NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2056 8.1627 120.5956 55.2064 34.1259 173.3751 2 K 4.6591 7.9098 124.8444 53.8398 34.3131 173.6340 3 W 4.9666 9.9305 128.3048 54.9161 33.1469 173.6176 4 E 5.3057 8.8344 122.8395 54.9973 31.0652 175.1786 5 M 4.7756 8.6993 119.9760 54.0410 34.8836 174.6358 6 G 4.2170 8.7701 108.0011 46.6400 0.0000 172.7286 7 L 4.4669 8.8075 120.7502 53.6393 45.8125 175.1519 8 Q 4.1383 8.6150 125.0256 55.5791 29.7998 176.5350 9 E 3.8769 9.0274 122.5192 59.7436 29.0803 179.1703 10 E 3.8248 7.9819 116.7150 59.7967 29.3280 178.5368 11 Y 4.3886 7.5355 116.9470 60.2698 37.9403 177.9537 12 I 3.6663 7.4696 120.7058 64.4104 37.2020 178.1743 13 E 3.9641 8.0821 118.7987 59.5239 29.3942 179.3361 14 L 4.0414 7.6323 117.6911 57.7554 41.6736 179.7184 15 I 4.1735 7.8935 121.2895 63.8114 36.8637 178.6375 16 K 4.0998 7.9713 118.1605 58.9624 31.9803 178.5423 17 A 4.2891 7.9834 119.0259 52.2051 18.6019 178.3240 18 G 3.9235 7.7759 105.2591 45.5881 0.0000 175.2983 19 K 3.9619 8.1894 119.5470 58.8666 32.3453 177.6326 20 K 4.4058 7.8294 123.9309 55.8425 31.8198 176.3459 21 K 4.6916 8.8578 125.6689 56.3041 33.6929 176.1899 22 I 5.1915 7.5882 120.2658 59.3975 41.1622 174.0346 23 E 4.5545 9.3162 127.5885 54.4575 31.5930 174.6710 24 G 4.5323 8.7170 114.2400 45.3486 0.0000 172.5337 25 R 4.9372 8.4427 120.9544 54.8822 35.5728 174.1620 26 L 4.0334 7.8563 120.0550 54.5621 42.1583 177.8225 27 Y 4.5859 8.0840 125.7358 56.6313 36.5622 173.7765 28 D 3.9316 7.1213 122.6664 51.4261 42.5536 177.0748 29 E 3.6965 8.5399 118.6648 59.8616 29.6697 178.7765 30 K 3.8629 7.7017 118.6983 59.3922 32.1958 178.5070 31 R 3.9222 7.8352 116.2505 57.7797 30.0779 177.9260 32 R 4.0131 7.1600 116.6234 56.0815 30.3759 176.5446 33 Q 4.3457 7.1033 116.4508 55.5090 29.6341 175.8501 34 I 4.3210 6.9610 118.9523 60.4467 38.5663 174.9721 35 K 4.6832 8.7558 120.0787 54.5472 35.5360 173.9516 36 P 4.5602 0.0000 0.0000 64.6433 31.6533 176.1969 37 G 4.0862 9.1317 111.0848 45.6233 0.0000 173.6844 38 D 4.8268 8.2376 119.2152 54.4006 42.5564 175.3278 39 I 5.0139 8.8081 120.4171 59.6831 40.8110 174.9343 40 I 4.8297 8.5343 126.1499 59.5552 40.2888 174.5889 41 I 4.5155 9.0858 129.0459 59.7652 38.7414 174.7768 42 F 5.1126 9.3271 127.5796 57.1294 40.0202 175.8792 43 E 3.7127 9.9163 123.8295 57.6010 28.1097 175.3864 44 G 3.9246 8.9069 102.2775 46.4399 0.0000 172.7654 45 G 4.1108 8.0348 106.5203 45.1530 0.0000 176.5444 46 K 4.1552 7.8130 119.2090 58.6302 32.5430 176.9681 47 L 4.7292 7.5451 120.4966 53.6641 46.1552 173.8099 48 K 5.1686 8.8123 124.6259 55.3046 35.5402 175.3022 49 V 4.9962 8.6032 115.8794 59.5632 36.7733 173.9478 50 K 4.8372 8.9774 123.9088 54.7988 34.5790 175.3698 51 V 4.2828 8.8904 128.1018 62.8943 31.8600 176.3018 52 K 4.5537 9.1109 127.7982 57.2846 33.6032 176.4784 53 G 4.1132 7.5395 104.8987 45.9009 0.0000 172.4747 54 I 5.2015 8.3088 120.0842 59.6127 41.0765 175.1287 55 R 4.5422 8.9883 125.0345 54.1632 33.9236 174.6019 56 V 4.4322 7.6900 121.1500 61.2006 34.1233 174.0130 57 Y 4.8679 9.0164 124.2894 56.0133 41.8297 176.6688 58 S 4.2469 8.8848 114.8653 60.5169 63.9811 174.4927 59 S 4.5026 7.3799 114.6712 56.0847 66.7464 174.9419 60 F 4.0101 9.1063 121.5232 60.1531 38.5042 177.9599 61 K 3.9207 8.1224 118.9451 59.7376 32.1705 178.4421 62 E 3.8898 8.0866 118.6638 59.4644 29.2836 179.0740 63 M 2.5500 7.6612 117.9754 58.1266 32.2904 178.2700 64 L 3.9582 8.0536 119.4094 57.8442 41.5324 179.4518 65 E 3.9453 7.8867 117.6943 59.1503 29.4519 178.9285 66 K 4.1234 7.5204 118.3569 59.2532 32.4917 178.3881 67 E 4.3959 8.2481 117.8794 56.1713 29.7427 175.3640 68 G 3.7668 8.1125 110.3362 45.4190 0.0000 173.7691 69 I 3.6645 8.4031 126.7303 63.6611 38.0881 177.5333 70 E 4.3111 8.1357 119.5120 58.4250 29.8879 176.9070 71 N 4.7785 8.5130 115.9651 54.2350 39.4244 176.7343 72 V 4.1757 7.7810 116.1023 64.0242 33.1563 176.0470 73 L 4.7801 8.1263 120.5797 51.1842 41.5787 173.0151 74 P 4.5535 0.0000 0.0000 64.2967 32.1664 175.2164 75 G 4.1189 9.0710 110.8181 45.7806 0.0000 174.5682 76 V 3.7007 7.2989 119.5904 62.6358 31.8517 