NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 G 3.9990 8.3549 109.7428 45.5883 0.0000 173.0869 5 S 4.3942 8.7170 113.8188 60.4797 63.6266 175.4343 6 R 3.5860 8.1219 120.3744 59.3643 31.2675 177.3777 7 R 3.6576 7.9890 116.9723 59.1210 29.8816 176.2917 8 Y 4.4679 8.3071 112.9871 57.5665 38.1768 174.7554 9 D 4.6024 7.7181 121.1177 53.6503 41.3889 176.5881 10 S 4.1505 8.7263 123.2683 59.5655 63.8171 173.8599 11 R 3.7830 8.5681 120.2161 57.0898 26.6576 176.9973 12 T 4.0352 7.7994 107.0479 63.2834 69.9083 175.4853 13 T 4.5806 7.2462 112.3448 61.3812 69.3338 173.1633 14 I 4.4738 7.3525 113.6742 59.7453 40.9797 174.7276 15 F 4.8409 8.3978 119.7433 56.7707 39.9686 176.0468 16 S 4.6862 8.3347 118.3265 55.6911 64.2007 173.5632 17 P 4.2355 0.0000 0.0000 65.1927 31.0087 177.3932 18 E 4.2150 8.1130 115.5177 56.0156 29.6890 176.4223 19 G 3.5858 8.2341 107.3656 46.2973 0.0000 173.7756 20 R 4.5750 7.7570 117.4475 53.9572 32.8875 175.8272 21 L 4.6480 8.0185 120.4190 54.1384 42.0673 177.0348 22 Y 3.5460 7.2827 119.5213 61.5516 37.7875 178.7836 23 Q 3.9678 8.0313 117.8077 59.3062 28.9142 179.6754 24 V 3.5666 7.5708 118.3987 66.0729 31.6983 177.7582 25 E 3.9719 8.0899 118.2997 59.7709 29.2918 179.0521 26 Y 4.4838 8.2481 116.8697 60.8766 37.8807 178.0738 27 A 4.0840 8.5738 122.4120 55.0686 18.4967 179.6345 28 L 3.9258 8.3127 117.9027 57.9262 41.4672 179.2874 29 E 3.9489 7.9744 118.2936 59.2431 29.8389 178.5566 30 S 4.3001 8.1042 113.1373 61.5771 62.4545 176.1294 31 I 3.7224 7.9751 122.8348 64.3315 36.6480 178.1904 32 S 4.2317 7.9774 113.3120 60.4370 62.7427 174.4704 33 H 4.7342 7.7429 118.1461 55.4816 29.1575 174.5023 34 A 4.4213 7.9853 123.5540 50.7178 19.5421 177.7334 35 G 4.0404 8.4640 106.7775 46.3646 0.0000 173.5222 36 T 4.3651 8.5875 119.4332 63.2360 69.9125 173.2686 37 A 5.1694 8.5238 126.2423 50.2153 22.0009 175.2984 38 I 4.6159 9.4325 123.1342 59.3229 41.2148 174.8987 39 G 4.4179 8.6658 111.6535 44.5518 0.0000 171.8990 40 I 4.7304 8.8765 125.4510 59.6934 41.0298 173.8857 41 M 4.8027 8.8402 126.7640 54.0040 33.4850 174.9052 42 A 4.8336 8.9491 129.0533 49.8180 22.0969 176.2629 43 S 4.3004 8.6826 113.4750 60.8457 63.1246 175.0242 44 D 4.8658 8.8177 118.2402 50.8907 39.6102 175.8863 45 G 4.0367 6.8914 108.3460 46.3666 0.0000 171.2970 46 I 5.1151 7.7126 118.5886 59.4181 41.0971 175.4161 47 V 4.4980 9.0125 125.2525 61.0583 34.3842 174.1899 48 L 5.2924 8.5716 126.1285 52.9561 44.6083 175.7005 49 A 4.8653 9.1223 124.3845 50.3367 22.8176 174.5888 50 A 5.0245 8.4155 120.9582 50.4664 22.5289 175.0234 51 E 4.4244 9.2351 122.3603 54.5261 31.4500 175.6129 52 R 4.2335 8.5652 126.6409 55.6337 30.2045 176.2397 53 K 3.9561 8.5720 125.3710 56.8276 32.8495 173.0646 54 V 3.1998 8.5904 131.6053 62.7348 32.3444 171.3553 55 T 4.6882 8.0755 114.5150 60.7476 71.7838 172.0297 56 S 4.6684 8.0772 114.6789 56.8200 65.7403 174.6876 57 T 3.8859 8.5191 119.9019 66.6908 68.1592 175.9707 58 L 4.1948 7.7406 118.3492 55.6704 42.1556 176.9716 59 L 3.9019 7.2840 121.9836 54.7978 42.3443 176.0545 60 E 4.2043 8.6028 127.1526 55.4872 28.7352 175.6102 61 Q 4.1866 8.4979 128.5942 58.2225 29.7297 177.6740 62 D 4.3609 8.1709 117.0415 57.0366 40.9458 176.9768 63 T 4.3543 7.7544 112.4207 63.2818 69.1747 174.3939 63A S 4.5214 7.1963 116.0449 57.7496 63.4926 174.0465 64 T 4.1022 7.8256 119.4922 63.3723 70.6029 173.0148 65 E 4.8127 8.7095 123.0785 55.6156 31.1933 176.4111 66 K 4.6396 7.6860 116.3031 56.0784 36.2416 175.5318 67 L 5.1641 7.6681 119.2713 53.0990 43.4534 175.7305 68 Y 4.7880 8.8873 121.5715 55.8613 41.9099 174.6446 69 K 4.5240 8.7754 124.1726 55.7242 32.6145 176.1133 70 L 4.4008 8.6973 127.3923 56.0157 42.8160 175.4238 71 N 4.9020 7.5339 113.8335 52.7871 41.6686 172.8679 72 D 4.6576 8.6029 116.7031 55.3154 41.4673 177.0892 73 K 4.7225 7.9223 116.7791 55.8905 34.6702 175.5079 74 I 5.2940 7.6337 120.5667 59.6544 41.6837 173.9879 75 A 5.1786 9.3569 126.7382 50.6693 23.2886 175.1487 76 V 4.9285 8.9453 111.2391 59.5606 36.5009 174.6097 77 A 5.2059 8.8036 124.4462 50.2956 21.4839 175.6491 78 V 4.8422 8.9458 122.2513 61.1973 34.0851 175.4700 79 A 4.3380 