NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3596 8.2644 123.5560 51.7696 19.9125 175.9604 3 V 3.6850 8.9921 121.4860 61.9474 31.8926 174.4487 4 N 4.8193 8.7837 124.8670 52.4095 40.6225 174.1099 5 V 4.3299 7.9836 119.5713 61.2744 34.3452 174.3643 6 Y 4.9391 8.7491 124.0756 55.5603 41.1410 176.7534 7 S 4.2564 8.9224 115.6543 61.4819 62.8818 175.4473 8 T 4.3082 7.8884 108.4669 61.9821 69.3389 175.1807 9 S 4.2988 7.8428 119.1547 58.4356 63.4060 173.9314 10 V 3.8566 8.2191 123.9677 62.6232 31.6403 175.2883 11 T 4.6665 8.0164 115.9302 59.3859 71.9885 173.2428 12 S 4.2450 8.3868 120.0898 58.6696 63.3930 174.8934 13 D 4.5198 8.2882 120.4516 53.1470 40.0508 176.7096 14 N 4.5701 8.4793 118.1167 53.6173 39.2082 174.6549 15 L 4.6922 8.1328 120.8423 53.0150 43.6392 177.7190 16 S 4.5907 8.4699 116.8726 58.3164 64.8726 175.5645 17 R 4.1436 8.7219 119.8339 59.9362 29.0345 178.3318 18 H 4.1299 8.3121 118.3515 59.3299 29.9751 176.8478 19 D 4.5016 8.4948 120.4766 57.1069 40.6389 178.5506 20 M 4.2507 8.5285 119.3810 58.7965 32.2814 178.3102 21 L 4.0976 8.4089 119.1087 57.5636 41.6669 179.3775 22 A 3.9752 8.0440 120.9530 54.7970 18.3294 179.3425 23 W 4.2319 8.3728 126.8323 60.7636 30.7973 178.2401 24 I 3.2257 7.7757 119.5015 64.4104 36.5593 178.3095 25 N 4.2568 8.3769 117.6401 56.2866 38.1296 177.5087 26 E 3.9654 8.3138 119.4777 59.5027 29.6818 179.2680 27 S 4.2859 7.9729 114.2715 60.4511 62.9472 175.6394 28 L 4.3323 7.4605 118.2711 52.9568 43.0612 176.1509 29 Q 3.3389 7.8744 116.6737 57.4078 25.9836 171.4646 30 L 4.8218 7.5810 116.1830 53.1761 45.1710 176.4343 31 N 5.0814 8.0855 114.7061 52.8330 39.5939 175.3496 32 L 4.2318 8.3331 117.6307 55.2869 42.3531 177.5432 33 T 4.5602 9.2510 111.3117 61.4675 70.5526 174.5036 34 K 4.7451 7.8193 120.8939 53.7394 36.4483 177.0851 35 I 3.8576 8.6644 122.9122 64.6335 37.0298 178.4944 36 E 4.0882 8.4823 118.9391 59.4561 28.7624 178.8398 37 Q 4.1413 8.1628 117.2865 57.7134 28.7741 177.8028 38 L 4.0206 8.0907 120.4224 56.2803 41.4315 178.3155 39 C 4.2772 7.8529 114.8346 60.9264 29.6309 175.4920 40 S 3.3136 7.3866 115.4065 58.6508 62.8258 176.2134 41 G 3.0884 7.9442 110.1461 45.7754 0.0000 175.5742 42 A 3.6088 7.3371 122.0102 54.9362 18.1945 179.4957 43 A 3.7016 7.5496 118.7902 55.3844 18.4661 179.2471 44 Y 4.1042 7.2157 114.6496 61.3934 37.9558 178.4162 45 C 4.2147 8.0042 117.6166 63.0626 28.2546 176.0805 46 Q 4.1168 8.2838 121.0088 59.2769 28.5443 178.2348 47 F 4.4726 8.5814 119.1786 60.8592 38.9211 177.5616 48 M 4.4925 8.8001 118.6144 58.5059 31.6257 178.1329 49 D 4.5092 8.3627 118.2984 57.6293 41.1712 178.1184 50 M 3.5194 7.8298 117.5559 58.3312 32.2516 177.9868 51 L 3.9581 7.9780 118.0997 56.3974 43.0624 178.0715 52 F 4.9235 8.3320 119.7176 54.0847 39.6457 171.0290 53 P 4.7456 0.0000 0.0000 63.4963 31.7228 177.0757 54 G 4.1125 8.4312 110.2049 45.2265 0.0000 174.4739 55 S 4.4077 8.5199 114.6164 59.8896 63.5901 174.0854 56 I 4.6487 7.5961 120.7479 59.2493 39.8989 176.4073 57 A 4.3985 8.3221 127.9574 51.1018 16.5987 177.4236 58 L 4.0215 8.3324 126.8907 58.1935 42.7310 180.0513 59 K 4.2337 8.1205 118.2795 56.5187 31.7533 179.7453 60 K 4.4056 7.8709 114.7392 57.2192 32.9668 177.2119 61 V 3.5153 7.3499 119.2224 62.5437 31.6730 175.9028 62 K 4.2892 8.6877 127.7943 54.9100 31.0621 176.5723 63 F 4.3421 8.5094 123.2137 59.3235 39.2122 176.5539 64 Q 4.6725 7.8308 118.9047 55.0690 29.3441 175.4897 65 A 4.2755 8.2967 123.2048 53.1384 18.8881 179.0795 66 K 4.7516 9.0462 121.8557 53.6854 34.6511 174.3602 67 L 4.5926 7.3018 116.4990 52.8288 44.8663 176.8522 68 E 3.4076 8.4450 122.5808 59.6619 29.4913 179.1003 69 H 4.2163 7.9877 114.4546 58.6497 28.5320 177.3444 70 E 4.1935 7.5247 122.6016 58.7354 29.1770 178.6532 71 Y 4.6416 7.4731 117.7128 60.7538 37.9396 178.6498 