NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9281 8.0549 120.3564 62.8684 31.4484 174.3004 2 H 4.6024 8.1952 123.1850 53.2779 31.6161 172.2124 3 L 4.4461 8.2415 125.4295 54.0798 43.5469 177.4757 4 T 4.1651 8.6912 113.1148 60.8107 70.9003 173.8976 5 P 4.1958 0.0000 0.0000 65.9928 31.3051 178.7854 6 E 4.0124 8.0762 115.7527 59.3500 29.5635 178.9225 7 E 3.9121 8.1921 119.6000 59.0212 29.5286 179.2950 8 K 3.8219 8.2143 118.7762 59.5030 32.0603 179.2490 9 S 4.0613 8.1001 113.0240 61.3284 62.3196 176.0847 10 A 3.9895 8.1187 123.4763 55.0675 18.1217 179.6693 11 V 3.5159 7.9997 117.0962 66.6003 31.6791 178.4726 12 T 3.9795 8.0615 115.1456 66.3855 68.0337 176.5811 13 A 4.0341 8.1904 122.1893 55.2348 18.8036 179.1422 14 L 3.8992 8.1594 118.8194 58.0572 42.1588 178.9815 15 W 4.4124 8.8400 128.5550 60.3404 30.4335 178.0435 16 G 3.8093 8.1354 104.5830 46.9760 0.0000 174.6497 17 K 4.4436 7.7762 118.1633 55.4668 33.1102 176.8062 18 V 3.5910 7.1034 120.4277 62.3666 31.9641 176.0875 19 N 4.5151 8.2493 125.3617 52.5336 38.4894 175.7350 20 V 3.4283 7.9103 121.8721 63.9506 31.7737 177.6941 21 D 4.3524 8.0523 118.2731 57.4224 40.7727 178.2780 22 E 3.8447 8.1484 118.8957 59.4483 29.6205 179.0451 23 V 3.5522 8.0053 118.6498 65.7107 31.4090 178.1796 24 G 3.6873 8.2404 105.6375 47.7811 0.0000 175.8122 25 G 3.6299 7.8257 108.3586 47.4297 0.0000 175.3291 26 E 3.8909 8.2631 121.5874 58.8138 29.6331 178.8253 27 A 3.9206 8.2169 121.1111 55.0681 18.5149 179.4139 28 L 3.9747 8.1998 119.2447 58.0476 42.1644 179.2622 29 G 3.5959 8.3278 106.0501 48.1159 0.0000 175.9087 30 R 3.9190 8.2663 121.2705 58.4143 29.8980 178.8252 31 L 4.0560 8.0487 120.3740 58.4265 42.1518 179.1891 32 L 4.0403 7.8286 119.5889 56.4550 41.2565 179.5983 33 V 3.5589 7.3445 117.8897 65.6986 31.7251 177.9150 34 V 3.5106 7.8286 117.0417 64.3003 32.7932 175.6610 35 Y 3.7383 7.3693 116.3321 54.4767 37.7262 174.3256 36 P 4.8971 0.0000 0.0000 64.3396 31.7994 178.4514 37 W 4.3744 8.0503 116.7699 59.4816 27.4792 177.7412 38 T 4.2251 7.6920 110.4812 63.9317 68.1115 176.0463 39 Q 4.3521 8.1403 121.6057 58.1351 28.4245 178.1901 40 R 3.7282 7.6522 117.0332 58.8732 29.2052 177.8409 41 F 4.3812 7.2113 115.8237 57.3765 39.4062 175.7232 42 F 4.4712 7.9250 118.4482 56.6191 39.7711 176.7339 43 E 3.9470 8.4563 124.4697 59.3873 29.4593 178.5007 44 S 4.4510 8.0094 111.0016 60.0049 63.3136 174.5549 45 F 4.6861 8.4081 119.4715 58.1530 39.9927 176.5295 46 G 4.0008 7.6182 106.1133 44.3529 0.0000 174.9856 47 D 4.4797 8.6237 126.3478 54.4309 41.0157 175.5920 48 L 4.9043 8.3349 127.1225 54.5274 42.9346 178.0854 49 S 4.3367 8.4523 116.3624 60.4796 63.5529 174.3148 50 T 4.7388 7.4391 110.2954 58.2422 73.0358 172.6664 51 P 4.1996 0.0000 0.0000 66.0590 31.3238 178.7397 52 D 4.3165 8.0724 116.7910 57.2267 40.5555 178.4295 53 A 3.9951 8.0167 120.6619 55.0604 18.6399 179.7255 54 V 3.6762 7.9615 116.6530 66.5841 31.5118 178.3191 55 M 4.0060 8.2267 117.4525 58.0775 31.8587 177.6509 56 G 3.8280 7.9940 104.7309 45.3782 0.0000 173.6467 57 N 4.3512 7.9279 120.1599 53.0510 39.6626 173.6677 58 P 4.2344 0.0000 0.0000 65.5189 31.4119 178.8485 59 K 3.6234 7.9232 117.0883 58.9776 31.8333 179.3230 60 V 3.6997 8.0719 118.5729 66.0567 31.4440 178.2960 61 K 3.9338 8.1418 117.9281 59.3888 31.8528 179.2643 62 A 3.9771 8.1930 121.3477 55.3958 18.2732 179.1994 63 H 4.3708 8.6074 117.2632 59.3376 29.8935 177.6613 64 G 3.7218 8.5487 107.9733 47.6840 0.0000 175.7109 65 K 3.9910 7.9203 120.2465 59.2848 32.0950 