9.4025 128.1574 53.2133 21.3329 174.9004 80 G 3.7184 8.4281 112.3558 45.8029 0.0000 171.5785 81 L 4.1164 8.2929 124.9015 54.8521 41.9863 177.7198 82 T 3.8786 8.9291 121.3161 66.8010 68.4332 176.1050 83 A 4.0030 8.0345 121.8162 55.3907 18.4125 179.2079 84 D 4.4331 8.1378 116.5280 57.4893 40.9938 178.6087 85 A 3.9786 8.1426 121.2938 55.3896 18.3912 179.5148 86 E 3.7807 8.4286 117.2491 59.4331 29.3197 179.7226 87 I 3.6973 7.5701 119.4398 64.4510 37.2177 178.5350 88 L 3.8299 7.5750 119.3208 57.5532 41.3059 179.5832 89 I 3.4926 8.1138 120.2584 64.3470 37.1268 177.9351 90 N 4.2600 8.0762 118.0677 56.9377 38.7638 177.0082 91 T 3.9622 7.7587 111.0247 64.4242 68.8675 176.6278 92 A 3.9773 7.9901 123.9293 55.0929 18.4788 179.7379 93 R 3.8870 8.2760 116.9493 59.4575 30.0588 179.4285 94 I 3.7456 7.7298 119.3979 64.6208 37.1138 177.9042 95 H 4.2107 8.4767 118.9436 59.2721 29.6411 177.1439 96 A 3.9656 8.0746 122.6017 55.3195 18.1560 179.6830 97 Q 4.0581 8.0815 116.0632 58.9065 28.7805 178.5761 98 N 4.3317 8.4654 117.9454 56.3021 38.5169 176.7436 99 Y 3.9602 8.0611 120.9406 60.6954 38.9119 177.8320 100 L 4.5855 8.0840 122.6153 57.7070 41.9458 178.9090 101 K 3.9482 8.1023 118.6868 59.4841 32.1469 178.7811 102 T 3.7733 7.5486 115.5023 65.8179 68.5246 175.0849 103 Y 4.5127 7.5217 114.8062 56.7996 39.2787 175.2765 104 N 4.4173 8.3343 116.2834 53.7975 36.9055 173.9007 105 E 4.8422 7.8499 114.5081 54.6649 33.9144 175.1101 106 D 4.7410 8.5637 121.6640 54.1028 41.6076 176.1454 107 I 2.8212 8.0034 122.4418 59.5425 38.6330 174.6855 108 P 4.1761 0.0000 0.0000 62.3061 32.9517 177.2112 109 V 3.4903 8.4436 122.2201 66.4477 31.4075 178.2764 110 E 3.8024 7.9689 118.1024 59.0711 29.5065 178.4601 111 I 3.5918 7.5484 119.4410 64.3565 37.2276 177.8979 112 L 3.9433 7.3783 120.9785 58.1631 41.8527 179.1616 113 V 2.9293 7.4813 118.1739 65.6902 31.2607 177.9992 114 R 3.8075 8.2730 118.9679 59.2245 29.8898 178.4930 115 R 3.8253 8.0137 118.5311 59.4402 30.2149 178.5294 116 L 4.0051 7.8040 118.7259 58.0005 41.5360 179.7468 117 S 4.2591 8.3337 115.1965 61.6345 62.7223 176.5167 118 D 4.3854 8.3316 121.9544 57.2456 40.3011 178.7729 119 I 3.8233 7.6099 119.5870 64.3803 36.9023 178.2978 120 K 4.2748 8.0469 119.0107 59.6099 31.9428 178.9966 121 Q 4.1584 8.5547 120.2212 59.1636 28.7882 178.7694 122 G 3.6460 8.1896 106.5616 48.1518 0.0000 175.0398 123 Y 3.9376 7.8406 116.2344 59.7677 37.9127 177.9068 124 T 4.2754 7.7472 115.9284 64.1757 69.2351 174.9978 125 Q 4.4394 8.0015 119.9786 56.1174 30.9354 174.2613 126 H 4.6624 7.6981 110.5751 55.2070 30.3757 172.8705 127 G 3.8093 8.8221 108.0276 44.1389 0.0000 175.1346 128 G 3.9602 7.8347 105.4131 46.2243 0.0000 173.1195 129 L 4.6874 6.8988 119.1019 52.1218 43.8339 176.7999 130 R 4.0976 8.1307 116.8018 55.5011 30.0698 174.7727 131 P 4.5129 0.0000 0.0000 61.8637 32.3753 175.7536 132 F 4.3550 8.3565 118.4753 57.3211 40.1182 177.4299 133 G 4.0311 8.7640 115.2857 44.9862 0.0000 172.8809 134 V 4.8661 7.2475 117.7423 61.4154 35.7279 175.0880 135 S 4.6658 8.5518 121.5345 56.6816 66.4954 173.0817 136 F 5.4243 8.6964 121.4024 55.6787 42.4283 174.6514 137 I 4.4822 8.3509 121.9827 59.9158 39.7541 174.0790 138 Y 5.0088 8.8554 124.8989 56.4412 39.6774 175.0159 139 A 4.7440 9.3262 126.2136 50.2853 21.6799 175.3735 140 G 4.9086 8.5238 108.3666 45.8842 0.0000 170.9349 141 Y 4.9414 8.3400 120.0799 55.9912 41.6368 173.7611 142 D 4.7076 7.5402 124.2982 51.6196 42.6296 174.6038 143 D 4.5098 8.5312 117.4616 53.7046 39.3905 176.3781 144 R 4.0934 8.3112 126.3386 56.7428 30.0667 175.4316 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 4 G 8.35 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 5 S 8.72 4.39 0.00 4.04 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 6 R 8.12 3.59 0.00 1.84 1.91 0.00 3.16 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 7 R 7.99 3.66 0.00 1.53 1.22 0.00 2.21 0.00 0.00 2.89 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.34 0.00 8 Y 8.31 4.47 0.00 2.95 2.97 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 9 D 7.72 4.60 0.00 2.71 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 