176.1231 77 K 4.1996 8.7326 127.3267 58.4741 32.6311 177.6844 78 S 4.8213 7.5789 111.8408 55.7032 67.3766 174.8790 79 I 3.7665 8.2388 123.2916 64.5171 36.8216 178.4700 80 E 3.9840 8.1675 119.0203 59.6972 29.5027 179.2023 81 E 4.1462 8.2368 118.0949 58.9546 29.4436 179.7034 82 G 3.5714 8.0836 106.1744 47.7753 0.0000 175.9110 83 V 3.8221 8.2064 121.3495 65.7876 31.2820 178.2484 84 K 3.9809 7.6207 116.9272 59.2087 31.9589 179.1422 85 V 3.4918 7.4167 118.2453 66.2649 31.4002 177.8234 86 Y 3.9952 7.3799 115.9399 60.7919 37.3791 178.0622 87 R 4.3718 8.0473 120.1796 58.3100 30.1685 177.9828 88 Q 3.8873 7.2026 116.5643 57.7150 28.6925 176.4924 89 F 4.6798 7.6266 117.6735 57.6914 40.7973 175.6302 90 Y 5.0257 7.4222 117.4812 55.3572 41.2967 174.8889 91 D 4.6580 8.7569 124.2483 53.0691 41.8561 177.3004 92 E 4.1220 8.7398 119.5133 59.3385 29.4194 179.2719 93 E 3.9292 8.2452 119.0958 59.4907 29.7774 179.0153 94 R 4.0011 8.3697 118.1411 58.9771 30.0887 178.5772 95 E 3.9157 8.2869 119.1655 59.4244 29.4576 179.1911 96 K 3.9734 8.0802 117.2681 59.0664 32.1373 179.1362 97 K 3.9314 7.9254 119.1012 59.7024 32.2530 178.0030 98 Y 4.4594 8.1189 115.5181 57.8525 38.6886 176.4325 99 G 3.8976 8.6593 106.0374 44.5197 0.0000 171.5372 100 V 4.6864 8.5500 117.7001 60.7088 34.8493 174.6703 101 V 4.7430 8.6883 126.2622 59.7915 34.3972 174.2818 102 A 4.9721 9.1259 125.5743 50.4590 21.4591 175.2426 103 I 4.6508 8.6967 124.8302 59.8409 39.2689 175.0467 104 E 4.6789 9.1778 130.5570 55.9298 30.3414 175.5861 105 I 5.2366 8.5637 120.1458 59.1618 41.3209 174.5085 106 E 4.7794 8.8628 123.9492 53.6233 32.5466 173.1224 107 P 4.8494 0.0000 0.0000 63.1660 32.3564 176.4969 108 I 4.0635 8.3303 121.5265 61.6191 37.2308 175.6894 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 M 8.16 4.21 0.00 2.20 1.84 0.00 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.43 0.00 2 K 7.91 4.66 0.00 1.68 1.41 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.20 1.43 7.81 3 W 9.93 4.97 0.00 3.20 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 4 E 8.83 5.31 0.00 1.88 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 2.22 2.23 0.00 5 M 8.70 4.78 0.00 2.13 2.21 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.45 0.00 6 G 8.77 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 8.81 4.47 0.00 1.31 1.41 0.66 0.34 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 8 Q 8.62 4.14 0.00 2.21 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.59 0.00 0.00 0.00 0.00 0.00 2.42 2.29 0.00 9 E 9.03 3.88 0.00 1.99 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 2.33 2.36 0.00 10 E 7.98 3.82 0.00 1.90 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 1.80 1.47 0.00 11 Y 7.54 4.39 0.00 3.08 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 12 I 7.47 3.67 2.01 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 1.48 0.73 0.93 0.00 0.00 13 E 8.08 3.96 0.00 2.11 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 2.38 2.54 0.00 14 L 7.63 4.04 0.00 1.96 1.77 1.01 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 15 I 7.89 4.17 2.01 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 2.06 0.99 0.00 0.00 16 K 7.97 4.10 0.00 1.91 1.89 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.68 7.81 17 A 7.98 4.29 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 18 G 7.78 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 19 K 8.19 3.96 0.00 1.95 1.90 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.79 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.53 7.81 20 K 7.83 4.41 0.00 1.84 1.74 0.00 1.78 0.00 0.00 1.76 0.00 0.00 2.55 0.00 0.00 2.36 0.00 0.00 0.00 0.00 1.60 1.65 7.81 21 K 8.86 4.69 0.00 1.77 1.82 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.58 7.81 22 I 7.59 5.19 1.91 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 1.27 0.91 1.01 0.00 0.00 23 E 9.32 4.55 0.00 2.14 1.93 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 2.41 2.38 0.00 24 G 8.72 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 0.00 0.00 0.00 0.00 25 R 8.44 4.94 0.00 1.83 1.79 0.00 3.21 