179.4458 66 K 3.9776 7.6671 117.2141 59.4331 32.0374 179.5014 67 V 3.6651 7.7106 118.3116 66.2890 31.5611 178.1859 68 L 4.4010 8.4513 118.9184 57.3587 41.3736 179.6460 69 G 3.7762 8.5931 106.2217 47.9660 0.0000 175.6434 70 A 4.1009 8.3016 123.5293 54.5833 18.1699 179.4536 71 F 4.1265 8.3843 118.4508 61.5799 39.7001 176.8804 72 S 4.1504 9.0776 113.0385 61.6795 62.3342 175.8371 73 D 4.4784 8.4958 121.6915 57.4038 40.5389 179.1116 74 G 3.5900 8.0099 106.0133 47.4148 0.0000 175.5577 75 L 3.7790 7.2073 119.6360 56.6544 41.6025 178.2501 76 A 4.2453 7.4562 118.8126 52.6766 19.6035 176.6790 77 H 4.8995 8.0640 115.2388 54.8374 29.8155 175.4124 78 L 3.9461 7.9230 119.5011 57.2791 41.9204 178.3021 79 D 4.6515 7.8979 116.2074 54.6695 41.9856 175.8403 80 N 5.0310 8.1006 118.2201 51.5791 39.3062 175.2581 81 L 4.1051 7.8111 121.7966 57.8107 42.0622 179.4688 82 K 4.0981 8.0186 117.4258 59.3489 32.5008 179.1130 83 G 3.7126 8.1433 105.6915 48.1128 0.0000 175.6090 84 T 3.6496 7.6480 117.3029 65.9478 68.7660 175.7148 85 F 4.5580 7.9744 116.7384 57.1169 39.1070 177.5803 86 A 4.0375 7.8044 123.1013 55.6473 18.2507 180.5134 87 T 3.8609 7.8263 107.7772 64.8936 68.8737 176.6520 88 L 4.1113 7.9306 121.4370 57.3778 41.7268 179.1209 89 S 4.4114 8.6547 114.8770 61.0781 62.4435 176.0312 90 E 3.9069 8.3716 121.3155 59.2718 29.1740 179.2501 91 L 3.8987 8.0852 120.2200 58.6394 42.1850 178.8609 92 H 4.2189 8.6794 116.4229 58.7640 28.6798 177.3311 93 C 3.5936 7.7771 120.7322 62.3788 31.1693 175.3538 94 D 4.4156 8.3444 119.9717 56.3189 40.5917 177.5173 95 K 4.2725 7.8524 117.1331 57.5286 33.3811 177.4659 96 L 4.2350 7.6926 115.9829 54.5760 42.6247 175.9185 97 H 4.1261 7.1575 113.4458 56.6754 26.5905 175.3305 98 V 3.8007 7.9035 118.4830 60.7624 32.4296 174.7038 99 D 4.2906 8.8114 127.1176 54.1222 41.4623 175.2769 100 P 3.1617 0.0000 0.0000 64.1842 31.8200 177.8569 101 E 3.8489 8.2857 119.3985 59.3924 29.2102 178.3885 102 N 4.2644 7.8708 116.3954 56.2349 38.4665 177.3065 103 F 4.4433 7.4389 119.2706 60.4544 39.0525 177.9775 104 R 3.9582 7.9214 117.3662 59.1356 29.9870 178.7913 105 L 3.8118 7.7268 118.7289 57.7765 41.5852 179.4071 106 L 4.0904 8.2565 120.5366 58.0045 42.0182 179.1350 107 G 3.6843 8.2875 105.7508 48.0718 0.0000 175.4749 108 N 4.4928 8.1709 118.7199 55.8292 38.4620 177.7838 109 V 3.6434 8.0510 119.9187 65.7968 31.5470 177.7647 110 L 3.8429 8.3382 120.5895 58.1522 41.8912 179.0503 111 V 3.5758 7.8888 118.0855 66.3383 31.3611 177.7963 112 C 4.1079 8.0697 116.3820 62.7424 27.8835 176.3207 113 V 3.5299 7.8754 120.0427 65.8452 31.0613 178.0641 114 L 3.8090 8.0055 118.9327 57.6289 41.3042 179.3640 115 A 3.6992 7.2750 120.5751 55.2353 18.0681 179.1568 116 H 4.1285 8.1074 115.9175 59.7739 30.0133 177.0025 117 H 4.0047 8.1264 116.9442 58.3951 28.8122 177.1202 118 F 4.5412 8.4713 118.2980 56.8095 39.6716 177.2760 119 G 3.8260 8.9369 108.3819 45.9566 0.0000 177.1701 120 K 3.9641 8.9589 121.7817 59.5420 32.3937 177.9845 121 E 4.0566 8.0101 119.5076 58.7221 30.0541 177.1626 122 F 4.5273 8.2263 123.1180 57.0629 37.8826 175.1997 123 T 4.1616 7.3214 115.3636 60.3905 71.2405 173.4677 124 P 4.1665 0.0000 0.0000 65.6171 31.3441 177.1937 125 P 4.1841 0.0000 0.0000 65.3838 31.1921 178.9086 126 V 3.5089 7.4697 116.9794 65.7998 31.4546 177.6981 127 Q 3.5427 7.8213 119.4793 59.1409 28.9451 178.2179 128 A 4.0093 8.1360 121.5259 55.1435 18.3623 179.4346 129 A 3.8746 7.9755 119.0856 55.7069 18.4402 179.5877 130 Y 3.9316 8.2784 115.1736 61.1544 37.9084 