NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.5921 8.4129 118.0443 56.9170 42.4139 173.9891 2 E 4.9109 8.3396 115.4397 53.8836 31.6363 172.6710 3 E 4.3249 9.8603 115.4159 58.3967 30.8465 175.3252 4 P 3.8297 0.0000 0.0000 61.3019 31.9969 174.4964 5 P 4.4390 0.0000 0.0000 62.9939 31.8478 176.0430 6 T 4.8522 7.9215 109.6207 60.1358 71.0235 173.4945 7 F 4.7167 8.2869 120.0796 55.6782 43.2359 174.8576 8 E 4.0363 8.9710 122.5474 59.1258 29.9665 177.7930 9 A 2.9151 8.0337 121.3727 53.4512 18.8954 176.5042 10 M 5.3500 7.5163 110.8266 53.4837 34.9365 174.2812 11 E 4.9786 9.0928 117.0112 54.4800 33.8205 174.3807 12 L 4.2404 8.5374 121.0638 54.8194 43.3426 175.9720 13 I 4.2108 8.1072 124.1052 61.8621 38.6084 176.4575 14 G 3.8652 9.0591 115.0519 44.8385 0.0000 173.1130 15 K 3.9924 8.1964 120.3268 53.7819 31.8913 174.4049 16 P 4.5435 0.0000 0.0000 61.5725 30.3697 176.0540 17 K 4.4032 8.9572 123.8765 54.2897 32.9666 176.3824 18 P 4.6272 0.0000 0.0000 65.3145 31.6243 175.7112 19 Y 5.2331 7.3187 117.8460 56.1040 41.6772 174.1466 20 Y 4.6157 8.1818 123.6920 56.0570 41.0144 175.2971 21 E 4.2576 10.1518 125.1360 54.7807 32.0346 175.5093 22 I 3.5770 8.0107 123.0887 62.5110 37.4108 177.0157 23 G 3.9682 9.0294 114.6813 44.9657 0.0000 173.4058 24 E 4.1663 7.7242 121.7129 56.3541 30.7760 175.3956 25 R 5.2039 8.6401 126.1629 54.6267 32.5838 174.9494 26 V 4.3463 8.7651 125.4003 61.0792 34.6584 173.8084 27 D 5.2926 8.2961 125.7270 52.7045 44.0159 174.5679 28 Y 5.2358 8.6957 119.3828 56.0345 41.0717 175.0863 29 K 4.7719 8.7399 120.1352 54.9820 36.5667 174.6984 30 C 4.8079 8.7254 118.5347 56.7338 41.9300 174.0674 31 K 4.3843 9.1709 122.8508 55.6691 33.3161 176.5414 32 K 3.9308 8.6726 123.0790 58.4429 32.6119 176.0876 33 G 3.8282 9.1359 114.0883 45.1994 0.0000 172.4806 34 Y 5.5078 8.0401 116.1053 56.3118 40.8986 175.1919 35 F 5.2206 9.2887 115.0691 55.5037 42.0134 172.9858 36 Y 4.8732 8.8350 121.4426 57.1700 40.2788 174.0016 37 I 4.5114 7.4384 126.3721 58.6620 40.4107 173.9362 38 P 4.3806 0.0000 0.0000 61.6627 31.9382 174.0849 39 P 4.8596 0.0000 0.0000 62.5094 31.3263 175.1013 40 L 4.0465 7.7033 118.3907 55.2456 42.0413 176.3236 41 A 4.5461 8.1458 122.7039 52.1875 19.5571 177.2282 42 T 4.8667 8.1905 110.7182 60.9799 69.5976 172.7486 43 H 5.3913 8.1361 115.0508 56.3816 31.7418 171.9275 44 T 4.7994 8.7960 112.5771 60.8494 71.6458 172.2660 45 I 5.3145 8.3316 124.6166 59.4518 41.7791 175.3270 46 C 4.1594 8.9204 126.8599 56.0340 44.0977 173.2172 47 D 4.7752 8.0298 128.8417 52.9499 40.0245 177.2265 48 R 4.0377 8.4671 117.1674 59.1116 30.0171 175.8696 49 N 4.9341 7.8026 120.5272 54.3565 38.8535 175.3553 50 H 4.7717 9.1204 107.8207 54.6529 30.0664 173.3340 51 T 4.5485 7.8066 108.6622 59.2935 72.1283 173.5640 52 W 4.5012 8.4996 123.5207 56.5097 29.7853 176.0714 53 L 4.2557 8.4196 123.0115 54.6048 42.0332 175.5032 54 P 4.6627 0.0000 0.0000 62.8568 31.9168 176.4576 55 V 4.4151 8.1680 121.5447 60.5756 33.8920 172.9614 56 S 5.0067 8.2000 115.7345 56.8042 66.0340 172.7985 57 D 4.5596 8.2039 117.2985 53.2847 39.6946 178.5065 58 D 4.0866 7.9125 121.6458 57.9678 41.2842 177.7363 59 A 3.6898 7.6397 120.3132 53.7467 19.5894 177.4808 60 C 4.9131 7.2983 113.3314 55.7547 40.6195 173.4231 61 Y 4.8440 7.9064 121.9835 56.1099 40.2463 175.8102 62 R 4.5168 8.7748 120.1046 56.1502 31.2315 176.7125 63 E 4.4687 9.1020 122.2400 57.2389 30.5716 176.5232 64 T 5.0670 8.4950 113.1760 60.5584 71.5383 174.2301 65 C 4.7638 8.8040 119.9979 54.5940 42.0985 172.4800 66 P 4.6430 0.0000 0.0000 62.5302 31.6366 176.1212 67 Y 4.6446 8.7442 122.5360 58.0432 39.2610 175.6205 68 I 4.1493 7.8757 126.5409 59.0435 38.9783 175.8056 69 R 3.7899 7.9085 124.8149 55.4958 30.5893 