NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9703 8.3544 109.7369 45.0993 0.0000 175.0372 2 S 4.4540 8.4507 118.0984 55.8607 65.1622 170.9527 3 S 4.6826 8.2043 119.5135 56.9372 66.4740 172.6113 4 G 4.2919 8.3074 122.0313 45.5880 0.0000 174.0217 5 S 4.4319 7.5869 109.3425 57.2247 65.0419 175.5083 6 S 4.3344 8.9456 120.4644 58.4569 63.3667 172.8461 7 G 4.3682 9.0029 121.2062 46.7714 0.0000 175.2725 8 L 3.9779 7.9539 120.2202 57.5433 41.2800 179.3328 9 K 3.8335 8.1197 117.6899 60.1224 32.1585 178.1591 10 M 4.2401 8.4780 119.0208 57.8040 31.8508 178.4046 11 L 4.0593 7.7742 120.6804 58.0582 42.2980 178.7679 12 R 4.0705 8.0401 115.5968 59.5171 29.3915 177.5724 13 D 4.4574 7.6952 117.2402 57.1717 41.3431 177.9349 14 M 3.9974 8.5747 119.7821 58.5239 31.9131 178.4268 15 T 3.7652 7.8686 111.6712 64.0724 67.6689 175.6929 16 G 3.6668 7.3253 105.5860 46.7319 0.0000 174.2117 17 L 3.8909 6.9897 120.3842 53.8888 42.3553 176.6648 18 P 4.2826 0.0000 0.0000 65.1997 31.4979 176.7224 19 H 4.7354 7.4951 112.8892 55.5249 28.8793 174.9605 20 N 4.9206 7.7317 116.4455 52.8665 40.7871 176.1003 21 R 4.0422 7.9881 117.4305 58.5912 31.0176 176.3714 22 K 4.9691 7.3738 114.5422 54.1097 35.4465 175.8301 23 C 4.5189 8.5160 122.9066 59.8649 32.4304 173.5768 24 F 4.2897 8.8600 120.5583 58.9438 39.0596 174.6988 25 D 4.5557 7.3408 118.2692 55.8496 43.3444 177.2056 26 C 3.8173 7.5983 112.7579 58.5416 30.1560 173.4230 27 D 4.4419 6.9092 116.7505 53.5785 39.9583 172.8877 28 Q 4.0123 7.2488 117.3498 55.1019 29.3927 175.7765 29 R 5.1163 7.7191 121.8435 56.1875 28.1293 173.9090 30 G 3.0740 8.1892 118.5072 44.8202 0.0000 169.1739 31 P 4.4835 0.0000 0.0000 63.5300 32.7456 176.8869 32 T 4.7760 8.6438 114.4537 61.7755 69.4508 171.9951 33 Y 5.0923 8.9099 116.6788 56.5651 43.4335 174.2440 34 V 4.6329 8.4403 113.3352 59.7576 36.3366 174.1032 35 N 4.9748 9.0182 125.1439 53.3615 39.1831 175.6671 36 M 4.1622 9.3269 127.2986 58.6276 32.3028 178.4275 37 T 4.0496 8.8548 115.7997 66.3911 68.9748 176.4773 38 V 3.7368 7.8075 120.1864 63.8788 31.8297 176.1756 39 G 3.6851 8.2568 107.5317 46.5676 0.0000 172.6453 40 S 5.0469 7.7701 113.7329 56.1903 66.9694 172.2730 41 F 4.9743 9.1475 118.7050 56.4494 40.1965 175.7551 42 V 4.6220 8.4337 119.1523 59.8704 35.2120 174.0281 43 C 5.2366 8.1758 115.3709 56.8264 32.6238 174.8441 44 T 3.1082 8.4778 111.4827 64.6280 67.0421 176.0603 45 S 4.1132 7.9088 116.1934 61.7750 63.1180 175.9799 46 C 4.2568 7.9809 118.7330 63.0261 28.1147 176.0870 47 S 4.0821 8.3128 116.4075 61.7808 62.0130 177.0946 48 G 3.5386 7.3705 108.2028 47.1615 0.0000 175.7184 49 S 4.2455 8.3405 117.8123 61.4186 62.8782 176.4324 50 L 3.8791 7.9095 121.1397 58.2096 41.1612 179.5865 51 R 3.9862 7.3094 115.6008 59.5680 30.1348 178.7193 52 G 3.9418 8.0635 104.1852 47.0632 0.0000 173.5607 53 L 4.2512 7.4285 119.6981 54.6280 42.3145 175.9057 54 N 4.9763 8.5657 117.4686 51.2659 41.4166 172.4050 55 P 4.4419 0.0000 0.0000 61.5517 32.2120 174.2055 56 P 4.4385 0.0000 0.0000 62.8376 31.3573 176.2240 57 H 4.3042 8.6854 121.0482 55.7786 29.5048 174.1669 58 R 4.6496 8.1671 117.3022 54.9604 32.3021 175.8508 59 V 5.0647 8.4835 116.7824 59.5903 35.4829 175.5976 60 K 4.6300 8.8820 122.2337 54.6812 36.3617 176.0783 61 S 3.1025 8.4994 119.6767 58.8225 62.4325 173.8929 62 I 4.3033 7.9668 124.5322 63.0591 37.2435 177.2833 63 S 4.5384 7.9417 114.3910 59.4904 64.3401 174.9366 64 M 4.1643 7.8187 119.1214 57.2331 32.3795 175.7055 65 T 4.4643 7.3385 113.1163 61.8601 72.3116 172.9709 66 T 4.4196 7.7533 118.2293 60.9604 69.2858 173.1489 67 F 4.8822 8.1681 120.0410 55.5345 43.1063 174.0533 68 T 4.6472 8.4795 115.7554 59.9804 70.9660 174.5259 69 Q 3.9591 8.6657 123.4578 59.5485 28.8954 178.3182 70 Q 3.9778 8.2027 117.8534 59.6064 28.1560 179.1887 71 E 4.0983 8.0386 119.4759 59.2401 29.9684 178.2997 72 I 3.7027 8.2497 120.0184 64.9328 37.2873 177.9361 73 E 4.0080 8.4642 118.8689 59.7048 29.1871 179.3858 74 F 4.2552 7.8712 119.7656 61.4530 39.3700 177.1998 75 L 3.7828 8.3568 