178.8429 131 Q 4.1342 8.8589 119.6570 58.8086 28.7335 178.8062 132 K 3.9576 8.0153 119.3507 59.3102 32.0103 179.4355 133 V 3.4601 7.6611 118.3756 66.3127 31.4197 178.6463 134 V 3.8587 8.3771 112.1741 64.1558 31.2580 178.5434 135 A 4.0862 8.2785 120.9860 55.0717 18.1572 179.9312 136 G 3.4538 8.2611 104.4333 47.8124 0.0000 176.1651 137 V 3.1561 8.0929 120.8736 65.5409 31.5181 178.0258 138 A 3.9348 8.1423 120.7258 55.2227 17.9882 179.4028 139 N 4.2939 8.2164 114.0977 56.2486 38.8938 177.2256 140 A 4.1571 8.1451 122.3874 55.2869 18.3303 179.7893 141 L 3.8735 8.0732 117.4417 57.3498 41.5681 179.0760 142 A 4.2608 7.9758 120.0237 54.0753 18.4025 178.8466 143 H 4.2972 8.1236 116.4610 58.3996 29.9454 175.8589 144 K 4.4967 8.1226 118.1575 56.1314 32.2130 176.2856 145 Y 4.1236 7.9716 117.2970 58.6066 38.3990 175.8417 146 H 4.3945 8.3683 117.1343 56.3532 28.0321 173.5521 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 V 8.05 3.93 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 0.97 0.00 0.00 0.95 0.00 0.00 2 H 8.20 4.60 0.00 3.16 3.13 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 3 L 8.24 4.45 0.00 1.55 1.53 0.83 0.80 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 4 T 8.69 4.17 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 1.26 0.00 0.00 5 P 0.00 4.20 0.00 2.16 2.14 0.00 3.58 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 2.10 2.14 0.00 6 E 8.08 4.01 0.00 2.14 2.19 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 2.34 2.33 0.00 7 E 8.19 3.91 0.00 2.24 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 2.29 2.32 0.00 8 K 8.21 3.82 0.00 1.92 1.81 0.00 1.63 0.00 0.00 1.52 0.00 0.00 2.83 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.39 7.81 9 S 8.10 4.06 0.00 3.89 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 10 A 8.12 3.99 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 11 V 8.00 3.52 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 0.58 0.00 0.00 0.35 0.00 0.00 12 T 8.06 3.98 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 1.26 0.00 0.00 13 A 8.19 4.03 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 14 L 8.16 3.90 0.00 1.91 1.92 0.23 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.84 4.41 0.00 3.83 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 16 G 8.14 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.78 4.44 0.00 2.18 2.10 0.00 1.91 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.66 7.81 18 V 7.10 3.59 1.21 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 -0.09 0.00 0.00 0.76 0.00 0.00 19 N 8.25 4.52 0.00 2.70 2.78 0.00 0.00 7.22 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 20 V 7.91 3.43 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 1.02 0.00 0.00 21 D 8.05 4.35 0.00 2.82 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 22 E 8.15 3.84 0.00 2.01 2.03 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 2.28 2.29 0.00 23 V 8.01 3.55 1.95 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 0.90 0.00 0.00 0.59 0.00 0.00 24 G 8.24 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 25 G 7.83 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.26 3.89 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 27 A 8.22 3.92 1.30 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 0.00 0.00 28 L 8.20 3.97 0.00 1.75 1.64 0.83 1.09 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 29 G 8.33 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 30 R 8.27 3.92 0.00 1.89 1.94 0.00 