72 I 3.8591 8.0671 120.6298 64.4574 36.7020 178.3639 73 Q 4.0143 8.0969 118.8526 59.2123 28.5767 178.8181 74 N 4.2405 8.2012 117.2351 56.4724 38.4942 177.5694 75 F 4.0956 8.4924 119.1973 60.2826 38.9296 177.9577 76 K 4.3193 8.3590 119.8987 58.8086 31.7795 179.3411 77 I 3.7046 7.6763 119.9363 64.2915 36.9561 178.1727 78 L 3.9487 7.7783 121.0489 58.3216 41.3910 178.9967 79 Q 3.9007 8.4512 118.1572 58.9372 28.5602 178.7598 80 A 4.2128 8.2589 122.0032 54.9343 18.3756 179.9834 81 G 3.7200 8.2063 104.4020 48.9122 0.0000 175.8256 82 F 4.3930 8.8279 121.0257 60.2736 39.0885 177.7006 83 K 3.9624 8.5180 119.2809 59.6263 31.8326 178.6253 84 R 3.9506 8.0509 117.7166 59.3702 30.0331 177.3577 85 M 4.2628 7.8844 115.1882 54.1009 32.3797 176.1175 86 G 3.7668 7.7216 106.7648 46.4861 0.0000 174.1684 87 V 3.9441 7.9339 120.4984 62.0136 31.7425 175.3106 88 D 4.8052 8.9034 129.5519 54.4716 41.5286 175.7584 89 K 4.2847 7.6735 118.0732 53.9586 34.4889 174.8565 90 I 4.0077 8.1143 127.1860 60.7399 37.7859 175.2728 91 I 3.9565 8.1405 126.9167 59.8065 38.3365 175.9163 92 P 4.4178 0.0000 0.0000 61.4070 27.8867 176.6983 93 V 2.7297 7.1449 123.5212 66.5995 31.7943 176.4305 94 D 4.2992 7.8482 116.8265 56.4849 39.3436 178.4926 95 K 4.0599 7.6968 119.0802 59.1968 32.3140 179.1429 96 L 3.9274 7.5250 119.1963 57.8750 41.2914 179.8861 97 V 4.1474 7.3745 110.4112 63.4952 31.5726 178.1955 98 K 4.2722 7.8051 117.3263 57.0991 31.8846 177.5495 99 G 3.8740 8.1876 109.3957 46.7083 0.0000 174.3008 100 K 4.3933 7.8634 120.5320 53.3840 33.0829 180.6367 101 F 4.2060 9.0393 124.8643 60.9843 39.4363 177.4211 102 Q 4.0357 8.2443 118.6357 59.3884 28.9800 177.7678 103 D 4.3976 8.0631 119.3650 57.5979 40.9842 178.4480 104 N 4.5381 7.9774 117.1467 56.1394 38.5269 177.4002 105 F 4.3198 8.5003 122.6584 61.0236 39.2441 176.7911 106 E 3.8507 8.3351 119.0698 59.3467 29.4105 178.6905 107 F 4.2835 8.3772 120.9021 61.3243 39.4283 177.5289 108 V 4.0031 8.2988 118.8775 64.8294 31.0312 178.3652 109 Q 3.8069 8.1290 118.8656 58.4709 28.4253 178.6138 110 W 3.9276 7.8804 129.3531 60.3922 30.7609 177.7987 111 F 3.1151 8.3696 121.0330 60.8270 38.7180 176.9591 112 K 3.3241 8.2596 119.5452 59.1274 31.8835 178.9731 113 K 3.6807 7.3013 118.7564 59.1076 31.3714 179.0234 114 F 3.5997 7.3084 121.1227 60.9364 39.1006 176.8372 115 F 3.4477 8.0009 120.3631 61.3606 38.9403 176.9021 116 D 4.2201 7.9821 117.1359 57.0914 40.6154 178.3657 117 A 3.9545 7.5652 120.2649 53.9368 18.3815 177.6739 118 N 4.5207 6.7193 111.4698 53.1005 40.7041 174.5149 119 Y 3.8575 7.3040 120.4892 57.2886 38.9985 174.8573 120 D 4.2448 8.1003 125.3823 52.8823 40.1144 177.1999 121 G 3.4070 5.3800 108.0395 44.7721 0.0000 173.9734 122 K 4.0489 7.3940 118.7220 56.6563 33.0061 176.7705 123 D 4.6827 8.4767 120.9898 54.8265 41.4863 175.4610 124 Y 4.5969 8.3512 122.5641 55.4381 41.8555 174.3208 125 D 4.5848 7.9269 126.7363 51.9751 42.0414 174.6853 126 P 4.0093 0.0000 0.0000 64.9911 31.3129 178.6425 127 V 3.3875 7.5596 117.1777 65.8750 31.7303 177.1187 128 A 4.0010 7.7232 118.6937 55.1477 18.1990 179.0639 129 A 3.9833 7.6049 118.2382 55.2597 18.5383 177.7715 130 R 3.7678 7.2728 119.7192 56.4506 30.0557 176.4737 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 2 A 8.26 4.36 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 3 V 8.99 3.68 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 0.73 0.00 0.00 0.89 0.00 0.00 4 N 8.78 4.82 0.00 2.81 2.24 0.00 0.00 6.84 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 5 V 7.98 4.33 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 0.78 0.00 0.00 0.86 0.00 0.00 6 Y 8.75 4.94 0.00 3.06 2.86 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 7 S 8.92 4.26 0.00 4.03 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 0.00 8 T 7.89 4.31 