NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 G 3.9471 8.3393 109.7390 45.0892 0.0000 174.5169 0 S 4.1768 7.8148 115.2948 57.6104 64.8752 173.1784 1 M 4.0685 8.9753 124.4223 58.5542 32.1560 180.1719 2 A 3.9709 7.9220 120.4204 55.1911 18.6845 179.6555 3 S 4.1234 8.2520 113.6957 61.9495 62.8745 177.1096 4 I 3.7677 8.0414 122.5697 64.1622 36.7477 178.1870 5 F 4.1078 8.6703 121.9116 61.7781 39.2488 177.2743 6 T 3.9897 8.2718 115.2389 66.6829 68.1686 176.7553 7 K 4.1425 8.1786 120.3137 59.4596 32.0717 179.5498 8 I 3.6899 7.8532 120.1852 64.4432 36.7708 178.3764 9 I 3.6630 7.2119 119.3312 64.3859 37.0310 177.3699 10 N 4.6030 7.9225 113.7960 52.6191 38.6000 175.3855 11 R 3.8850 7.6202 118.1787 57.3095 28.1972 177.3128 12 E 4.2152 8.4498 120.0357 57.6481 29.9632 177.0613 13 L 4.8336 7.3993 116.8019 51.7080 44.7163 174.4863 14 P 4.4378 0.0000 0.0000 62.6806 31.9482 176.2522 15 G 4.1619 8.3295 109.2525 44.0325 0.0000 173.2380 16 R 4.4966 8.1268 121.2657 54.3329 29.1519 175.2054 17 F 4.6997 8.6092 120.2100 57.4021 39.8304 175.8755 18 V 4.5767 8.7734 116.5775 61.6149 33.9369 175.2637 19 Y 4.8196 7.9589 120.4599 56.4405 42.2778 172.9456 20 E 5.0864 7.6361 126.2160 55.1060 31.5438 173.5827 21 D 4.8727 9.1124 125.9767 51.5701 42.6333 175.6022 22 D 4.6533 8.8377 117.5056 56.9696 40.9729 177.1858 23 D 4.9531 9.1344 117.8880 54.1402 43.4838 175.8196 24 V 5.0621 7.8414 116.3099 61.2527 35.3698 174.7406 25 V 5.4089 9.2610 119.2718 59.7685 36.1220 174.3731 26 A 5.6934 9.6076 123.2845 49.6966 22.6482 175.2792 27 F 5.0924 7.6934 115.1091 54.8426 41.6523 173.6742 28 L 4.5463 8.6777 121.2003 55.0342 41.9074 177.4304 29 T 4.1763 8.2617 118.5030 61.7486 67.8590 174.6926 30 I 3.9996 8.3213 119.5425 62.6131 38.4882 175.9825 31 E 5.3423 7.7886 119.6688 52.8079 29.5545 173.3516 32 P 4.2828 0.0000 0.0000 62.5733 32.6747 178.5907 33 M 3.7846 8.6854 122.1193 57.9335 32.3415 176.3729 34 T 4.5200 6.9917 106.2907 59.2183 72.1167 172.6131 35 Q 3.9228 8.1770 123.5486 57.6793 29.2792 176.5292 36 G 3.7420 8.6985 113.0304 44.8031 0.0000 172.6374 37 H 4.5062 8.0234 120.7410 56.9126 30.7211 174.1491 38 T 5.0434 9.3811 122.7359 61.7074 72.2664 172.9021 39 L 4.9471 8.4631 124.9739 52.9405 44.3614 175.4447 40 V 4.6873 8.5049 123.8818 61.0988 33.9104 174.5515 41 V 4.8988 9.0478 127.9660 60.3429 34.6798 172.7099 42 P 4.8890 0.0000 0.0000 62.9796 31.4480 176.7097 43 R 4.2273 9.0323 122.5808 59.3066 30.5743 177.5606 44 E 4.0309 8.2989 118.2737 56.3769 30.0554 177.1520 45 E 4.2074 8.5608 125.3850 55.6673 28.0340 175.8661 46 I 4.7032 7.4873 115.6707 59.0422 41.2945 174.3025 47 D 4.9096 8.0849 119.0550 54.1492 44.5257 172.2180 48 N 4.3722 8.6621 119.4260 52.3253 34.9708 174.7337 49 W 4.5189 8.5605 119.3369 59.5236 28.3493 179.4926 50 Q 3.1724 6.3453 114.7559 57.3695 27.9959 176.1739 51 D 4.5205 7.5898 117.1016 53.8755 41.5786 176.7908 52 V 3.8016 7.1698 119.9808 62.1854 32.3112 176.1409 53 D 4.5839 8.5403 126.2692 54.3233 42.6671 177.9879 54 S 4.2594 8.6587 117.0076 61.4425 63.2185 176.3189 55 A 4.0025 8.1671 123.7248 55.2302 18.2737 179.3190 56 A 4.0151 7.9942 118.2758 55.2315 18.5192 179.4376 57 F 4.2587 8.5640 119.3007 61.7162 39.5048 177.2022 58 N 4.2944 8.7126 116.3339 56.0372 38.2576 177.7612 59 R 3.9017 7.9149 119.3537 59.2370 30.1129 179.1843 60 V 3.5465 7.6323 117.6331 66.1382 31.5020 177.9280 61 M 3.8954 8.0959 118.9275 58.1467 31.7755 178.8655 62 G 3.5732 8.0528 105.8148 47.9925 0.0000 175.9550 63 V 3.3317 7.6195 121.0966 65.3919 31.3615 178.2501 64 S 3.9881 8.1324 115.2733 61.5512 62.5476 176.6754 65 Q 3.9050 8.0527 120.7350 58.7062 28.4611 178.5047 66 L 3.8794 7.6992 121.2707 58.2423 42.0490 179.1328 67 I 3.7770 7.9333 120.1140 64.1416 37.0056 178.4821 68 G 3.6315 8.3182 106.9896 47.9324 0.0000 175.7208 69 K 3.9316 8.3657 121.4544 59.0678 32.0553 179.3548 70 A 4.0248 8.0160 120.9638 55.2410 18.2346 180.1646 71 V 3.9475 8.2465 111.3598 64.5319 31.7437 178.5721 72 C 4.3035 8.1616 120.4086 