NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3965 8.1233 122.4679 51.9939 20.1487 175.7692 2 E 4.6028 8.8473 122.0491 54.3864 32.0114 170.5343 3 V 4.2385 8.9057 124.7705 61.4304 32.6584 175.5333 4 A 4.2599 8.7469 130.0660 51.4853 19.4947 176.1778 5 P 3.6809 0.0000 0.0000 65.6986 31.3664 179.0272 6 G 3.7853 7.9204 103.6534 47.2763 0.0000 173.5785 7 D 4.6940 8.0833 118.8249 53.9711 41.5449 176.9107 8 V 3.6371 7.2952 119.2044 62.5604 31.9036 175.0955 9 A 4.3159 8.5459 130.5820 51.4728 18.8264 176.4913 10 I 4.7027 8.1250 123.7760 59.5784 40.3320 175.7964 11 D 4.6539 8.5849 126.4375 52.6240 41.1300 176.7480 12 G 3.8233 8.4954 106.8367 46.9039 0.0000 174.0971 13 Q 4.2542 9.3950 118.8804 55.4061 29.7043 176.4875 14 G 3.9177 8.2077 107.6009 45.3639 0.0000 173.4274 15 H 4.8218 7.9406 116.6910 55.1003 29.8188 174.8109 16 V 4.5501 8.5115 121.6414 61.0398 32.2162 176.0916 17 A 4.1352 8.5732 130.4165 53.4506 18.8172 176.9789 18 R 4.5602 7.5877 115.9709 53.5328 31.4448 174.1375 19 P 4.5128 0.0000 0.0000 62.8649 32.1319 176.8797 20 L 4.0889 8.8677 120.2608 56.6247 42.3909 176.2751 21 T 5.0526 7.2013 112.0412 60.7121 70.3543 173.1548 22 D 4.5852 8.7810 123.8834 56.2804 41.9795 176.2553 23 A 3.9188 8.1826 120.7228 51.7090 18.2029 175.3766 24 P 4.3991 0.0000 0.0000 63.0045 32.1120 176.8549 25 G 3.6705 8.3893 110.4220 45.2616 0.0000 173.8661 26 D 4.6012 9.4350 124.0799 52.1283 41.2407 175.0677 27 P 4.4332 0.0000 0.0000 66.0114 31.4232 178.0556 28 V 3.5376 7.7649 116.0095 66.2903 31.3969 177.3804 29 E 3.9736 8.4717 118.2458 59.2906 29.2632 178.8016 30 G 3.6822 8.5771 105.9537 48.1106 0.0000 175.0869 31 R 2.5448 7.3670 120.6565 58.7604 30.2759 177.8915 32 R 3.9796 7.6089 116.8288 59.5745 29.8950 179.1811 33 L 4.0177 7.7462 118.2845 57.8939 41.6491 179.2306 34 M 4.1474 7.8752 118.2917 57.3482 31.6074 177.7870 35 T 4.2048 7.6084 107.9529 61.9439 70.2961 174.3360 36 D 4.4491 7.7037 122.7004 53.5346 40.7005 176.6431 37 R 4.0304 8.5605 128.0159 59.1381 30.3366 177.8823 38 S 4.4456 8.7399 113.8179 60.3550 63.1669 174.1483 39 V 4.1031 7.6414 117.5359 62.9054 33.2253 176.5928 40 G 3.5566 8.7079 108.6699 46.6852 0.0000 173.8275 41 N 4.2296 8.1509 116.9521 54.4719 37.7029 176.0097 42 C 4.3404 8.1231 116.1605 62.6257 28.5859 175.9890 43 I 4.8948 8.0059 109.7468 61.1532 37.8147 177.4008 44 A 3.9174 7.8967 124.6321 54.9789 18.5084 178.7093 45 C 4.6704 8.5074 112.0464 59.9052 31.0808 173.8740 46 H 5.2067 7.9834 115.7079 53.7653 31.8919 172.9176 47 E 4.6325 8.7743 121.9431 55.7551 31.4277 175.9872 48 V 4.5743 8.2404 122.7461 61.0584 33.4790 176.0872 49 T 3.8420 8.7628 118.4158 64.7810 68.7406 175.6590 50 E 3.9131 8.2649 121.6992 58.6772 29.8158 177.1003 51 M 4.3814 7.8976 120.8625 53.4542 30.8572 176.6783 52 A 4.2195 7.8874 122.7694 55.5999 19.0112 178.6233 53 D 4.4992 8.0664 111.8845 54.4053 40.5398 177.2544 54 A 3.3769 8.0908 120.6893 52.7862 18.8102 176.0101 55 Q 3.3381 7.6757 126.6789 56.3518 28.2628 173.9177 56 F 3.9428 7.8084 126.1680 57.9459 35.9981 174.1446 57 P 4.6403 0.0000 0.0000 62.3507 32.4599 177.1763 58 G 4.4870 9.1729 110.2534 45.1084 0.0000 173.4708 59 T 4.6109 8.0681 105.1684 60.9881 69.8954 175.1629 60 V 3.6266 8.1459 122.7729 66.1752 31.6923 176.4393 61 G 4.0264 7.5657 105.5635 44.1035 0.0000 171.7440 62 P 4.5901 0.0000 0.0000 62.1572 32.2161 176.0043 63 S 4.2711 8.7275 115.6842 59.4075 62.6726 174.0838 64 L 4.3826 9.1028 125.4987 54.5523 41.8287 176.2564 65 D 4.3819 7.4690 120.0389 56.2067 41.0620 177.0964 66 G 3.8816 8.9537 111.5800 45.5552 0.0000 175.3377 67 V 3.2657 7.4541 120.1891 63.8272 31.4248 177.8294 68 A 4.1408 7.6736 121.6124 53.3481 18.5532 177.6597 69 A 4.4430 7.9286 117.9732 52.1645 19.6126 177.9217 70 R 4.4544 7.7008 110.5796 55.9428 31.4856 175.8717 71 Y 5.0637 7.4960 115.1180 54.9812 41.1302 174.2411 72 P 4.5871 0.0000 0.0000 61.8948 33.8477 176.8985 73 E 3.8645 8.7903 118.5878 59.8984 29.2845 178.9582 74 A 4.5261 7.9567 121.0792 54.8424 18.3710 179.1156 75 M 3.6277 7.7400 116.2644 