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 26 L 7.86 4.03 0.00 1.17 1.23 0.83 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 8.08 4.59 0.00 2.73 3.15 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 0.00 0.00 0.00 0.00 28 D 7.12 3.93 0.00 2.35 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 0.00 0.00 0.00 29 E 8.54 3.70 0.00 1.91 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 2.22 2.32 0.00 30 K 7.70 3.86 0.00 1.77 1.64 0.00 1.75 0.00 0.00 1.86 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.22 1.41 7.81 31 R 7.84 3.92 0.00 1.93 1.94 0.00 3.22 0.00 0.00 3.08 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.65 0.00 32 R 7.16 4.01 0.00 1.58 1.56 0.00 2.81 0.00 0.00 2.79 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.07 0.00 33 Q 7.10 4.35 0.00 1.31 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.88 0.00 0.00 0.00 0.00 0.00 2.20 2.26 0.00 34 I 6.96 4.32 1.70 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.18 -0.29 0.91 0.00 0.00 35 K 8.76 4.68 0.00 1.96 1.91 0.00 1.38 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.75 1.48 7.81 36 P 0.00 4.56 0.00 2.08 2.07 0.00 3.66 0.00 0.00 3.68 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 37 G 9.13 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 0.00 0.00 0.00 0.00 38 D 8.24 4.83 0.00 2.92 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 39 I 8.81 5.01 1.82 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.73 0.94 0.00 0.00 40 I 8.53 4.83 1.43 0.00 0.00 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 1.25 0.90 0.01 0.00 0.00 41 I 9.09 4.52 1.95 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.00 0.95 0.00 0.00 42 F 9.33 5.11 0.00 3.13 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 43 E 9.92 3.71 0.00 2.22 1.95 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 2.25 2.32 0.00 44 G 8.91 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 45 G 8.03 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 0.00 0.00 0.00 46 K 7.81 4.16 0.00 1.85 1.93 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.63 7.81 47 L 7.55 4.73 0.00 1.98 1.68 1.01 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 48 K 8.81 5.17 0.00 1.82 1.87 0.00 1.50 0.00 0.00 1.83 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.45 7.81 49 V 8.60 5.00 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 0.93 0.00 0.00 1.04 0.00 0.00 50 K 8.98 4.84 0.00 1.80 1.67 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.38 7.81 51 V 8.89 4.28 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 0.89 0.00 0.00 1.03 0.00 0.00 52 K 9.11 4.55 0.00 1.70 1.91 0.00 1.83 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.58 1.55 7.81 53 G 7.54 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 0.00 0.00 0.00 54 I 8.31 5.20 1.85 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 1.35 0.68 0.86 0.00 0.00 55 R 8.99 4.54 0.00 1.78 1.35 0.00 3.09 0.00 0.00 3.06 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.41 0.00 56 V 7.69 4.43 1.62 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 0.19 0.00 0.00 -0.08 0.00 0.00 57 Y 9.02 4.87 0.00 2.70 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 58 S 8.88 4.25 0.00 3.95 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 59 S 7.38 4.50 0.00 4.15 3.93 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 60 F 9.11 4.01 0.00 3.10 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 61 K 8.12 3.92 0.00 1.87 1.83 0.00 1.75 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.66 1.55 7.81 62 E 8.09 3.89 0.00 2.16 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 2.33 2.49 0.00 63 M 7.66 2.55 0.00 1.94 1.76 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.43 0.00 64 L 8.05 3.96 0.00 1.85 1.73 1.11 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 65 E 7.89 3.95 0.00 2.04 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 2.33 2.41 0.00 66 K 7.52 4.12 0.00 1.78 1.66 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.16 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.72 1.65 7.81 67 E 8.25 4.40 