NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8100 8.3544 109.7357 43.7229 0.0000 174.6119 2 S 3.5372 8.0226 114.0112 56.3518 60.5245 169.3061 3 S 4.6242 7.9995 112.1988 56.7349 67.0952 173.1649 4 G 3.8831 8.2829 109.0471 43.7385 0.0000 172.7111 5 S 4.2558 8.5925 120.6661 58.3006 63.4046 173.8217 6 S 4.7711 8.1354 116.5815 57.1296 64.3880 174.0487 7 G 4.1962 7.9547 110.8134 44.9504 0.0000 173.0117 8 K 4.3084 8.4061 116.9898 55.8088 34.6660 176.2038 9 A 3.6953 8.0047 119.7918 52.6960 16.0993 176.7060 10 E 4.2272 8.1389 119.4467 57.2731 29.4478 176.6779 11 A 4.0630 8.0839 122.3776 51.5899 21.4817 175.3989 12 E 4.2771 8.8524 125.4776 55.0121 28.8214 175.1723 13 Q 4.1002 8.1346 124.2176 54.4470 31.5168 175.1624 14 N 3.7769 7.9329 121.8311 50.9717 38.2071 175.4062 15 W 4.6184 7.8060 128.8790 55.6669 29.7744 176.2246 16 W 4.9923 7.1958 114.5129 55.3054 29.9971 176.2788 17 E 4.6150 8.2928 117.7436 55.4296 29.5570 174.8533 18 G 3.8983 8.3617 109.6882 45.2764 0.0000 168.2805 19 P 4.2854 0.0000 0.0000 61.9869 32.4285 176.0212 20 P 4.4342 0.0000 0.0000 61.7994 32.4628 174.9052 21 Q 3.6503 7.8418 117.7170 56.5155 29.5211 175.8921 22 D 4.3406 8.3110 120.4734 53.2688 44.0362 176.3400 23 L 3.8964 8.0723 124.0089 57.9375 41.9773 179.7921 24 S 3.8399 7.9210 114.5370 61.6808 62.8780 176.1116 25 V 3.5012 7.6574 112.4391 64.7470 31.4085 176.9886 26 H 4.0856 7.8741 116.2695 55.0857 29.0589 176.3455 27 L 4.2054 8.0936 121.4839 56.0161 41.7106 176.5811 28 W 5.6674 6.8941 116.1182 54.8649 30.5218 174.2123 29 Y 5.2929 8.8513 123.7117 56.4236 41.9988 174.2160 30 A 3.6963 8.2754 127.5492 50.5643 21.9948 176.6168 31 G 3.9602 7.8541 117.2222 45.2739 0.0000 172.5074 32 P 4.5283 0.0000 0.0000 63.7875 31.4514 175.9124 33 M 3.6050 7.2634 118.7015 54.8906 33.1760 176.5725 34 E 4.3964 8.4864 123.7954 55.3886 32.8573 176.7841 35 R 3.7910 8.5697 117.2559 59.8562 29.7916 177.5482 36 A 4.1119 8.1271 119.5634 55.5508 17.8886 179.5873 37 G 3.6060 8.1820 103.0892 47.8195 0.0000 175.5885 38 A 3.9128 7.8920 122.6598 54.8615 18.7168 179.1414 39 E 3.9011 8.5157 117.5680 59.9738 29.6510 179.4074 40 S 4.1393 8.2351 112.6896 61.7223 62.3700 176.4627 41 I 3.7425 7.2692 121.7053 64.4655 36.8152 177.9373 42 L 4.3919 7.9475 115.9958 55.6882 41.7467 178.2876 43 A 4.3534 8.1815 121.3092 54.5903 19.3615 178.9010 44 N 4.5162 8.5304 114.1798 56.0351 39.0518 176.1292 45 R 4.2259 7.5750 117.6561 55.5999 30.8825 176.2982 46 S 4.3324 8.3599 114.1624 58.3595 63.3207 173.7227 47 D 4.6067 8.6108 122.9706 55.8429 39.3326 175.8357 48 G 4.0175 8.4148 111.0587 45.7547 0.0000 173.3343 49 T 4.9595 7.9950 117.1866 63.8633 69.8400 173.1925 50 F 5.8590 8.9069 118.3633 56.5756 41.8353 172.3218 51 L 4.2684 8.0149 117.7862 55.4983 43.4655 173.0600 52 V 4.9093 8.3252 118.4584 61.2576 33.9112 174.2815 53 R 5.6721 9.3896 124.6978 53.7951 32.5996 174.5611 54 Q 5.0804 8.6570 120.8925 54.6287 31.4277 174.7227 55 R 4.4050 8.3357 124.6465 55.5351 31.3495 176.5551 56 V 3.9594 8.2666 114.7707 63.3775 32.4315 177.8961 57 K 3.9205 8.1537 118.1299 59.0604 31.8962 176.3938 58 D 4.7045 7.6671 118.1000 52.2018 43.3058 175.3115 59 A 3.9474 8.9884 127.8851 55.4000 18.8622 178.1721 60 A 4.2400 7.5662 118.0437 50.6207 17.4317 176.7617 61 E 4.6134 7.1993 122.7618 54.2725 33.8097 174.8517 62 F 5.6865 8.6017 124.9481 56.0060 43.3399 174.0985 63 A 5.6488 9.5882 120.8786 51.1308 23.2628 175.4625 64 I 5.0586 8.4788 122.5719 59.2872 39.2106 174.5484 65 S 5.0484 8.6025 122.9255 56.4921 64.3329 172.4885 66 I 5.6522 8.3691 126.9053 58.0664 41.2269 173.7539 67 K 4.6570 8.5677 129.5196 55.9208 33.5221 174.8662 68 Y 4.5823 9.5021 125.8773 57.9682 42.4560 172.8759 69 N 3.6922 8.5102 121.7624 55.8915 36.5762 173.9812 70 V 3.4661 7.7934 103.8688 61.6313 30.1697 173.2568 71 E 4.6321 7.4865 116.6341 55.0912 33.6159 174.5271 72 V 4.2715 8.2644 122.0400 62.0033 32.5290 175.5269 73 K 4.7524 8.8603 127.0368 55.5597 34.6593 175.1458 74 H 5.4415 8.4393 117.4022 54.5504 33.2118 172.9487 75 I 4.5284 8.3254 120.1030 59.4154 41.5305 