890 175.2783 24 L 4.0562 7.7590 126.6393 58.3695 42.8373 177.4955 25 Q 3.9803 8.0429 119.0820 59.0598 29.1602 178.2756 26 G 3.6182 7.9302 107.4566 47.5582 0.0000 175.5078 27 T 3.7162 7.7965 118.3349 66.0177 68.4364 176.3562 28 A 2.5800 7.4014 122.4662 54.7923 18.4532 179.2074 29 N 4.4756 8.0788 114.8169 57.0270 38.6070 177.8401 30 T 3.9814 7.7252 116.2764 66.6772 68.5131 177.0916 31 V 3.7209 8.0822 120.5317 66.0842 31.5985 177.7986 32 F 4.5176 8.8310 120.9099 61.4463 39.1471 176.4757 33 Y 4.2095 8.4081 118.8386 60.9686 38.6630 177.7875 34 N 4.3104 8.7015 117.6131 56.2704 38.5259 176.8294 35 Y 4.4038 8.5185 121.2634 61.0234 39.1779 178.2421 36 L 3.6748 7.8863 119.7522 57.1911 41.3298 179.5543 37 K 3.6809 7.5169 119.2320 59.1536 32.2159 178.5246 38 K 3.8997 7.8345 118.6869 57.7853 33.8082 176.4348 39 Y 4.7265 7.8109 116.6563 54.8239 38.2764 174.2562 40 P 4.7707 0.0000 0.0000 64.8972 31.3744 178.6234 41 S 4.1639 8.1589 113.9977 61.6203 62.6455 176.0394 42 N 4.1352 8.0870 119.2307 55.6494 38.3202 176.8919 43 Q 4.2647 7.9927 121.1594 59.4655 28.8765 178.0684 44 D 4.5659 7.6005 118.1898 56.6272 40.8953 178.2904 45 K 4.2941 7.9149 118.1188 57.0205 32.3021 176.7173 46 F 4.7219 7.8758 118.6278 55.4453 39.1902 175.9665 47 E 4.0422 8.9533 127.2302 59.6126 29.4923 180.0880 48 T 4.1879 8.1038 107.3525 63.7303 68.8460 174.9747 49 L 4.5936 8.2996 121.7512 55.0829 42.7885 176.5331 50 K 4.1226 7.5376 119.4077 57.7211 32.3783 176.9393 51 G 3.9246 9.1348 113.8775 45.5745 0.0000 172.4423 52 H 5.0531 7.2365 114.7402 52.7120 31.7683 172.4341 53 P 4.3593 0.0000 0.0000 62.5683 32.1586 177.1976 54 L 3.9814 8.7815 123.7610 58.7525 41.7160 179.2884 55 D 4.4630 8.0595 116.6995 57.0602 40.8441 178.0735 56 E 4.0899 7.9349 118.5937 58.6888 29.6902 178.6875 57 V 4.1273 7.5243 111.0813 61.9198 32.2233 178.0811 58 K 2.4800 7.5487 117.5497 58.9718 32.2625 177.4084 59 D 4.5887 7.6888 116.6168 54.3241 41.5186 176.9236 60 T 4.3305 7.7805 111.4199 60.7438 71.2333 175.3269 61 A 4.0363 8.5650 124.3365 55.5812 18.4093 179.6869 62 N 4.2626 8.2029 114.8700 56.7607 39.1068 176.4916 63 F 4.1329 8.1116 122.0960 61.5662 39.4293 177.3536 64 K 4.2311 8.3076 117.6797 59.0788 31.8129 179.0393 65 L 3.9064 8.1422 120.9113 58.2485 41.8876 179.0898 66 I 3.4564 7.4974 119.1637 64.2182 37.1260 178.1215 67 A 3.4708 7.3711 121.4973 55.1080 18.1538 179.9928 68 G 3.5969 8.3227 104.7585 47.8171 0.0000 176.1439 69 R 4.0584 8.1188 118.5130 58.9170 29.5734 179.0069 70 I 3.5756 7.4671 120.6493 64.4826 37.1307 178.4871 71 F 4.2857 8.4803 117.9456 60.7307 38.6086 177.9398 72 T 3.9964 8.6025 116.0931 66.6225 68.1566 176.5313 73 I 3.5177 7.4742 121.0996 64.4953 37.0416 178.4927 74 F 3.8766 7.4921 118.0081 60.3445 38.5264 177.0831 75 D 4.6224 8.6330 117.9833 57.8037 40.8466 178.3045 76 N 4.3929 8.2156 115.7708 56.3485 38.8871 176.9386 77 C 4.1201 8.2159 118.6265 62.6696 28.2324 176.2971 78 V 3.5566 7.8941 120.1031 65.9871 30.8822 177.9641 79 K 3.9765 8.1583 117.4035 59.1381 32.1178 177.9102 80 N 4.9419 7.7368 113.8825 53.1166 38.6465 177.2842 81 V 3.5310 7.7799 116.7048 64.2683 31.7108 177.3454 82 G 3.9381 8.0196 106.4612 45.5679 0.0000 174.1623 83 N 4.8198 8.3156 119.1247 50.4934 39.9980 174.1762 84 D 4.3774 8.4936 126.6840 56.9593 41.1891 177.9999 85 K 3.9556 8.1136 119.5449 59.5970 32.1691 178.8462 86 G 3.5732 8.0315 105.3667 47.6049 0.0000 175.1178 87 F 4.0317 8.6770 123.7052 61.3386 39.3817 177.2990 88 Q 3.7342 8.5001 117.8454 58.6665 28.4224 178.7053 89 K 4.0109 8.1856 120.7753 59.3310 31.9935 178.8469 90 V 3.4541 7.3244 117.5285 66.1186 31.7806 177.8890 91 I 3.4014 7.0390 119.0911 64.1294 36.7482 178.0501 92 A 3.9448 8.0733 122.0147 55.6024 17.9296 179.5146 93 D 4.3209 8.0204 116.2549 57.0378 40.9642 178.0103 94 M 4.3269 7.5144 115.1236 56.2280 32.0617 178.0780 95 S 4.5784 7.8503 116.6021 61.3438 61.5194 176.1580 96 G 3.8701 8.2470 108.9648 47.7558 0.0000 173.6530 97 P 4.4958 0.0000 0.0000 64.9727 31.5790 178.0122 98 H 4.6162 7.7491 114.1962 56.9996 28.8527 175.9951 99 V 3.5586 7.4182 119.4502 64.7807 31.5402 174.8353 100 A 3.8392 8.7568 126.8909 52.9211 16.4041 176.7458 101 R 4.3014 7.7047 116.0090 56.0983 