NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3340 8.2493 123.5818 50.8877 20.8223 176.7800 2 K 4.1779 7.5679 112.8237 55.3477 34.9164 174.2041 3 K 4.3828 8.3041 124.2080 55.1023 34.8790 176.6639 4 V 4.5094 7.8648 122.3096 58.9231 34.5493 175.2528 5 Q 3.9854 8.4175 118.8779 57.1835 28.6200 175.6785 6 A 3.8789 8.8016 120.6410 53.8867 18.9897 177.2714 7 Y 3.4791 8.1366 120.7034 58.5405 36.6059 169.8549 8 V 4.1959 8.0015 116.3552 59.8789 34.1449 175.1431 9 K 5.0838 8.0198 120.9711 54.7960 35.7350 175.6731 10 L 4.3273 8.4373 121.2206 55.1023 44.1437 174.0225 11 Q 4.8965 8.7689 121.0608 54.6403 29.4195 175.0209 12 V 4.5278 7.9768 123.5006 59.0839 34.5639 175.2624 13 A 3.9299 8.7770 123.7295 52.4589 18.5330 176.4068 14 A 3.8217 8.3556 120.5479 53.7204 19.0890 179.2565 15 G 4.2569 7.2828 107.2882 41.0000 0.0000 171.9348 16 M 4.1689 7.5136 115.9700 55.3879 35.3032 173.4331 17 A 4.2090 8.5338 126.6046 52.3999 21.6882 175.1192 18 N 4.6287 9.1569 117.0774 53.0286 38.2384 173.1131 19 P 4.3241 0.0000 0.0000 62.7348 31.9562 176.7327 20 S 4.0170 8.6104 117.1580 61.1685 62.7353 173.5407 21 P 4.3893 0.0000 0.0000 65.3773 31.3497 176.1871 22 P 4.4498 0.0000 0.0000 65.2805 32.8774 177.2891 23 V 4.2061 7.5110 113.6004 61.3534 32.7056 181.1507 24 G 3.8353 9.4787 108.5749 45.3051 0.0000 172.9819 25 P 4.1757 0.0000 0.0000 66.2643 31.1687 175.6725 26 A 3.8253 7.8736 117.5564 55.8093 18.3845 178.7948 27 L 4.1270 7.5537 116.3706 57.0123 41.2381 179.2360 28 G 3.6355 8.2049 107.7333 47.9098 0.0000 175.6772 29 Q 3.9869 7.5557 119.3674 59.0725 28.8424 178.5048 30 Q 4.1384 7.5252 117.4535 57.7776 28.6542 177.6367 31 G 4.1433 7.1978 107.6150 45.3211 0.0000 174.1227 32 V 3.4491 7.3842 118.3995 62.3751 32.2684 176.5015 33 N 4.7535 8.2992 122.5640 52.1119 38.4606 175.8601 34 I 3.5308 8.2384 124.8729 64.9598 37.2860 176.9639 35 M 3.9459 8.1021 117.6933 59.1162 32.1007 177.8415 36 E 3.9813 8.4395 118.4452 59.5988 29.5006 178.5992 37 F 4.4074 8.5429 120.1193 61.4829 39.5588 176.1043 38 C 4.0978 8.3745 118.5744 62.8706 31.1615 176.0031 39 K 3.9698 8.1425 119.3172 59.1764 31.5638 179.2616 40 A 4.0579 8.4303 121.5041 55.5422 18.4148 179.0124 41 F 4.1465 8.7580 120.0943 61.5703 39.4825 176.8428 42 N 4.6534 8.4772 116.7093 54.9673 38.1866 177.2096 43 A 4.0171 7.5440 122.5243 55.3142 18.6014 179.8645 44 K 3.9476 7.6895 116.3557 59.2604 32.1581 179.5172 45 T 3.8115 7.5881 109.6296 63.7268 68.1446 176.2527 46 D 4.2366 7.3824 121.8927 57.5901 40.9900 177.7785 47 S 4.1887 7.8169 113.5349 61.4772 63.0919 175.1200 48 I 3.7813 7.2524 118.5309 60.2000 38.2545 174.9559 49 E 3.8449 8.7873 123.6452 56.9622 29.5150 177.0687 50 K 4.2119 8.5018 123.6005 57.1602 32.9509 177.6783 51 G 3.9372 9.0024 110.6196 45.0596 0.0000 172.7231 52 L 4.8027 7.2421 120.5134 51.7794 44.0366 174.0345 53 P 4.5618 0.0000 0.0000 63.1591 31.8123 175.4315 54 I 4.6512 8.1576 125.9274 58.0872 40.3876 173.1121 55 P 4.7984 0.0000 0.0000 62.6821 32.6693 175.4936 56 V 4.8562 9.0877 124.0182 59.7505 35.0790 174.7776 57 V 4.3113 8.1745 122.4451 61.3757 33.3001 174.2575 58 I 4.6321 7.9954 129.9042 60.4921 39.1291 175.0081 59 T 4.5597 8.8087 121.4774 60.2821 69.6141 173.1660 60 V 4.2894 8.2612 128.4267 61.8454 33.1712 174.2576 61 Y 4.8818 8.0772 122.2612 55.7554 40.4851 176.7316 62 A 4.1801 8.7060 122.8188 55.4717 18.4407 178.5880 63 D 4.4040 8.1326 114.0486 55.7214 41.3772 177.3356 64 R 4.1747 8.6206 116.3715 56.4211 29.0188 176.0427 65 S 4.6457 7.8016 113.3916 58.2301 63.3135 171.7771 66 F 5.1741 7.6061 115.6787 56.3371 40.0639 172.9140 67 T 5.0606 8.5388 108.9514 60.4124 72.6459 172.4726 68 F 5.7375 7.9457 115.0153 56.3505 40.5001 173.6903 69 V 4.3697 8.5693 114.5303 60.0254 33.8841 174.4308 70 T 4.7635 8.6964 121.0733 61.0736 67.7435 174.0135 71 K 4.6079 8.1817 132.0399 56.4439 32.6527 175.5995 72 T 4.6115 8.2860 118.7498 60.1641 69.1716 173.3703 73 P 4.4944 0.0000 0.0000 62.2657 31.9137 174.8536 74 P 4.3333 0.0000 0.0000 63.0692 33.1604 177.5509 75 A 3.9825 8.5709 122.0153 55.1609 18.4136 179.9983 76 A 3.9295 8.0007 118.8567 55.3330 18.4932 179.8449 77 V 3.4900 7.7118 115.9898 66.2837 