176.6566 70 D 4.4348 8.6209 121.0492 54.1629 41.4279 175.1836 71 P 4.2833 0.0000 0.0000 62.1882 32.0291 175.5119 72 L 3.9641 8.2212 122.6948 56.7603 42.3926 176.5672 73 N 4.0334 9.0000 120.9296 53.7643 36.2827 173.5914 74 G 4.1882 7.9170 106.0738 45.8019 0.0000 172.1005 75 Q 4.7946 8.7176 118.6141 54.8933 33.8607 173.8010 76 A 4.5455 8.9974 126.5988 50.4387 20.0544 175.5852 77 V 4.2919 7.8320 115.1894 59.5599 34.0067 174.2504 78 P 4.5477 0.0000 0.0000 62.7883 31.6026 176.1881 79 A 4.5470 8.8284 124.8022 51.8831 19.6750 177.1417 80 N 4.8674 7.7552 110.5569 52.2696 40.4968 174.5545 81 G 3.8593 9.0250 105.1010 46.2324 0.0000 173.5976 82 T 4.3590 7.4961 109.5605 61.7140 69.8629 172.3002 83 Y 4.6213 8.5051 123.1226 57.8337 38.5870 175.7224 84 E 4.6693 8.0305 120.9473 55.6917 30.1908 176.5272 85 F 4.3606 8.3911 117.6682 58.4437 38.2921 174.7377 86 G 3.6890 8.8387 112.3762 45.3519 0.0000 173.3125 87 Y 4.8615 7.6251 116.7213 56.2409 41.3461 174.5810 88 Q 5.4490 8.7032 117.6118 54.9096 33.1505 173.3403 89 M 4.8440 8.9784 118.4323 53.8776 35.2331 173.5409 90 H 5.3038 8.8138 125.2730 54.3642 32.8478 172.7690 91 F 5.2925 8.6570 123.1438 55.7189 41.6383 174.7397 92 I 4.7111 8.7596 123.6134 59.6949 40.6849 173.6949 93 C 5.1712 8.7043 123.0734 55.1031 39.6387 173.9253 94 N 4.5389 8.4669 123.2215 53.3001 39.1074 174.6559 95 E 4.1238 8.5927 115.3942 57.5159 30.1302 173.3197 96 G 3.9525 9.2161 110.7556 45.4063 0.0000 172.5442 97 Y 5.2502 7.7784 115.1569 56.2139 42.1200 174.3242 98 Y 5.0078 8.8258 119.7181 55.0771 41.6892 174.3833 99 L 4.8174 8.7116 123.3326 54.7035 43.5604 175.7309 100 I 4.2522 8.5174 118.5144 60.4626 40.0440 172.9849 101 G 3.5808 8.8832 116.8454 45.9744 0.0000 167.3183 102 E 3.5399 8.1746 126.8758 56.1872 26.1261 174.0704 103 E 4.4604 8.2763 120.1213 56.7479 31.1288 176.0132 104 I 5.2283 7.4531 120.3225 59.8422 41.5458 174.4615 105 L 4.6339 8.7382 125.3954 53.0218 45.0724 175.5714 106 Y 4.9890 8.4114 122.5076 58.1823 39.5620 174.3610 107 C 4.6923 9.2310 124.5865 55.5718 43.4775 172.1871 108 E 5.0537 8.6866 125.8625 54.4380 32.4348 174.8490 109 L 4.5155 8.3149 123.7401 53.8461 43.2066 176.0964 110 K 4.3817 8.7867 126.3395 55.3224 34.6358 177.7299 111 G 3.9414 8.3708 117.5978 46.8819 0.0000 175.1834 112 S 4.4372 8.9625 121.3730 58.2068 63.9606 173.7837 113 V 4.2209 7.3166 120.1444 60.7524 33.2338 173.6517 114 A 5.1002 8.2533 127.1616 50.3397 20.7597 176.0141 115 I 4.5638 8.2939 115.0164 58.8544 42.2404 174.2162 116 W 5.2035 8.5204 121.8713 55.7759 30.5853 177.1202 117 S 4.6740 9.3122 117.9444 57.7400 62.9903 173.8757 118 G 3.9052 7.2717 109.1909 45.7794 0.0000 172.4922 119 K 4.1507 8.2089 120.6451 54.5663 32.8554 174.6805 120 P 3.6291 0.0000 0.0000 62.3709 31.6769 174.3657 121 P 4.3683 0.0000 0.0000 62.3834 32.6598 175.2606 122 I 4.3891 7.8766 121.0109 59.9706 40.1156 174.6217 123 C 5.1573 8.5133 121.9419 55.4623 42.1425 172.9959 124 E 4.5925 8.8030 125.9047 54.0993 31.4521 176.4008 125 K 3.4889 8.6629 124.1771 56.0009 32.4943 177.2290 126 V 3.9160 7.9502 122.4042 62.8955 32.2380 171.8429 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 C 8.41 4.59 0.00 2.15 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 0.00 0.00 0.00 2 E 8.34 4.91 0.00 2.07 1.78 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 2.21 1.92 0.00 3 E 9.86 4.32 0.00 2.05 2.06 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 2.42 2.58 0.00 4 P 0.00 3.83 0.00 1.66 0.81 0.00 3.68 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.07 0.00 5 P 0.00 4.44 0.00 2.13 1.85 0.00 3.49 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 6 T 7.92 4.85 4.26 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 1.24 0.00 0.00 