31.3557 175.9346 102 P 4.6170 0.0000 0.0000 61.8361 30.0584 175.4521 103 I 4.4066 7.3191 120.2199 60.0798 39.9858 176.9228 104 T 4.3407 8.1234 115.6883 61.4267 71.2066 175.3896 105 H 4.6523 8.9249 119.4590 59.0041 28.5955 178.0003 106 G 3.7955 8.2501 107.1685 48.1907 0.0000 175.4242 107 S 4.1463 8.1407 118.0530 61.5258 62.8635 176.6757 108 Y 4.3588 7.6601 119.1466 61.2935 37.7377 178.2013 109 N 4.1459 8.8239 117.8856 56.2650 38.5604 177.2692 110 D 4.1778 8.3803 120.7678 56.9631 40.7322 178.4320 111 L 3.5808 7.8271 120.7358 58.0447 41.9659 178.6995 112 R 3.9905 8.1442 118.7855 59.7018 29.8501 178.5645 113 G 3.6896 8.1683 105.1545 47.8902 0.0000 175.8405 114 V 3.8208 8.0419 120.8441 65.7048 31.3404 178.1898 115 I 3.8059 7.8547 118.7463 64.5741 37.1623 177.4026 116 Y 4.1061 8.3850 120.4926 60.9482 38.7605 177.9084 117 D 4.3752 8.7253 120.4466 57.3131 40.7044 178.8517 118 S 4.2125 7.9288 113.5563 60.9187 63.1213 175.6730 119 M 3.9379 7.5256 121.0428 55.2059 32.6452 175.5172 120 H 3.9145 7.1103 114.3487 56.4615 27.1348 175.0321 121 L 4.0500 7.0982 117.3561 54.2336 42.6054 177.9068 122 D 4.7135 8.3089 122.3728 52.9442 41.8455 177.4924 123 S 4.2341 8.5226 113.9362 61.4995 62.8990 176.6185 124 T 3.8730 7.9510 119.0938 67.0317 68.2801 176.1997 125 H 4.3168 9.0801 118.6358 58.6520 28.6209 178.0459 126 G 4.1745 8.8621 109.0663 47.3417 0.0000 175.4646 127 A 4.0582 8.3147 123.3265 54.7973 18.3962 179.6236 128 A 3.9453 7.8734 119.3261 54.9552 18.4095 179.5092 129 W 4.2014 8.6343 127.1866 61.0101 30.8109 178.0097 130 N 4.3117 8.8078 116.5984 56.0798 37.8959 177.6626 131 K 3.9023 8.1161 120.1679 59.4529 32.0798 179.0873 132 M 3.7017 7.7749 118.4812 58.8631 32.0640 178.2782 133 M 4.0085 7.9090 119.1847 58.2838 32.0343 178.4597 134 D 4.4494 8.4242 119.6275 57.4387 40.9593 178.6026 135 N 4.2531 8.0204 117.0005 56.0352 38.3913 176.9696 136 F 3.8662 8.7141 122.5358 61.6745 39.3510 177.3894 137 F 3.7673 8.6027 117.2253 60.0189 38.6325 177.1081 138 Y 4.1769 8.2271 119.5539 60.7476 38.6568 178.3002 139 V 2.9086 7.6600 118.8648 65.7203 31.4708 177.6301 140 F 3.8747 7.7903 120.4974 61.6301 39.1272 176.7836 141 Y 4.2065 7.9093 116.3363 60.8752 37.5429 178.1678 142 E 3.9066 8.0913 119.7609 59.5623 29.5398 178.7876 143 C 4.2881 8.1499 116.4938 59.9998 40.0571 176.0991 144 L 3.7485 7.6842 119.7760 57.5348 41.1740 178.3715 145 D 4.7190 7.6824 116.3156 53.8035 40.8027 176.7643 146 G 3.8614 7.8486 107.3151 46.5167 0.0000 174.7554 147 R 4.5818 8.0930 116.2107 55.2500 30.6081 176.4045 148 C 4.6584 7.8917 117.5833 57.8091 42.7177 174.0163 149 S 4.0559 7.9076 115.9634 61.4552 62.3445 176.0102 150 Q 3.9179 7.8447 119.7317 58.1550 28.0481 177.0008 151 F 4.9755 7.9078 117.3991 57.5789 41.3434 175.4805 152 S 4.3231 7.6079 119.9625 58.7233 62.5713 173.8481 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 A 8.26 2.79 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 2 F 7.65 3.83 0.00 3.20 3.01 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 3 V 8.44 4.18 1.88 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 0.74 0.00 0.00 0.81 0.00 0.00 4 G 8.66 3.77 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 0.00 0.00 0.00 5 L 7.90 4.57 0.00 1.51 1.52 0.66 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 6 S 9.06 4.46 0.00 3.98 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 0.00 7 D 8.55 4.32 0.00 2.80 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 8 S 8.00 4.14 0.00 4.08 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 9 E 8.03 3.93 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 2.32 2.34 0.00 10 E 8.38 3.94 0.00 2.11 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 2.29 2.68 0.00 11 K 7.97 4.08 0.00 2.06 1.88 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.64 7.81 12 L 8.18 4.01 0.00 1.89 1.72 0.94 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 13 V 8.07 3.88 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 1.15 0.00 0.00 1.04 0.00 0.00 14 R 7.70 4.10 0.00 2.04 2.09 0.00 3.27 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.04 0.00 15 D 8.39 4.54 0.00 2.96 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.51 