118.6886 57.5481 41.2242 179.4799 76 Q 3.9992 8.4574 118.1254 58.6675 28.8195 178.4424 77 K 4.1064 8.4726 118.4225 59.7956 31.8388 176.8271 78 H 4.4764 7.8191 116.3807 51.9943 30.0294 174.3394 79 G 4.0177 8.2030 112.2895 44.9941 0.0000 174.0135 80 N 4.5818 8.4089 115.2800 55.3463 38.4834 176.5724 81 E 3.7395 7.8837 118.1169 59.8232 30.2040 178.7878 82 V 3.9283 7.8936 111.2265 64.7507 31.9185 177.9466 83 C 3.8111 7.7179 113.8748 63.4613 28.2694 175.9063 84 K 4.4326 8.7598 119.8465 60.5371 31.9024 178.5066 85 Q 4.0374 8.2938 116.9931 59.5975 28.8516 179.7422 86 I 3.7289 8.4610 120.5061 63.7392 36.8440 177.8306 87 W 4.9978 8.8314 118.1509 57.2437 29.3284 176.9254 88 L 4.9071 7.8802 119.1828 54.3170 41.7876 178.5717 89 G 3.8724 8.7460 109.4291 48.9743 0.0000 175.5363 90 L 4.3178 8.3270 118.6550 56.3869 42.2757 177.5185 91 F 3.4430 7.5996 118.9830 58.6101 39.7866 174.5445 92 D 4.7672 8.6743 127.1540 53.2202 44.5150 176.0359 93 D 4.6587 9.0296 124.7333 56.7326 39.7397 178.7953 94 R 4.1194 8.0650 117.7787 58.8323 30.5923 177.6593 95 S 4.2486 8.0782 110.7678 61.1658 62.7567 173.9062 96 S 4.4573 8.2486 113.9809 56.9124 66.8863 171.9582 97 A 4.8870 8.2205 123.4695 50.5771 21.7557 175.0405 98 I 4.5029 7.9935 119.6098 59.0159 38.9024 175.6394 99 P 4.4752 0.0000 0.0000 62.3828 32.5426 175.1170 100 D 4.2793 8.1767 116.8671 52.6542 41.0886 175.8098 101 F 5.2459 7.7638 116.9305 57.8127 39.6365 176.9803 102 R 4.4848 8.2366 118.6928 56.4111 33.1184 176.6176 103 D 4.9530 7.9045 117.9674 51.9563 43.5543 175.8982 104 P 4.2942 0.0000 0.0000 65.9370 31.4729 178.5150 105 Q 4.0133 8.1171 118.8990 58.8966 29.0528 178.5357 106 K 4.1495 7.9456 118.8330 59.6995 32.2357 179.4740 107 V 3.6908 7.6439 118.2662 65.7084 31.2576 177.9100 108 K 4.0156 8.7731 120.2776 59.3833 31.9811 178.3863 109 E 4.1203 8.3321 117.4042 59.6921 29.2939 178.8903 110 F 4.2981 8.2989 120.6868 61.2430 39.6536 177.1625 111 L 4.0245 8.5467 118.9271 58.0499 41.3889 179.7388 112 Q 4.2499 8.2991 119.2598 58.6157 28.8442 178.5995 113 E 4.0811 7.8494 118.8599 58.3520 29.4213 178.6809 114 K 4.5105 7.5996 118.9950 57.4480 31.2765 176.1736 115 Y 4.5960 7.2559 114.1468 59.6810 39.4615 177.7268 116 E 4.2067 8.1890 118.6061 58.9437 29.8381 179.0668 117 K 4.1486 8.3730 116.2710 55.5478 33.8106 176.4554 118 K 4.6184 7.3538 114.5832 56.3938 29.4798 175.8751 119 R 3.6805 7.8970 120.2089 59.0046 30.6020 177.3348 120 W 4.6258 7.3525 117.9278 57.2945 29.6549 176.6690 121 Y 4.7964 8.1243 121.2754 56.9491 38.6475 175.1561 122 V 4.0608 8.3033 127.5485 59.9498 33.5094 173.3052 123 P 4.3592 0.0000 0.0000 61.6843 32.4380 175.8953 124 P 4.2121 0.0000 0.0000 65.7914 31.7352 178.3223 125 E 3.8314 8.0979 117.5109 58.9419 29.6424 177.7397 126 Q 4.2030 7.9530 116.9878 57.7597 30.2436 176.0908 127 A 4.0604 7.8020 120.1632 54.9660 18.3098 178.0781 128 K 4.3571 7.7602 113.1122 55.9153 33.9951 176.3008 129 S 4.6360 8.2131 114.0040 57.5795 64.5997 173.7218 130 G 4.0897 7.8107 108.8113 44.5094 0.0000 171.5638 131 P 4.1485 0.0000 0.0000 64.2002 31.4486 176.1026 132 S 4.4038 7.5403 112.8117 56.9756 63.6341 173.5974 133 S 4.5782 8.3619 125.6279 56.1126 61.8101 174.9093 134 G 3.8352 8.3118 112.3096 45.7175 0.0000 170.9954 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 3.97 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 0.00 0.00 0.00 2 S 8.45 4.45 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 3 S 8.20 4.68 0.00 3.81 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 G 8.31 4.29 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 0.00 5 S 7.59 4.43 0.00 3.94 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 6 S 8.95 4.33 0.00 3.86 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 7 G 9.00 4.37 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 0.00 8 L 7.95 3.98 0.00 1.69 1.79 0.99 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.12 3.83 0.00 1.90 1.87 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.17 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.62 