NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.2978 8.3027 118.9433 56.3040 31.8411 174.5878 2 Q 4.1642 8.6068 123.2924 54.6545 28.7473 173.7657 3 L 4.6650 8.6026 127.1969 54.7216 43.3890 176.4530 4 T 4.3905 9.1347 112.0029 60.2053 71.3515 175.6274 5 K 3.5270 8.7655 122.3229 60.2417 31.9554 178.8795 6 C 4.4420 8.0147 115.2964 59.1468 41.5245 175.4281 7 E 3.8816 7.7253 119.5653 59.8015 29.0952 179.7727 8 V 3.4791 8.0604 118.2536 65.7158 31.2663 177.6996 9 F 4.0767 7.7553 119.1562 61.3863 39.5141 176.6978 10 R 4.1038 8.4014 117.5089 59.8848 29.8324 179.0375 11 E 3.9994 8.2761 116.6291 58.5831 29.5330 178.3150 12 L 4.4169 7.7014 118.4683 54.1642 41.8462 178.0502 13 K 3.6357 7.8769 123.7451 59.9276 31.9644 178.1459 14 D 4.4975 7.8638 114.4980 55.6197 41.0897 176.7347 15 L 4.2256 7.8745 119.7297 54.6395 42.3088 176.2661 16 K 4.0930 7.8428 119.2217 59.5237 32.3755 177.2367 17 G 3.9672 9.3645 114.3610 44.9909 0.0000 171.7386 18 Y 4.3264 8.1374 122.5160 58.3425 38.9940 176.3609 19 G 3.8538 8.4191 115.9053 45.0393 0.0000 173.9797 20 G 3.8235 7.9875 107.1499 45.5845 0.0000 173.2170 21 V 3.9043 7.5736 120.2138 61.5060 32.3401 176.1738 22 S 4.9352 9.0546 123.0043 57.0540 65.7783 175.4062 23 L 4.0077 8.3301 121.4320 57.6654 41.2955 177.7549 24 P 4.8027 0.0000 0.0000 65.2740 31.2686 178.2114 25 E 3.8352 7.9895 117.1336 59.4429 29.3390 179.5592 26 W 4.3540 7.9047 118.6484 59.2093 29.2286 179.0218 27 V 3.6873 8.4699 118.8460 66.0843 31.0879 176.9470 28 C 2.4500 7.7121 118.2005 59.5704 41.4792 175.8511 29 T 3.7923 7.8987 117.5713 66.7479 67.9331 176.8678 30 T 3.8855 8.5301 112.2164 64.6087 68.5994 176.1321 31 F 3.3955 8.0364 123.5113 61.0760 39.1064 176.0303 32 H 4.5011 7.7031 111.9358 56.1610 28.5975 176.0767 33 T 4.5036 7.1168 116.4594 64.6105 70.0615 175.4198 34 S 4.5260 7.8990 111.9250 56.6708 64.1036 174.3600 35 G 3.5270 8.3496 108.3265 47.0113 0.0000 174.1103 36 Y 3.8030 8.0377 113.5941 58.1110 35.4714 168.4607 37 D 5.0972 7.8855 121.0937 53.0761 41.0297 177.0063 38 T 4.0406 8.6130 118.7331 63.5317 69.7777 175.6547 39 Q 4.8085 8.2521 120.1318 55.5869 29.8802 175.4222 40 A 4.2731 8.0197 122.5294 51.9428 19.5788 177.4439 41 I 4.8597 8.3410 122.7066 59.3210 40.4214 175.0595 42 V 4.5184 8.4362 126.8574 61.0285 34.0159 174.3160 43 Q 5.1339 8.1932 124.0860 53.4052 32.3876 173.4771 44 N 4.4596 8.2875 112.6720 53.7591 40.5820 174.4594 45 N 4.3746 9.0087 118.4391 54.2351 34.0750 172.1187 46 D 4.6678 6.0500 118.7575 52.6002 40.6887 176.0489 47 S 4.8773 8.1641 111.5930 57.2576 67.2042 172.9572 48 T 4.9768 9.1096 114.4820 60.6796 71.0020 172.0854 49 E 5.3548 9.5661 127.5704 54.8258 33.1322 174.4741 50 Y 5.0469 9.2519 120.8155 57.6909 41.6119 177.0166 51 G 4.1851 9.3016 111.6604 45.5784 0.0000 173.1665 52 L 3.9873 8.5176 118.5817 57.0483 42.0256 178.7791 53 F 4.6277 8.1153 113.9049 56.6023 40.2766 175.0889 54 Q 3.7257 7.7032 119.0244 56.9658 26.4615 174.0250 55 I 4.3232 8.3367 118.7143 59.9702 38.4817 175.9830 56 N 5.6569 8.9317 122.0463 51.6189 39.3875 174.7350 57 N 5.6552 8.5984 115.7555 52.3851 37.8787 176.4958 58 K 4.2241 8.8997 120.6220 59.2803 32.3530 178.1103 59 I 4.5213 7.5995 107.6085 58.5691 39.2868 176.8116 60 W 4.5104 7.9855 121.1779 58.6189 29.9974 173.3094 61 C 5.6177 7.9763 110.8673 54.1583 45.2040 172.9274 62 K 5.0721 8.6081 118.7587 55.7276 35.1213 175.1618 63 D 4.8583 8.0186 119.5544 52.9544 42.1251 175.3016 64 D 4.4833 8.8334 117.4093 57.3742 41.0847 177.9049 65 Q 4.1447 8.2718 119.5221 58.2657 29.8163 175.3957 66 N 5.0334 8.5179 115.8498 50.9331 38.5574 172.6368 67 P 4.5015 0.0000 0.0000 64.2061 