7 F 8.29 4.72 0.00 2.92 2.99 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 8 E 8.97 4.04 0.00 1.91 1.92 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 2.29 2.34 0.00 9 A 8.03 2.92 0.82 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 10 M 7.52 5.35 0.00 1.77 2.04 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.93 0.00 11 E 9.09 4.98 0.00 2.03 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 0.00 2.21 2.26 0.00 12 L 8.54 4.24 0.00 1.50 1.52 0.39 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 13 I 8.11 4.21 1.76 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.80 0.86 0.00 0.00 14 G 9.06 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 15 K 8.20 3.99 0.00 1.79 1.64 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.77 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.36 1.04 7.81 16 P 0.00 4.54 0.00 2.09 2.11 0.00 3.65 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 2.05 2.12 0.00 17 K 8.96 4.40 0.00 0.79 1.36 0.00 1.51 0.00 0.00 1.57 0.00 0.00 2.82 0.00 0.00 2.38 0.00 0.00 0.00 0.00 1.29 1.38 7.81 18 P 0.00 4.63 0.00 2.22 2.15 0.00 3.50 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 2.12 2.09 0.00 19 Y 7.32 5.23 0.00 3.00 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 20 Y 8.18 4.62 0.00 2.62 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 21 E 10.15 4.26 0.00 2.02 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 2.34 2.36 0.00 22 I 8.01 3.58 1.84 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.28 0.89 0.00 0.00 23 G 9.03 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 24 E 7.72 4.17 0.00 2.31 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 2.48 2.35 0.00 25 R 8.64 5.20 0.00 1.88 1.79 0.00 3.13 0.00 0.00 3.10 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.61 0.00 26 V 8.77 4.35 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 0.15 0.00 0.00 0.36 0.00 0.00 27 D 8.30 5.29 0.00 2.56 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 0.00 0.00 0.00 0.00 28 Y 8.70 5.24 0.00 2.76 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 29 K 8.74 4.77 0.00 1.78 1.84 0.00 1.31 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.40 7.81 30 C 8.73 4.81 0.00 3.00 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 31 K 9.17 4.38 0.00 1.89 1.87 0.00 1.96 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.66 1.37 7.81 32 K 8.67 3.93 0.00 1.74 1.79 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.46 7.81 33 G 9.14 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 34 Y 8.04 5.51 0.00 2.86 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 35 F 9.29 5.22 0.00 3.21 3.13 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 36 Y 8.84 4.87 0.00 3.13 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 37 I 7.44 4.51 2.07 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.56 0.89 0.00 0.00 38 P 0.00 4.38 0.00 2.07 2.12 0.00 3.69 0.00 0.00 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.37 0.00 39 P 0.00 4.86 0.00 2.15 2.13 0.00 3.50 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.07 0.00 40 L 7.70 4.05 0.00 1.51 1.60 0.83 0.72 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 41 A 8.15 4.55 1.18 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 0.00 0.00 42 T 8.19 4.87 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 1.38 0.00 0.00 43 H 8.14 5.39 0.00 3.28 3.35 0.00 5.50 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 T 8.80 4.80 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 0.98 0.00 0.00 45 I 8.33 5.31 1.97 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 1.34 1.19 0.99 0.00 0.00 46 C 8.92 4.16 0.00 2.24 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 