174.3412 76 K 4.6040 8.7269 127.3091 55.5393 32.0038 175.6291 77 I 4.4973 8.9913 129.4833 60.6902 39.1639 175.7456 78 M 4.9573 9.1054 126.8475 54.6905 34.6466 175.4409 79 T 5.1489 8.4205 109.3615 60.2840 71.5679 173.2359 80 A 4.4560 8.4388 129.6202 50.8442 20.9111 175.6202 81 E 3.9501 9.9088 124.7758 57.9964 27.1725 175.8470 82 G 3.7691 8.1687 100.6779 46.0400 0.0000 173.0791 83 L 4.9743 7.3399 120.2982 53.4584 45.2948 175.0106 84 Y 5.8098 8.6481 116.0391 58.0131 42.6510 174.6956 85 R 5.3310 8.7653 119.3035 55.5326 32.2991 175.4698 86 I 4.5529 8.9284 113.9113 60.9606 39.1357 174.9351 87 T 4.8065 7.6617 109.9464 59.5835 71.8157 173.4474 88 E 4.2231 8.6612 119.4046 58.7416 30.4568 178.4185 89 K 4.0230 8.1319 118.0729 58.7147 32.4150 177.0976 90 K 4.2434 7.6563 117.4664 55.1148 33.5104 175.2693 91 A 4.6128 7.5042 125.1712 51.0593 21.8309 175.6121 92 F 4.8182 9.1833 120.5887 55.6864 42.2013 176.2469 93 R 4.4605 8.7482 116.7370 57.1348 30.9724 177.2953 94 G 4.1267 7.6882 103.1075 41.4399 0.0000 172.9680 95 L 3.4751 6.6566 123.1125 58.0118 42.1506 179.3394 96 T 4.0666 7.7192 115.1338 66.9518 68.4358 175.9758 97 E 3.9990 8.1152 119.5761 59.5372 29.2906 178.9837 98 L 3.0406 7.6202 120.0088 57.6257 41.6420 179.3056 99 V 3.5058 7.4841 118.0147 65.7850 31.5016 177.6658 100 E 4.9038 8.5626 117.0575 57.4793 29.4608 178.1195 101 F 4.5389 8.0521 121.4550 60.7281 40.1551 177.0282 102 Y 4.2221 7.5415 116.0195 61.1916 37.6926 178.5138 103 Q 4.2345 7.6794 120.0327 57.6007 28.5168 178.4047 104 Q 4.4808 7.7315 117.2718 54.8130 30.3401 175.0239 105 N 4.6389 6.9285 116.7678 50.8715 39.6216 174.8693 106 S 4.0576 8.5074 120.0344 58.7327 63.4879 175.8619 107 L 4.0397 7.9600 125.2764 56.7814 41.6786 179.4592 108 K 4.3971 7.9593 117.4119 59.0514 32.7054 178.5351 109 D 4.2846 8.2594 118.8539 57.3175 41.3407 176.8413 110 C 4.2428 8.0621 114.0733 61.6897 29.3980 174.9601 111 F 4.9784 8.0987 121.0820 55.7353 37.0974 176.8555 112 K 4.5466 7.8700 121.5558 60.2288 33.3471 178.6862 113 S 4.1957 8.3909 113.1621 61.1380 61.8933 174.8725 114 L 4.3241 8.3963 126.3199 54.2129 39.9243 176.5016 115 D 4.4171 7.8776 126.6534 54.1125 41.1467 176.5499 116 T 4.3507 7.0254 111.1066 60.9384 70.6701 171.7699 117 T 4.4273 7.7580 118.9366 59.1331 70.1915 172.2434 118 L 3.5860 7.9421 123.9414 55.2646 41.0342 177.4615 119 Q 3.8831 8.4692 122.9775 57.4181 29.5140 176.4870 120 F 5.3398 7.7718 115.4148 55.1298 43.2861 173.9617 121 P 2.9700 0.0000 0.0000 62.0276 32.5686 175.1557 122 F 4.3221 8.7230 118.7096 61.4831 39.1590 177.5952 123 K 3.7025 7.5532 119.3114 56.9911 32.5178 176.3667 124 E 4.6908 7.3145 117.5330 54.7134 33.5621 174.8254 125 P 4.7129 0.0000 0.0000 62.4298 32.7069 174.2458 126 E 4.7962 8.5788 116.0798 54.9380 32.0809 174.2310 127 K 4.5495 7.9833 115.9463 56.2197 35.3998 175.0714 128 R 3.4933 8.4901 116.1510 60.3145 28.4296 176.0069 129 T 3.5198 8.0082 107.4888 64.1854 66.2474 173.2938 130 I 3.9415 7.3268 122.0592 61.0494 38.8158 174.8595 131 S 4.6157 8.2668 121.8547 57.5823 66.6844 174.1165 132 R 4.4532 8.2297 121.1524 54.1969 31.1844 175.9832 133 S 4.2900 8.6352 117.6115 58.1804 63.0220 174.3936 134 G 3.9833 8.1563 114.2581 42.5897 0.0000 169.6743 135 P 4.2578 0.0000 0.0000 63.8940 31.9607 177.4839 136 S 3.7238 8.7094 120.5590 59.1579 60.6376 172.1158 137 S 4.4897 8.1972 112.4407 57.0834 65.3272 173.4409 138 G 4.0229 9.1345 115.1353 45.9690 0.0000 173.4533 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 G 8.35 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 2 S 8.02 3.54 0.00 4.08 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 3 S 8.00 4.62 0.00 3.94 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 4 G 8.28 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 5 S 8.59 4.26 0.00 3.98 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 6 S 8.14 4.77 0.00 3.87 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 7 G 7.95 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 0.00 0.00 0.00 0.00 8 K 8.41 4.31 0.00 1.83 1.88 