NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4507 8.1927 115.4142 57.7940 64.6463 174.2307 3 V 3.3904 8.1729 119.3919 65.2739 31.1539 175.8165 4 Y 4.0428 8.8357 120.2180 60.7802 38.6140 177.2537 5 D 4.2488 8.0884 119.0566 57.4233 40.7367 178.7336 6 A 3.9865 7.6431 119.3159 54.7446 18.5828 179.4289 7 A 3.8927 8.0784 119.2719 55.2641 18.4536 179.6983 8 A 3.7973 7.9291 117.9266 54.6619 18.3134 179.3124 9 Q 4.2022 7.3567 114.5803 57.6604 28.9622 175.6612 10 L 3.7332 7.3300 120.7882 55.3151 41.7781 177.7770 11 T 4.2742 8.1667 114.3827 60.4408 71.5333 175.1759 12 A 3.9593 8.3804 122.5834 55.5813 18.2623 179.6587 13 D 4.2912 7.9466 116.8108 57.3629 40.9248 179.0360 14 V 3.4936 7.3536 117.7158 65.9441 31.5551 178.2957 15 K 3.8449 8.3405 118.6730 59.1233 31.7309 179.3042 16 K 3.9640 8.1122 120.0274 59.7084 32.2988 178.7389 17 D 4.6410 8.1189 119.1842 57.2234 40.6866 178.8233 18 L 3.7694 8.0527 119.7624 57.7253 41.5653 179.7659 19 R 4.0600 8.1228 118.0063 59.4644 28.6210 178.8983 20 D 4.4717 8.4831 119.1349 57.3898 40.8153 179.0169 21 S 3.2249 8.0691 114.5119 60.6265 63.0654 176.3546 22 W 4.3260 8.5495 131.9329 59.8922 30.1798 177.9910 23 K 3.8366 7.8663 118.2147 59.7591 31.8045 178.8510 24 V 3.7129 7.2115 118.2060 65.6750 31.4508 178.0107 25 I 3.5984 7.7515 119.3570 64.2349 36.9016 178.4908 26 G 2.0000 7.0998 104.7782 45.6532 0.0000 175.1073 27 S 4.2675 7.2944 115.5818 59.2204 64.8484 173.9300 28 D 4.6985 7.2769 122.1249 51.3677 41.0385 175.6382 29 K 3.8914 7.8948 123.0529 58.6565 32.5612 178.4663 30 K 4.0022 7.9324 119.5236 59.3841 32.2997 178.9877 31 G 3.5826 8.2436 107.2879 47.5509 0.0000 175.4458 32 N 4.5076 8.3932 119.5762 55.0790 38.5896 178.0775 33 G 3.4518 8.0897 107.6870 47.7659 0.0000 176.1115 34 V 3.5736 7.6995 120.7756 65.4497 31.5289 177.9093 35 A 3.9951 7.7390 121.5484 54.3160 18.1526 179.3839 36 L 3.7472 7.7079 118.6799 58.5387 42.1926 179.1873 37 M 3.4951 7.7053 118.6657 58.3561 31.3304 178.8834 38 T 3.9736 8.0151 110.2635 65.2024 68.8805 176.6954 39 T 3.8452 7.8755 118.5845 66.0449 68.3158 176.4204 40 L 3.8290 7.5711 122.3278 58.2214 42.1500 179.1612 41 F 4.4923 7.6475 117.4900 60.3922 38.5544 177.6653 42 A 4.1441 8.0562 119.9218 55.1634 18.3275 178.9260 43 D 4.6217 8.1165 115.7435 55.2683 42.7597 176.8115 44 N 5.2555 8.2145 115.8521 49.4180 38.9443 174.9071 45 Q 4.3120 8.3718 121.5002 57.9911 28.7622 178.1132 46 E 4.1142 8.2832 118.0122 58.6384 29.5861 178.3079 47 T 4.3205 8.2583 110.5640 63.2791 69.3338 176.5519 48 I 3.7432 7.7422 123.5003 64.8040 36.9256 178.0572 49 G 3.6303 8.0476 104.4545 48.0921 0.0000 174.7710 50 Y 4.4548 7.9319 117.8456 59.7139 38.1508 176.3987 51 F 4.9643 8.2441 119.4906 56.6477 39.9518 178.0873 52 K 4.0003 8.2353 122.5312 59.8406 32.5352 178.8076 53 R 3.9579 8.0032 118.7469 58.9892 30.0816 176.8947 54 L 4.2736 8.0261 115.7890 54.7566 42.7050 179.0865 55 G 3.7368 7.7042 106.8939 46.1531 0.0000 175.7227 56 D 4.4733 8.3754 122.6140 53.4197 39.7436 177.2934 57 V 3.8708 7.9415 119.6255 62.5386 31.7817 178.2844 58 S 4.3373 8.0986 114.2752 59.8920 63.0402 175.3539 59 Q 4.1194 8.1615 120.3073 56.4477 29.8460 177.3670 60 G 3.9106 7.5779 107.2567 46.2181 0.0000 175.8978 61 M 3.8716 9.0419 120.8194 58.5124 32.0103 177.3902 62 A 3.9911 7.5506 119.8415 54.3448 18.8243 177.2977 63 N 4.5945 8.3220 115.7329 52.8070 39.3464 175.1597 64 D 4.3639 8.6697 129.5276 56.6105 39.5638 178.5773 65 K 3.9993 8.1133 119.4400 59.0755 32.0944 178.9695 66 L 4.0502 8.5119 120.8297 57.9491 42.0161 178.9643 67 R 