10 S 8.73 4.15 0.00 3.91 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 11 R 8.57 3.78 0.00 2.01 1.97 0.00 3.11 0.00 0.00 3.20 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 12 T 7.80 4.04 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 13 T 7.25 4.58 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 1.17 0.00 0.00 14 I 7.35 4.47 1.95 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 1.69 1.21 0.92 0.00 0.00 15 F 8.40 4.84 0.00 3.09 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 16 S 8.33 4.69 0.00 3.78 2.85 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 17 P 0.00 4.24 0.00 2.09 2.19 0.00 3.74 0.00 0.00 3.83 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 18 E 8.11 4.22 0.00 1.88 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 2.26 2.34 0.00 19 G 8.23 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 20 R 7.76 4.57 0.00 1.69 1.69 0.00 3.06 0.00 0.00 3.12 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.50 0.00 21 L 8.02 4.65 0.00 1.59 1.50 0.84 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 7.28 3.55 0.00 2.86 2.44 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 23 Q 8.03 3.97 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.91 0.00 0.00 0.00 0.00 0.00 2.47 2.39 0.00 24 V 7.57 3.57 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 1.16 0.00 0.00 0.91 0.00 0.00 25 E 8.09 3.97 0.00 2.00 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 2.44 2.39 0.00 26 Y 8.25 4.48 0.00 2.97 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 27 A 8.57 4.08 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 28 L 8.31 3.93 0.00 1.92 1.75 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 29 E 7.97 3.95 0.00 2.05 2.29 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 2.35 2.43 0.00 30 S 8.10 4.30 0.00 3.99 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 0.00 31 I 7.98 3.72 2.00 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 1.89 0.77 0.93 0.00 0.00 32 S 7.98 4.23 0.00 3.96 4.05 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 33 H 7.74 4.73 0.00 3.30 3.33 0.00 5.65 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.99 4.42 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 35 G 8.46 4.04 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 0.00 0.00 0.00 36 T 8.59 4.37 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 37 A 8.52 5.17 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 38 I 9.43 4.62 1.87 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 1.17 0.70 0.92 0.00 0.00 39 G 8.67 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 0.00 0.00 0.00 0.00 40 I 8.88 4.73 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 1.12 0.65 0.92 0.00 0.00 41 M 8.84 4.80 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.55 0.00 42 A 8.95 4.83 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 43 S 8.68 4.30 0.00 4.00 4.02 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 44 D 8.82 4.87 0.00 2.77 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 45 G 6.89 4.04 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 0.00 0.00 0.00 46 I 7.71 5.12 1.91 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 0.76 0.97 0.00 0.00 47 V 9.01 4.50 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 1.07 0.00 0.00 0.94 0.00 0.00 48 L 8.57 5.29 0.00 1.52 1.52 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 49 A 9.12 4.87 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 50 A 8.42 5.02 1.17 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 0.00 0.00 51 E 9.24 4.42 0.00 2.00 1.83 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 2.24 2.27 0.00 52 R 8.57 4.23 0.00 1.84 1.96 0.00 3.25 0.00 0.00 3.14 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.60 0.00 53 K 8.57 3.96 0.00 1.79 1.72 0.00 2.04 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.43 7.81 54 V 8.59 3.20 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 0.84 0.00 0.00 0.93 0.00 0.00 55 T 8.08 4.69 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 56 S 8.08 4.67 0.00 3.81 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 