NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.1313 8.1749 117.3706 63.7803 70.7131 175.7240 3 T 2.9945 6.9504 113.0973 63.0506 63.9524 171.1593 4 F 4.5128 7.2166 121.2370 55.7043 40.7104 174.8369 5 R 4.3870 8.0393 119.0992 54.6126 33.0592 173.6169 6 F 5.1134 8.0034 119.5797 55.5871 41.3337 175.4114 7 C 3.9942 8.1470 117.3813 57.4446 31.5757 171.9968 8 R 4.8738 8.3614 118.0340 56.7745 31.2331 176.8699 9 D 4.3324 8.1518 113.6042 54.5562 41.1996 173.0563 10 C 4.5988 8.0920 114.8964 61.5408 30.8806 175.6948 11 N 4.2931 6.7158 118.9118 57.5436 36.5122 174.0969 12 N 4.8152 7.8950 125.8777 53.0400 39.7840 174.3898 13 M 4.4034 8.4691 126.2230 54.8472 34.2753 175.0083 14 L 5.6358 7.7417 120.8388 52.3056 44.2706 175.8171 15 Y 4.6617 9.1132 122.2657 56.3506 39.8496 173.2311 16 P 5.3589 0.0000 0.0000 62.4057 33.4438 174.9036 17 R 4.8084 9.2174 119.8308 54.9179 35.2975 173.1850 18 E 4.8777 8.6502 120.8661 54.7259 32.0749 175.4295 19 D 4.5288 8.7377 126.8533 52.9294 40.7280 176.9036 20 K 3.8298 8.8041 124.0291 59.4140 32.3907 178.5751 21 E 4.0394 8.1896 117.8041 58.4572 29.6744 176.9694 22 N 4.7649 8.1958 113.2810 52.0316 39.7572 173.6585 23 N 4.1132 7.9948 117.2357 52.2462 35.8122 172.8837 24 R 4.4208 7.1634 116.0253 55.4574 33.0084 173.5447 25 L 4.8953 8.0014 121.4607 53.5381 44.4758 174.9526 26 L 4.9543 8.2957 124.5589 53.2879 46.3483 176.6433 27 F 5.2009 8.7239 123.0476 57.5546 41.9126 173.2914 28 E 4.9269 8.0651 114.5454 57.2155 33.6884 174.6649 29 C 5.1864 8.9306 117.8951 58.3810 34.6835 174.1937 30 R 4.6001 8.4826 122.1616 56.3391 30.6627 176.5123 31 T 4.5021 8.1677 114.4676 64.7762 71.6550 174.1631 32 C 4.8499 7.6688 115.5460 58.2785 29.0318 175.0431 33 S 4.6083 8.5898 111.3184 57.3230 65.3861 172.9807 34 Y 4.2311 7.8138 121.4987 57.7093 39.2650 175.7504 35 V 4.9127 8.0013 121.8195 62.2184 34.4685 172.2469 36 E 5.1193 8.9550 124.9381 54.0143 32.9198 175.4186 37 E 4.4155 8.9021 118.9847 56.0604 30.6824 176.3372 38 A 3.5882 8.4834 123.7427 52.5439 18.2967 178.2673 39 G 3.7340 9.1277 112.2295 48.3405 0.0000 173.5322 40 S 4.6272 7.5636 111.5625 55.9927 65.1665 171.9633 41 P 4.3412 0.0000 0.0000 63.6272 31.3345 176.3248 42 L 4.3135 7.7930 122.2156 54.3547 41.0464 175.9180 43 V 4.1166 8.3892 126.6738 64.8899 32.1605 175.6669 44 Y 5.0175 7.6290 117.7318 56.0070 41.7745 173.5992 45 R 4.2816 7.5402 124.3359 54.9252 33.5087 173.4420 46 H 4.2039 8.5664 123.2591 57.4394 31.0294 171.9192 47 E 3.5250 7.9405 127.2961 56.0974 28.3649 173.4644 48 L 4.1451 8.4446 125.2728 56.9512 42.3941 178.4859 49 I 4.1110 7.3244 123.8292 60.2717 35.8763 175.8382 50 T 4.2665 7.9189 121.3252 63.3915 68.8963 174.7374 51 N 4.9663 8.4043 117.4003 52.4383 41.1609 173.9995 52 I 4.2810 7.7248 113.1206 60.5008 38.2713 175.1291 53 G 3.8031 9.1383 112.4748 45.1887 0.0000 175.0970 54 E 3.6461 7.5710 119.6051 59.3183 30.1444 177.7191 55 T 4.4646 7.1442 113.2959 62.0078 69.2884 173.6071 56 A 3.8041 7.8274 124.4282 52.8160 19.6279 179.4978 57 G 3.6075 7.9296 102.6234 47.0265 0.0000 175.3362 58 V 4.5215 7.7288 132.0358 60.6287 31.9324 175.5755 59 V 3.6217 7.6755 120.3731 63.2187 32.2722 175.9654 60 Q 4.2030 8.6921 123.9806 57.7149 28.8246 176.2274 61 D 4.7538 7.7720 115.7936 54.9737 41.8132 177.4909 62 I 3.7538 7.9392 119.7120 62.5165 37.9498 176.1653 63 G 3.9377 7.8620 107.1072 47.0620 0.0000 174.6667 64 S 4.3683 8.8717 114.1719 58.3615 63.4197 173.4816 65 D 4.6506 7.8025 121.9106 52.4145 40.9727 174.0125 66 P 4.4092 0.0000 0.0000 65.8862 31.4656 177.8635 67 T 3.9330 7.9027 107.5822 63.3438 68.7613 174.1124 68 L 4.3605 7.5163 122.0014 53.2506 43.0708 174.2611 69 P 4.7809 0.0000 0.0000 62.2858 33.3096 174.7924 70 R 6.0300 8.9612 119.5505 53.8443 32.5600 175.1873 71 S 4.8521 8.6590 116.0727 56.2734 66.9053 173.6208 72 D 4.8119 8.4645 118.8498 53.3110 39.7020 176.7459 73 R 4.2895 7.7240 120.1862 56.0402 31.3117 174.6070 74 E 5.5598 8.3991 115.8939 53.4724 30.2188 175.0132 75 C 2.9218 8.0934 116.9482 53.9715 42.3717 172.8105 76 P 4.0227 0.0000 0.0000 64.7120 30.8611 176.3853 77 K 4.2576 6.8007 113.1074 57.0708 34.9247 175.7097 78 C 3.8254 8.1156 113.6879 57.4081 41.6728 174.1365 79 H 3.8637 7.8006 114.3685 56.4872 26.9895 174.5084 80 S 4.5053 7.6685 116.4732 57.8840 64.4201 174.0146 81 