3.92 1.37 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 0.00 0.00 0.00 17 W 8.36 4.34 0.00 3.64 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 18 A 7.61 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 19 P 0.00 4.12 0.00 1.88 2.03 0.00 3.65 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.10 0.00 20 I 7.14 3.55 0.56 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.24 0.10 0.00 0.00 21 H 7.65 4.10 0.00 3.09 3.49 0.00 5.94 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 G 7.78 3.80 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 0.00 0.00 0.00 23 D 7.72 4.69 0.00 2.64 2.39 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 24 L 7.76 4.06 0.00 1.79 1.66 1.31 0.87 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 25 Q 8.04 3.98 0.00 2.19 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 26 G 7.93 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 27 T 7.80 3.72 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 1.17 0.00 0.00 28 A 7.40 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 29 N 8.08 4.48 0.00 2.93 3.06 0.00 0.00 7.12 6.65 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 30 T 7.73 3.98 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 1.27 0.00 0.00 31 V 8.08 3.72 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 1.45 0.00 0.00 1.09 0.00 0.00 32 F 8.83 4.52 0.00 3.08 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 33 Y 8.41 4.21 0.00 3.47 3.29 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 34 N 8.70 4.31 0.00 3.07 2.96 0.00 0.00 6.72 7.70 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 35 Y 8.52 4.40 0.00 3.22 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 36 L 7.89 3.67 0.00 1.45 1.50 0.62 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 37 K 7.52 3.68 0.00 1.04 1.63 0.00 1.63 0.00 0.00 1.57 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.28 1.25 7.81 38 K 7.83 3.90 0.00 1.64 1.52 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.30 1.03 7.81 39 Y 7.81 4.73 0.00 2.62 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 40 P 0.00 4.77 0.00 2.21 2.22 0.00 3.83 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.80 0.00 41 S 8.16 4.16 0.00 4.07 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 0.00 42 N 8.09 4.14 0.00 2.71 3.10 0.00 0.00 6.51 6.84 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 43 Q 7.99 4.26 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.81 0.00 0.00 0.00 0.00 0.00 2.49 2.56 0.00 44 D 7.60 4.57 0.00 2.61 2.74 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 45 K 7.91 4.29 0.00 1.34 1.56 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.53 7.81 46 F 7.88 4.72 0.00 3.28 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.95 4.04 0.00 2.06 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 2.44 2.30 0.00 48 T 8.10 4.19 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 1.30 0.00 0.00 49 L 8.30 4.59 0.00 2.08 1.94 1.06 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.54 4.12 0.00 1.97 1.93 0.00 2.02 0.00 0.00 1.91 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.59 7.81 51 G 9.13 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 H 7.24 5.05 0.00 3.19 3.22 0.00 5.87 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 53 P 0.00 4.36 0.00 2.19 1.99 0.00 3.84 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.10 0.00 54 L 8.78 3.98 0.00 1.87 1.66 1.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 55 D 8.06 4.46 0.00 2.70 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 56 E 7.93 4.09 0.00 2.23 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 2.34 2.35 0.00 57 V 7.52 4.13 2.21 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 0.92 0.00 0.00 1.09 0.00 0.00 58 K 7.55 2.48 0.00 1.16 1.68 0.00 0.94 0.00 0.00 1.32 0.00 0.00 2.77 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.42 1.12 7.81 59 D 7.69 4.59 0.00 2.61 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 60 T 7.78 4.33 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 1.24 0.00 0.00 61 A 8.57 4.04 1.37 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 0.00 0.00 0.00 