NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4261 8.3044 120.3581 55.3771 33.6734 173.9750 2 V 4.3717 7.8232 124.7239 61.3804 33.9382 172.9047 3 T 4.8714 8.9208 124.5615 61.6706 71.6183 172.5594 4 L 4.5033 9.2091 129.5199 53.5869 44.1019 174.6259 5 Y 5.1619 8.7837 126.3789 57.5905 39.3597 175.1875 6 T 5.1271 8.9123 115.4548 61.0649 72.6960 172.5143 7 S 5.0835 8.4372 113.3380 57.1158 65.6423 172.6581 8 P 4.3641 0.0000 0.0000 62.9687 32.1176 175.8060 9 S 3.5691 8.5408 111.4826 59.5361 60.7357 173.6794 10 C 4.6427 7.4976 118.5793 57.0461 34.3184 172.7785 11 T 3.8493 8.4862 125.7591 66.8659 68.3020 176.7052 12 S 4.1544 8.0922 115.3252 61.5175 62.8373 176.1862 13 C 4.1381 7.9843 120.1602 62.6728 27.9977 175.6745 14 R 3.9013 7.7475 119.8865 59.3655 29.6057 178.7894 15 K 3.7374 7.9577 118.1396 58.9283 31.8815 179.2854 16 A 3.9446 7.6721 121.0852 55.0912 18.3756 179.5791 17 R 3.5372 8.2492 117.4188 59.5955 30.1913 178.6381 18 A 4.0264 8.0731 120.4954 54.7476 18.0993 179.4349 19 W 3.9832 8.3687 127.1404 60.5485 30.8228 178.3105 20 L 3.9956 8.1307 119.0406 57.8881 41.0210 179.3897 21 E 4.2320 8.1896 118.5167 59.3753 29.1931 179.2260 22 E 3.9485 8.0386 117.8888 58.7749 29.4706 177.9941 23 H 4.4042 7.1690 113.6540 54.0637 29.3431 174.6018 24 E 3.7349 7.6453 119.0113 57.3782 27.4601 174.9862 25 I 4.3714 8.1202 119.3787 59.4640 38.0199 175.2529 26 P 4.6436 0.0000 0.0000 62.8346 32.3360 175.4699 27 F 5.3856 8.1769 116.9499 55.9825 40.7178 173.2903 28 V 4.2788 9.0661 120.2526 59.9271 33.6307 174.0870 29 E 5.1983 8.6799 124.8816 54.7718 31.8847 175.1242 30 R 4.8704 9.0901 124.1377 54.4408 34.7353 173.8003 31 N 5.0664 9.5392 123.9132 53.3266 39.0920 175.4998 32 I 3.6319 8.9458 122.1917 63.6873 37.5207 177.6239 33 F 4.4094 8.9695 121.9073 59.7870 39.2710 177.2541 34 S 4.5039 8.4396 111.9762 59.4105 64.1164 173.7537 35 E 4.7643 8.1583 119.8709 53.8324 29.5124 173.8141 36 P 4.3239 0.0000 0.0000 62.6322 32.6686 176.7774 37 L 4.3568 8.1298 121.6896 54.4620 42.6318 177.8883 38 S 4.4770 9.0418 118.5470 57.7980 65.4992 175.7029 39 I 3.6112 8.0938 122.6444 64.2411 36.7769 178.4848 40 D 4.2788 7.9086 119.7866 57.2543 40.8612 178.3396 41 E 4.0090 8.1006 119.0929 59.2468 29.4137 179.4052 42 I 3.5350 7.4265 119.5231 64.3713 37.0713 178.7162 43 K 3.9112 7.6895 119.1589 59.1657 31.5424 179.2528 44 Q 3.9446 7.7705 119.4217 59.0973 29.2474 178.1750 45 I 3.9086 7.6341 120.4426 64.2623 37.1278 178.2125 46 L 3.9724 7.8206 119.8474 58.0618 41.3154 179.5226 47 R 3.8667 8.0388 117.2141 59.7017 29.9445 177.7233 48 M 4.3132 7.8366 116.8850 55.9728 32.4127 176.6243 49 T 4.3337 7.3823 109.3058 61.5981 69.8066 173.8340 50 E 4.4398 10.2148 121.6946 57.2825 30.7710 177.2079 51 D 4.9231 8.3589 116.2864 53.5529 42.4075 177.7967 52 G 3.7770 7.6483 111.1776 47.2114 0.0000 178.3421 53 T 3.9445 8.4731 113.6043 64.4846 68.4033 175.9500 54 D 4.4149 8.0903 120.5779 57.0951 40.8450 177.8867 55 E 4.1861 7.8463 118.6554 57.8895 29.8935 177.3597 56 I 4.2619 7.6859 109.7927 60.3433 39.1981 174.7185 57 I 4.6322 7.5332 123.3340 60.0025 37.2544 176.4205 58 S 4.3288 8.5263 122.5651 57.2022 61.2844 174.9343 59 T 2.0000 7.6704 115.9536 63.0214 68.4794 175.6351 60 R 4.4002 7.3161 120.0567 56.0926 31.4742 177.0370 61 S 4.3778 7.9891 114.8783 58.1359 64.7565 175.5028 62 K 4.0153 8.5620 122.7299 59.8045 32.0402 180.0522 63 V 3.6169 7.9120 118.9021 64.8971 30.7895 177.9630 64 F 4.0598 8.0305 121.2249 60.9952 38.9676 177.3002 65 Q 4.1025 7.8703 116.7530 58.7027 28.6557 178.3152 66 K 4.1139 8.1294 