58.4643 31.7874 178.4240 76 I 3.7383 7.5519 119.8046 64.3458 37.2260 178.3837 77 R 4.0085 8.5075 120.1813 59.2954 29.8636 178.4913 78 G 4.1632 8.0572 106.4121 47.4949 0.0000 175.4663 79 I 3.8040 7.5177 120.7990 63.7021 36.8306 177.8616 80 L 4.4989 7.6001 118.5423 56.5497 41.7727 179.3713 81 V 4.0244 8.1339 118.9070 64.6753 32.1903 175.7554 82 N 5.1859 8.5841 122.1464 52.1695 40.0745 174.1327 83 S 4.3016 8.9084 120.5828 61.1906 61.9147 177.7746 84 K 3.8346 8.4585 120.2275 59.1768 31.9808 178.9332 85 N 4.4837 8.2743 115.9396 55.4889 38.6748 175.9828 86 V 3.8301 6.9536 114.3228 63.4731 32.8514 175.7631 87 F 4.9732 8.4996 119.8722 53.7131 38.9538 171.1568 88 P 4.4157 0.0000 0.0000 64.3928 31.8188 176.3275 89 E 3.8718 9.0721 120.1714 57.0612 26.7510 174.5050 90 T 4.1179 7.6228 113.1997 62.0902 67.8045 175.1046 91 V 3.8170 8.2212 119.5531 63.1040 32.0929 176.4407 92 M 4.1557 7.8844 120.7787 54.7603 32.3043 174.2420 93 P 4.1903 0.0000 0.0000 62.6627 32.0618 175.4734 94 A 4.4456 8.2586 123.6991 51.6826 19.5221 177.1307 95 Y 4.5286 8.4371 119.6115 58.6975 38.7998 175.8015 96 Y 5.1328 8.1709 121.2170 57.4290 39.5365 174.9213 97 R 4.6855 8.2002 115.5701 54.7363 32.4706 176.7803 98 V 4.8274 8.0063 110.3795 61.2740 33.7277 174.9505 99 E 4.5933 7.5213 117.8597 55.9554 33.2862 175.5148 100 G 3.6753 8.7415 107.8631 45.9688 0.0000 173.8166 101 F 4.4638 7.5705 117.8230 56.6070 39.8051 174.6778 102 N 4.7460 8.2963 119.5661 52.5795 39.7359 173.9701 103 R 3.8589 8.6399 127.3995 56.4144 27.5608 175.4726 104 P 4.2486 0.0000 0.0000 62.9822 32.6578 176.5513 105 G 4.3212 8.2879 109.9761 44.2315 0.0000 172.7184 106 I 3.9278 8.8353 121.4446 60.8084 37.9779 177.6820 107 A 3.2151 8.3831 130.7644 53.1853 18.6159 177.1394 108 F 4.8609 8.7075 115.0619 59.7892 39.5348 176.0071 109 T 4.1507 8.0397 112.1907 62.1376 69.2446 175.9927 110 S 4.1677 8.1819 116.2648 58.3295 61.0715 169.2545 111 K 4.5001 7.4698 120.0686 54.5344 33.6626 174.6886 112 P 4.7585 0.0000 0.0000 62.4542 32.1848 176.3369 113 I 3.8436 8.1389 124.9789 61.4439 37.6325 175.4019 114 E 4.4994 9.0349 126.7558 56.0021 31.6206 175.6184 115 G 3.8270 8.7597 111.0380 43.6817 0.0000 171.8270 116 E 3.8715 8.6152 121.5351 56.6610 29.9685 177.4908 117 I 3.9944 8.2668 127.2930 60.9886 37.9073 175.8414 118 R 4.4307 8.2458 124.5297 54.1256 31.3881 174.6558 119 P 4.6617 0.0000 0.0000 62.4101 32.0973 176.4082 120 L 4.1697 8.6871 120.0161 57.7519 41.7887 177.8984 121 M 5.0856 8.0802 116.0360 52.7195 35.7846 175.8632 122 T 4.3960 8.8175 113.3689 60.9766 71.0731 175.5009 123 A 3.7176 8.8353 122.9636 55.4216 18.1527 179.7936 124 G 3.7098 8.1474 103.1550 48.4156 0.0000 175.4119 125 Q 3.9667 8.1074 121.0044 58.5566 28.6558 179.3424 126 I 3.6885 7.8860 120.7085 64.3898 37.0431 178.3827 127 E 3.9475 8.4561 119.8159 59.3712 29.3120 178.9873 128 D 4.4531 8.7630 119.4188 57.5863 40.9428 179.2372 129 V 3.6585 7.8723 118.5713 65.9036 31.4556 178.2659 130 V 3.6182 8.2788 118.3345 65.7248 31.1259 177.6638 131 A 3.9769 8.0589 119.9588 55.5048 18.4303 178.5541 132 Y 4.2296 7.9793 117.6139 61.1228 38.9290 178.1789 133 L 3.2828 8.6307 120.0074 58.2972 41.5694 179.3072 134 M 4.2383 8.0526 116.9854 57.1577 32.0298 177.7317 135 T 4.1446 8.2020 109.9155 62.1282 70.9913 175.0288 136 L 4.2301 7.3286 125.3298 54.0594 40.4464 177.5838 137 T 4.1186 7.3826 106.6984 61.3262 70.2772 175.3419 138 Q 3.9444 7.9217 128.1518 56.5494 29.7441 172.5390 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 A 8.12 4.40 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 2 E 8.85 4.60 0.00 2.01 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 2.27 2.41 0.00 3 V 8.91 4.24 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 0.81 0.00 0.00 0.96 0.00 0.00 4 A 8.75 4.26 1.26 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 0.00 0.00 5 P 0.00 3.68 0.00 1.92 1.85 0.00 3.41 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.44 0.00 6 G 7.92 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 0.00 0.00 0.00 7 D 8.08 4.69 