3.10 0.00 0.00 3.03 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 31 L 8.05 4.06 0.00 1.89 1.89 0.95 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.83 4.04 0.00 1.89 1.67 0.91 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.34 3.56 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 0.71 0.00 0.00 0.92 0.00 0.00 34 V 7.83 3.51 1.57 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 -0.11 0.00 0.00 0.77 0.00 0.00 35 Y 7.37 3.74 0.00 2.57 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 36 P 0.00 4.90 0.00 2.29 2.27 0.00 3.66 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.90 0.00 37 W 8.05 4.37 0.00 3.58 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 38 T 7.69 4.23 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 1.03 0.00 0.00 39 Q 8.14 4.35 0.00 2.25 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.43 2.45 0.00 40 R 7.65 3.73 0.00 1.64 1.96 0.00 3.00 0.00 0.00 2.60 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.50 0.00 41 F 7.21 4.38 0.00 1.84 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 F 7.92 4.47 0.00 2.83 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 43 E 8.46 3.95 0.00 1.96 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 2.40 2.31 0.00 44 S 8.01 4.45 0.00 4.16 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 45 F 8.41 4.69 0.00 3.20 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 46 G 7.62 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 0.00 0.00 0.00 47 D 8.62 4.48 0.00 2.67 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 48 L 8.33 4.90 0.00 1.66 1.63 1.08 1.04 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 49 S 8.45 4.34 0.00 4.01 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 50 T 7.44 4.74 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 1.21 0.00 0.00 51 P 0.00 4.20 0.00 2.15 2.11 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 52 D 8.07 4.32 0.00 2.67 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 53 A 8.02 4.00 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 54 V 7.96 3.68 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 1.04 0.00 0.00 0.97 0.00 0.00 55 M 8.23 4.01 0.00 2.00 2.09 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.79 0.00 56 G 7.99 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 7.93 4.35 0.00 3.10 2.87 0.00 0.00 7.17 7.73 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 58 P 0.00 4.23 0.00 2.13 2.04 0.00 3.62 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 59 K 7.92 3.62 0.00 1.53 0.74 0.00 1.74 0.00 0.00 1.51 0.00 0.00 2.82 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.25 1.31 7.81 60 V 8.07 3.70 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 1.08 0.00 0.00 1.09 0.00 0.00 61 K 8.14 3.93 0.00 1.94 1.81 0.00 1.84 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.52 7.81 62 A 8.19 3.98 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 63 H 8.61 4.37 0.00 3.54 3.52 0.00 5.80 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 64 G 8.55 3.72 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 0.00 0.00 0.00 65 K 7.92 3.99 0.00 2.05 1.90 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.40 0.00 0.00 0.00 0.00 1.61 1.65 7.81 66 K 7.67 3.98 0.00 2.03 1.87 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.51 1.49 7.81 67 V 7.71 3.67 2.26 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 1.10 0.00 0.00 1.04 0.00 0.00 68 L 8.45 4.40 0.00 2.01 1.94 1.10 1.24 