R 5.0530 8.0947 117.6153 55.2460 30.5249 177.0950 82 E 4.6189 8.3481 118.6110 54.8393 32.9242 174.9201 83 N 6.1250 9.0887 120.8210 50.3347 43.4396 174.6156 84 V 5.6698 8.5858 120.4762 59.1965 33.7110 174.7047 85 F 4.9028 9.7085 122.0238 55.5020 40.2011 174.2474 86 F 4.5882 7.3768 110.7481 56.8549 40.7190 172.7201 87 Q 4.6335 8.5733 116.4895 53.7664 32.4587 174.6186 88 S 3.5823 8.4782 112.9873 59.2194 62.1521 174.2767 89 Q 3.8492 8.0641 125.2624 56.6852 28.5488 176.2591 90 Q 4.0803 7.2221 119.3157 55.2138 28.2053 176.6672 91 R 4.2272 8.1294 127.5561 55.9281 27.7434 175.8904 92 R 4.6408 7.2685 118.8946 54.0531 33.3026 175.8062 93 K 4.1269 8.3422 120.5138 59.3840 32.3873 179.3947 94 D 4.5211 7.9841 117.2255 55.5509 39.4636 176.8900 95 T 3.9079 7.0805 115.6373 64.0459 68.9327 173.7462 96 S 4.6379 8.3315 118.6307 58.0703 64.7283 173.5846 97 M 4.6988 8.2123 118.2298 54.8939 32.3029 176.6198 98 V 4.2130 7.8481 117.0613 62.0941 33.4679 174.4265 99 L 5.1980 8.2448 123.8115 52.8263 44.2635 175.4536 100 F 4.8810 8.9414 120.9165 56.1003 41.4019 175.1736 101 F 4.7964 9.3511 123.3692 56.0322 41.9486 175.1462 102 V 5.4737 7.7704 118.2249 60.6636 35.2695 173.6327 103 C 4.7606 8.9467 128.4154 59.4156 32.1041 173.8278 104 L 4.3050 8.6522 125.7725 55.5876 41.7887 177.3462 105 S 4.8531 7.9974 114.2226 56.2134 63.4538 173.9612 106 C 5.6716 8.4455 127.1979 59.0483 28.9214 175.4176 107 S 4.1763 7.9543 113.9064 59.2143 60.0205 168.3741 108 H 4.8487 8.1392 118.2882 55.2005 32.1301 173.6767 109 I 5.4303 7.9729 123.7400 58.7093 36.4449 174.3023 110 F 4.7821 8.7064 120.2724 56.0099 40.4455 176.1418 111 T 5.2183 8.2580 117.3695 61.4180 71.0330 173.9643 112 S 4.5741 8.3486 113.9163 58.4605 63.3281 174.5847 113 D 4.6690 8.0796 120.3720 54.2218 38.2375 176.9482 114 Q 4.1141 8.2757 121.5664 57.6691 29.1519 177.8695 115 K 4.1329 7.9452 116.2806 56.7014 32.6015 176.4836 116 N 4.3326 8.0817 114.8916 54.1881 36.1972 174.4229 117 K 4.1695 8.1537 122.4218 56.8224 32.1820 177.2011 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 2 T 8.17 4.13 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 1.34 0.00 0.00 3 T 6.95 2.99 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 4 F 7.22 4.51 0.00 2.77 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 5 R 8.04 4.39 0.00 1.67 1.71 0.00 3.21 0.00 0.00 3.64 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.53 0.00 6 F 8.00 5.11 0.00 3.06 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 7 C 8.15 3.99 0.00 1.98 2.65 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 0.00 0.00 0.00 0.00 8 R 8.36 4.87 0.00 2.06 2.06 0.00 3.38 0.00 0.00 3.48 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.33 0.00 9 D 8.15 4.33 0.00 2.93 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 10 C 8.09 4.60 0.00 3.10 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 N 6.72 4.29 0.00 2.91 2.80 0.00 0.00 6.94 7.67 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 12 N 7.90 4.82 0.00 2.69 2.43 0.00 0.00 7.03 7.66 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 13 M 8.47 4.40 0.00 1.80 1.72 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.84 0.00 14 L 7.74 5.64 0.00 1.35 1.50 0.89 0.94 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 15 Y 9.11 4.66 0.00 2.90 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 16 P 0.00 5.36 0.00 2.21 2.58 0.00 3.87 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.17 0.00 17 R 9.22 4.81 0.00 1.72 1.82 0.00 3.20 0.00 0.00 3.11 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 18 E 8.65 4.88 0.00 1.95 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.26 0.00 19 D 8.74 4.53 0.00 2.76 2.54 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 20 K 8.80 3.83 0.00 1.78 1.87 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.45 7.81 21 E 8.19 4.04 0.00 1.92 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 2.29 2.33 0.00 22 N 8.20 4.76 0.00 2.95 2.80 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 23 N 7.99 4.11 0.00 2.87 2.85 0.00 0.00 6.78 7.69 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 24 R 7.16 4.42 0.00 1.78 1.95 0.00 2.92 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.50 0.00 25 L 8.00 4.90 0.00 1.68 1.38 0.87 