0.00 2.81 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 8 V 7.30 3.64 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 0.80 0.00 0.00 1.25 0.00 0.00 9 A 8.55 4.32 1.26 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 0.00 0.00 10 I 8.12 4.70 1.87 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.93 0.94 0.00 0.00 11 D 8.58 4.65 0.00 2.88 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 12 G 8.50 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 13 Q 9.39 4.25 0.00 1.58 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.48 0.00 0.00 0.00 0.00 0.00 2.15 2.26 0.00 14 G 8.21 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 0.00 0.00 0.00 15 H 7.94 4.82 0.00 3.42 3.26 0.00 5.58 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 V 8.51 4.55 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 1.10 0.00 0.00 0.95 0.00 0.00 17 A 8.57 4.14 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 18 R 7.59 4.56 0.00 1.77 1.82 0.00 3.26 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 19 P 0.00 4.51 0.00 2.33 1.94 0.00 3.64 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.10 0.00 20 L 8.87 4.09 0.00 1.42 1.48 0.18 0.35 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 21 T 7.20 5.05 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 1.25 0.00 0.00 22 D 8.78 4.59 0.00 2.61 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 23 A 8.18 3.92 1.26 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 0.00 0.00 24 P 0.00 4.40 0.00 2.05 2.00 0.00 3.68 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 2.03 2.16 0.00 25 G 8.39 3.67 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 0.00 0.00 0.00 26 D 9.44 4.60 0.00 2.67 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 27 P 0.00 4.43 0.00 2.27 2.22 0.00 3.69 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.21 0.00 28 V 7.76 3.54 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 0.97 0.00 0.00 0.94 0.00 0.00 29 E 8.47 3.97 0.00 2.09 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 0.00 2.54 2.42 0.00 30 G 8.58 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 31 R 7.37 2.54 0.00 1.34 1.90 0.00 3.24 0.00 0.00 3.12 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.26 0.00 32 R 7.61 3.98 0.00 1.96 1.92 0.00 3.37 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.81 0.00 33 L 7.75 4.02 0.00 1.77 1.67 0.93 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 34 M 7.88 4.15 0.00 1.99 2.14 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 2.57 2.51 0.00 35 T 7.61 4.20 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 36 D 7.70 4.45 0.00 2.69 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 37 R 8.56 4.03 0.00 1.80 1.93 0.00 3.12 0.00 0.00 2.91 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.76 0.00 38 S 8.74 4.45 0.00 4.23 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 39 V 7.64 4.10 2.10 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 0.80 0.00 0.00 1.01 0.00 0.00 40 G 8.71 3.56 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 0.00 0.00 0.00 41 N 8.15 4.23 0.00 3.20 2.97 0.00 0.00 7.21 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 42 C 8.12 4.34 0.00 3.17 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 43 I 8.01 4.89 1.96 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.86 0.94 0.00 0.00 44 A 7.90 3.92 1.47 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 0.00 0.00 45 C 8.51 4.67 0.00 2.83 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 46 H 7.98 5.21 0.00 3.20 3.17 0.00 5.61 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.77 4.63 0.00 1.95 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 2.40 2.49 0.00 48 V 8.24 4.57 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 1.17 0.00 0.00 1.02 0.00 0.00 49 T 8.76 3.84 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 1.30 0.00 0.00 50 E 8.26 3.91 0.00 1.94 2.10 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 2.32 2.32 0.00 51 M 7.90 4.38 