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 69 G 8.59 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 70 A 8.30 4.10 1.57 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 71 F 8.38 4.13 0.00 3.15 3.41 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 72 S 9.08 4.15 0.00 4.60 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 0.00 73 D 8.50 4.48 0.00 2.84 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 74 G 8.01 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.21 3.78 0.00 1.39 1.40 -0.52 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.46 4.25 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 77 H 8.06 4.90 0.00 3.10 3.13 0.00 5.82 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 78 L 7.92 3.95 0.00 1.52 1.65 0.76 0.99 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 79 D 7.90 4.65 0.00 2.64 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 80 N 8.10 5.03 0.00 2.70 2.60 0.00 0.00 7.14 6.25 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 81 L 7.81 4.11 0.00 1.74 1.80 0.85 0.99 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 82 K 8.02 4.10 0.00 1.66 1.78 0.00 1.64 0.00 0.00 1.34 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.28 1.44 7.81 83 G 8.14 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 84 T 7.65 3.65 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 0.42 0.00 0.00 85 F 7.97 4.56 0.00 3.18 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 86 A 7.80 4.04 1.42 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 0.00 0.00 0.00 87 T 7.83 3.86 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 1.20 0.00 0.00 88 L 7.93 4.11 0.00 2.01 1.89 1.09 0.95 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 89 S 8.65 4.41 0.00 4.14 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 0.00 90 E 8.37 3.91 0.00 2.20 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 91 L 8.09 3.90 0.00 1.86 1.87 0.92 0.93 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 92 H 8.68 4.22 0.00 3.62 3.79 0.00 5.86 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.78 3.59 0.00 1.23 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 94 D 8.34 4.42 0.00 2.66 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 95 K 7.85 4.27 0.00 1.82 1.80 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.51 7.81 96 L 7.69 4.23 0.00 1.70 1.63 0.71 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.16 4.13 0.00 3.45 3.42 0.00 5.64 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.90 3.80 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 0.06 0.00 0.00 0.41 0.00 0.00 99 D 8.81 4.29 0.00 2.78 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 0.00 100 P 0.00 3.16 0.00 1.93 1.87 0.00 3.34 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.44 0.00 101 E 8.29 3.85 0.00 2.02 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 0.00 2.29 2.37 0.00 102 N 7.87 4.26 0.00 2.47 2.70 0.00 0.00 6.95 8.00 0.00 0.00 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 F 7.44 4.44 0.00 3.10 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 0.00 104 R 7.92 3.96 0.00 1.92 1.97 0.00 3.30 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.97 0.00 105 L 7.73 3.81 0.00 1.69 1.29 0.65 -0.07 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 0.00 106 L 8.26 4.09 0.00 1.86 1.74 0.94 1.39 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 0.00 107 G 8.29 3.68 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 0.00 0.00 0.00 108 N 8.17 4.49 0.00 