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 26 L 8.30 4.95 0.00 1.59 1.49 0.92 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 27 F 8.72 5.20 0.00 3.10 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 28 E 8.07 4.93 0.00 2.15 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 2.36 2.22 0.00 29 C 8.93 5.19 0.00 2.88 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 30 R 8.48 4.60 0.00 1.39 1.62 0.00 2.21 0.00 0.00 2.71 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.11 0.00 31 T 8.17 4.50 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 32 C 7.67 4.85 0.00 3.12 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 33 S 8.59 4.61 0.00 3.85 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 34 Y 7.81 4.23 0.00 2.97 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 35 V 8.00 4.91 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 0.91 0.00 0.00 1.11 0.00 0.00 36 E 8.96 5.12 0.00 2.34 2.60 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 2.46 2.48 0.00 37 E 8.90 4.42 0.00 1.98 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 38 A 8.48 3.59 1.10 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 0.00 0.00 39 G 9.13 3.73 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 0.00 0.00 0.00 40 S 7.56 4.63 0.00 3.83 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 41 P 0.00 4.34 0.00 2.24 2.16 0.00 3.84 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 42 L 7.79 4.31 0.00 1.67 1.72 0.97 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 43 V 8.39 4.12 2.22 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 1.00 0.00 0.00 1.06 0.00 0.00 44 Y 7.63 5.02 0.00 2.85 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 45 R 7.54 4.28 0.00 1.62 1.55 0.00 3.21 0.00 0.00 3.09 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.46 0.00 46 H 8.57 4.20 0.00 2.94 3.22 0.00 6.13 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 7.94 3.53 0.00 2.04 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.27 0.00 48 L 8.44 4.15 0.00 1.66 1.68 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 49 I 7.32 4.11 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.49 0.91 0.00 0.00 50 T 7.92 4.27 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 1.25 0.00 0.00 51 N 8.40 4.97 0.00 2.77 2.79 0.00 0.00 6.58 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 52 I 7.72 4.28 1.85 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 1.32 0.53 0.90 0.00 0.00 53 G 9.14 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 54 E 7.57 3.65 0.00 2.02 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 2.39 2.46 0.00 55 T 7.14 4.46 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 1.45 0.00 0.00 56 A 7.83 3.80 1.13 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 0.00 0.00 57 G 7.93 3.61 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 0.00 0.00 0.00 58 V 7.73 4.52 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 0.98 0.00 0.00 1.12 0.00 0.00 59 V 7.68 3.62 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 1.13 0.00 0.00 0.95 0.00 0.00 60 Q 8.69 4.20 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 61 D 7.77 4.75 0.00 2.75 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 62 I 7.94 3.75 2.01 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.84 0.98 0.00 0.00 63 G 7.86 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 64 S 8.87 4.37 0.00 3.88 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 D 7.80 4.65 0.00 2.67 2.65 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 0.00 0.00 0.00 0.00 66 P 0.00 4.41 0.00 2.22 2.17 0.00 3.83 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 67 T 7.90 3.93 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 1.20 0.00 0.00 68 L 7.52 4.36 0.00 1.82 1.58 1.01 0.82 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 69 P 0.00 4.78 0.00 1.81 1.87 0.00 3.48 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.98 0.00 70 R 8.96 6.03 0.00 1.76 1.92 0.00 3.42 0.00 0.00 4.01 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.42 0.00 71 S 8.66 4.85 0.00 3.76 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 72 D 8.46 4.81 0.00 2.80 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 73 R 7.72 4.29 0.00 1.87 1.87 0.00 2.64 