7.81 10 M 8.48 4.24 0.00 2.06 2.26 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.70 0.00 11 L 7.77 4.06 0.00 1.72 1.77 0.70 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 12 R 8.04 4.07 0.00 2.01 2.11 0.00 3.12 0.00 0.00 3.16 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.69 0.00 13 D 7.70 4.46 0.00 2.78 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 14 M 8.57 4.00 0.00 1.84 2.38 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.52 0.00 15 T 7.87 3.77 4.65 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 1.38 0.00 0.00 16 G 7.33 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 17 L 6.99 3.89 0.00 1.45 0.94 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 18 P 0.00 4.28 0.00 2.13 2.13 0.00 3.48 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.90 0.00 19 H 7.50 4.74 0.00 3.25 3.42 0.00 5.47 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 N 7.73 4.92 0.00 2.67 2.54 0.00 0.00 6.75 7.30 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 21 R 7.99 4.04 0.00 1.69 1.99 0.00 3.19 0.00 0.00 3.35 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.60 0.00 22 K 7.37 4.97 0.00 1.62 1.68 0.00 1.66 0.00 0.00 1.81 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.30 7.81 23 C 8.52 4.52 0.00 3.13 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 24 F 8.86 4.29 0.00 3.03 3.09 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 25 D 7.34 4.56 0.00 2.68 2.55 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 0.00 0.00 0.00 0.00 26 C 7.60 3.82 0.00 3.02 3.11 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 27 D 6.91 4.44 0.00 2.10 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 0.00 0.00 0.00 0.00 28 Q 7.25 4.01 0.00 2.15 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.92 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 29 R 7.72 5.12 0.00 1.95 1.96 0.00 2.70 0.00 0.00 3.89 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 30 G 8.19 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 0.00 0.00 0.00 31 P 0.00 4.48 0.00 2.39 2.20 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 2.12 2.30 0.00 32 T 8.64 4.78 4.34 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 1.50 0.00 0.00 33 Y 8.91 5.09 0.00 3.02 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 34 V 8.44 4.63 1.49 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 -0.61 0.00 0.00 0.61 0.00 0.00 35 N 9.02 4.97 0.00 2.67 2.60 0.00 0.00 6.76 7.23 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 36 M 9.33 4.16 0.00 1.80 2.10 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.79 0.00 37 T 8.85 4.05 4.19 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 1.01 0.00 0.00 38 V 7.81 3.74 1.81 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 0.60 0.00 0.00 0.40 0.00 0.00 39 G 8.26 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 0.00 0.00 0.00 40 S 7.77 5.05 0.00 3.76 3.48 0.00 0.00 0.00 0.00 0.00 0.00 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 9.15 4.97 0.00 2.98 3.09 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 42 V 8.43 4.62 2.12 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 0.76 0.00 0.00 0.99 0.00 0.00 43 C 8.18 5.24 0.00 3.01 3.09 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 44 T 8.48 3.11 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 1.21 0.00 0.00 45 S 7.91 4.11 0.00 3.84 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 46 C 7.98 4.26 0.00 2.94 3.11 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 47 S 8.31 4.08 0.00 3.64 3.71 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 48 G 7.37 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.34 4.25 0.00 3.96 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 50 L 7.91 3.88 0.00 1.78 1.66 0.89 0.79 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 51 R 7.31 3.99 0.00 2.09 2.01 0.00 3.18 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.83 0.00 52 G 8.06 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 