NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4661 8.3049 120.3312 55.2154 33.4580 174.1064 2 E 4.0942 8.3781 118.5832 55.0231 30.2467 174.9279 3 A 3.9997 9.3523 126.2654 52.7938 19.7046 178.5756 4 L 3.9401 8.4898 122.9111 56.0052 41.9478 177.9956 5 G 3.7779 8.4449 102.4283 45.4971 0.0000 172.7988 6 A 4.4959 7.3272 116.4428 51.0379 21.8069 176.5179 7 D 4.6975 8.6202 121.5699 53.6153 42.4466 175.8140 8 V 4.5490 8.4075 122.4043 61.5165 34.3408 175.5826 9 T 4.4069 8.3647 124.0403 61.1139 68.2239 172.9517 10 Q 3.7741 8.1537 122.9503 55.8151 29.1651 177.8853 11 G 4.1575 8.6961 107.7712 45.8758 0.0000 172.3954 12 L 5.1018 8.1906 120.1153 52.8475 45.9018 175.1624 13 E 5.1944 8.8437 118.8030 54.0360 34.4940 175.2911 14 K 3.9501 8.3777 122.8952 58.3437 32.4683 177.3416 15 G 3.9927 8.9110 115.2905 45.0395 0.0000 173.8111 16 S 4.3266 8.1886 116.8881 58.4796 64.2361 173.3475 17 L 5.1265 8.4553 123.8939 53.5079 42.7032 175.5668 18 I 4.6330 8.6933 117.8193 59.1934 41.6059 174.2505 19 T 4.5558 8.4675 118.1694 62.8144 70.2761 174.5834 20 C 4.8154 8.5869 126.4422 57.5752 30.6035 173.7512 21 A 4.5136 8.5745 132.8309 49.5724 15.8217 174.7647 22 D 5.1642 7.4910 119.3505 53.6625 41.9684 176.2237 23 N 5.0069 8.1695 114.8850 52.8658 37.5780 176.7999 24 T 3.8834 8.3254 111.8856 64.0200 69.1617 175.0228 25 G 3.9549 7.6662 109.7840 45.0787 0.0000 172.9260 26 A 4.6851 7.4944 123.4545 51.4715 19.7924 176.6387 27 R 4.3424 8.6926 122.8010 57.6214 31.6111 175.5991 28 E 5.0904 7.9852 118.9307 54.3881 32.1193 173.9545 29 L 5.1918 8.8744 126.5502 52.8034 45.4244 175.3199 30 K 4.9304 8.7206 123.2977 54.2850 34.7465 175.5631 31 V 3.9739 8.6071 128.3790 63.6939 32.0340 176.3201 32 I 4.3628 8.4532 126.4346 62.7242 40.0518 175.4151 33 S 4.6419 7.6716 115.1046 57.7145 68.0686 173.7229 34 V 4.5641 8.1574 120.2450 61.0423 33.9359 174.2916 35 H 4.1342 9.1540 128.4114 57.9602 30.0554 174.6535 36 G 3.9537 8.5549 112.9550 46.3569 0.0000 171.9236 37 Y 4.7676 7.7807 119.4993 55.1992 40.5034 175.2056 38 S 4.4154 7.6284 120.4699 56.3614 66.6737 173.1063 39 G 4.0477 7.7208 116.5484 44.9424 0.0000 174.5636 40 T 4.4681 8.3962 117.2832 60.0368 69.9811 172.0248 41 K 3.9903 8.4117 126.3681 57.8762 32.5364 176.9374 42 N 4.4607 8.9366 121.2436 53.8521 37.4662 174.4058 43 R 4.0814 8.0552 119.4643 55.7949 30.5349 175.5298 44 H 4.4323 8.7845 123.5020 54.7412 29.2944 173.2250 45 P 4.6897 0.0000 0.0000 63.6328 31.6985 175.2585 46 K 5.0599 8.1111 123.2323 55.1495 34.8967 175.4237 47 A 4.6353 8.6922 122.9784 50.8386 23.3437 175.4297 48 G 4.3652 8.9574 105.3111 45.1126 0.0000 172.1244 49 L 4.2424 9.1406 120.2216 56.8693 41.8184 178.4042 50 G 4.0665 8.9944 111.1722 45.4478 0.0000 172.6322 51 D 4.9515 7.8863 120.0197 52.6406 43.3003 175.5753 52 K 4.6755 8.6799 124.3172 55.5122 33.4623 175.4041 53 I 4.9252 8.2970 120.9457 59.5222 41.1937 174.3671 54 T 4.8402 8.5688 119.5401 62.3641 70.4703 174.3166 55 V 5.0688 9.4142 125.1303 61.4035 35.9214 173.6630 56 S 5.2284 8.7385 118.1210 56.3731 66.6513 173.2189 57 V 4.2458 8.2014 122.1878 62.9756 31.7631 176.6208 58 T 4.0542 9.0533 126.1527 65.9505 69.0482 175.4226 59 K 4.5737 8.7669 119.0540 54.7437 36.4276 176.9013 60 G 3.9176 8.5936 108.0205 44.3232 0.0000 172.8666 61 T 3.9754 8.2189 111.2977 61.2225 69.2530 173.5911 62 P 4.1111 0.0000 0.0000 66.0220 31.2302 178.4482 63 E 4.0546 8.0735 115.6150 59.1953 29.6283 178.4605 64 M 4.2199 8.7007 118.8471 56.2513 32.4426 176.9493 65 R 3.9010 6.7404 117.6136 57.6275 30.6449 177.3893 66 R 4.0003 8.3897 118.6679 56.5556 29.2344 176.6932 67 Q 4.2295 7.5764 118.1200 55.5810 30.3070 175.5222 68 V 4.2667 8.3268 123.0216 61.7956 32.3081 174.3682 69 L 4.8678 8.8886 128.0746 52.8569 45.9077 174.9672 70 E 5.0482 8.4080 119.4306 55.2734 32.6951 174.2961 71 A 4.7788 8.3791 124.7604 51.3430 23.5951 174.8713 72 V 4.5648 7.9678 117.0196 61.1416 35.4089 175.1750 73 