2.83 2.95 0.00 0.00 6.69 7.08 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 0.00 109 V 8.05 3.64 2.25 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 1.14 0.00 0.00 1.19 0.00 0.00 110 L 8.34 3.84 0.00 1.69 1.82 0.85 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.89 3.58 2.33 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 1.34 0.00 0.00 1.13 0.00 0.00 112 C 8.07 4.11 0.00 3.19 2.93 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 0.00 113 V 7.88 3.53 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 0.88 0.00 0.00 0.92 0.00 0.00 114 L 8.01 3.81 0.00 1.01 1.03 0.68 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.28 3.70 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 0.00 116 H 8.11 4.13 0.00 3.20 3.46 0.00 5.78 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.13 4.00 0.00 2.84 2.62 0.00 5.71 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.47 4.54 0.00 3.26 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 0.00 119 G 8.94 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 K 8.96 3.96 0.00 1.92 2.02 0.00 1.64 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.47 1.42 7.81 121 E 8.01 4.06 0.00 2.06 2.42 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 2.32 2.29 0.00 122 F 8.23 4.53 0.00 3.07 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 0.00 123 T 7.32 4.16 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 124 P 0.00 4.17 0.00 2.16 2.15 0.00 3.58 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 125 P 0.00 4.18 0.00 2.11 2.07 0.00 3.49 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 2.08 2.11 0.00 126 V 7.47 3.51 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 0.92 0.00 0.00 0.88 0.00 0.00 127 Q 7.82 3.54 0.00 1.67 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.42 2.60 0.00 128 A 8.14 4.01 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 0.00 129 A 7.98 3.87 1.28 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 0.00 0.00 130 Y 8.28 3.93 0.00 3.32 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 8.86 4.13 0.00 2.21 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.80 0.00 0.00 0.00 0.00 0.00 2.75 2.62 0.00 132 K 8.02 3.96 0.00 1.98 1.81 0.00 1.63 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.59 7.81 133 V 7.66 3.46 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.71 0.00 0.00 134 V 8.38 3.86 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.10 0.00 0.00 135 A 8.28 4.09 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 0.00 136 G 8.26 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 8.09 3.16 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 0.39 0.00 0.00 0.63 0.00 0.00 138 A 8.14 3.93 1.44 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 0.00 0.00 0.00 139 N 8.22 4.29 0.00 2.86 2.89 0.00 0.00 7.03 8.08 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 0.00 140 A 8.15 4.16 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 0.00 141 L 8.07 3.87 0.00 0.82 0.38 -0.04 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.98 4.26 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 0.00 143 H 8.12 4.30 0.00 3.38 3.54 0.00 5.94 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.12 4.50 0.00 1.83 1.84 0.00 1.81 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.72 7.81 145 Y 7.97 4.12 0.00 3.14 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 0.00 146 H 8.37 4.39 0.00 3.22 3.24 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00