3.9885 8.3664 119.0711 59.4686 30.1880 178.7562 68 G 3.6712 8.4276 105.8579 48.0211 0.0000 175.1826 69 H 4.2477 8.4143 120.5738 59.2472 29.7277 177.6099 70 S 4.0803 8.3253 116.2404 61.5399 62.7856 176.5379 71 I 3.9000 7.9650 122.5099 64.7964 36.9901 178.6110 72 T 4.0972 7.9216 116.3704 66.5900 68.2611 176.3889 73 L 3.8718 8.0861 122.3560 58.4451 42.0936 179.0280 74 M 4.2284 7.9050 118.3659 58.3483 31.7561 178.0801 75 Y 4.1614 7.8690 115.9587 60.1382 38.1032 177.8033 76 A 3.7403 7.5762 121.9088 54.9252 18.2364 179.6750 77 L 3.5347 7.3687 116.9936 57.5135 41.6837 179.2861 78 Q 3.5791 7.7714 119.7002 58.8691 28.9008 177.7650 79 N 4.3188 8.1351 118.2009 56.7611 38.8201 176.7346 80 F 4.4875 7.5728 117.5549 60.8996 39.1746 177.3389 81 I 3.6773 7.7537 119.4768 64.5945 36.6217 178.3049 82 D 4.4236 8.0284 118.3847 56.6772 40.9545 177.7547 83 Q 4.4099 7.7116 116.6981 55.5641 28.7536 177.2140 84 L 3.8864 7.3490 121.5455 58.2264 41.7129 178.2944 85 D 4.5491 7.9678 114.1805 55.2718 41.0721 176.3031 86 N 4.8637 8.0982 118.5136 49.6032 39.5453 172.1678 87 P 4.1672 0.0000 0.0000 65.5054 31.4067 177.3219 88 D 4.5101 8.3149 116.8350 57.7317 40.9379 178.5656 89 D 4.3934 8.3015 118.8571 57.0201 40.7653 178.5391 90 L 3.9775 8.1315 121.0677 58.0993 42.0718 179.1518 91 V 3.5679 8.3497 118.7541 66.2487 31.0217 177.8436 92 C 4.1951 7.9352 114.1781 61.2401 29.4413 176.2030 93 V 3.7344 7.8025 114.6397 63.9234 31.1909 178.6681 94 V 3.7409 8.1235 118.3409 66.1883 31.3155 178.0615 95 E 3.9756 8.4055 118.2507 58.9107 28.9597 179.3757 96 K 3.8768 7.4123 118.6650 59.6197 32.3434 178.7545 97 F 4.6937 8.2891 117.7464 60.1834 38.8227 177.6190 98 A 4.0230 8.3778 121.0109 55.1847 18.1893 179.6334 99 V 3.5867 7.6620 116.4158 66.3825 30.6345 177.8362 100 N 4.3518 7.9506 115.8445 56.6933 38.4211 176.7618 101 H 4.5592 8.1634 116.4414 58.0907 29.2474 177.6180 102 I 3.7787 8.4257 122.4875 64.4520 36.6680 178.4541 103 T 4.0344 7.9933 109.7379 63.9690 68.6352 175.8609 104 R 4.3254 6.9568 115.8346 54.7020 30.6585 176.0532 105 K 3.7530 7.6961 116.8504 57.5056 29.9500 175.9998 106 I 4.0777 7.6467 120.0703 59.9120 37.8850 177.2789 107 S 4.4928 8.3509 119.9928 57.4720 65.1691 174.9819 108 A 4.0158 8.4968 123.3187 55.1757 17.8141 179.8219 109 A 3.9895 7.8958 118.0211 55.5290 18.9108 179.3179 110 E 4.1446 8.1934 116.7140 59.4578 29.6336 179.3759 111 F 4.1724 8.6235 121.0006 60.9243 39.4876 177.0237 112 G 3.9008 8.0840 104.5070 46.4373 0.0000 175.3440 113 K 4.1688 7.9669 120.8681 58.6354 32.0242 178.4789 114 I 3.4603 7.5230 118.5438 63.1280 37.6840 177.3485 115 N 4.4782 8.2859 117.9903 56.2778 38.3180 177.2116 116 G 3.6798 7.6245 106.7867 47.4800 0.0000 173.8107 117 P 4.1887 0.0000 0.0000 65.1056 31.3144 178.6988 118 I 3.4998 7.6610 118.4930 64.1900 36.9781 178.3693 119 K 3.9368 8.1585 120.3882 59.4832 32.0514 179.0617 120 K 3.9805 7.9960 118.7714 59.3450 31.5490 179.5583 121 V 3.5264 7.9703 118.7594 65.9267 31.3632 177.9566 122 L 3.8650 8.0840 118.6768 57.9133 41.5087 179.4317 123 A 4.0382 8.2126 120.8475 55.1098 18.1167 179.7298 124 S 4.4378 8.0724 111.5822 60.5125 62.9106 175.8699 125 K 4.4021 7.0931 119.8228 55.4311 32.3470 175.6085 126 N 4.1545 8.3169 115.4164 54.2764 36.1670 174.0136 127 F 4.4868 8.2891 118.1005 55.9670 39.9920 177.4009 128 G 4.0796 8.7036 114.5218 44.2029 0.0000 172.2156 129 D 4.4880 8.8807 118.7465 57.5701 40.7663 178.6040 130 K 3.8170 8.1489 119.3619 59.9630 32.1217 178.2660 131 Y 4.1688 7.9862 116.1007 60.9530 37.9444 177.8900 132 A 4.2431 8.3086 