V 4.1532 8.2922 127.1689 62.8588 31.6880 176.2301 74 V 3.9307 8.8875 129.7048 64.5581 33.1505 175.8779 75 R 4.1471 7.4418 117.2708 54.3990 34.8140 174.2173 76 Q 4.9023 7.9725 118.1506 54.9908 31.6457 175.9682 77 R 4.3350 9.2279 120.5431 58.5897 30.4580 177.7435 78 K 4.2290 7.8554 118.4405 55.5115 32.7481 175.3576 79 P 4.9306 0.0000 0.0000 62.9042 32.2937 175.5085 80 I 4.7799 8.5039 114.2419 59.2891 41.5653 173.9674 81 R 4.8961 8.8046 124.9345 55.0128 31.6076 175.9736 82 R 4.6279 8.7568 125.8296 54.4112 31.4709 175.7327 83 P 4.2709 0.0000 0.0000 66.0497 31.3650 176.9892 84 D 4.6037 8.0705 114.7158 53.2136 39.2933 177.3924 85 G 4.0024 8.4835 109.3076 46.1093 0.0000 174.6421 86 T 4.1375 7.8411 116.9925 63.7101 69.5443 174.0374 87 R 5.0525 8.4241 123.4742 55.1123 32.5049 176.0115 88 V 4.4729 8.7970 121.4731 61.0894 34.7125 174.3423 89 K 5.0023 8.4779 125.8392 55.2911 35.7454 175.3897 90 F 4.6820 8.8406 120.4059 55.7150 41.6350 176.4757 91 E 4.0224 9.0156 120.2212 58.8971 29.6813 175.0270 92 D 4.7842 7.7441 115.5734 52.5561 42.8429 173.6329 93 N 5.2562 8.7357 114.6445 51.7864 41.0826 174.1777 94 A 5.2704 9.0523 124.0166 50.5827 23.3346 174.6534 95 A 5.5875 9.3479 120.3544 49.4832 23.5387 175.4442 96 V 4.4529 8.0518 118.7945 60.7118 34.3320 174.9164 97 I 3.9005 8.1102 128.6306 62.3993 38.0696 175.3555 98 V 4.7177 8.8564 125.1154 61.4386 35.3832 174.1800 99 D 5.1080 7.7706 122.1120 51.4829 41.7851 176.3253 100 E 3.9133 8.8297 117.0783 59.8619 29.3952 177.6717 101 N 4.6200 9.1154 113.8820 52.8193 38.9161 175.0059 102 E 3.7044 8.1702 116.8521 57.2562 27.6067 173.5049 103 D 4.9623 8.3008 118.4890 50.9266 42.1374 174.1647 104 P 4.2575 0.0000 0.0000 63.2440 31.4027 177.2090 105 R 3.8320 8.5797 122.7554 58.4341 30.2331 176.4880 106 G 4.0350 7.1010 103.4057 44.6582 0.0000 172.8738 107 T 4.3912 8.4551 113.8196 63.9775 70.0589 175.2118 108 E 4.7722 9.7456 121.0391 54.3571 33.7696 174.8985 109 L 5.0428 8.4115 123.1933 52.6589 43.0887 176.0763 110 K 4.1986 8.6063 124.2625 56.5753 33.0266 178.0287 111 G 3.9294 8.9531 110.9891 43.9698 0.0000 170.1816 112 P 4.8774 0.0000 0.0000 62.9183 32.6145 175.3480 113 I 4.7307 8.1388 117.1235 59.7011 41.8752 174.8366 114 A 4.7744 8.1867 126.1293 51.6641 19.4276 179.2030 115 R 3.8944 8.8534 118.1091 59.5367 29.1793 178.9812 116 E 3.9544 8.3519 118.8094 59.3654 29.2860 179.3755 117 V 3.3615 7.6586 117.8437 65.7063 31.5125 177.5876 118 A 3.9755 8.0516 120.5906 55.5444 18.0818 179.5355 119 Q 3.9454 7.2048 114.2737 58.0389 29.0306 178.0973 120 R 4.0770 7.4360 116.8209 56.9099 32.1189 176.5564 121 F 4.9581 7.6074 118.6303 54.4482 38.9336 175.7120 122 G 3.8405 8.4590 111.5846 48.1083 0.0000 172.3662 123 S 4.1318 8.0901 117.9416 59.9110 62.7107 176.5949 124 V 3.6135 7.7377 121.6035 65.6258 31.3579 177.5513 125 A 4.0556 8.2270 120.9746 55.1831 18.2962 179.8803 126 S 4.4065 8.8505 108.8771 59.3023 62.4902 175.0184 127 A 4.6479 7.5495 123.0282 51.9005 20.3553 177.3207 128 A 4.1936 8.4741 119.8878 52.4516 19.1035 177.9116 129 T 4.1877 8.5334 118.8000 66.0764 69.5029 175.0407 130 M 4.8568 7.7751 120.0167 53.5902 35.8088 174.8933 131 I 4.8040 8.2161 122.0897 59.5284 40.0081 175.4170 132 V 3.8908 8.6987 126.3601 62.9442 31.0036 175.6466 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.47 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.63 0.00 2 E 8.38 4.09 0.00 1.95 1.80 0.00 0.00 0.00 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 2.34 0.00 3 A 9.35 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 8.49 3.94 0.00 1.64 1.74 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 5 G 8.44 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 0.00 0.00 0.00 6 A 7.33 4.50 1.20 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 7 D 8.62 4.70 0.00 2.62 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 8 V 8.41 4.55 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 