31.7325 177.8789 78 L 4.0177 8.0355 118.6952 58.0517 41.4029 179.6960 79 L 4.0277 8.3819 119.1522 57.4738 41.4674 179.6979 80 K 3.9654 7.9723 118.5990 59.3336 31.9412 179.4224 81 K 3.9127 8.1098 118.3463 59.4584 31.8252 178.9472 82 A 3.9650 7.8793 119.3521 55.5360 18.3827 179.4162 83 A 4.2870 8.2834 117.7063 53.1074 18.4209 178.6818 84 G 3.8176 8.0045 105.1034 45.9467 0.0000 173.4126 85 I 4.4122 7.5801 112.3710 59.0787 39.6044 175.6094 86 K 4.2288 8.4552 119.8574 57.8075 32.7960 176.4801 87 S 4.7059 7.5832 110.4229 55.9810 66.1080 173.8609 88 G 3.9179 8.3648 110.7179 45.4448 0.0000 173.1180 89 S 4.4569 8.1666 111.5939 57.6968 64.0044 175.4094 90 G 4.0900 8.3455 114.4575 45.5140 0.0000 174.4635 91 K 4.5426 7.2585 119.2818 52.4080 31.9587 173.8251 92 P 4.8529 0.0000 0.0000 63.3709 32.4795 175.8918 93 N 4.9022 8.9664 121.0866 53.9161 37.4047 176.1363 94 K 4.0472 7.8345 117.3031 58.5994 32.4276 176.4197 95 D 4.7791 7.8056 116.7704 51.9084 43.4989 174.3787 96 K 4.5544 8.6499 126.1128 56.3125 33.6830 176.8866 97 V 4.0314 8.1710 116.6318 62.8637 32.8788 175.6376 98 G 4.2970 7.6398 106.1644 45.4313 0.0000 171.7659 99 K 5.3831 8.3809 117.6318 55.5314 36.1076 175.8927 100 I 4.9411 8.9417 121.5639 59.6563 41.7376 175.3672 101 S 5.3667 9.0988 120.5556 57.5116 63.7617 175.6442 102 R 3.9504 8.6035 120.6481 59.1917 29.7672 179.3189 103 A 4.1616 7.9166 120.3766 55.2027 18.4459 179.3057 104 Q 4.1718 7.6957 117.8804 58.6822 28.8659 179.1561 105 L 4.0163 7.6957 119.5928 58.1444 41.5863 179.7568 106 Q 4.0922 7.9219 117.9383 58.9213 28.2333 178.6760 107 E 3.9775 8.0485 119.5199 59.4912 29.4649 179.4926 108 I 3.8264 8.2635 120.1348 64.2202 37.1533 178.3601 109 A 4.0624 8.5408 122.0934 55.0811 17.9224 179.5085 110 Q 3.9422 8.0037 117.6570 59.4330 29.1799 178.2516 111 T 4.0405 7.6623 116.0273 66.6512 68.8424 176.7017 112 K 4.1650 8.7759 119.5978 58.1729 32.0947 179.4156 113 A 3.9247 7.7488 122.1406 55.1563 18.1344 179.1806 114 A 3.9593 8.0265 118.3439 55.4713 18.4268 178.3729 115 D 4.6162 8.2787 113.2993 55.5751 41.4919 176.7676 116 M 4.4793 7.3420 118.3766 54.3351 33.1650 176.3756 117 T 4.0655 8.7006 115.7004 64.0102 68.0291 174.9780 118 G 3.8629 7.7593 108.2918 44.9838 0.0000 173.4476 119 A 4.1148 8.7967 128.5555 54.3059 19.0770 177.1612 120 D 5.0675 7.6195 113.9741 50.6910 43.9695 176.6266 121 I 3.7075 8.1867 113.3466 64.1877 37.3068 177.9044 122 E 3.9019 8.2797 119.5592 59.1422 29.3734 178.9352 123 A 3.9847 8.8800 120.8291 55.4964 18.4672 179.5629 124 M 4.0010 7.9130 116.7943 58.9674 32.0755 178.9814 125 T 3.8778 8.4514 116.1010 66.8948 68.6091 176.6037 126 R 4.0717 8.2600 120.4989 59.3836 29.7783 178.5642 127 S 4.1357 8.1120 115.1245 61.8073 62.7291 176.8032 128 I 3.6918 7.7040 121.8999 64.1512 36.8008 178.1885 129 E 4.0549 8.2484 119.8011 59.3962 29.0175 179.6524 130 G 3.6025 8.1253 105.3301 47.7684 0.0000 175.5948 131 T 4.0824 7.4824 111.6328 64.4697 68.8947 176.8193 132 A 3.9871 8.1978 123.8902 55.0694 18.2814 179.8516 133 R 3.9355 8.1043 114.9738 58.7173 30.1603 178.6010 134 S 4.4714 7.6776 113.0389 59.7231 63.5480 175.1009 135 M 4.4469 8.1586 120.7266 54.3740 32.3667 176.8974 136 G 3.7154 8.0077 107.4506 46.0528 0.0000 172.4761 137 L 4.9277 7.7434 119.5419 52.5948 43.0499 176.8176 138 V 3.9501 8.4719 124.7467 62.5614 33.2543 174.9736 139 V 5.5735 8.4620 124.0735 60.1874 34.0256 174.1920 140 E 4.5711 8.6634 126.4898 54.4931 31.6560 175.7338 141 D 4.4587 8.6576 123.0491 54.3481 41.3812 175.5508 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 A 8.25 4.33 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 2 K 7.57 4.18 0.00 1.90 1.76 0.00 1.58 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.31 1.46 7.81 3 K 8.30 4.38 0.00 1.69 1.75 0.00 1.58 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.49 7.81 4 V 7.86 4.51 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 0.78 0.00 0.00 0.93 0.00 0.00 5 Q 8.42 3.99 0.00 2.46 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.61 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 6 A 8.80 3.88 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 7 Y 8.14 