NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 28 S 4.3176 8.3349 115.2698 58.0149 63.0605 173.2139 29 V 3.6848 7.2517 115.4952 60.6825 32.9941 175.0125 30 T 4.6723 9.7821 119.1132 60.4016 70.6145 172.8652 31 V 5.0450 8.5890 127.8338 61.8363 34.0518 173.0773 32 H 5.1579 9.0836 123.0405 53.9626 32.6657 171.7726 33 S 4.9382 8.4390 111.4876 56.9156 64.5671 174.2456 34 S 4.3552 8.2532 123.2359 60.5675 63.2577 174.7003 35 E 4.5658 7.3963 122.6338 53.6273 28.3059 173.9855 36 P 4.5607 0.0000 0.0000 63.8577 32.8180 176.5354 37 E 4.7855 7.8939 120.7981 56.0790 31.8119 174.3207 38 V 4.2558 8.7319 128.4010 61.8245 33.8749 175.4276 39 R 4.9144 8.3642 124.5387 54.7596 33.0055 173.9787 40 I 4.6468 8.3283 123.6289 58.0445 41.6338 172.9720 41 P 4.6975 0.0000 0.0000 62.4334 31.2320 175.7909 42 E 3.8826 8.8666 123.3057 57.0152 30.9386 176.5221 43 N 4.9257 8.7664 118.6818 53.5717 37.0554 173.8571 44 N 5.1618 7.2869 114.8707 50.8332 42.2709 172.3889 45 P 5.0876 0.0000 0.0000 61.9347 32.8361 176.0774 46 V 4.4976 8.0921 119.9687 60.4280 34.7844 172.4800 47 K 4.9396 8.5096 123.6975 54.6841 34.7222 174.8942 48 L 4.5458 8.7120 128.3220 53.6533 43.1474 175.5696 49 S 5.2394 8.7030 119.2155 57.0302 65.2032 173.5003 50 C 5.1261 9.0589 125.1315 54.7387 39.3588 172.4676 51 A 4.8258 8.7285 129.5719 50.5438 20.0163 175.2311 52 Y 5.3984 8.2746 120.3357 55.8026 41.2309 175.1234 53 S 4.6203 9.9704 114.7279 58.4328 66.1887 174.5869 54 G 4.1478 9.3098 112.8174 45.4003 0.0000 173.4145 55 F 5.0629 8.3704 118.0049 55.8155 41.3555 175.0893 56 S 4.6851 8.9992 117.1633 59.6130 64.8342 174.9743 57 S 5.0169 8.4069 115.5363 56.1257 61.9699 172.0560 58 P 4.9482 0.0000 0.0000 62.5194 33.4098 177.8668 59 R 4.4606 8.6185 119.7947 54.5815 33.2840 174.9667 60 V 4.3049 8.5998 124.6228 62.0101 33.8412 174.4300 61 E 5.1445 8.8328 125.8690 54.9788 33.5504 173.6112 62 W 5.3685 9.8176 126.6901 54.8831 32.6520 174.6575 63 K 5.0336 9.1558 122.8457 54.6043 35.3778 175.3475 64 F 4.4965 9.3081 127.5086 57.5260 41.4243 174.0280 65 D 4.4811 7.7123 123.2448 52.6456 44.0827 173.8956 66 Q 4.2887 7.8493 128.4610 54.4930 27.7940 174.0814 67 G 3.7682 8.7775 112.8501 44.0701 0.0000 170.9191 68 D 4.6931 7.8835 121.1178 53.7802 44.5240 176.4693 69 T 4.1850 7.6793 116.5840 63.0907 69.0612 173.1290 70 T 4.9218 8.2715 123.2005 61.9412 70.6195 174.3301 71 R 4.7655 8.6456 123.8309 54.2318 34.6795 174.0417 72 L 4.5217 8.6122 124.7115 54.9803 42.6542 175.6714 73 V 3.4531 8.9637 126.4097 64.2037 33.1865 174.9394 74 C 5.3479 7.9377 119.6608 57.8482 35.1787 171.7419 75 Y 4.8990 8.3824 123.1942 55.7445 41.1917 174.8554 76 N 3.9446 9.1304 119.3168 55.4343 35.9487 173.4459 77 N 3.1400 7.6024 106.9675 52.9728 37.4317 175.1076 78 K 4.1294 6.7530 116.9693 54.5468 35.3821 175.1123 79 I 4.2148 8.0403 127.4662 60.8447 37.9545 175.9517 80 T 4.3603 8.7821 115.2661 61.2451 69.6819 175.5104 81 A 4.0100 8.7997 124.1706 55.4487 18.3884 180.0080 82 S 4.3412 8.2931 108.1609 60.6375 63.1963 174.2912 83 Y 4.5255 7.9219 117.1591 57.4489 39.9474 176.9372 84 E 3.8959 8.3319 120.8387 59.3841 29.5834 177.6543 85 D 4.6334 8.0058 115.3989 54.8555 40.2038 177.2784 86 R 4.6364 8.1608 117.1078 55.5377 30.8624 174.6026 87 V 4.6389 7.7550 119.2033 62.7982 34.4685 173.1291 88 T 4.6811 8.6962 118.2226 59.9352 71.6013 173.3038 89 F 4.9911 8.5321 125.0428 57.5628 41.2901 174.7892 90 L 4.0054 5.8325 117.4246 52.9660 45.7314 174.6752 91 P 4.4350 0.0000 0.0000 64.6568 31.6044 177.0828 92 T 4.5614 8.5858 107.6478 60.6083 68.4065 172.7703 93 G 5.0997 7.4508 107.7944 44.5543 0.0000 172.9106 94 I 4.5113 7.2232 114.8054 59.6499 39.9548 174.6275 95 T 5.0891 8.3402 113.5137 60.0936 72.2215 172.4750 96 F 4.9336 9.3913 122.7509 55.9590 40.6666 176.8483 97 K 4.0078 8.5834 124.8786 59.5585 32.7459 177.0247 98 S 4.7352 7.8403 111.1636 57.4971 65.7199 174.2892 99 V 4.8152 8.2381 118.7229 59.8676 35.2243 174.2773 100 T 4.9689 8.4297 110.5776 59.9341 72.3689 175.3291 101 R 3.9400 8.7117 120.0448 59.0731 30.2891 179.0322 102 E 4.0315 7.5687 116.4244 59.2379 