62.8046 27.5279 177.0319 73 K 3.9747 8.1395 124.8729 59.7885 31.1327 180.8451 74 A 4.0397 8.2597 121.5543 54.0292 18.2752 178.8361 75 F 4.5533 8.0122 112.8465 55.9160 40.4003 176.0279 76 R 3.8426 7.4983 115.7104 57.7976 27.6922 176.1641 77 T 4.6907 7.5780 106.6090 59.4605 71.5724 175.3996 78 E 3.9370 8.9609 124.8535 58.6948 30.1648 176.9251 79 R 4.8077 7.7806 115.8110 54.2318 33.9760 174.7513 80 S 4.9262 8.5570 115.2988 56.4933 65.3908 173.5076 81 G 3.5886 8.2651 113.0694 44.8169 0.0000 172.2737 82 L 5.2572 8.1618 122.3260 53.1140 45.1849 175.6468 83 I 4.8244 8.8333 125.6065 59.6546 41.7167 174.1764 84 I 4.5102 8.3574 125.4721 59.8542 39.3844 173.6179 85 A 4.4495 9.1205 128.3060 50.1167 20.9040 176.5274 86 G 4.0405 8.1713 101.4543 44.8181 0.0000 174.8516 87 L 4.1424 7.5577 118.8036 56.6795 42.0692 177.6806 88 E 4.2487 8.0034 116.8063 57.0768 30.4374 176.4822 89 V 4.1605 7.0998 114.6541 60.4546 34.2107 174.2511 90 P 4.7095 0.0000 0.0000 60.8272 30.6515 175.8746 91 H 4.8446 7.4429 116.2082 54.8035 33.2355 172.0094 92 L 4.2586 8.7262 129.5584 56.4639 42.3047 176.0280 93 H 5.2001 8.6870 119.9978 54.5190 31.6267 172.6535 94 V 4.2978 8.7764 122.2054 61.5042 33.8157 174.0979 95 H 5.0705 9.1955 126.0401 55.3568 30.2821 174.5045 96 V 4.8841 8.9818 123.3853 60.9822 34.6416 174.1256 97 F 5.2445 7.9635 121.6843 54.6058 41.4420 171.9806 98 P 4.7033 0.0000 0.0000 63.2333 32.0830 175.3447 99 T 4.9337 8.6595 115.9578 60.7746 70.2164 173.6751 100 R 4.6550 9.0294 123.9030 55.8543 32.4786 175.7526 101 S 4.7274 8.0293 110.7646 56.2970 65.9390 174.6083 102 L 4.2154 8.7999 126.3046 57.9485 41.5810 179.7636 103 S 4.2971 8.0853 111.8774 60.8420 63.1927 175.0878 104 D 4.2928 7.9704 120.8726 56.9723 40.6861 177.0704 105 F 3.8626 8.0775 118.5107 57.5431 39.2554 174.5006 106 G 3.7879 8.0684 111.0954 44.4808 0.0000 173.3570 107 F 4.3294 8.6839 115.7295 57.6434 39.8308 178.4153 108 A 4.1536 7.9946 123.1162 54.5655 18.9177 177.2068 109 N 4.9820 7.5715 112.2066 52.2468 38.8679 174.2000 110 V 3.7218 7.4232 111.8593 61.2946 33.0464 176.5303 111 D 4.5666 8.6059 122.5729 53.4425 40.5377 177.4073 112 R 4.2171 8.4350 126.2225 57.9912 30.8248 177.0683 113 N 4.9765 7.6778 115.4416 51.0937 39.0968 171.4654 114 P 4.5580 0.0000 0.0000 61.5079 32.9379 178.0706 115 S 4.2329 8.4669 115.5360 58.1740 64.6827 173.5539 116 P 4.2453 0.0000 0.0000 65.8530 31.0075 178.5158 117 E 3.9427 8.1749 117.7381 59.2960 29.6531 178.8533 118 S 4.1489 8.0038 114.1774 61.5107 62.9139 176.5179 119 L 4.0147 7.9421 122.6924 57.4729 41.3423 179.0841 120 D 4.3985 8.4938 119.2267 57.6080 40.7207 178.8800 121 E 3.9687 8.5088 118.8731 59.1994 29.4379 179.2501 122 A 4.3069 8.2692 120.8786 55.3339 18.5122 179.4134 123 Q 3.9550 8.5206 118.1731 59.2401 29.0511 178.3027 124 A 3.9972 8.2114 121.8139 55.3447 18.4871 179.8638 125 K 3.8394 8.3120 117.2383 59.4135 31.9332 179.8461 126 I 3.7049 7.9095 120.1645 64.3798 37.1043 178.5871 127 K 3.9712 8.2709 119.1536 59.4048 31.8517 179.2491 128 A 3.9675 8.3611 121.1054 55.0786 18.2359 179.5797 129 A 3.9138 8.0307 119.2863 55.2113 18.2290 179.7778 130 L 3.9320 8.0169 116.4975 58.0052 42.0684 179.3327 131 A 4.1446 8.0087 120.6217 55.2042 18.0726 179.4880 132 Q 3.9430 7.8702 117.2121 59.0891 29.2645 177.7734 133 L 4.2541 8.0097 117.4894 55.7456 41.9972 177.2957 134 A 4.3230 7.5677 125.4641 52.3405 18.5362 176.9007 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 8.34 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 0.00 0.00 0.00 0 S 7.81 4.18 0.00 4.15 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 1 M 8.98 4.07 0.00 2.09 2.17 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 2.89 2.58 0.00 2 A 7.92 3.97 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 3 S 8.25 4.12 0.00 4.05 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 4 I 8.04 3.77 1.94 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 1.43 0.84 0.94 0.00 0.00 5 F 8.67 4.11 0.00 3.19 