47 D 8.03 4.78 0.00 2.91 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 48 R 8.47 4.04 0.00 1.85 1.92 0.00 3.26 0.00 0.00 3.15 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.21 0.00 49 N 7.80 4.93 0.00 2.66 2.78 0.00 0.00 6.74 7.89 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 50 H 9.12 4.77 0.00 2.99 3.15 0.00 5.85 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 T 7.81 4.55 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 1.21 0.00 0.00 52 W 8.50 4.50 0.00 3.23 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 53 L 8.42 4.26 0.00 1.66 1.67 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.66 0.00 1.95 2.00 0.00 3.73 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 2.04 2.11 0.00 55 V 8.17 4.42 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 0.66 0.00 0.00 0.73 0.00 0.00 56 S 8.20 5.01 0.00 4.05 3.84 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 57 D 8.20 4.56 0.00 2.64 2.57 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 58 D 7.91 4.09 0.00 2.51 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 59 A 7.64 3.69 1.07 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 0.00 0.00 60 C 7.30 4.91 0.00 2.53 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 61 Y 7.91 4.84 0.00 2.56 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 62 R 8.77 4.52 0.00 1.93 1.95 0.00 3.10 0.00 0.00 2.40 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.81 0.00 63 E 9.10 4.47 0.00 1.97 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 2.54 2.50 0.00 64 T 8.50 5.07 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 1.37 0.00 0.00 65 C 8.80 4.76 0.00 2.39 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 0.00 0.00 0.00 0.00 66 P 0.00 4.64 0.00 2.32 2.14 0.00 3.71 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.15 0.00 67 Y 8.74 4.64 0.00 2.82 2.96 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 0.00 0.00 0.00 68 I 7.88 4.15 1.58 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.99 0.77 0.00 0.00 69 R 7.91 3.79 0.00 1.72 1.84 0.00 3.33 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.57 0.00 70 D 8.62 4.43 0.00 2.63 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 71 P 0.00 4.28 0.00 2.12 2.05 0.00 3.76 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.14 0.00 72 L 8.22 3.96 0.00 1.52 1.50 0.85 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 73 N 9.00 4.03 0.00 2.33 1.42 0.00 0.00 6.76 7.75 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 74 G 7.92 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 75 Q 8.72 4.79 0.00 2.12 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.71 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 76 A 9.00 4.55 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 77 V 7.83 4.29 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 0.70 0.00 0.00 0.86 0.00 0.00 78 P 0.00 4.55 0.00 2.00 2.02 0.00 3.70 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 2.28 2.22 0.00 79 A 8.83 4.55 1.36 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 0.00 0.00 0.00 80 N 7.76 4.87 0.00 2.79 2.82 0.00 0.00 7.01 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 81 G 9.03 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 82 T 7.50 4.36 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 0.73 0.00 0.00 83 Y 8.51 4.62 0.00 3.11 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 84 E 8.03 4.67 0.00 2.13 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 2.45 2.32 0.00 85 F 8.39 4.36 0.00 3.06 2.96 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 0.00 0.00 0.00 86 G 8.84 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 87 Y 7.63 