62 N 8.20 4.26 0.00 2.84 2.93 0.00 0.00 6.80 7.71 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 63 F 8.11 4.13 0.00 3.30 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 64 K 8.31 4.23 0.00 1.97 1.90 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.85 1.81 7.81 65 L 8.14 3.91 0.00 1.83 1.86 0.94 0.99 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 66 I 7.50 3.46 1.48 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 1.43 0.61 -0.15 0.00 0.00 67 A 7.37 3.47 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 68 G 8.32 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 69 R 8.12 4.06 0.00 2.05 2.31 0.00 2.79 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.65 0.00 70 I 7.47 3.58 2.21 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.12 1.07 0.00 0.00 71 F 8.48 4.29 0.00 3.23 3.35 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 72 T 8.60 4.00 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 1.24 0.00 0.00 73 I 7.47 3.52 1.55 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.79 0.54 0.00 0.00 74 F 7.49 3.88 0.00 2.77 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 0.00 0.00 0.00 75 D 8.63 4.62 0.00 3.43 3.05 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 0.00 0.00 0.00 76 N 8.22 4.39 0.00 2.78 2.82 0.00 0.00 7.12 7.96 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 77 C 8.22 4.12 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 78 V 7.89 3.56 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 1.15 0.00 0.00 0.35 0.00 0.00 79 K 8.16 3.98 0.00 1.97 1.93 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.10 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.55 1.78 7.81 80 N 7.74 4.94 0.00 3.04 3.02 0.00 0.00 6.97 7.28 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 81 V 7.78 3.53 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 0.73 0.00 0.00 0.98 0.00 0.00 82 G 8.02 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 N 8.32 4.82 0.00 2.77 2.81 0.00 0.00 7.20 8.11 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 84 D 8.49 4.38 0.00 2.63 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 K 8.11 3.96 0.00 1.80 1.81 0.00 1.71 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.52 7.81 86 G 8.03 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 F 8.68 4.03 0.00 3.37 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 88 Q 8.50 3.73 0.00 2.21 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.58 0.00 0.00 0.00 0.00 0.00 1.81 2.33 0.00 89 K 8.19 4.01 0.00 1.93 1.93 0.00 1.50 0.00 0.00 1.56 0.00 0.00 2.97 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.41 1.45 7.81 90 V 7.32 3.45 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 0.67 0.00 0.00 0.85 0.00 0.00 91 I 7.04 3.40 1.47 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.17 0.24 0.00 0.00 92 A 8.07 3.94 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 D 8.02 4.32 0.00 2.66 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 94 M 7.51 4.33 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.33 0.00 95 S 7.85 4.58 0.00 3.92 4.30 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 96 G 8.25 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 97 P 0.00 4.50 0.00 1.91 2.10 0.00 3.91 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.17 0.00 98 H 7.75 4.62 0.00 3.57 3.67 0.00 5.84 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 99 V 7.42 3.56 2.21 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 0.70 0.00 0.00 0.99 0.00 0.00 100 A 8.76 3.84 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 R 7.70 4.30 0.00 2.04 1.90 0.00 3.28 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 102 P 0.00 4.62 0.00 2.17 2.09 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 103 I 7.32 4.41 1.97 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.66 0.36 0.00 0.00 104 T 8.12 4.34 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 1.20 0.00 0.00 105 H 8.92 4.65 0.00 3.14 3.37 0.00 5.66 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 0.00 106 G 8.25 3.80 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 0.00 0.00 0.00 107 S 8.14 4.15 0.00 