3.48 0.00 3.06 2.91 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 8 V 8.00 4.20 1.91 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 0.57 0.00 0.00 0.66 0.00 0.00 9 K 8.02 5.08 0.00 1.54 1.61 0.00 1.89 0.00 0.00 1.79 0.00 0.00 3.06 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.25 1.37 7.81 10 L 8.44 4.33 0.00 1.63 1.58 0.75 0.58 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 11 Q 8.77 4.90 0.00 1.94 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.81 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 12 V 7.98 4.53 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 0.20 0.00 0.00 0.91 0.00 0.00 13 A 8.78 3.93 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.36 3.82 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 15 G 7.28 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 0.00 0.00 0.00 0.00 16 M 7.51 4.17 0.00 1.94 1.90 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 17 A 8.53 4.21 1.15 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 0.00 0.00 18 N 9.16 4.63 0.00 2.74 3.31 0.00 0.00 6.97 7.69 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 19 P 0.00 4.32 0.00 2.20 1.96 0.00 3.66 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 20 S 8.61 4.02 0.00 3.81 3.87 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 21 P 0.00 4.39 0.00 2.06 2.09 0.00 3.72 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 22 P 0.00 4.45 0.00 2.02 2.09 0.00 3.66 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 23 V 7.51 4.21 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 0.96 0.00 0.00 0.91 0.00 0.00 24 G 9.48 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.18 0.00 2.13 2.12 0.00 3.96 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 2.10 2.16 0.00 26 A 7.87 3.83 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 27 L 7.55 4.13 0.00 1.53 1.62 0.25 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 28 G 8.20 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.56 3.99 0.00 1.93 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.91 0.00 0.00 0.00 0.00 0.00 2.29 2.77 0.00 30 Q 7.53 4.14 0.00 1.97 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.39 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 31 G 7.20 4.14 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 0.00 32 V 7.38 3.45 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 -0.49 0.00 0.00 0.58 0.00 0.00 33 N 8.30 4.75 0.00 3.21 2.93 0.00 0.00 6.86 7.27 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 34 I 8.24 3.53 1.89 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.95 0.93 0.00 0.00 35 M 8.10 3.95 0.00 2.18 2.12 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.72 0.00 36 E 8.44 3.98 0.00 2.22 2.42 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 2.47 2.45 0.00 37 F 8.54 4.41 0.00 3.33 3.19 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 38 C 8.37 4.10 0.00 3.10 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 39 K 8.14 3.97 0.00 1.85 1.85 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.61 7.81 40 A 8.43 4.06 1.65 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 41 F 8.76 4.15 0.00 1.51 2.36 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 42 N 8.48 4.65 0.00 2.82 2.80 0.00 0.00 6.55 8.06 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 43 A 7.54 4.02 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 44 K 7.69 3.95 0.00 1.89 1.82 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.44 7.81 45 T 7.59 3.81 3.89 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 -0.21 0.00 0.00 46 D 7.38 4.24 0.00 2.71 2.73 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 47 S 7.82 4.19 0.00 3.95 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 48 I 7.25 3.78 1.82 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 1.29 0.74 0.89 0.00 0.00 49 E 8.79 3.84 0.00 2.03 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 2.32 0.00 50 K 8.50 4.21 0.00 1.73 1.71 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.15 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.39 1.50 7.81 51 G 9.00 