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.56 0.00 52 A 7.89 4.22 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 53 D 8.07 4.50 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 54 A 8.09 3.38 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 0.00 0.00 55 Q 7.68 3.34 0.00 2.24 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.79 0.00 0.00 0.00 0.00 0.00 2.23 2.03 0.00 56 F 7.81 3.94 0.00 3.28 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 57 P 0.00 4.64 0.00 2.27 2.08 0.00 3.76 0.00 0.00 3.65 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 58 G 9.17 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.07 4.61 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 1.23 0.00 0.00 60 V 8.15 3.63 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 0.78 0.00 0.00 0.93 0.00 0.00 61 G 7.57 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 0.00 0.00 0.00 62 P 0.00 4.59 0.00 2.10 2.06 0.00 3.83 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 2.05 1.95 0.00 63 S 8.73 4.27 0.00 3.91 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 64 L 9.10 4.38 0.00 1.72 1.63 0.84 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 65 D 7.47 4.38 0.00 2.61 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 66 G 8.95 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 67 V 7.45 3.27 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 0.67 0.00 0.00 0.94 0.00 0.00 68 A 7.67 4.14 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 0.00 0.00 69 A 7.93 4.44 1.24 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 0.00 0.00 0.00 70 R 7.70 4.45 0.00 1.63 1.84 0.00 2.21 0.00 0.00 2.91 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.56 0.00 71 Y 7.50 5.06 0.00 3.06 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 72 P 0.00 4.59 0.00 2.27 2.20 0.00 3.76 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.03 0.00 73 E 8.79 3.86 0.00 2.05 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 2.38 2.40 0.00 74 A 7.96 4.53 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 75 M 7.74 3.63 0.00 1.99 1.45 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.20 0.00 76 I 7.55 3.74 2.04 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 1.57 1.17 0.94 0.00 0.00 77 R 8.51 4.01 0.00 1.82 1.90 0.00 3.30 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 78 G 8.06 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 0.00 0.00 0.00 0.00 79 I 7.52 3.80 2.15 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 1.45 0.67 1.17 0.00 0.00 80 L 7.60 4.50 0.00 1.88 1.75 0.91 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.13 4.02 2.28 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 1.14 0.00 0.00 1.02 0.00 0.00 82 N 8.58 5.19 0.00 2.77 2.66 0.00 0.00 7.02 7.18 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 83 S 8.91 4.30 0.00 4.29 4.48 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.46 3.83 0.00 2.14 1.91 0.00 1.62 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 3.35 0.00 0.00 0.00 0.00 1.47 1.50 7.81 85 N 8.27 4.48 0.00 2.82 2.84 0.00 0.00 6.85 7.19 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 86 V 6.95 3.83 1.47 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 -0.19 0.00 0.00 0.75 0.00 0.00 87 F 8.50 4.97 0.00 3.17 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 88 P 0.00 4.42 0.00 2.07 2.05 0.00 3.84 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 89 E 9.07 3.87 0.00 2.17 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 2.30 0.00 90 T 7.62 4.12 4.53 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 1.42 0.00 0.00 91 V 8.22 3.82 2.10 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 0.74 0.00 0.00 0.94 0.00 0.00 92 M 7.88 4.16 0.00 2.14 2.09 0.00 0.00 0.00 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.79 0.00 93 P 0.00 4.19 0.00 1.17 1.65 0.00 3.91 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.08 0.00 94 A 8.26 4.45 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 0.00 