118.8269 59.5402 32.2140 179.1653 67 L 3.9047 7.7745 117.9452 55.6078 42.8258 177.0745 68 N 3.8683 7.0168 114.4175 54.6004 37.4395 173.3588 69 V 4.2415 6.6495 111.3019 59.1738 34.9251 176.2037 70 N 4.5269 8.4165 121.9875 52.7940 38.1558 174.8435 71 V 3.7777 8.3000 127.0045 65.6595 32.2004 177.8650 72 E 3.9612 8.4368 118.5652 59.0962 29.2515 177.8622 73 S 4.6166 7.8702 109.4076 57.9277 63.8363 173.8728 74 M 4.2770 7.4206 119.0278 54.0239 32.1514 174.5782 75 P 4.2482 0.0000 0.0000 62.5604 32.5301 177.0141 76 L 3.6946 8.6133 124.0407 58.5722 41.7570 179.5275 77 Q 3.6291 7.7477 116.9704 58.6573 28.5320 178.2294 78 D 4.4525 7.8196 120.0926 56.8292 40.8477 178.3847 79 L 3.9321 7.5254 121.0083 58.1930 42.0203 178.6193 80 Y 4.4182 7.5616 116.3227 61.3377 37.8952 178.6541 81 R 4.0251 7.8074 117.6028 58.9617 30.1017 178.9060 82 L 4.0107 8.2321 120.7725 58.1973 41.8790 179.1038 83 I 3.7895 8.1760 119.3410 64.2745 37.0612 177.6365 84 N 4.4280 7.8899 117.3412 56.5878 38.8602 176.5739 85 E 4.2458 8.0378 119.1880 57.9349 30.9470 176.8373 86 H 4.9406 8.0244 115.7879 52.5894 29.6241 171.7423 87 P 4.1577 0.0000 0.0000 65.1037 31.6004 178.9924 88 G 3.8805 8.2044 105.8495 48.0999 0.0000 174.5723 89 L 4.2105 8.1740 120.1720 57.3456 41.8831 177.0885 90 L 4.7042 7.6988 119.2896 54.4121 41.9350 177.7931 91 R 4.3963 8.9463 123.4969 56.5597 30.8723 176.0361 92 R 4.8337 8.1269 116.2043 54.4629 32.4695 172.7328 93 P 4.8561 0.0000 0.0000 62.6795 33.7546 174.7288 94 I 4.9975 8.6854 120.1677 59.7450 40.3504 174.7640 95 I 4.7940 9.0149 128.9770 59.4950 39.3713 174.8209 96 I 5.4227 8.5230 126.5839 59.7962 41.8866 173.4131 97 D 5.5310 9.0109 127.0617 51.7244 43.0901 175.5473 98 E 4.2202 9.1474 115.0584 57.9132 29.6459 177.0838 99 K 4.4075 8.1463 119.6487 56.9658 34.5759 175.7047 100 R 4.6937 9.4084 114.3184 54.0826 32.6159 173.1813 101 L 5.3769 8.1815 119.4617 53.4735 45.4342 175.2883 102 Q 4.5900 9.5101 125.9872 54.4510 32.7693 173.4285 103 V 4.6926 8.6272 125.8150 62.2154 33.6604 176.2068 104 G 4.0781 9.3173 112.7708 45.9463 0.0000 171.7872 105 Y 4.4083 8.2226 120.6045 55.8996 39.7761 174.5017 106 N 4.3972 7.6293 124.7273 50.5972 41.4910 174.3624 107 E 3.5266 8.2264 126.2652 58.6785 29.7401 177.7432 108 D 4.5191 7.7776 118.0894 56.5152 41.6411 178.3534 109 E 3.8496 8.9253 119.4927 59.3810 29.4335 179.2273 110 I 3.7108 7.3286 118.2830 63.6649 37.8362 177.5843 111 R 4.2518 7.3964 118.2467 58.1484 29.6306 178.1735 112 R 4.0993 7.7012 117.2854 57.6561 30.1621 177.5341 113 F 4.4043 8.1372 116.8146 57.0643 39.7784 175.7794 114 L 4.4537 7.5359 119.8709 53.5254 42.2473 175.1474 115 P 4.6022 0.0000 0.0000 61.7621 32.5066 175.6313 116 R 4.0620 8.3108 119.5875 56.0674 30.4731 176.2535 117 K 4.4525 8.2818 124.4458 54.5830 33.9965 176.7720 118 V 3.7635 8.2038 118.5828 63.4863 31.3716 175.6431 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 4.43 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.60 0.00 2 V 7.82 4.37 2.36 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 0.46 0.00 0.00 1.09 0.00 0.00 3 T 8.92 4.87 4.04 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 0.44 0.00 0.00 4 L 9.21 4.50 0.00 1.61 1.64 0.80 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 5 Y 8.78 5.16 0.00 3.14 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 6 T 8.91 5.13 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 1.28 0.00 0.00 7 S 8.44 5.08 0.00 4.31 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 P 0.00 4.36 0.00 2.04 2.04 0.00 3.87 