121.8974 55.3118 18.4969 179.4698 133 N 4.3630 8.9886 115.2149 56.2325 38.2251 177.5041 134 A 3.9333 7.9646 122.2526 55.1302 18.5596 179.8476 135 W 3.9077 8.5246 117.0413 59.4974 29.0490 178.7000 136 A 4.5124 8.0814 122.5102 54.5647 17.5372 179.8360 137 K 3.9491 7.6376 116.0483 59.4223 32.4900 179.0580 138 L 3.9546 7.6130 120.4420 57.9724 41.9880 179.1709 139 V 3.7998 8.1246 118.1466 65.8983 31.4884 177.8881 140 A 4.6847 7.9905 121.9179 54.3646 17.8833 179.8036 141 V 3.4341 7.2049 116.0715 66.1076 31.8017 178.1354 142 V 3.5002 7.4897 117.5129 65.9731 31.5230 177.8067 143 Q 3.8068 8.0847 117.5796 58.8258 28.3106 178.6259 144 A 4.0518 7.9164 120.3688 54.0871 18.4516 178.4163 145 A 4.3554 7.7377 117.4893 52.3024 19.6311 177.0682 146 L 4.1650 7.5914 122.2067 54.6778 41.8853 176.3875 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 S 8.19 4.45 0.00 4.05 4.11 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 3 V 8.17 3.39 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 0.90 0.00 0.00 4 Y 8.84 4.04 0.00 3.05 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 5 D 8.09 4.25 0.00 2.94 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 6 A 7.64 3.99 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 7 A 8.08 3.89 1.20 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 0.00 0.00 8 A 7.93 3.80 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 Q 7.36 4.20 0.00 2.18 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.79 0.00 0.00 0.00 0.00 0.00 2.29 2.51 0.00 10 L 7.33 3.73 0.00 1.63 1.60 0.76 0.81 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 11 T 8.17 4.27 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 1.20 0.00 0.00 12 A 8.38 3.96 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 13 D 7.95 4.29 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 14 V 7.35 3.49 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 0.90 0.00 0.00 0.86 0.00 0.00 15 K 8.34 3.84 0.00 1.90 1.78 0.00 1.66 0.00 0.00 1.51 0.00 0.00 2.88 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.36 1.57 7.81 16 K 8.11 3.96 0.00 1.97 2.05 0.00 1.60 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.47 1.59 7.81 17 D 8.12 4.64 0.00 2.84 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 18 L 8.05 3.77 0.00 1.62 1.23 0.54 -0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.12 4.06 0.00 2.04 2.05 0.00 3.14 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.94 0.00 20 D 8.48 4.47 0.00 2.89 2.88 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 21 S 8.07 3.22 0.00 3.37 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 22 W 8.55 4.33 0.00 3.84 3.39 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 23 K 7.87 3.84 0.00 2.00 1.88 0.00 1.81 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.81 7.81 24 V 7.21 3.71 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 1.10 0.00 0.00 1.10 0.00 0.00 25 I 7.75 3.60 1.72 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 1.25 0.85 0.62 0.00 0.00 26 G 7.10 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 0.00 0.00 0.00 0.00 0.00 0.00 27 S 7.29 4.27 0.00 3.94 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 28 D 7.28 4.70 0.00 2.56 2.39 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 29 K 7.89 3.89 0.00 1.69 1.65 0.00 1.14 0.00 0.00 0.69 0.00 0.00 2.13 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.19 1.33 7.81 30 K 7.93 4.00 0.00 1.82 1.77 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.50 7.81 31 G 8.24 