0.83 0.00 0.00 0.95 0.00 0.00 9 T 8.36 4.41 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 10 Q 8.15 3.77 0.00 1.97 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.95 0.00 0.00 0.00 0.00 0.00 2.12 2.42 0.00 11 G 8.70 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 12 L 8.19 5.10 0.00 1.68 1.50 0.89 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.84 5.19 0.00 1.87 1.79 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 2.22 2.24 0.00 14 K 8.38 3.95 0.00 1.74 1.72 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.53 7.81 15 G 8.91 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 0.00 0.00 0.00 16 S 8.19 4.33 0.00 3.81 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 17 L 8.46 5.13 0.00 1.51 1.61 0.94 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 18 I 8.69 4.63 2.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.17 0.89 0.00 0.00 19 T 8.47 4.56 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 1.20 0.00 0.00 20 C 8.59 4.82 0.00 3.03 3.04 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 21 A 8.57 4.51 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 22 D 7.49 5.16 0.00 2.77 2.62 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 0.00 0.00 0.00 23 N 8.17 5.01 0.00 2.85 3.02 0.00 0.00 5.72 7.22 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 24 T 8.33 3.88 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 1.26 0.00 0.00 25 G 7.67 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 26 A 7.49 4.69 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 27 R 8.69 4.34 0.00 1.79 1.95 0.00 3.08 0.00 0.00 3.09 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 28 E 7.99 5.09 0.00 2.01 1.84 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 2.26 2.43 0.00 29 L 8.87 5.19 0.00 1.57 1.50 0.89 0.69 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 30 K 8.72 4.93 0.00 1.77 1.74 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.79 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.33 7.81 31 V 8.61 3.97 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 0.94 0.00 0.00 0.94 0.00 0.00 32 I 8.45 4.36 2.00 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 1.22 0.97 0.91 0.00 0.00 33 S 7.67 4.64 0.00 3.76 3.75 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 34 V 8.16 4.56 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 0.95 0.00 0.00 0.86 0.00 0.00 35 H 9.15 4.13 0.00 3.22 3.33 0.00 6.16 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.55 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 37 Y 7.78 4.77 0.00 2.90 3.04 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 38 S 7.63 4.42 0.00 3.78 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 39 G 7.72 4.05 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 0.00 0.00 0.00 40 T 8.40 4.47 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 1.23 0.00 0.00 41 K 8.41 3.99 0.00 1.75 1.73 0.00 1.93 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.52 7.81 42 N 8.94 4.46 0.00 2.94 2.99 0.00 0.00 7.02 7.66 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 43 R 8.06 4.08 0.00 1.78 2.10 0.00 3.36 0.00 0.00 3.37 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.66 0.00 44 H 8.78 4.43 0.00 3.33 3.23 0.00 5.80 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 P 0.00 4.69 0.00 2.21 2.46 0.00 3.73 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.06 0.00 46 K 8.11 5.06 0.00 1.64 1.75 0.00 1.46 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.03 1.05 7.81 47 A 8.69 4.64 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 48 G 8.96 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 49 L 9.14 4.24 0.00 1.61 1.67 0.99 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 50 G 8.99 4.07 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 51 D 7.89 4.95 0.00 2.76 2.59 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 52 K 8.68 4.68 0.00 1.72 1.66 0.00 1.52 0.00 0.00 1.65 0.00 0.00 2.66 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.37 1.44 7.81 53 I 8.30 4.93 2.