57 T 8.52 3.89 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 58 L 7.74 4.19 0.00 1.62 1.71 0.92 0.93 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 59 L 7.28 3.90 0.00 1.53 1.69 0.92 1.14 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 60 E 8.60 4.20 0.00 1.95 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 2.28 2.35 0.00 61 Q 8.50 4.19 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.36 6.68 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 62 D 8.17 4.36 0.00 2.68 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 63 T 7.75 4.35 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 63A S 7.20 4.52 0.00 4.04 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 64 T 7.83 4.10 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 0.62 0.00 0.00 65 E 8.71 4.81 0.00 2.06 2.02 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 2.14 2.28 0.00 66 K 7.69 4.64 0.00 1.64 1.81 0.00 1.68 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.44 7.81 67 L 7.67 5.16 0.00 1.34 1.47 0.90 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 68 Y 8.89 4.79 0.00 2.82 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 69 K 8.78 4.52 0.00 1.78 1.75 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.49 7.81 70 L 8.70 4.40 0.00 1.80 1.68 0.90 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 71 N 7.53 4.90 0.00 2.62 2.79 0.00 0.00 6.97 8.47 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 72 D 8.60 4.66 0.00 2.72 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 73 K 7.92 4.72 0.00 1.71 2.03 0.00 1.67 0.00 0.00 2.12 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.46 7.81 74 I 7.63 5.29 1.88 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.98 0.96 0.00 0.00 75 A 9.36 5.18 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 76 V 8.95 4.93 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 0.22 0.00 0.00 0.82 0.00 0.00 77 A 8.80 5.21 1.23 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 0.00 0.00 0.00 78 V 8.95 4.84 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 0.77 0.00 0.00 1.33 0.00 0.00 79 A 9.40 4.34 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 80 G 8.43 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 81 L 8.29 4.12 0.00 1.68 1.64 0.93 1.16 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 82 T 8.93 3.88 4.28 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 1.32 0.00 0.00 83 A 8.03 4.00 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 84 D 8.14 4.43 0.00 2.95 2.95 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 85 A 8.14 3.98 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 86 E 8.43 3.78 0.00 2.11 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 2.04 2.46 0.00 87 I 7.57 3.70 2.07 0.00 0.00 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 1.79 1.19 0.98 0.00 0.00 88 L 7.58 3.83 0.00 1.91 1.71 0.59 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.11 3.49 1.79 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.70 0.73 0.00 0.00 90 N 8.08 4.26 0.00 2.81 2.92 0.00 0.00 7.03 6.98 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 91 T 7.76 3.96 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 1.23 0.00 0.00 92 A 7.99 3.98 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 93 R 8.28 3.89 0.00 2.01 1.99 0.00 3.11 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.82 0.00 94 I 7.73 3.75 2.04 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 1.42 0.72 0.94 0.00 0.00 95 H 8.48 4.21 0.00 3.24 3.48 0.00 5.78 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 96 A 8.07 3.97 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 97 Q 8.08 4.06 0.00 2.25 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.75 0.00 0.00 0.00 0.00 0.00 2.61 2.56 0.00 98 N 8.47 4.33 0.00 2.96 2.90 0.00 0.00 6.56 7.20 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 99 Y 8.06 3.96 0.00 3.19 3.12 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 0.00 100 L 8.08 4.59 0.00 1.92 1.88 1.02 0.56 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 0.00 101 K 8.10 3.95 0.00 