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 9 S 7.84 4.30 0.00 4.07 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 10 V 8.22 3.86 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 0.80 0.00 0.00 0.93 0.00 0.00 11 T 8.02 4.67 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 1.22 0.00 0.00 12 S 8.39 4.25 0.00 3.77 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 13 D 8.29 4.52 0.00 2.69 2.46 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 14 N 8.48 4.57 0.00 2.67 2.78 0.00 0.00 6.90 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 L 8.13 4.69 0.00 1.68 1.66 0.85 0.88 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 16 S 8.47 4.59 0.00 4.16 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 17 R 8.72 4.14 0.00 2.13 2.05 0.00 2.75 0.00 0.00 3.00 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 18 H 8.31 4.13 0.00 3.24 3.39 0.00 5.67 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 19 D 8.49 4.50 0.00 2.87 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 20 M 8.53 4.25 0.00 2.51 2.34 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 2.90 2.89 0.00 21 L 8.41 4.10 0.00 1.89 1.72 1.00 1.14 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 22 A 8.04 3.98 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 23 W 8.37 4.23 0.00 3.38 3.47 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.78 3.23 1.93 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.50 0.71 0.00 0.00 25 N 8.38 4.26 0.00 2.75 2.90 0.00 0.00 7.12 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 26 E 8.31 3.97 0.00 2.03 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 2.35 2.39 0.00 27 S 7.97 4.29 0.00 3.58 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 7.46 4.33 0.00 1.33 1.35 -0.18 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 29 Q 7.87 3.34 0.00 2.32 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.80 6.75 0.00 0.00 0.00 0.00 0.00 2.27 1.93 0.00 30 L 7.58 4.82 0.00 1.63 1.49 0.73 0.83 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 31 N 8.09 5.08 0.00 2.59 2.71 0.00 0.00 6.85 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 L 8.33 4.23 0.00 1.71 1.59 0.82 0.81 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 33 T 9.25 4.56 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 1.21 0.00 0.00 34 K 7.82 4.75 0.00 1.79 1.97 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.44 1.42 7.81 35 I 8.66 3.86 2.11 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.19 0.95 0.00 0.00 36 E 8.48 4.09 0.00 2.13 2.16 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 2.71 2.65 0.00 37 Q 8.16 4.14 0.00 2.24 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.84 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 38 L 8.09 4.02 0.00 1.88 1.66 1.05 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 39 C 7.85 4.28 0.00 3.23 3.18 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 40 S 7.39 3.31 0.00 3.82 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 41 G 7.94 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 0.00 0.00 0.00 42 A 7.34 3.61 1.08 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 0.00 0.00 0.00 43 A 7.55 3.70 0.94 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 44 Y 7.22 4.10 0.00 2.96 2.80 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 0.00 0.00 0.00 45 C 8.00 4.21 0.00 3.07 2.97 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 46 Q 8.28 4.12 0.00 2.29 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.43 2.59 0.00 47 F 8.58 4.47 0.00 3.71 3.56 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 48 M 8.80 4.49 0.00 2.44 2.62 0.00 0.00 0.00 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.19 3.46 0.00 49 D 8.36 4.51 0.00 2.98 3.02 