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 32 N 8.39 4.51 0.00 2.69 2.72 0.00 0.00 6.99 8.44 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 33 G 8.09 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 34 V 7.70 3.57 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 1.08 0.00 0.00 0.95 0.00 0.00 35 A 7.74 4.00 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 36 L 7.71 3.75 0.00 1.66 1.74 0.76 0.85 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 37 M 7.71 3.50 0.00 1.72 1.93 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.69 0.00 38 T 8.02 3.97 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 1.29 0.00 0.00 39 T 7.88 3.85 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 1.19 0.00 0.00 40 L 7.57 3.83 0.00 1.57 1.24 0.86 0.86 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 41 F 7.65 4.49 0.00 3.24 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 42 A 8.06 4.14 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 43 D 8.12 4.62 0.00 2.66 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 44 N 8.21 5.26 0.00 2.97 2.91 0.00 0.00 7.04 8.36 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 45 Q 8.37 4.31 0.00 2.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.92 0.00 0.00 0.00 0.00 0.00 2.48 2.62 0.00 46 E 8.28 4.11 0.00 2.14 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 0.00 2.42 2.35 0.00 47 T 8.26 4.32 4.75 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 0.00 0.00 0.00 1.42 0.00 0.00 48 I 7.74 3.74 1.90 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 1.13 0.71 0.73 0.00 0.00 49 G 8.05 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 50 Y 7.93 4.45 0.00 2.84 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 51 F 8.24 4.96 0.00 3.05 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 52 K 8.24 4.00 0.00 1.94 2.08 0.00 1.51 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.45 7.81 53 R 8.00 3.96 0.00 1.82 2.06 0.00 3.27 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 54 L 8.03 4.27 0.00 1.86 1.74 0.96 0.84 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 55 G 7.70 3.74 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 0.00 0.00 0.00 56 D 8.38 4.47 0.00 2.67 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 57 V 7.94 3.87 1.72 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 0.56 0.00 0.00 0.29 0.00 0.00 58 S 8.10 4.34 0.00 3.98 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 59 Q 8.16 4.12 0.00 2.23 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.84 0.00 0.00 0.00 0.00 0.00 2.46 2.44 0.00 60 G 7.58 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 61 M 9.04 3.87 0.00 1.96 2.13 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.62 0.00 62 A 7.55 3.99 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 63 N 8.32 4.59 0.00 2.77 2.89 0.00 0.00 6.77 9.28 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 64 D 8.67 4.36 0.00 2.93 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 65 K 8.11 4.00 0.00 2.15 1.95 0.00 1.69 0.00 0.00 1.89 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.56 1.52 7.81 66 L 8.51 4.05 0.00 1.79 1.86 1.03 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 67 R 8.37 3.99 0.00 2.09 2.06 0.00 3.16 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 68 G 8.43 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 69 H 8.41 4.25 0.00 3.38 3.62 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 S 8.33 4.08 0.00 3.98 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 