29.5001 177.5156 103 D 4.4465 7.9161 116.5235 54.1163 40.9160 176.2934 104 T 4.4152 8.0602 117.5734 62.5160 69.3666 175.1906 105 G 4.0804 8.0314 112.5285 46.5475 0.0000 170.9440 106 T 5.1227 7.6918 118.5525 62.2664 70.5031 173.3196 107 Y 5.0409 9.7750 126.3164 57.5192 39.6844 174.9370 108 T 4.8399 9.1463 122.0904 62.1212 70.9543 172.7200 109 C 4.1826 8.7211 127.5569 54.7242 46.0471 172.1356 110 M 5.0973 8.8781 125.9469 53.4044 35.2383 175.1333 111 V 4.2602 8.5244 122.2625 61.2336 34.1836 173.8292 112 S 5.3169 8.3206 122.9961 56.7003 65.0494 173.5291 113 E 5.0474 9.2936 127.6598 55.2669 32.0716 174.5327 114 E 4.2346 7.9153 118.1562 56.8741 29.8110 176.5153 115 G 4.0314 9.6434 112.8693 44.6162 0.0000 174.2945 116 G 4.0233 7.7445 105.5272 46.4030 0.0000 174.1181 117 N 4.7236 8.2590 117.0880 53.1075 38.3754 174.7303 118 S 4.4057 7.9268 115.7950 56.5802 65.8173 172.5069 119 Y 5.4256 7.7624 122.5531 55.2286 40.7914 174.8410 120 G 4.4808 9.0383 108.7587 44.9020 0.0000 170.7605 121 E 5.3878 8.6017 117.8042 55.5313 32.4470 175.1115 122 V 4.5702 8.2916 123.7429 60.6033 35.1489 172.6623 123 K 5.1330 8.6674 121.7831 54.7692 34.6767 175.6069 124 V 4.5533 9.4435 123.8176 60.9897 34.8314 173.8740 125 K 5.1179 8.6444 128.4880 54.7811 34.2903 174.2959 126 L 4.9368 9.2415 130.1583 53.4123 44.6717 174.9420 127 I 4.6725 8.6047 127.5882 59.4860 39.0791 174.4789 128 V 4.2822 8.0459 128.1104 62.1434 32.2981 175.9410 129 L 4.3273 8.6135 127.1565 54.9601 41.7729 176.7260 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 28 S 8.33 4.32 0.00 3.79 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 V 7.25 3.68 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 -0.04 0.00 0.00 0.73 0.00 0.00 30 T 9.78 4.67 4.28 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 0.00 0.00 0.00 1.36 0.00 0.00 31 V 8.59 5.05 2.23 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 0.89 0.00 0.00 1.08 0.00 0.00 32 H 9.08 5.16 0.00 3.25 3.40 0.00 5.26 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 S 8.44 4.94 0.00 3.90 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 34 S 8.25 4.36 0.00 3.95 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 35 E 7.40 4.57 0.00 2.18 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.26 0.00 36 P 0.00 4.56 0.00 2.19 2.32 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 2.10 2.00 0.00 37 E 7.89 4.79 0.00 1.96 1.88 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 2.24 2.27 0.00 38 V 8.73 4.26 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 0.90 0.00 0.00 0.89 0.00 0.00 39 R 8.36 4.91 0.00 1.65 1.80 0.00 3.20 0.00 0.00 3.15 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 40 I 8.33 4.65 1.81 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 1.18 1.44 0.80 0.00 0.00 41 P 0.00 4.70 0.00 1.95 1.96 0.00 3.71 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 42 E 8.87 3.88 0.00 2.20 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 0.00 2.28 2.29 0.00 43 N 8.77 4.93 0.00 2.88 2.87 0.00 0.00 6.77 8.03 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 44 N 7.29 5.16 0.00 2.87 2.65 0.00 0.00 7.06 7.91 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 45 P 0.00 5.09 0.00 1.93 2.08 0.00 3.73 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.16 0.00 46 V 8.09 4.50 1.97 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 0.41 0.00 0.00 0.82 0.00 0.00 47 K 8.51 4.94 0.00 1.70 1.66 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.68 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.24 1.34 7.81 48 L 8.71 4.55 0.00 1.12 1.54 0.35 0.70 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 49 S 8.70 5.24 0.00 3.92 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 50 C 9.06 5.13 0.00 3.47 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 51 A 8.73 4.83 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 Y 8.27 5.40 0.00 3.02 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 53 S 9.97 4.62 0.00 3.84 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 54 G 9.31 4.15 