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 6 T 8.27 3.99 4.49 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 1.28 0.00 0.00 7 K 8.18 4.14 0.00 1.96 1.84 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.61 1.62 7.81 8 I 7.85 3.69 1.47 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.82 -0.22 0.00 0.00 9 I 7.21 3.66 1.83 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.31 0.94 0.00 0.00 10 N 7.92 4.60 0.00 2.75 2.84 0.00 0.00 7.10 7.70 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 11 R 7.62 3.88 0.00 1.91 1.95 0.00 3.39 0.00 0.00 2.82 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.56 0.00 12 E 8.45 4.22 0.00 2.03 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 0.00 2.31 2.41 0.00 13 L 7.40 4.83 0.00 1.54 1.51 0.91 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.44 0.00 2.04 1.99 0.00 3.61 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 15 G 8.33 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 0.00 0.00 0.00 0.00 16 R 8.13 4.50 0.00 1.92 1.95 0.00 3.16 0.00 0.00 3.48 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.67 0.00 17 F 8.61 4.70 0.00 3.04 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 18 V 8.77 4.58 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 0.73 0.00 0.00 1.04 0.00 0.00 19 Y 7.96 4.82 0.00 3.11 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 20 E 7.64 5.09 0.00 1.95 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 0.00 2.13 2.15 0.00 21 D 9.11 4.87 0.00 2.88 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.84 4.65 0.00 2.71 2.81 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 23 D 9.13 4.95 0.00 2.69 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 24 V 7.84 5.06 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 1.15 0.00 0.00 1.00 0.00 0.00 25 V 9.26 5.41 2.60 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 0.80 0.00 0.00 1.30 0.00 0.00 26 A 9.61 5.69 1.22 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 27 F 7.69 5.09 0.00 2.52 1.56 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.68 4.55 0.00 1.58 1.66 1.00 0.91 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 29 T 8.26 4.18 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 0.95 0.00 0.00 30 I 8.32 4.00 1.89 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 1.48 0.75 0.94 0.00 0.00 31 E 7.79 5.34 0.00 1.91 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 2.24 2.19 0.00 32 P 0.00 4.28 0.00 2.24 2.10 0.00 3.93 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.93 0.00 33 M 8.69 3.78 0.00 1.39 1.03 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.12 0.00 34 T 6.99 4.52 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 1.06 0.00 0.00 35 Q 8.18 3.92 0.00 1.90 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.52 0.00 0.00 0.00 0.00 0.00 2.23 2.33 0.00 36 G 8.70 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 37 H 8.02 4.51 0.00 3.29 3.07 0.00 5.54 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 9.38 5.04 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 1.17 0.00 0.00 39 L 8.46 4.95 0.00 0.56 1.29 1.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 40 V 8.50 4.69 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 0.95 0.00 0.00 0.82 0.00 0.00 41 V 9.05 4.90 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 1.29 0.00 0.00 0.94 0.00 0.00 42 P 0.00 4.89 0.00 2.24 2.15 0.00 4.25 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.14 0.00 43 R 9.03 4.23 0.00 1.79 2.12 0.00 3.40 0.00 0.00 3.20 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.81 0.00 44 E 8.30 4.03 0.00 1.99 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 2.33 2.38 0.00 45 E 8.56 4.21 0.00 2.02 1.92 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 2.37 2.28 0.00 46 I 7.49 4.70 1.91 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.05 0.99 0.00 0.00 47 D 8.08 4.91 0.00 2.73 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.66 4.37 0.00 2.98 