71 I 7.97 3.90 1.96 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 1.56 1.62 1.15 0.00 0.00 72 T 7.92 4.10 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 1.31 0.00 0.00 73 L 8.09 3.87 0.00 1.65 1.76 0.85 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 74 M 7.91 4.23 0.00 1.99 2.13 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.88 0.00 75 Y 7.87 4.16 0.00 3.26 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 76 A 7.58 3.74 0.32 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 77 L 7.37 3.53 0.00 1.47 1.18 0.90 1.16 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 78 Q 7.77 3.58 0.00 2.50 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.80 0.00 0.00 0.00 0.00 0.00 2.61 2.57 0.00 79 N 8.14 4.32 0.00 3.00 2.94 0.00 0.00 7.23 7.90 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 80 F 7.57 4.49 0.00 3.04 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 81 I 7.75 3.68 1.63 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 -0.24 0.85 0.00 0.00 82 D 8.03 4.42 0.00 2.83 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 83 Q 7.71 4.41 0.00 2.08 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.72 0.00 0.00 0.00 0.00 0.00 2.85 2.63 0.00 84 L 7.35 3.89 0.00 1.55 1.68 0.78 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 85 D 7.97 4.55 0.00 2.66 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 86 N 8.10 4.86 0.00 2.68 2.65 0.00 0.00 7.10 7.33 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 87 P 0.00 4.17 0.00 2.12 1.81 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 1.99 2.08 0.00 88 D 8.31 4.51 0.00 2.99 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 89 D 8.30 4.39 0.00 2.88 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 90 L 8.13 3.98 0.00 1.91 1.77 0.81 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 91 V 8.35 3.57 2.34 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 1.03 0.00 0.00 1.10 0.00 0.00 92 C 7.94 4.20 0.00 3.13 3.18 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 93 V 7.80 3.73 2.35 0.00 0.00 0.00 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 1.26 0.00 0.00 94 V 8.12 3.74 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 0.96 0.00 0.00 0.42 0.00 0.00 95 E 8.41 3.98 0.00 2.05 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 2.31 2.61 0.00 96 K 7.41 3.88 0.00 1.81 1.83 0.00 0.94 0.00 0.00 1.27 0.00 0.00 2.75 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.30 1.42 7.81 97 F 8.29 4.69 0.00 3.42 3.23 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 98 A 8.38 4.02 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 99 V 7.66 3.59 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 1.03 0.00 0.00 1.02 0.00 0.00 100 N 7.95 4.35 0.00 3.26 2.93 0.00 0.00 7.01 7.88 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 0.00 101 H 8.16 4.56 0.00 3.40 3.44 0.00 5.82 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 I 8.43 3.78 2.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.73 0.91 0.00 0.00 103 T 7.99 4.03 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 1.32 0.00 0.00 104 R 6.96 4.33 0.00 1.80 1.79 0.00 3.42 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.63 0.00 105 K 7.70 3.75 0.00 1.92 1.91 0.00 1.87 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.56 7.81 106 I 7.65 4.08 2.01 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.74 1.02 0.00 0.00 107 S 8.35 4.49 0.00 4.13 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 0.00 108 A 8.50 