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 50 M 7.83 3.52 0.00 2.15 1.13 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.51 0.00 51 L 7.98 3.96 0.00 1.40 0.13 0.75 0.05 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 52 F 8.33 4.92 0.00 3.11 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 P 0.00 4.75 0.00 2.14 2.14 0.00 3.82 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.26 0.00 54 G 8.43 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 0.00 0.00 0.00 55 S 8.52 4.41 0.00 4.21 4.40 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 56 I 7.60 4.65 2.02 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.38 1.07 0.00 0.00 57 A 8.32 4.40 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 58 L 8.33 4.02 0.00 1.85 1.79 1.20 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 59 K 8.12 4.23 0.00 1.82 1.72 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.36 1.03 7.81 60 K 7.87 4.41 0.00 2.12 1.87 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.40 1.22 7.81 61 V 7.35 3.52 1.59 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 -0.18 0.00 0.00 0.83 0.00 0.00 62 K 8.69 4.29 0.00 1.66 1.73 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.33 7.81 63 F 8.51 4.34 0.00 3.05 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 64 Q 7.83 4.67 0.00 2.03 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.92 0.00 0.00 0.00 0.00 0.00 2.28 2.41 0.00 65 A 8.30 4.28 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.05 4.75 0.00 1.75 1.66 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.27 1.23 7.81 67 L 7.30 4.59 0.00 1.31 1.35 0.91 0.79 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 68 E 8.45 3.41 0.00 1.91 1.86 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 2.38 2.60 0.00 69 H 7.99 4.22 0.00 3.35 3.50 0.00 5.51 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 7.52 4.19 0.00 2.04 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 0.00 2.18 1.77 0.00 71 Y 7.47 4.64 0.00 3.16 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 I 8.07 3.86 2.07 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 1.55 0.74 0.94 0.00 0.00 73 Q 8.10 4.01 0.00 2.30 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.65 0.00 74 N 8.20 4.24 0.00 2.87 2.58 0.00 0.00 7.09 7.63 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 75 F 8.49 4.10 0.00 3.24 2.97 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 76 K 8.36 4.32 0.00 1.97 1.87 0.00 1.70 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.51 7.81 77 I 7.68 3.70 2.04 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.71 0.91 0.00 0.00 78 L 7.78 3.95 0.00 1.65 1.76 1.09 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 79 Q 8.45 3.90 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.32 2.53 0.00 80 A 8.26 4.21 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.21 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 82 F 8.83 4.39 0.00 3.20 3.12 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 83 K 8.52 3.96 0.00 1.88 2.01 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.49 7.81 84 R 8.05 3.95 0.00 2.25 2.18 0.00 3.41 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.56 0.00 85 M 7.88 4.26 0.00 1.46 1.90 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.77 0.00 86 G 7.72 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 V 7.93 3.94 1.51 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 -0.26 0.00 0.00 0.70 0.00 0.00 88 D 8.90 4.81 0.00 2.69 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 89 K 7.67 4.28 0.00 1.01 1.20 0.00 1.07 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.30 1.02 7.81 90 I 8.11 4.01 1.80 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 1.39 0.62 0.85 0.00 0.00 91 I 8.14 3.96 1.66 