2.75 0.00 0.00 6.51 7.68 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 49 W 8.56 4.52 0.00 3.81 3.49 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 50 Q 6.35 3.17 0.00 1.30 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.88 0.00 0.00 0.00 0.00 0.00 1.84 1.81 0.00 51 D 7.59 4.52 0.00 2.66 2.63 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 52 V 7.17 3.80 2.27 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 0.95 0.00 0.00 1.07 0.00 0.00 53 D 8.54 4.58 0.00 2.76 2.60 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 54 S 8.66 4.26 0.00 4.13 4.18 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 55 A 8.17 4.00 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 56 A 7.99 4.02 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 57 F 8.56 4.26 0.00 3.27 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 58 N 8.71 4.29 0.00 2.94 2.87 0.00 0.00 7.07 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 59 R 7.91 3.90 0.00 2.08 2.01 0.00 3.22 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.88 0.00 60 V 7.63 3.55 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 1.04 0.00 0.00 0.98 0.00 0.00 61 M 8.10 3.90 0.00 1.86 2.04 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.07 0.00 62 G 8.05 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 63 V 7.62 3.33 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 0.52 0.00 0.00 0.82 0.00 0.00 64 S 8.13 3.99 0.00 3.92 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 65 Q 8.05 3.91 0.00 2.19 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.47 0.00 66 L 7.70 3.88 0.00 1.67 1.63 0.92 1.05 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 67 I 7.93 3.78 1.77 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 1.47 0.71 0.88 0.00 0.00 68 G 8.32 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 69 K 8.37 3.93 0.00 1.95 1.86 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.57 7.81 70 A 8.02 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 71 V 8.25 3.95 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 0.94 0.00 0.00 1.03 0.00 0.00 72 C 8.16 4.30 0.00 3.22 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 73 K 8.14 3.97 0.00 1.78 1.81 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.33 7.81 74 A 8.26 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 F 8.01 4.55 0.00 3.19 3.10 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 76 R 7.50 3.84 0.00 1.99 1.97 0.00 3.11 0.00 0.00 3.27 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.52 0.00 77 T 7.58 4.69 4.41 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 1.31 0.00 0.00 78 E 8.96 3.94 0.00 1.95 2.03 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 2.29 2.33 0.00 79 R 7.78 4.81 0.00 1.78 1.77 0.00 3.13 0.00 0.00 3.26 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 80 S 8.56 4.93 0.00 3.74 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 81 G 8.27 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 L 8.16 5.26 0.00 1.46 1.40 0.80 0.82 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 83 I 8.83 4.82 2.00 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 1.45 0.93 1.07 0.00 0.00 84 I 8.36 4.51 1.27 0.00 0.00 0.56 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 0.33 0.88 0.00 0.00 85 A 9.12 4.45 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 86 G 8.17 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 L 7.56 4.14 0.00 1.48 1.65 0.86 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 88 E 8.00 4.25 0.00 1.90 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 2.13 2.05 0.00 89 V 7.10 4.16 1.57 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 -0.25 0.00 0.00 0.79 0.00 0.00 90 P 0.00 4.71 0.00 2.21 2.07 0.00 3.32 0.00 0.00 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.89 0.00 91 H 7.44 4.84 0.00 3.09 2.95 0.00 5.78 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 92 L 8.73 4.26 0.00 1.76 1.76 1.15 1.22 