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 9 S 8.54 3.57 0.00 3.93 3.85 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 10 C 7.50 4.64 0.00 3.02 2.88 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 11 T 8.49 3.85 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 12 S 8.09 4.15 0.00 4.14 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 C 7.98 4.14 0.00 3.20 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 14 R 7.75 3.90 0.00 1.89 2.04 0.00 3.08 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 1.58 1.65 0.00 15 K 7.96 3.74 0.00 1.12 0.74 0.00 1.64 0.00 0.00 1.57 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.26 1.41 7.81 16 A 7.67 3.94 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 R 8.25 3.54 0.00 1.91 2.07 0.00 3.15 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.86 0.00 18 A 8.07 4.03 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 19 W 8.37 3.98 0.00 3.66 3.47 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 20 L 8.13 4.00 0.00 1.29 1.29 -0.00 0.87 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 21 E 8.19 4.23 0.00 2.09 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 2.61 2.84 0.00 22 E 8.04 3.95 0.00 1.72 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 0.00 2.26 2.37 0.00 23 H 7.17 4.40 0.00 2.36 2.89 0.00 5.81 0.00 0.00 0.00 0.00 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 E 7.65 3.73 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.20 0.00 25 I 8.12 4.37 2.02 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 1.23 0.93 1.06 0.00 0.00 26 P 0.00 4.64 0.00 2.12 1.98 0.00 3.73 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.12 0.00 27 F 8.18 5.39 0.00 3.06 2.90 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 28 V 9.07 4.28 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 0.75 0.00 0.00 0.87 0.00 0.00 29 E 8.68 5.20 0.00 2.21 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 2.27 2.56 0.00 30 R 9.09 4.87 0.00 1.64 1.89 0.00 3.20 0.00 0.00 3.11 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.53 0.00 31 N 9.54 5.07 0.00 2.86 2.81 0.00 0.00 6.52 7.27 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 32 I 8.95 3.63 1.61 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 1.32 -0.12 0.95 0.00 0.00 33 F 8.97 4.41 0.00 3.23 3.16 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 34 S 8.44 4.50 0.00 4.03 4.06 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 0.00 0.00 0.00 35 E 8.16 4.76 0.00 2.07 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 0.00 2.26 2.29 0.00 36 P 0.00 4.32 0.00 2.03 2.01 0.00 3.70 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.37 0.00 37 L 8.13 4.36 0.00 1.47 1.42 0.37 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 38 S 9.04 4.48 0.00 4.00 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 39 I 8.09 3.61 1.81 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 1.61 0.69 0.68 0.00 0.00 40 D 7.91 4.28 0.00 2.65 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 41 E 8.10 4.01 0.00 2.09 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 2.38 2.35 0.00 42 I 7.43 3.53 1.66 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.58 0.74 0.00 0.00 43 K 7.69 3.91 0.00 1.81 1.77 0.00 1.34 0.00 0.00 1.52 0.00 0.00 2.85 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.30 0.65 7.81 44 Q 7.77 3.94 0.00 2.15 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.96 0.00 0.00 0.00 0.00 0.00 2.41 2.42 0.00 45 I 7.63 3.91 1.97 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.80 