32.0864 177.6703 68 H 4.6726 7.9958 114.8926 55.2804 29.0438 174.7079 69 S 4.2368 7.7127 114.5884 58.2262 62.7285 174.9368 70 S 4.0288 8.6962 120.5783 59.4340 63.5777 173.4257 71 N 4.2198 8.3606 119.4494 54.3716 37.3707 175.1883 72 I 3.6906 8.0162 120.5010 64.8691 37.7016 177.7054 73 C 4.4463 8.4708 115.7073 57.4623 40.7377 172.4657 74 N 4.0357 8.5579 116.9654 53.3221 36.9542 173.5177 75 I 4.1389 8.2072 116.1000 59.8053 42.1503 173.2867 76 S 4.5057 8.3093 122.9146 58.9021 63.2346 175.9649 77 C 3.6479 8.7812 124.0325 59.9853 39.2550 175.7964 78 D 4.1384 7.5621 118.8604 54.9886 39.0309 177.9667 79 K 3.9611 7.4188 119.8126 58.5057 31.7258 177.0590 80 F 5.4906 7.6683 117.2509 56.6678 38.8828 176.6593 81 L 5.4017 8.2240 118.6362 53.4634 42.9544 176.3777 82 D 4.8022 7.8534 118.3513 52.5290 41.5423 175.1597 83 D 4.5014 8.4499 117.0151 55.9654 41.5202 176.3634 84 D 4.4767 7.4197 116.3961 53.9775 40.9298 176.2181 85 L 4.6469 8.4191 126.1774 55.2937 42.2007 178.1930 86 T 3.8101 8.4648 117.5185 67.4556 68.4851 175.6779 87 D 4.4216 8.0241 119.9431 56.5002 39.5740 178.0194 88 D 4.0907 8.2399 119.8672 57.4368 40.8300 178.7971 89 I 3.2485 7.8953 120.3982 64.3663 37.0049 178.4717 90 M 3.8767 7.8189 119.2201 58.0401 31.6028 177.9862 91 C 4.2523 7.9696 118.9548 59.4084 40.5678 175.6175 92 V 3.2331 7.2490 119.8038 65.7144 31.0105 178.0873 93 K 3.5698 7.7680 118.2316 59.3301 31.8246 179.2377 94 K 4.0141 7.6996 118.1352 59.6503 31.8961 179.4103 95 I 3.1519 7.6991 120.0272 64.2859 37.0421 178.4193 96 L 4.1570 8.5245 120.0758 58.0397 41.1939 179.3096 97 D 4.6320 7.9938 117.7915 56.2367 41.0339 178.0022 98 K 4.4910 8.1342 117.8368 57.7277 33.6910 177.5243 99 V 4.3136 8.0952 109.5646 59.8842 33.4583 176.2515 100 G 3.9686 7.9048 107.9566 44.4840 0.0000 174.2103 101 I 4.1124 8.1283 116.9712 63.7076 38.0145 176.9768 102 N 4.7692 8.1630 115.1884 54.3321 38.7303 175.1751 103 Y 3.7902 8.0043 121.5455 60.2453 38.9857 176.1186 104 W 4.5538 7.9186 124.1695 56.2108 27.8759 177.0610 105 L 4.0879 8.3850 124.6469 56.9788 41.6690 179.1989 106 A 3.9116 8.0344 120.5679 53.9259 18.9800 178.7643 107 H 4.0703 8.3121 116.3138 59.1176 29.7834 177.1764 108 K 4.3992 8.3068 121.3273 58.8061 32.1380 178.0645 109 A 4.2410 7.4203 119.9870 53.7749 18.7357 177.9680 110 L 4.6908 7.8555 113.9275 54.6191 43.9864 176.6190 111 C 4.9993 8.3451 114.7232 56.8170 41.2037 174.4104 112 S 4.5597 7.6901 113.9266 57.5960 62.8001 173.1161 113 E 4.8619 8.0325 116.5457 56.7078 31.3196 174.8349 114 K 3.9359 8.4428 115.2572 57.5597 29.4638 177.9252 115 L 4.5448 8.0705 119.4880 56.9354 41.7270 178.9281 116 D 4.5017 8.0467 117.8200 55.3766 39.4477 176.9674 117 Q 3.9001 7.8345 116.8223 56.5657 29.1578 175.9357 118 W 5.0424 7.8339 119.7008 56.7084 29.9362 174.8598 119 L 4.6433 7.7902 116.6310 53.1003 43.8233 177.7659 120 C 4.4348 7.5831 121.0189 55.3763 41.5125 173.9496 121 E 4.0864 8.3636 123.7227 56.5277 29.9782 175.3948 122 K 4.2248 8.9253 124.7955 53.9160 31.8937 172.1776 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 E 8.30 4.30 0.00 2.08 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 2.28 2.34 0.00 2 Q 8.61 4.16 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 7.04 0.00 0.00 0.00 0.00 0.00 2.37 2.62 0.00 3 L 8.60 4.66 0.00 1.65 1.45 0.92 0.84 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 4 T 9.13 4.39 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 5 K 8.77 3.53 0.00 2.00 1.90 0.00 1.69 0.00 0.00 1.78 0.00 0.00 2.96 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.57 1.82 7.81 6 C 8.01 4.44 0.00 2.97 3.07 