1.84 1.92 0.00 1.82 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.44 7.81 102 T 7.55 3.77 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 -0.04 0.00 0.00 103 Y 7.52 4.51 0.00 2.64 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.33 4.42 0.00 2.89 2.93 0.00 0.00 6.72 7.20 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 0.00 105 E 7.85 4.84 0.00 2.15 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 2.36 2.54 0.00 106 D 8.56 4.74 0.00 2.70 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 0.00 107 I 8.00 2.82 1.49 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 0.91 -0.36 0.75 0.00 0.00 108 P 0.00 4.18 0.00 1.99 1.81 0.00 2.87 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.01 0.00 109 V 8.44 3.49 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 0.91 0.00 0.00 0.86 0.00 0.00 110 E 7.97 3.80 0.00 1.98 1.83 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 2.29 2.31 0.00 111 I 7.55 3.59 1.74 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.59 0.87 0.00 0.00 112 L 7.38 3.94 0.00 1.53 1.66 0.87 0.79 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 0.00 113 V 7.48 2.93 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 0.60 0.00 0.00 -0.25 0.00 0.00 114 R 8.27 3.81 0.00 1.91 2.00 0.00 3.14 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 115 R 8.01 3.83 0.00 1.90 2.01 0.00 3.14 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.57 0.00 116 L 7.80 4.01 0.00 1.90 1.82 0.92 0.77 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 0.00 117 S 8.33 4.26 0.00 4.01 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 0.00 118 D 8.33 4.39 0.00 2.97 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 0.00 119 I 7.61 3.82 2.08 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 1.59 0.65 0.99 0.00 0.00 120 K 8.05 4.27 0.00 2.11 1.94 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.48 1.58 7.81 121 Q 8.55 4.16 0.00 2.25 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.57 0.00 122 G 8.19 3.65 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 0.00 0.00 0.00 123 Y 7.84 3.94 0.00 3.15 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 0.00 124 T 7.75 4.28 4.47 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 1.15 0.00 0.00 125 Q 8.00 4.44 0.00 1.90 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.64 0.00 0.00 0.00 0.00 0.00 2.26 2.20 0.00 126 H 7.70 4.66 0.00 3.17 3.20 0.00 5.74 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.82 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 0.00 128 G 7.83 3.96 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 0.00 0.00 0.00 129 L 6.90 4.69 0.00 1.81 1.61 0.88 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 130 R 8.13 4.10 0.00 1.90 1.92 0.00 3.00 0.00 0.00 3.20 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.52 0.00 131 P 0.00 4.51 0.00 2.07 2.08 0.00 3.66 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 2.03 2.11 0.00 132 F 8.36 4.35 0.00 2.86 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 0.00 133 G 8.76 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 0.00 134 V 7.25 4.87 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 -0.17 0.00 0.00 0.85 0.00 0.00 135 S 8.55 4.67 0.00 3.82 3.62 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 0.00 136 F 8.70 5.42 0.00 2.39 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 0.00 0.00 0.00 137 I 8.35 4.48 1.87 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 1.25 0.74 0.94 0.00 0.00 138 Y 8.86 5.01 0.00 2.79 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 0.00 139 A 9.33 4.74 1.23 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 0.00 0.00 0.00 140 G 8.52 4.91 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 0.00 141 Y 8.34 4.94 0.00 2.98 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 0.00 142 D 7.54 4.71 0.00 2.60 2.43 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 0.00 143 D 8.53 4.51 0.00 2.82 2.85 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 0.00 144 R 8.31 4.09 0.00 1.65 1.83 0.00 3.23 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.48 0.00