3.80 3.89 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 0.00 0.00 0.00 108 Y 7.66 4.36 0.00 3.48 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 0.00 109 N 8.82 4.15 0.00 2.80 2.80 0.00 0.00 7.06 7.81 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 0.00 110 D 8.38 4.18 0.00 2.52 1.54 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 0.00 111 L 7.83 3.58 0.00 1.01 1.78 0.53 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 112 R 8.14 3.99 0.00 1.88 2.02 0.00 2.89 0.00 0.00 2.94 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 113 G 8.17 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.04 3.82 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 1.40 0.00 0.00 115 I 7.85 3.81 2.07 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.86 0.97 0.00 0.00 116 Y 8.38 4.11 0.00 3.30 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 0.00 117 D 8.73 4.38 0.00 2.77 2.74 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 0.00 118 S 7.93 4.21 0.00 4.05 4.17 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 0.00 119 M 7.53 3.94 0.00 1.58 1.76 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.25 0.00 120 H 7.11 3.91 0.00 3.20 3.23 0.00 5.65 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 L 7.10 4.05 0.00 1.39 1.53 0.62 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 122 D 8.31 4.71 0.00 2.98 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 0.00 123 S 8.52 4.23 0.00 4.13 4.22 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 0.00 124 T 7.95 3.87 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 125 H 9.08 4.32 0.00 3.31 3.40 0.00 5.82 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 0.00 126 G 8.86 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 A 8.31 4.06 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 0.00 128 A 7.87 3.95 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.63 4.20 0.00 3.58 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 0.00 130 N 8.81 4.31 0.00 2.98 2.80 0.00 0.00 7.09 7.32 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 0.00 131 K 8.12 3.90 0.00 1.90 1.69 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.77 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.59 7.81 132 M 7.77 3.70 0.00 1.68 1.79 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 133 M 7.91 4.01 0.00 2.03 1.89 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.57 0.00 134 D 8.42 4.45 0.00 2.76 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 0.00 135 N 8.02 4.25 0.00 2.58 2.49 0.00 0.00 6.63 7.70 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 0.00 136 F 8.71 3.87 0.00 3.02 2.97 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 0.00 137 F 8.60 3.77 0.00 3.20 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 Y 8.23 4.18 0.00 3.17 3.24 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 0.00 139 V 7.66 2.91 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.67 0.00 0.00 140 F 7.79 3.87 0.00 2.02 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 0.00 0.00 0.00 141 Y 7.91 4.21 0.00 3.02 2.83 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 0.00 142 E 8.09 3.91 0.00 2.12 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 1.79 1.79 0.00 143 C 8.15 4.29 0.00 2.98 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 0.00 144 L 7.68 3.75 0.00 1.58 1.60 0.61 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 145 D 7.68 4.72 0.00 2.85 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 0.00 146 G 7.85 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 R 8.09 4.58 0.00 1.83 1.98 0.00 3.13 0.00 0.00 3.12 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.46 0.00 148 C 7.89 4.66 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 0.00 149 S 7.91 4.06 0.00 4.02 4.05 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 0.00 0.00 0.00 150 Q 7.84 3.92 0.00 1.78 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.89 0.00 0.00 0.00 0.00 0.00 1.51 1.16 0.00 151 F 7.91 4.98 0.00 3.01 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 0.00 152 S 7.61 4.32 0.00 3.94 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