53 L 7.43 4.25 0.00 1.71 1.99 1.02 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 54 N 8.57 4.98 0.00 2.61 2.65 0.00 0.00 7.24 8.21 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 55 P 0.00 4.44 0.00 2.22 2.04 0.00 3.85 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 56 P 0.00 4.44 0.00 2.20 2.27 0.00 3.78 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 57 H 8.69 4.30 0.00 3.04 3.21 0.00 5.66 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 58 R 8.17 4.65 0.00 1.74 1.80 0.00 3.00 0.00 0.00 3.11 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 59 V 8.48 5.06 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 0.70 0.00 0.00 0.97 0.00 0.00 60 K 8.88 4.63 0.00 1.90 1.47 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.13 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.23 1.38 7.81 61 S 8.50 3.10 0.00 3.28 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 62 I 7.97 4.30 1.84 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 1.02 0.66 0.90 0.00 0.00 63 S 7.94 4.54 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 64 M 7.82 4.16 0.00 1.88 2.05 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 2.58 2.48 0.00 65 T 7.34 4.46 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 0.78 0.00 0.00 66 T 7.75 4.42 4.16 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 1.07 0.00 0.00 67 F 8.17 4.88 0.00 2.97 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 68 T 8.48 4.65 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 1.27 0.00 0.00 69 Q 8.67 3.96 0.00 2.23 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.55 0.00 0.00 0.00 0.00 0.00 2.46 2.62 0.00 70 Q 8.20 3.98 0.00 2.33 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.67 0.00 0.00 0.00 0.00 0.00 2.45 2.52 0.00 71 E 8.04 4.10 0.00 2.41 2.20 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 2.41 2.42 0.00 72 I 8.25 3.70 2.03 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 1.82 0.91 0.95 0.00 0.00 73 E 8.46 4.01 0.00 2.09 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 2.37 2.38 0.00 74 F 7.87 4.26 0.00 3.37 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 75 L 8.36 3.78 0.00 1.97 1.87 0.69 1.22 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 76 Q 8.46 4.00 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.98 0.00 0.00 0.00 0.00 0.00 2.41 2.53 0.00 77 K 8.47 4.11 0.00 1.78 1.97 0.00 1.55 0.00 0.00 1.60 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.56 1.29 7.81 78 H 7.82 4.48 0.00 3.12 3.08 0.00 5.96 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 G 8.20 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 80 N 8.41 4.58 0.00 3.11 3.13 0.00 0.00 6.60 8.08 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 81 E 7.88 3.74 0.00 1.53 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 2.03 2.17 0.00 82 V 7.89 3.93 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 0.65 0.00 0.00 1.00 0.00 0.00 83 C 7.72 3.81 0.00 3.21 3.24 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 84 K 8.76 4.43 0.00 2.20 1.97 0.00 1.31 0.00 0.00 1.21 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.27 7.81 85 Q 8.29 4.04 0.00 2.35 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.82 0.00 0.00 0.00 0.00 0.00 2.49 2.52 0.00 86 I 8.46 3.73 1.97 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 1.45 0.90 0.56 0.00 0.00 87 W 8.83 5.00 0.00 3.68 3.54 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.88 4.91 0.00 1.73 1.57 0.46 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 89 G 8.75 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 0.00 0.00 0.00 90 L 8.33 4.32 0.00 2.06 2.05 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 91 F 7.60 3.44 0.00 2.52 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 92 D 8.67 4.77 0.00 2.73 2.53 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 93 D 9.03 4.66 0.00 2.83 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 94 R 8.07 4.12 0.00 1.84 2.03 0.00 3.24 