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.53 0.00 74 E 8.40 5.56 0.00 1.98 1.87 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 2.10 2.12 0.00 75 C 8.09 2.92 0.00 2.68 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 76 P 0.00 4.02 0.00 1.90 2.04 0.00 3.23 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.93 0.00 77 K 6.80 4.26 0.00 1.58 1.59 0.00 1.51 0.00 0.00 1.59 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.21 1.14 7.81 78 C 8.12 3.83 0.00 3.19 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 79 H 7.80 3.86 0.00 3.21 3.28 0.00 5.65 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 7.67 4.51 0.00 3.79 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 81 R 8.09 5.05 0.00 1.65 1.88 0.00 3.19 0.00 0.00 4.01 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.44 0.00 82 E 8.35 4.62 0.00 1.89 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 0.00 2.31 2.33 0.00 83 N 9.09 6.13 0.00 2.79 2.92 0.00 0.00 6.34 7.56 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 84 V 8.59 5.67 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.97 0.00 0.00 85 F 9.71 4.90 0.00 2.41 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 0.00 0.00 0.00 86 F 7.38 4.59 0.00 2.82 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 87 Q 8.57 4.63 0.00 1.94 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.88 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 88 S 8.48 3.58 0.00 3.71 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 89 Q 8.06 3.85 0.00 2.09 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.99 0.00 0.00 0.00 0.00 0.00 1.72 1.85 0.00 90 Q 7.22 4.08 0.00 1.97 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 7.47 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 91 R 8.13 4.23 0.00 1.79 1.85 0.00 3.31 0.00 0.00 3.06 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.50 0.00 92 R 7.27 4.64 0.00 1.70 1.75 0.00 3.21 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.59 0.00 93 K 8.34 4.13 0.00 1.85 1.81 0.00 1.72 0.00 0.00 1.86 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.41 7.81 94 D 7.98 4.52 0.00 2.78 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 95 T 7.08 3.91 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 1.20 0.00 0.00 96 S 8.33 4.64 0.00 4.02 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 97 M 8.21 4.70 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.49 0.00 98 V 7.85 4.21 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 0.95 0.00 0.00 1.05 0.00 0.00 99 L 8.24 5.20 0.00 1.13 1.36 1.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 100 F 8.94 4.88 0.00 3.22 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 0.00 101 F 9.35 4.80 0.00 1.51 2.62 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 0.00 102 V 7.77 5.47 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 1.18 0.00 0.00 0.92 0.00 0.00 103 C 8.95 4.76 0.00 3.10 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 0.00 104 L 8.65 4.31 0.00 1.64 1.74 0.99 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.00 4.85 0.00 3.81 3.79 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 0.00 106 C 8.45 5.67 0.00 3.12 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 0.00 107 S 7.95 4.18 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 0.00 108 H 8.14 4.85 0.00 3.26 3.20 0.00 5.81 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 I 7.97 5.43 1.90 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.90 1.09 0.00 0.00 110 F 8.71 4.78 0.00 3.08 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 0.00 111 T 8.26 5.22 4.12 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 1.12 0.00 0.00 112 S 8.35 4.57 0.00 4.21 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 8.08 4.67 0.00 2.70 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 0.00 114 Q 8.28 4.11 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 7.06 0.00 0.00 0.00 0.00 0.00 2.37 2.74 0.00 115 K 7.95 4.13 0.00 1.75 1.86 0.00 1.86 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.46 7.81 116 N 8.08 4.33 0.00 2.88 2.94 0.00 0.00 7.02 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 K 8.15 4.17 0.00 1.75 1.73 0.00 1.79 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.43 7.81