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.29 1.34 7.81 9 A 8.00 3.70 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 10 E 8.14 4.23 0.00 1.98 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 2.49 2.25 0.00 11 A 8.08 4.06 1.21 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 0.00 0.00 12 E 8.85 4.28 0.00 1.92 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 2.16 2.24 0.00 13 Q 8.13 4.10 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.91 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 14 N 7.93 3.78 0.00 1.97 1.42 0.00 0.00 6.83 7.55 0.00 0.00 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 W 7.81 4.62 0.00 3.18 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 W 7.20 4.99 0.00 3.36 3.33 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 17 E 8.29 4.61 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 2.33 2.42 0.00 18 G 8.36 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 19 P 0.00 4.29 0.00 2.00 1.95 0.00 3.39 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.21 0.00 20 P 0.00 4.43 0.00 2.16 2.11 0.00 3.77 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 21 Q 7.84 3.65 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.77 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 22 D 8.31 4.34 0.00 2.58 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 L 8.07 3.90 0.00 1.34 1.69 1.29 0.73 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 24 S 7.92 3.84 0.00 3.50 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 25 V 7.66 3.50 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 0.47 0.00 0.00 0.55 0.00 0.00 26 H 7.87 4.09 0.00 2.37 1.56 0.00 5.62 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 L 8.09 4.21 0.00 1.76 1.90 1.05 0.81 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 28 W 6.89 5.67 0.00 3.27 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 29 Y 8.85 5.29 0.00 2.82 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 30 A 8.28 3.70 1.13 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 0.00 0.00 31 G 7.85 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 32 P 0.00 4.53 0.00 2.19 2.18 0.00 3.80 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 33 M 7.26 3.60 0.00 1.89 1.91 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.43 0.00 34 E 8.49 4.40 0.00 2.23 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 0.00 2.34 2.35 0.00 35 R 8.57 3.79 0.00 1.90 1.92 0.00 3.17 0.00 0.00 3.31 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.77 0.00 36 A 8.13 4.11 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 37 G 8.18 3.61 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 0.00 0.00 0.00 38 A 7.89 3.91 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 E 8.52 3.90 0.00 2.14 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.60 0.00 40 S 8.24 4.14 0.00 4.04 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 41 I 7.27 3.74 2.15 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.99 1.12 0.00 0.00 42 L 7.95 4.39 0.00 1.65 1.82 0.90 0.85 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 43 A 8.18 4.35 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 44 N 8.53 4.52 0.00 2.80 2.90 0.00 0.00 7.26 7.67 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 45 R 7.58 4.23 0.00 2.01 1.97 0.00 3.22 0.00 0.00 3.46 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00 46 S 8.36 4.33 0.00 3.87 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 8.61 4.61 0.00 2.86 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 48 G 8.41 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 0.00 0.00 0.00 49 T 8.00 4.96 4.35 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 1.39 0.00 0.00 50 F 8.91 5.86 0.00 2.85 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 51 L 8.01 4.27 0.00 1.74 1.83 0.92 0.42 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 52 V 8.33 4.91 2.58 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 1.09 0.00 0.00 0.42 0.00 0.00 53 R 9.39 5.67 0.00 1.87 2.00 0.00 3.10 0.00 