0.00 0.00 3.29 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 95 S 8.08 4.25 0.00 3.98 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 96 S 8.25 4.46 0.00 3.22 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 A 8.22 4.89 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 98 I 7.99 4.50 1.86 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.91 0.90 0.00 0.00 99 P 0.00 4.48 0.00 2.13 2.15 0.00 3.38 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 1.72 1.67 0.00 100 D 8.18 4.28 0.00 2.61 2.53 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 0.00 101 F 7.76 5.25 0.00 3.01 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 0.00 102 R 8.24 4.48 0.00 1.73 1.91 0.00 3.17 0.00 0.00 3.20 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 103 D 7.90 4.95 0.00 2.79 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 0.00 104 P 0.00 4.29 0.00 2.27 2.31 0.00 3.72 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 2.08 2.02 0.00 105 Q 8.12 4.01 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.97 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 106 K 7.95 4.15 0.00 2.08 1.86 0.00 1.75 0.00 0.00 1.75 0.00 0.00 3.13 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.67 7.81 107 V 7.64 3.69 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 1.20 0.00 0.00 1.14 0.00 0.00 108 K 8.77 4.02 0.00 1.88 2.06 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.49 7.81 109 E 8.33 4.12 0.00 2.21 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 0.00 2.66 2.51 0.00 110 F 8.30 4.30 0.00 3.27 3.29 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 0.00 111 L 8.55 4.02 0.00 2.06 1.83 1.09 1.28 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 0.00 112 Q 8.30 4.25 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.82 0.00 0.00 0.00 0.00 0.00 2.42 2.50 0.00 113 E 7.85 4.08 0.00 1.96 1.67 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 2.26 2.53 0.00 114 K 7.60 4.51 0.00 1.60 0.90 0.00 1.50 0.00 0.00 1.62 0.00 0.00 3.20 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.66 1.78 7.81 115 Y 7.26 4.60 0.00 2.98 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 0.00 116 E 8.19 4.21 0.00 2.15 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 2.43 2.44 0.00 117 K 8.37 4.15 0.00 1.71 1.75 0.00 1.82 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.44 7.81 118 K 7.35 4.62 0.00 1.97 2.12 0.00 1.66 0.00 0.00 0.97 0.00 0.00 2.73 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.65 1.59 7.81 119 R 7.90 3.68 0.00 1.01 0.66 0.00 2.64 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 1.11 0.00 120 W 7.35 4.63 0.00 3.96 3.34 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 0.00 121 Y 8.12 4.80 0.00 3.18 3.20 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 0.00 122 V 8.30 4.06 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 0.86 0.00 0.00 0.94 0.00 0.00 123 P 0.00 4.36 0.00 2.16 1.97 0.00 3.26 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.57 0.00 124 P 0.00 4.21 0.00 2.20 2.30 0.00 3.66 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.95 0.00 125 E 8.10 3.83 0.00 1.91 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 2.33 2.40 0.00 126 Q 7.95 4.20 0.00 1.91 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.85 0.00 0.00 0.00 0.00 0.00 2.21 2.35 0.00 127 A 7.80 4.06 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 0.00 128 K 7.76 4.36 0.00 1.87 1.81 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.63 1.35 7.81 129 S 8.21 4.64 0.00 3.98 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 0.00 130 G 7.81 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 0.00 131 P 0.00 4.15 0.00 2.19 2.18 0.00 3.70 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 132 S 7.54 4.40 0.00 3.88 3.76 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 0.00 133 S 8.36 4.58 0.00 3.88 3.79 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 0.00 134 G 8.31 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