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 93 H 8.69 5.20 0.00 3.23 3.39 0.00 5.55 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 94 V 8.78 4.30 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 0.94 0.00 0.00 0.88 0.00 0.00 95 H 9.20 5.07 0.00 3.30 3.34 0.00 5.61 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 V 8.98 4.88 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 0.87 0.00 0.00 0.84 0.00 0.00 97 F 7.96 5.24 0.00 2.86 2.81 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 98 P 0.00 4.70 0.00 2.10 2.17 0.00 3.63 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.54 0.00 99 T 8.66 4.93 4.18 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 1.26 0.00 0.00 100 R 9.03 4.66 0.00 1.84 1.92 0.00 3.22 0.00 0.00 3.17 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 101 S 8.03 4.73 0.00 3.87 3.66 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.80 4.22 0.00 1.77 1.73 0.89 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 103 S 8.09 4.30 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 0.00 104 D 7.97 4.29 0.00 2.67 2.50 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 0.00 105 F 8.08 3.86 0.00 3.18 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 0.00 106 G 8.07 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 0.00 0.00 0.00 107 F 8.68 4.33 0.00 3.19 3.10 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 0.00 108 A 7.99 4.15 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 0.00 109 N 7.57 4.98 0.00 2.58 2.63 0.00 0.00 7.00 7.71 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 0.00 110 V 7.42 3.72 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 0.69 0.00 0.00 0.99 0.00 0.00 111 D 8.61 4.57 0.00 2.64 2.60 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 0.00 112 R 8.43 4.22 0.00 1.84 1.97 0.00 3.23 0.00 0.00 3.16 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 113 N 7.68 4.98 0.00 2.59 2.66 0.00 0.00 7.03 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 0.00 114 P 0.00 4.56 0.00 2.21 2.11 0.00 3.82 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 115 S 8.47 4.23 0.00 4.07 4.04 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 0.00 0.00 0.00 0.00 116 P 0.00 4.25 0.00 2.18 2.17 0.00 3.61 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 117 E 8.17 3.94 0.00 2.04 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 2.40 2.39 0.00 118 S 8.00 4.15 0.00 4.13 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 0.00 119 L 7.94 4.01 0.00 1.90 1.78 0.93 1.11 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 0.00 120 D 8.49 4.40 0.00 2.86 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 0.00 121 E 8.51 3.97 0.00 2.04 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 0.00 2.51 2.50 0.00 122 A 8.27 4.31 1.58 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 0.00 123 Q 8.52 3.96 0.00 2.18 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 124 A 8.21 4.00 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 0.00 125 K 8.31 3.84 0.00 1.56 1.49 0.00 1.51 0.00 0.00 1.26 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.31 1.50 7.81 126 I 7.91 3.70 2.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.95 0.98 0.00 0.00 127 K 8.27 3.97 0.00 2.02 1.89 0.00 1.89 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.63 7.81 128 A 8.36 3.97 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 0.00 129 A 8.03 3.91 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 0.00 130 L 8.02 3.93 0.00 1.84 1.83 1.07 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 131 A 8.01 4.14 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 0.00 132 Q 7.87 3.94 0.00 2.29 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.88 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 133 L 8.01 4.25 0.00 1.79 1.70 0.95 0.78 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 0.00 134 A 7.57 4.32 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