0.00 95 Y 8.44 4.53 0.00 3.50 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 96 Y 8.17 5.13 0.00 2.87 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 97 R 8.20 4.69 0.00 1.94 1.68 0.00 3.30 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.52 0.00 98 V 8.01 4.83 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 0.87 0.00 0.00 99 E 7.52 4.59 0.00 1.73 1.68 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 2.16 2.23 0.00 100 G 8.74 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 0.00 101 F 7.57 4.46 0.00 3.06 2.92 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 0.00 102 N 8.30 4.75 0.00 2.66 2.74 0.00 0.00 7.00 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 0.00 103 R 8.64 3.86 0.00 2.01 2.00 0.00 3.27 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 104 P 0.00 4.25 0.00 1.92 2.02 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 2.06 2.05 0.00 105 G 8.29 4.32 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 0.00 0.00 0.00 106 I 8.84 3.93 1.82 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.51 0.87 0.00 0.00 107 A 8.38 3.22 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 F 8.71 4.86 0.00 3.04 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 0.00 109 T 8.04 4.15 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 1.27 0.00 0.00 110 S 8.18 4.17 0.00 4.08 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 0.00 111 K 7.47 4.50 0.00 1.63 1.70 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.57 1.55 7.81 112 P 0.00 4.76 0.00 1.92 1.97 0.00 3.67 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 2.01 2.10 0.00 113 I 8.14 3.84 1.84 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.49 0.88 0.00 0.00 114 E 9.03 4.50 0.00 1.92 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 2.20 2.25 0.00 115 G 8.76 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 0.00 116 E 8.62 3.87 0.00 1.93 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 2.29 2.34 0.00 117 I 8.27 3.99 2.06 0.00 0.00 1.00 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 0.67 0.90 0.00 0.00 118 R 8.25 4.43 0.00 1.78 1.85 0.00 3.21 0.00 0.00 3.28 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 119 P 0.00 4.66 0.00 2.58 1.91 0.00 3.78 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.89 0.00 120 L 8.69 4.17 0.00 2.03 2.06 0.52 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 121 M 8.08 5.09 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.50 0.00 122 T 8.82 4.40 4.32 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 1.34 0.00 0.00 123 A 8.84 3.72 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 0.00 124 G 8.15 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 0.00 125 Q 8.11 3.97 0.00 2.28 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 126 I 7.89 3.69 1.82 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.78 0.81 0.00 0.00 127 E 8.46 3.95 0.00 2.06 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 2.38 2.46 0.00 128 D 8.76 4.45 0.00 2.84 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 0.00 129 V 7.87 3.66 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 0.83 0.00 0.00 0.91 0.00 0.00 130 V 8.28 3.62 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 1.02 0.00 0.00 0.99 0.00 0.00 131 A 8.06 3.98 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 0.00 132 Y 7.98 4.23 0.00 3.23 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 0.00 133 L 8.63 3.28 0.00 1.79 1.70 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 134 M 8.05 4.24 0.00 1.95 2.28 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.87 0.00 135 T 8.20 4.14 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 1.23 0.00 0.00 136 L 7.33 4.23 0.00 1.71 1.53 0.80 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 137 T 7.38 4.12 4.20 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 1.21 0.00 0.00 138 Q 7.92 3.94 0.00 2.18 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.68 0.00 0.00 0.00 0.00 0.00 2.18 2.30 0.00