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.70 0.88 0.00 0.00 54 T 8.57 4.84 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 1.26 0.00 0.00 55 V 9.41 5.07 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 1.13 0.00 0.00 0.90 0.00 0.00 56 S 8.74 5.23 0.00 3.89 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 0.00 57 V 8.20 4.25 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.92 0.00 0.00 58 T 9.05 4.05 4.38 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 1.30 0.00 0.00 59 K 8.77 4.57 0.00 1.65 1.64 0.00 1.65 0.00 0.00 1.82 0.00 0.00 2.81 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.40 1.53 7.81 60 G 8.59 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 61 T 8.22 3.98 4.24 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 1.24 0.00 0.00 62 P 0.00 4.11 0.00 2.17 2.15 0.00 3.59 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.22 0.00 63 E 8.07 4.05 0.00 1.93 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 2.31 2.33 0.00 64 M 8.70 4.22 0.00 1.97 2.18 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.70 0.00 65 R 6.74 3.90 0.00 1.92 1.87 0.00 3.25 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.74 0.00 66 R 8.39 4.00 0.00 2.01 2.10 0.00 3.15 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 67 Q 7.58 4.23 0.00 2.10 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.77 0.00 0.00 0.00 0.00 0.00 2.37 2.30 0.00 68 V 8.33 4.27 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 0.79 0.00 0.00 0.92 0.00 0.00 69 L 8.89 4.87 0.00 1.55 1.51 0.90 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.41 5.05 0.00 1.99 1.70 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 0.00 2.21 2.25 0.00 71 A 8.38 4.78 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 72 V 7.97 4.56 1.84 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 0.91 0.00 0.00 -0.03 0.00 0.00 73 V 8.29 4.15 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 0.82 0.00 0.00 0.92 0.00 0.00 74 V 8.89 3.93 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.95 0.00 0.00 75 R 7.44 4.15 0.00 1.48 1.18 0.00 3.17 0.00 0.00 3.53 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 1.28 0.00 76 Q 7.97 4.90 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.92 0.00 0.00 0.00 0.00 0.00 2.33 2.66 0.00 77 R 9.23 4.34 0.00 1.84 2.07 0.00 3.15 0.00 0.00 3.03 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.56 0.00 78 K 7.86 4.23 0.00 1.77 1.73 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.54 1.55 7.81 79 P 0.00 4.93 0.00 1.99 1.98 0.00 3.69 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 2.03 2.10 0.00 80 I 8.50 4.78 2.05 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.16 0.99 0.00 0.00 81 R 8.80 4.90 0.00 1.91 1.84 0.00 3.08 0.00 0.00 3.17 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 82 R 8.76 4.63 0.00 1.92 1.82 0.00 3.22 0.00 0.00 3.17 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.61 0.00 83 P 0.00 4.27 0.00 2.03 2.16 0.00 3.67 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 2.04 2.12 0.00 84 D 8.07 4.60 0.00 2.78 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 85 G 8.48 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.84 4.14 4.32 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 1.19 0.00 0.00 87 R 8.42 5.05 0.00 1.67 1.84 0.00 3.32 0.00 0.00 3.15 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 88 V 8.80 4.47 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 0.72 0.00 0.00 0.89 0.00 0.00 89 K 8.48 5.00 0.00 1.97 1.72 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.73 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.23 1.38 7.81 90 F 8.84 4.68 0.00 3.30 3.06 