4.02 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 0.00 109 A 7.90 3.99 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 E 8.19 4.14 0.00 2.14 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 2.43 2.39 0.00 111 F 8.62 4.17 0.00 3.22 3.21 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 0.00 112 G 8.08 3.90 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 0.00 0.00 0.00 113 K 7.97 4.17 0.00 1.94 1.89 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.50 1.62 7.81 114 I 7.52 3.46 1.51 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 1.31 1.08 0.77 0.00 0.00 115 N 8.29 4.48 0.00 2.93 2.89 0.00 0.00 6.70 7.15 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 0.00 116 G 7.62 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 0.00 117 P 0.00 4.19 0.00 2.04 1.99 0.00 3.66 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.10 0.00 118 I 7.66 3.50 1.96 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.66 0.65 0.00 0.00 119 K 8.16 3.94 0.00 1.95 2.01 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.46 1.53 7.81 120 K 8.00 3.98 0.00 1.98 1.81 0.00 1.69 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.58 7.81 121 V 7.97 3.53 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 0.91 0.00 0.00 0.89 0.00 0.00 122 L 8.08 3.86 0.00 2.00 2.01 1.02 0.86 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 0.00 123 A 8.21 4.04 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.07 4.44 0.00 4.02 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 0.00 125 K 7.09 4.40 0.00 2.06 1.93 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.39 1.62 7.81 126 N 8.32 4.15 0.00 2.55 2.76 0.00 0.00 6.82 7.44 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 0.00 127 F 8.29 4.49 0.00 3.13 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 0.00 128 G 8.70 4.08 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 0.00 0.00 0.00 129 D 8.88 4.49 0.00 2.74 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 0.00 130 K 8.15 3.82 0.00 1.72 1.62 0.00 1.59 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.97 1.35 7.81 131 Y 7.99 4.17 0.00 3.47 3.18 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 0.00 132 A 8.31 4.24 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.99 4.36 0.00 2.92 2.89 0.00 0.00 6.88 7.74 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 0.00 134 A 7.96 3.93 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 0.00 135 W 8.52 3.91 0.00 3.49 3.35 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.08 4.51 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 0.00 137 K 7.64 3.95 0.00 1.86 1.81 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.60 7.81 138 L 7.61 3.95 0.00 1.46 1.69 0.66 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 139 V 8.12 3.80 2.37 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 1.23 0.00 0.00 1.26 0.00 0.00 140 A 7.99 4.68 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 0.00 141 V 7.20 3.43 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 0.64 0.00 0.00 0.79 0.00 0.00 142 V 7.49 3.50 1.86 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 0.33 0.00 0.00 0.78 0.00 0.00 143 Q 8.08 3.81 0.00 2.29 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.60 2.60 0.00 144 A 7.92 4.05 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 0.00 145 A 7.74 4.36 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 0.00 146 L 7.59 4.17 0.00 1.68 1.53 0.55 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00