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 0.00 0.00 0.00 52 L 7.24 4.80 0.00 1.84 1.60 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 53 P 0.00 4.56 0.00 2.10 2.11 0.00 3.73 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 54 I 8.16 4.65 1.96 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.32 1.20 0.00 0.00 55 P 0.00 4.80 0.00 2.18 2.20 0.00 3.75 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.00 0.00 56 V 9.09 4.86 2.40 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 0.53 0.00 0.00 1.31 0.00 0.00 57 V 8.17 4.31 1.99 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 0.32 0.00 0.00 0.92 0.00 0.00 58 I 8.00 4.63 1.41 0.00 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 -0.10 0.56 0.00 0.00 59 T 8.81 4.56 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 1.24 0.00 0.00 60 V 8.26 4.29 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 0.96 0.00 0.00 0.73 0.00 0.00 61 Y 8.08 4.88 0.00 3.12 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 62 A 8.71 4.18 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 D 8.13 4.40 0.00 2.72 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 64 R 8.62 4.17 0.00 2.07 2.35 0.00 3.26 0.00 0.00 3.19 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.80 0.00 65 S 7.80 4.65 0.00 4.21 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 66 F 7.61 5.17 0.00 3.04 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 T 8.54 5.06 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 1.40 0.00 0.00 68 F 7.95 5.74 0.00 3.19 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 V 8.57 4.37 2.14 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 0.91 0.00 0.00 1.01 0.00 0.00 70 T 8.70 4.76 4.52 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 1.27 0.00 0.00 71 K 8.18 4.61 0.00 1.93 2.13 0.00 1.96 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.51 1.43 7.81 72 T 8.29 4.61 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 1.30 0.00 0.00 73 P 0.00 4.49 0.00 2.24 2.20 0.00 3.87 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 2.01 2.03 0.00 74 P 0.00 4.33 0.00 2.19 2.05 0.00 3.67 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.20 0.00 75 A 8.57 3.98 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 76 A 8.00 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 77 V 7.71 3.49 2.25 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 1.08 0.00 0.00 0.94 0.00 0.00 78 L 8.04 4.02 0.00 1.89 1.72 0.98 0.52 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 79 L 8.38 4.03 0.00 1.85 1.72 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 80 K 7.97 3.97 0.00 2.05 2.03 0.00 1.68 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.74 7.81 81 K 8.11 3.91 0.00 1.95 1.86 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.68 7.81 82 A 7.88 3.96 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 83 A 8.28 4.29 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 84 G 8.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 I 7.58 4.41 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 1.43 0.71 0.91 0.00 0.00 86 K 8.46 4.23 0.00 1.76 1.90 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.39 1.41 7.81 87 S 7.58 4.71 0.00 3.76 3.69 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 88 G 8.36 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 89 S 8.17 4.46 0.00 4.20 4.10 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 0.00 0.00 0.00 90 G 8.35 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 91 K 7.26 4.54 0.00 1.83 1.72 0.00 1.59 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.47 7.81 92 P 0.00 4.85 0.00 2.03 2.09 0.00 3.79 0.00 0.00 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.10 0.00 93 N 8.97 4.90 0.00 2.90 3.03 0.00 0.00 6.92 7.61 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 94 K 7.83 4.05 0.00 1.72 2.03 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.37 7.81 95 D 7.81 4.78 0.00 2.60 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 K 8.65 4.55 0.00 1.97 1.80 0.00 1.62 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.45 7.81 97 V 8.17 4.03 