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 7 E 7.73 3.88 0.00 2.15 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 2.32 2.32 0.00 8 V 8.06 3.48 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 0.94 0.00 0.00 0.39 0.00 0.00 9 F 7.76 4.08 0.00 3.17 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 10 R 8.40 4.10 0.00 2.12 2.01 0.00 3.43 0.00 0.00 3.24 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.89 0.00 11 E 8.28 4.00 0.00 1.97 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 2.33 2.46 0.00 12 L 7.70 4.42 0.00 1.56 1.47 0.75 0.76 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 13 K 7.88 3.64 0.00 1.87 1.77 0.00 1.60 0.00 0.00 1.59 0.00 0.00 2.86 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.56 7.81 14 D 7.86 4.50 0.00 2.60 2.59 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 15 L 7.87 4.23 0.00 1.63 1.48 0.19 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.84 4.09 0.00 1.80 1.84 0.00 1.50 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.39 7.81 17 G 9.36 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 18 Y 8.14 4.33 0.00 3.07 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 19 G 8.42 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 0.00 0.00 0.00 20 G 7.99 3.82 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 0.00 0.00 0.00 21 V 7.57 3.90 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 0.07 0.00 0.00 0.82 0.00 0.00 22 S 9.05 4.94 0.00 4.10 4.03 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 23 L 8.33 4.01 0.00 1.64 1.56 0.86 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 24 P 0.00 4.80 0.00 2.31 2.46 0.00 4.02 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 25 E 7.99 3.84 0.00 2.00 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 0.00 2.28 2.35 0.00 26 W 7.90 4.35 0.00 3.51 3.06 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 27 V 8.47 3.69 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 1.16 0.00 0.00 28 C 7.71 2.45 0.00 1.51 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 29 T 7.90 3.79 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 1.21 0.00 0.00 30 T 8.53 3.89 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 31 F 8.04 3.40 0.00 2.72 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 32 H 7.70 4.50 0.00 3.11 3.21 0.00 5.69 0.00 0.00 0.00 0.00 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 T 7.12 4.50 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 34 S 7.90 4.53 0.00 4.07 4.15 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 35 G 8.35 3.53 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 0.00 0.00 0.00 36 Y 8.04 3.80 0.00 3.31 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 37 D 7.89 5.10 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 38 T 8.61 4.04 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 39 Q 8.25 4.81 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.87 0.00 0.00 0.00 0.00 0.00 2.55 2.34 0.00 40 A 8.02 4.27 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 I 8.34 4.86 1.81 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 1.10 0.87 0.66 0.00 0.00 42 V 8.44 4.52 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 0.97 0.00 0.00 0.98 0.00 0.00 43 Q 8.19 5.13 0.00 2.06 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 7.41 0.00 0.00 0.00 0.00 0.00 2.14 2.14 0.00 44 N 8.29 4.46 0.00 2.74 2.86 0.00 0.00 6.86 6.71 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 45 N 9.01 4.37 0.00 2.93 3.29 0.00 0.00 6.36 8.06 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 46 D 6.05 4.67 0.00 2.73 