0.92 0.00 0.00 46 L 7.82 3.97 0.00 1.84 1.77 0.97 1.00 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 47 R 8.04 3.87 0.00 2.08 2.12 0.00 3.26 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 48 M 7.84 4.31 0.00 2.07 2.26 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 2.65 2.98 0.00 49 T 7.38 4.33 4.50 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 1.34 0.00 0.00 50 E 10.21 4.44 0.00 1.92 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 2.24 2.38 0.00 51 D 8.36 4.92 0.00 2.63 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 52 G 7.65 3.78 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 0.00 0.00 0.00 53 T 8.47 3.94 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 1.24 0.00 0.00 54 D 8.09 4.41 0.00 2.82 2.76 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 55 E 7.85 4.19 0.00 2.11 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 2.33 2.30 0.00 56 I 7.69 4.26 1.86 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 1.43 1.13 0.91 0.00 0.00 57 I 7.53 4.63 1.86 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 1.55 0.92 0.96 0.00 0.00 58 S 8.53 4.33 0.00 3.97 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 59 T 7.67 2.00 3.40 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 0.85 0.00 0.00 60 R 7.32 4.40 0.00 1.75 1.96 0.00 3.19 0.00 0.00 3.23 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.48 0.00 61 S 7.99 4.38 0.00 4.11 4.06 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 0.00 0.00 0.00 62 K 8.56 4.02 0.00 1.87 1.93 0.00 1.70 0.00 0.00 1.89 0.00 0.00 3.01 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.56 1.52 7.81 63 V 7.91 3.62 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 0.92 0.00 0.00 0.92 0.00 0.00 64 F 8.03 4.06 0.00 3.12 3.26 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 0.00 65 Q 7.87 4.10 0.00 2.30 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.73 0.00 0.00 0.00 0.00 0.00 2.55 2.80 0.00 66 K 8.13 4.11 0.00 1.68 1.85 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.68 7.81 67 L 7.77 3.90 0.00 1.40 1.57 0.77 0.82 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 68 N 7.02 3.87 0.00 2.82 2.68 0.00 0.00 7.05 7.38 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 69 V 6.65 4.24 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 0.69 0.00 0.00 0.70 0.00 0.00 70 N 8.42 4.53 0.00 2.64 2.74 0.00 0.00 7.00 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 71 V 8.30 3.78 2.18 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 0.99 0.00 0.00 1.04 0.00 0.00 72 E 8.44 3.96 0.00 2.00 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 2.28 0.00 73 S 7.87 4.62 0.00 3.95 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 74 M 7.42 4.28 0.00 2.29 2.07 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 2.53 2.46 0.00 75 P 0.00 4.25 0.00 2.24 1.96 0.00 3.67 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 2.17 2.04 0.00 76 L 8.61 3.69 0.00 1.62 1.48 0.81 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 77 Q 7.75 3.63 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.69 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 78 D 7.82 4.45 0.00 2.88 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 79 L 7.53 3.93 0.00 1.70 1.66 0.96 0.91 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 80 Y 7.56 4.42 0.00 3.16 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 81 R 7.81 4.03 0.00 2.08 1.99 0.00 3.13 0.00 0.00 3.11 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 82 L 8.23 4.01 