4.86 0.00 2.89 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 88 Q 8.70 5.45 0.00 2.52 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.85 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 89 M 8.98 4.84 0.00 1.57 1.33 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.40 0.00 90 H 8.81 5.30 0.00 3.14 3.08 0.00 5.57 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 91 F 8.66 5.29 0.00 2.79 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 92 I 8.76 4.71 1.89 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 1.31 0.79 0.94 0.00 0.00 93 C 8.70 5.17 0.00 2.90 3.19 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 94 N 8.47 4.54 0.00 2.73 2.82 0.00 0.00 6.94 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 95 E 8.59 4.12 0.00 1.99 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 2.23 1.88 0.00 96 G 9.22 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 0.00 0.00 0.00 97 Y 7.78 5.25 0.00 2.95 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 98 Y 8.83 5.01 0.00 2.97 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 99 L 8.71 4.82 0.00 1.70 1.63 0.88 0.93 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 I 8.52 4.25 1.87 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.77 0.86 0.00 0.00 101 G 8.88 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.17 3.54 0.00 1.98 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 2.10 2.19 0.00 103 E 8.28 4.46 0.00 2.18 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 2.32 2.29 0.00 104 I 7.45 5.23 1.85 0.00 0.00 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 1.60 0.65 0.82 0.00 0.00 105 L 8.74 4.63 0.00 1.53 1.62 0.77 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 106 Y 8.41 4.99 0.00 3.07 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 0.00 107 C 9.23 4.69 0.00 1.64 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 0.00 108 E 8.69 5.05 0.00 2.02 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 2.29 2.36 0.00 109 L 8.31 4.52 0.00 1.02 1.27 0.58 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 110 K 8.79 4.38 0.00 1.73 1.67 0.00 1.80 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.31 1.47 7.81 111 G 8.37 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 0.00 112 S 8.96 4.44 0.00 3.83 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 0.00 113 V 7.32 4.22 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 0.99 0.00 0.00 0.89 0.00 0.00 114 A 8.25 5.10 1.19 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 0.00 115 I 8.29 4.56 1.88 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 1.19 0.70 0.88 0.00 0.00 116 W 8.52 5.20 0.00 3.37 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 0.00 117 S 9.31 4.67 0.00 3.95 4.31 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 0.00 118 G 7.27 3.91 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 0.00 0.00 0.00 119 K 8.21 4.15 0.00 1.68 1.62 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.31 1.40 7.81 120 P 0.00 3.63 0.00 1.87 1.75 0.00 3.61 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 1.90 1.92 0.00 121 P 0.00 4.37 0.00 1.59 1.95 0.00 2.20 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.72 0.00 122 I 7.88 4.39 1.74 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 1.11 1.02 0.80 0.00 0.00 123 C 8.51 5.16 0.00 2.92 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 0.00 124 E 8.80 4.59 0.00 1.44 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 2.11 2.19 0.00 125 K 8.66 3.49 0.00 1.78 1.75 0.00 1.94 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.19 1.15 7.81 126 V 7.95 3.92 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 0.62 0.00 0.00 0.95 0.00 0.00