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 47 S 8.16 4.88 0.00 4.22 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 T 9.11 4.98 4.13 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 0.00 0.00 1.29 0.00 0.00 49 E 9.57 5.35 0.00 2.13 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 2.27 2.25 0.00 50 Y 9.25 5.05 0.00 3.18 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 51 G 9.30 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 0.00 0.00 0.00 52 L 8.52 3.99 0.00 1.48 1.37 0.87 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 53 F 8.12 4.63 0.00 3.01 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 54 Q 7.70 3.73 0.00 2.36 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.79 0.00 0.00 0.00 0.00 0.00 2.50 2.64 0.00 55 I 8.34 4.32 1.83 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 1.46 0.97 0.00 0.00 56 N 8.93 5.66 0.00 3.14 3.20 0.00 0.00 5.96 6.96 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 57 N 8.60 5.66 0.00 3.13 3.29 0.00 0.00 6.98 7.15 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 58 K 8.90 4.22 0.00 1.92 1.92 0.00 1.72 0.00 0.00 1.82 0.00 0.00 3.09 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.52 1.47 7.81 59 I 7.60 4.52 1.31 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.57 0.74 0.00 0.00 60 W 7.99 4.51 0.00 3.79 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 61 C 7.98 5.62 0.00 3.06 3.37 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 62 K 8.61 5.07 0.00 1.82 1.92 0.00 1.28 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.28 7.81 63 D 8.02 4.86 0.00 2.77 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 64 D 8.83 4.48 0.00 2.73 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 65 Q 8.27 4.14 0.00 2.07 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.31 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 66 N 8.52 5.03 0.00 2.80 2.78 0.00 0.00 6.93 7.06 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 67 P 0.00 4.50 0.00 2.07 2.11 0.00 3.44 0.00 0.00 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.92 0.00 68 H 8.00 4.67 0.00 3.14 3.35 0.00 5.94 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 S 7.71 4.24 0.00 4.17 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 70 S 8.70 4.03 0.00 3.93 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 71 N 8.36 4.22 0.00 3.04 2.81 0.00 0.00 7.03 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 72 I 8.02 3.69 1.76 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.48 1.04 0.00 0.00 73 C 8.47 4.45 0.00 3.40 3.34 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 74 N 8.56 4.04 0.00 2.87 2.89 0.00 0.00 6.90 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 I 8.21 4.14 1.94 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.79 0.67 0.00 0.00 76 S 8.31 4.51 0.00 3.75 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 77 C 8.78 3.65 0.00 2.07 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 78 D 7.56 4.14 0.00 2.89 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 79 K 7.42 3.96 0.00 1.42 2.00 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.30 1.48 7.81 80 F 7.67 5.49 0.00 3.25 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 81 L 8.22 5.40 0.00 1.79 1.76 1.14 1.22 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 82 D 7.85 4.80 0.00 2.78 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 83 D 8.45 4.50 0.00 2.70 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 84 D 7.42 4.48 0.00 2.62 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 85 L 8.42 4.65 0.00 1.72 1.71 0.99 0.80 