0.00 1.98 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 2.38 2.49 0.00 68 G 8.11 3.77 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 0.00 0.00 0.00 69 I 8.40 3.66 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.94 0.92 0.00 0.00 70 E 8.14 4.31 0.00 1.96 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 2.30 2.41 0.00 71 N 8.51 4.78 0.00 3.03 2.86 0.00 0.00 6.34 7.26 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 72 V 7.78 4.18 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 0.95 0.00 0.00 0.99 0.00 0.00 73 L 8.13 4.78 0.00 1.65 1.56 0.73 0.84 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 74 P 0.00 4.55 0.00 2.08 2.05 0.00 3.75 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 2.09 2.34 0.00 75 G 9.07 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 0.00 0.00 0.00 76 V 7.30 3.70 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 0.83 0.00 0.00 0.93 0.00 0.00 77 K 8.73 4.20 0.00 1.78 1.85 0.00 1.76 0.00 0.00 1.82 0.00 0.00 3.13 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.36 7.81 78 S 7.58 4.82 0.00 4.19 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 79 I 8.24 3.77 1.89 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 1.65 0.97 0.94 0.00 0.00 80 E 8.17 3.98 0.00 2.06 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 2.41 2.48 0.00 81 E 8.24 4.15 0.00 2.16 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 2.32 2.45 0.00 82 G 8.08 3.57 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 0.00 0.00 0.00 83 V 8.21 3.82 2.30 0.00 0.00 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 1.12 0.00 0.00 84 K 7.62 3.98 0.00 1.90 1.79 0.00 1.89 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.68 7.81 85 V 7.42 3.49 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 0.80 0.00 0.00 0.86 0.00 0.00 86 Y 7.38 4.00 0.00 2.63 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 R 8.05 4.37 0.00 1.90 2.04 0.00 3.21 0.00 0.00 3.37 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.57 0.00 88 Q 7.20 3.89 0.00 1.07 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.54 0.00 0.00 0.00 0.00 0.00 2.33 2.18 0.00 89 F 7.63 4.68 0.00 1.93 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 Y 7.42 5.03 0.00 3.30 3.01 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 0.00 0.00 0.00 91 D 8.76 4.66 0.00 2.95 2.89 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 92 E 8.74 4.12 0.00 2.09 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 2.49 2.44 0.00 93 E 8.25 3.93 0.00 2.06 2.24 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 2.38 2.40 0.00 94 R 8.37 4.00 0.00 2.14 2.28 0.00 3.56 0.00 0.00 3.36 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.02 0.00 95 E 8.29 3.92 0.00 2.39 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 2.15 1.93 0.00 96 K 8.08 3.97 0.00 1.88 1.84 0.00 1.77 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.70 7.81 97 K 7.93 3.93 0.00 1.63 1.74 0.00 1.51 0.00 0.00 1.04 0.00 0.00 2.34 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.70 1.16 7.81 98 Y 8.12 4.46 0.00 3.03 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 G 8.66 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 0.00 100 V 8.55 4.69 1.75 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 0.70 0.00 0.00 -0.41 0.00 0.00 101 V 8.69 4.74 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 0.75 0.00 0.00 0.93 0.00 0.00 102 A 9.13 4.97 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 0.00 103 I 8.70 4.65 1.96 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 1.14 0.71 0.96 0.00 0.00 104 E 9.18 4.68 0.00 2.08 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 0.00 2.34 2.29 0.00 105 I 8.56 5.24 2.01 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.94 1.04 0.00 0.00 106 E 8.86 4.78 0.00 2.07 1.82 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 2.22 2.26 0.00 107 P 0.00 4.85 0.00 2.16 2.11 0.00 3.84 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.18 0.00 108 I 8.33 4.06 1.89 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 1.18 0.65 0.92 0.00 0.00