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.51 0.24 0.00 0.00 92 P 0.00 4.42 0.00 2.10 2.09 0.00 3.11 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 1.78 1.92 0.00 93 V 7.14 2.73 1.87 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 0.90 0.00 0.00 0.71 0.00 0.00 94 D 7.85 4.30 0.00 2.81 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 95 K 7.70 4.06 0.00 1.87 1.98 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.46 7.81 96 L 7.53 3.93 0.00 1.02 1.51 -0.08 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 97 V 7.37 4.15 2.33 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 0.93 0.00 0.00 1.04 0.00 0.00 98 K 7.81 4.27 0.00 1.90 1.90 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.64 7.81 99 G 8.19 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 0.00 100 K 7.86 4.39 0.00 1.70 1.69 0.00 1.80 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.43 0.99 7.81 101 F 9.04 4.21 0.00 3.27 3.12 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 0.00 102 Q 8.24 4.04 0.00 2.43 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.68 0.00 0.00 0.00 0.00 0.00 2.43 2.02 0.00 103 D 8.06 4.40 0.00 2.74 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 N 7.98 4.54 0.00 2.85 2.95 0.00 0.00 6.70 7.99 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 0.00 105 F 8.50 4.32 0.00 1.84 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 0.00 106 E 8.34 3.85 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 107 F 8.38 4.28 0.00 3.15 3.18 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 0.00 108 V 8.30 4.00 2.46 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 1.02 0.00 0.00 1.32 0.00 0.00 109 Q 8.13 3.81 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.85 0.00 0.00 0.00 0.00 0.00 1.93 1.99 0.00 110 W 7.88 3.93 0.00 3.31 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 0.00 111 F 8.37 3.12 0.00 2.86 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 0.00 112 K 8.26 3.32 0.00 1.43 1.67 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.84 0.99 7.81 113 K 7.30 3.68 0.00 1.58 1.60 0.00 1.69 0.00 0.00 1.49 0.00 0.00 2.81 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.29 1.33 7.81 114 F 7.31 3.60 0.00 1.51 1.87 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 0.00 115 F 8.00 3.45 0.00 2.86 2.80 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 0.00 0.00 0.00 116 D 7.98 4.22 0.00 2.44 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 0.00 117 A 7.57 3.95 1.12 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 0.00 0.00 118 N 6.72 4.52 0.00 1.99 2.28 0.00 0.00 6.93 7.34 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 0.00 119 Y 7.30 3.86 0.00 1.57 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 0.00 0.00 0.00 0.00 120 D 8.10 4.24 0.00 2.61 2.54 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 0.00 121 G 5.38 3.41 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 0.00 122 K 7.39 4.05 0.00 1.95 1.90 0.00 1.86 0.00 0.00 1.81 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.68 1.62 7.81 123 D 8.48 4.68 0.00 2.73 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 Y 8.35 4.60 0.00 2.95 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 0.00 125 D 7.93 4.58 0.00 2.72 2.32 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 0.00 126 P 0.00 4.01 0.00 2.35 2.38 0.00 3.64 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 1.97 2.16 0.00 127 V 7.56 3.39 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 0.77 0.00 0.00 0.82 0.00 0.00 128 A 7.72 4.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.60 3.98 1.16 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 0.00 130 R 7.27 3.77 0.00 1.59 1.38 0.00 2.21 0.00 0.00 2.40 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.26 0.00