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 86 T 8.46 3.81 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 87 D 8.02 4.42 0.00 3.02 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 88 D 8.24 4.09 0.00 2.95 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 89 I 7.90 3.25 1.80 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.61 0.61 0.00 0.00 90 M 7.82 3.88 0.00 2.01 2.17 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 2.55 2.58 0.00 91 C 7.97 4.25 0.00 3.16 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 92 V 7.25 3.23 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 0.16 0.00 0.00 -0.37 0.00 0.00 93 K 7.77 3.57 0.00 1.62 1.22 0.00 1.34 0.00 0.00 1.04 0.00 0.00 2.43 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.30 0.97 7.81 94 K 7.70 4.01 0.00 2.06 2.04 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.73 7.81 95 I 7.70 3.15 1.66 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.12 -0.25 0.00 0.00 96 L 8.52 4.16 0.00 2.15 2.01 1.29 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 97 D 7.99 4.63 0.00 3.01 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 98 K 8.13 4.49 0.00 2.07 2.03 0.00 1.63 0.00 0.00 1.76 0.00 0.00 3.12 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.65 1.87 7.81 99 V 8.10 4.31 2.24 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 0.99 0.00 0.00 1.12 0.00 0.00 100 G 7.90 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 0.00 101 I 8.13 4.11 1.78 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.89 0.80 0.00 0.00 102 N 8.16 4.77 0.00 2.80 2.87 0.00 0.00 6.86 7.46 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 0.00 103 Y 8.00 3.79 0.00 2.57 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 0.00 0.00 0.00 104 W 7.92 4.55 0.00 3.84 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 0.00 105 L 8.38 4.09 0.00 1.71 1.70 0.91 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 106 A 8.03 3.91 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 0.00 107 H 8.31 4.07 0.00 3.20 3.44 0.00 5.60 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 0.00 108 K 8.31 4.40 0.00 1.83 1.84 0.00 1.65 0.00 0.00 2.39 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.37 7.81 109 A 7.42 4.24 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 L 7.86 4.69 0.00 1.76 1.59 0.87 0.67 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 0.00 111 C 8.35 5.00 0.00 2.83 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 0.00 112 S 7.69 4.56 0.00 3.93 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 0.00 113 E 8.03 4.86 0.00 2.03 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.26 0.00 114 K 8.44 3.94 0.00 2.11 1.98 0.00 1.68 0.00 0.00 1.83 0.00 0.00 3.04 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.49 7.81 115 L 8.07 4.54 0.00 1.84 1.85 1.09 1.02 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 0.00 116 D 8.05 4.50 0.00 2.74 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 0.00 117 Q 7.83 3.90 0.00 1.54 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.44 0.00 0.00 0.00 0.00 0.00 1.45 1.16 0.00 118 W 7.83 5.04 0.00 3.56 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 0.00 119 L 7.79 4.64 0.00 1.52 1.46 0.91 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 120 C 7.58 4.43 0.00 1.36 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 0.00 121 E 8.36 4.09 0.00 1.99 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 2.23 1.87 0.00 122 K 8.93 4.22 0.00 1.83 1.94 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.52 0.00 0.00 0.00 0.00 1.18 0.84 7.81