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 0.00 0.00 0.00 91 E 9.02 4.02 0.00 1.97 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 2.31 2.26 0.00 92 D 7.74 4.78 0.00 2.68 2.64 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 93 N 8.74 5.26 0.00 2.63 2.71 0.00 0.00 6.48 7.12 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 94 A 9.05 5.27 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 9.35 5.59 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 96 V 8.05 4.45 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 1.05 0.00 0.00 0.95 0.00 0.00 97 I 8.11 3.90 1.84 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 0.34 0.91 0.00 0.00 98 V 8.86 4.72 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 0.66 0.00 0.00 0.77 0.00 0.00 99 D 7.77 5.11 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 0.00 100 E 8.83 3.91 0.00 1.97 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 2.31 2.33 0.00 101 N 9.12 4.62 0.00 3.00 2.85 0.00 0.00 7.13 7.14 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 0.00 102 E 8.17 3.70 0.00 2.19 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 2.15 2.27 0.00 103 D 8.30 4.96 0.00 2.69 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 0.00 104 P 0.00 4.26 0.00 2.34 2.22 0.00 3.69 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 2.08 2.00 0.00 105 R 8.58 3.83 0.00 1.79 1.97 0.00 3.22 0.00 0.00 3.21 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.56 0.00 106 G 7.10 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 0.00 0.00 0.00 107 T 8.46 4.39 4.24 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 1.21 0.00 0.00 108 E 9.75 4.77 0.00 1.71 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 2.21 2.25 0.00 109 L 8.41 5.04 0.00 1.52 1.60 0.97 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 110 K 8.61 4.20 0.00 1.63 1.75 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.41 1.43 7.81 111 G 8.95 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 0.00 0.00 0.00 112 P 0.00 4.88 0.00 2.26 2.18 0.00 3.81 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 2.15 2.11 0.00 113 I 8.14 4.73 1.90 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 1.14 0.53 0.92 0.00 0.00 114 A 8.19 4.77 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.85 3.89 0.00 2.07 2.24 0.00 3.00 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 116 E 8.35 3.95 0.00 2.10 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 2.42 2.57 0.00 117 V 7.66 3.36 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.98 0.00 0.00 118 A 8.05 3.98 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 0.00 119 Q 7.20 3.95 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.67 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 120 R 7.44 4.08 0.00 1.07 0.66 0.00 2.83 0.00 0.00 2.90 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.26 0.00 121 F 7.61 4.96 0.00 3.13 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 0.00 122 G 8.46 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 0.00 123 S 8.09 4.13 0.00 4.07 4.17 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 0.00 124 V 7.74 3.61 2.39 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 1.06 0.00 0.00 0.95 0.00 0.00 125 A 8.23 4.06 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 0.00 126 S 8.85 4.41 0.00 4.03 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 A 7.55 4.65 1.35 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 0.00 0.00 0.00 128 A 8.47 4.19 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 0.00 129 T 8.53 4.19 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 M 7.78 4.86 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.54 0.00 131 I 8.22 4.80 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.62 0.94 0.00 0.00 132 V 8.70 3.89 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 0.64 0.00 0.00 0.98 0.00 0.00