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 0.71 0.00 0.00 0.98 0.00 0.00 98 G 7.64 4.30 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.38 5.38 0.00 1.90 1.73 0.00 1.56 0.00 0.00 1.71 0.00 0.00 2.72 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.30 1.43 7.81 100 I 8.94 4.94 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 1.29 0.57 0.95 0.00 0.00 101 S 9.10 5.37 0.00 4.01 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.60 3.95 0.00 1.89 2.03 0.00 3.29 0.00 0.00 3.34 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.79 0.00 103 A 7.92 4.16 1.31 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 0.00 0.00 0.00 104 Q 7.70 4.17 0.00 2.25 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.70 0.00 0.00 0.00 0.00 0.00 2.39 2.27 0.00 105 L 7.70 4.02 0.00 1.80 1.74 0.92 1.36 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 0.00 106 Q 7.92 4.09 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.68 0.00 107 E 8.05 3.98 0.00 2.23 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 2.33 2.64 0.00 108 I 8.26 3.83 1.99 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 1.46 0.88 0.92 0.00 0.00 109 A 8.54 4.06 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 0.00 110 Q 8.00 3.94 0.00 2.18 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.90 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 111 T 7.66 4.04 4.39 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 1.22 0.00 0.00 112 K 8.78 4.16 0.00 1.75 1.86 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.63 1.61 7.81 113 A 7.75 3.92 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 0.00 114 A 8.03 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 0.00 115 D 8.28 4.62 0.00 2.78 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 0.00 116 M 7.34 4.48 0.00 2.02 1.99 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.48 0.00 117 T 8.70 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 1.22 0.00 0.00 118 G 7.76 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 0.00 0.00 0.00 119 A 8.80 4.11 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 0.00 120 D 7.62 5.07 0.00 2.99 2.75 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 0.00 121 I 8.19 3.71 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 1.64 1.06 0.91 0.00 0.00 122 E 8.28 3.90 0.00 2.26 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 2.41 2.45 0.00 123 A 8.88 3.98 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 M 7.91 4.00 0.00 2.12 2.25 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.59 0.00 125 T 8.45 3.88 4.39 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 1.27 0.00 0.00 126 R 8.26 4.07 0.00 1.99 2.03 0.00 3.11 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 127 S 8.11 4.14 0.00 4.09 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 0.00 128 I 7.70 3.69 2.02 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 1.53 0.83 0.92 0.00 0.00 129 E 8.25 4.05 0.00 2.22 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 2.33 2.58 0.00 130 G 8.13 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 T 7.48 4.08 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 1.28 0.00 0.00 132 A 8.20 3.99 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 0.00 133 R 8.10 3.94 0.00 1.79 2.01 0.00 3.16 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.96 0.00 134 S 7.68 4.47 0.00 4.05 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 0.00 135 M 8.16 4.45 0.00 2.05 2.19 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.54 0.00 136 G 8.01 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 0.00 137 L 7.74 4.93 0.00 1.62 1.62 0.92 0.96 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 0.00 138 V 8.47 3.95 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 0.81 0.00 0.00 0.93 0.00 0.00 139 V 8.46 5.57 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 0.99 0.00 0.00 0.93 0.00 0.00 140 E 8.66 4.57 0.00 2.04 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 2.28 2.23 0.00 141 D 8.66 4.46 0.00 2.64 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 0.00 0.00 0.00 0.00