0.00 3.24 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.44 0.00 54 Q 8.66 5.08 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.90 0.00 0.00 0.00 0.00 0.00 2.09 2.00 0.00 55 R 8.34 4.40 0.00 1.86 1.78 0.00 3.31 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 56 V 8.27 3.96 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 0.77 0.00 0.00 0.92 0.00 0.00 57 K 8.15 3.92 0.00 1.73 1.90 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.50 7.81 58 D 7.67 4.70 0.00 2.55 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 A 8.99 3.95 1.27 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 0.00 0.00 60 A 7.57 4.24 1.21 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 0.00 0.00 61 E 7.20 4.61 0.00 2.10 1.69 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 2.27 2.42 0.00 62 F 8.60 5.69 0.00 3.36 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 63 A 9.59 5.65 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 64 I 8.48 5.06 1.83 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 1.08 2.14 0.86 0.00 0.00 65 S 8.60 5.05 0.00 3.87 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 66 I 8.37 5.65 1.91 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 1.30 1.98 0.82 0.00 0.00 67 K 8.57 4.66 0.00 1.93 1.70 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.63 1.55 7.81 68 Y 9.50 4.58 0.00 2.91 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 69 N 8.51 3.69 0.00 1.44 2.29 0.00 0.00 6.79 7.55 0.00 0.00 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 V 7.79 3.47 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.85 0.00 0.00 71 E 7.49 4.63 0.00 1.92 1.73 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 2.18 2.34 0.00 72 V 8.26 4.27 2.31 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 0.68 0.00 0.00 0.99 0.00 0.00 73 K 8.86 4.75 0.00 1.64 1.63 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.68 7.81 74 H 8.44 5.44 0.00 2.90 3.13 0.00 5.66 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 I 8.33 4.53 1.89 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 0.09 0.36 1.15 0.00 0.00 76 K 8.73 4.60 0.00 1.80 1.78 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.50 7.81 77 I 8.99 4.50 2.17 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.86 1.14 0.00 0.00 78 M 9.11 4.96 0.00 1.96 2.20 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.52 0.00 79 T 8.42 5.15 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 1.11 0.00 0.00 80 A 8.44 4.46 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 81 E 9.91 3.95 0.00 2.04 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 2.22 2.22 0.00 82 G 8.17 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 83 L 7.34 4.97 0.00 1.65 1.64 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 84 Y 8.65 5.81 0.00 2.94 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 85 R 8.77 5.33 0.00 2.14 2.17 0.00 3.16 0.00 0.00 3.43 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 86 I 8.93 4.55 2.18 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.79 1.13 0.00 0.00 87 T 7.66 4.81 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 1.10 0.00 0.00 88 E 8.66 4.22 0.00 2.10 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 2.26 2.32 0.00 89 K 8.13 4.02 0.00 1.74 1.87 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.41 7.81 90 K 7.66 4.24 0.00 1.58 1.66 0.00 0.74 0.00 0.00 1.32 0.00 0.00 2.97 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.11 0.69 7.81 91 A 7.50 4.61 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.18 4.82 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 93 R 8.75 4.46 0.00 1.96 2.09 0.00 3.11 0.00 0.00 3.30 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.73 0.00 94 G 7.69 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 0.00 0.00 0.00 95 L 6.66 3.48 0.00 0.93 1.04 0.69 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 96 T 7.72 4.07 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 1.32 0.00 0.00 97 E 8.12 4.00 0.00 2.18 