0.00 1.86 1.89 0.96 1.15 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 83 I 8.18 3.79 2.07 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.93 0.87 0.00 0.00 84 N 7.89 4.43 0.00 2.72 2.98 0.00 0.00 7.27 7.68 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 85 E 8.04 4.25 0.00 2.00 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 2.30 2.49 0.00 86 H 8.02 4.94 0.00 3.18 3.21 0.00 5.64 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.16 0.00 1.06 1.73 0.00 3.70 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 1.97 0.00 88 G 8.20 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 89 L 8.17 4.21 0.00 1.78 1.84 0.99 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 90 L 7.70 4.70 0.00 1.60 1.53 0.74 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.95 4.40 0.00 1.72 1.86 0.00 3.26 0.00 0.00 3.26 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.57 0.00 92 R 8.13 4.83 0.00 1.82 1.89 0.00 3.13 0.00 0.00 3.33 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 93 P 0.00 4.86 0.00 2.15 2.25 0.00 3.68 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 94 I 8.69 5.00 2.08 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 1.27 0.96 1.06 0.00 0.00 95 I 9.01 4.79 1.80 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.73 0.01 0.00 0.00 96 I 8.52 5.42 2.02 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.85 1.12 0.00 0.00 97 D 9.01 5.53 0.00 2.88 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 E 9.15 4.22 0.00 2.12 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 2.30 2.26 0.00 99 K 8.15 4.41 0.00 1.65 1.76 0.00 1.61 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.28 1.31 7.81 100 R 9.41 4.69 0.00 1.64 1.73 0.00 2.21 0.00 0.00 2.53 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.75 0.00 101 L 8.18 5.38 0.00 1.65 1.54 1.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 102 Q 9.51 4.59 0.00 2.27 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.52 0.00 0.00 0.00 0.00 0.00 2.27 2.42 0.00 103 V 8.63 4.69 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 0.91 0.00 0.00 0.95 0.00 0.00 104 G 9.32 4.08 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 0.00 105 Y 8.22 4.41 0.00 2.99 2.90 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 0.00 106 N 7.63 4.40 0.00 2.49 2.33 0.00 0.00 6.82 7.65 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 0.00 107 E 8.23 3.53 0.00 1.90 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 2.31 2.52 0.00 108 D 7.78 4.52 0.00 2.77 2.61 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 0.00 109 E 8.93 3.85 0.00 1.84 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 2.24 2.35 0.00 110 I 7.33 3.71 1.42 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 0.29 1.24 -0.61 0.00 0.00 111 R 7.40 4.25 0.00 1.93 2.07 0.00 3.29 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.74 0.00 112 R 7.70 4.10 0.00 1.61 1.73 0.00 3.02 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 113 F 8.14 4.40 0.00 3.31 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 7.54 4.45 0.00 1.97 1.70 1.09 0.80 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 0.00 115 P 0.00 4.60 0.00 2.21 2.10 0.00 3.84 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 116 R 8.31 4.06 0.00 1.81 1.89 0.00 3.23 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 117 K 8.28 4.45 0.00 1.80 1.74 0.00 1.84 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.38 7.81 118 V 8.20 3.76 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.94 0.00 0.00