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 0.00 2.42 2.36 0.00 98 L 7.62 3.04 0.00 1.11 1.43 0.52 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 99 V 7.48 3.51 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 0.58 0.00 0.00 0.24 0.00 0.00 100 E 8.56 4.90 0.00 2.10 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 0.00 2.54 2.50 0.00 101 F 8.05 4.54 0.00 3.27 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 0.00 102 Y 7.54 4.22 0.00 2.99 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 0.00 103 Q 7.68 4.23 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.96 0.00 0.00 0.00 0.00 0.00 2.19 2.41 0.00 104 Q 7.73 4.48 0.00 1.88 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.80 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 105 N 6.93 4.64 0.00 2.32 2.58 0.00 0.00 5.19 5.12 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 0.00 106 S 8.51 4.06 0.00 3.82 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 0.00 107 L 7.96 4.04 0.00 1.72 1.68 0.30 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 108 K 7.96 4.40 0.00 2.10 2.02 0.00 1.63 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.38 7.81 109 D 8.26 4.28 0.00 2.76 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 0.00 110 C 8.06 4.24 0.00 2.55 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 0.00 0.00 0.00 0.00 111 F 8.10 4.98 0.00 3.10 2.87 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 0.00 112 K 7.87 4.55 0.00 1.90 1.99 0.00 1.23 0.00 0.00 0.61 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.50 1.51 7.81 113 S 8.39 4.20 0.00 3.91 4.01 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 0.00 114 L 8.40 4.32 0.00 1.88 1.47 0.87 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 115 D 7.88 4.42 0.00 2.62 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 0.00 116 T 7.03 4.35 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 0.52 0.00 0.00 117 T 7.76 4.43 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 1.07 0.00 0.00 118 L 7.94 3.59 0.00 1.05 0.13 0.05 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 119 Q 8.47 3.88 0.00 1.23 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.19 6.80 0.00 0.00 0.00 0.00 0.00 2.07 2.24 0.00 120 F 7.77 5.34 0.00 3.12 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 0.00 121 P 0.00 2.97 0.00 2.42 2.24 0.00 4.04 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 2.14 2.22 0.00 122 F 8.72 4.32 0.00 2.96 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 K 7.55 3.70 0.00 1.93 1.69 0.00 1.87 0.00 0.00 1.76 0.00 0.00 3.38 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.80 7.81 124 E 7.31 4.69 0.00 1.90 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 125 P 0.00 4.71 0.00 2.37 2.48 0.00 3.70 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 2.01 1.91 0.00 126 E 8.58 4.80 0.00 2.13 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 0.00 2.25 2.27 0.00 127 K 7.98 4.55 0.00 1.97 1.92 0.00 1.56 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.51 7.81 128 R 8.49 3.49 0.00 1.94 2.03 0.00 3.40 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.70 0.00 129 T 8.01 3.52 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 1.22 0.00 0.00 130 I 7.33 3.94 2.08 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 1.03 0.95 0.00 0.00 131 S 8.27 4.62 0.00 3.88 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 0.00 132 R 8.23 4.45 0.00 1.78 1.87 0.00 3.39 0.00 0.00 3.16 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 133 S 8.64 4.29 0.00 3.84 3.78 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 0.00 134 G 8.16 3.98 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 0.00 0.00 0.00 135 P 0.00 4.26 0.00 2.19 2.09 0.00 3.94 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 136 S 8.71 3.72 0.00 3.95 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 0.00 137 S 8.20 4.49 0.00 3.84 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 0.00 138 G 9.13 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 0.00 0.00 0.00