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 0.00 55 F 8.37 5.06 0.00 3.25 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 56 S 9.00 4.69 0.00 4.03 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 57 S 8.41 5.02 0.00 3.95 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 58 P 0.00 4.95 0.00 1.59 2.06 0.00 3.89 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.34 0.00 59 R 8.62 4.46 0.00 1.70 1.81 0.00 3.28 0.00 0.00 3.11 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 60 V 8.60 4.30 2.31 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 1.01 0.00 0.00 0.70 0.00 0.00 61 E 8.83 5.14 0.00 2.05 1.66 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 2.20 2.53 0.00 62 W 9.82 5.37 0.00 3.28 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 63 K 9.16 5.03 0.00 1.69 1.67 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.80 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.36 1.38 7.81 64 F 9.31 4.50 0.00 2.66 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 D 7.71 4.48 0.00 2.56 2.29 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 66 Q 7.85 4.29 0.00 1.60 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.50 0.00 0.00 0.00 0.00 0.00 2.21 2.29 0.00 67 G 8.78 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 68 D 7.88 4.69 0.00 2.57 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 69 T 7.68 4.18 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 1.20 0.00 0.00 70 T 8.27 4.92 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 1.17 0.00 0.00 71 R 8.65 4.77 0.00 2.01 1.97 0.00 3.28 0.00 0.00 3.20 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 72 L 8.61 4.52 0.00 1.67 1.61 0.82 1.08 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 73 V 8.96 3.45 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 0.59 0.00 0.00 0.61 0.00 0.00 74 C 7.94 5.35 0.00 3.01 2.92 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 75 Y 8.38 4.90 0.00 3.02 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 76 N 9.13 3.94 0.00 2.76 2.85 0.00 0.00 7.17 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 N 7.60 3.14 0.00 2.56 2.49 0.00 0.00 6.51 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 K 6.75 4.13 0.00 1.42 0.98 0.00 1.34 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.98 1.17 7.81 79 I 8.04 4.21 1.84 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.11 0.94 0.00 0.00 80 T 8.78 4.36 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 1.54 0.00 0.00 81 A 8.80 4.01 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 82 S 8.29 4.34 0.00 4.12 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 83 Y 7.92 4.53 0.00 2.91 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 E 8.33 3.90 0.00 2.15 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 2.34 2.29 0.00 85 D 8.01 4.63 0.00 2.78 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 R 8.16 4.64 0.00 1.85 2.06 0.00 2.84 0.00 0.00 3.09 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.47 0.00 87 V 7.76 4.64 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.30 0.00 0.00 88 T 8.70 4.68 4.22 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 1.17 0.00 0.00 89 F 8.53 4.99 0.00 2.96 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 90 L 5.83 4.01 0.00 1.66 1.24 0.82 1.00 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 91 P 0.00 4.43 0.00 2.01 2.23 0.00 3.50 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.19 0.00 92 T 8.59 4.56 4.22 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 1.15 0.00 0.00 93 G 7.45 5.10 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 0.00 0.00 0.00 94 I 7.22 4.51 1.47 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.07 0.31 0.56 0.00 0.00 95 T 8.34 5.09 4.22 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 1.13 0.00 0.00 96 F 9.39 4.93 0.00 2.85 2.98 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 0.00 0.00 0.00 97 K 8.58 4.01 0.00 1.80 1.85 0.00 1.82 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.39 7.81 98 S 7.84 4.74 0.00 3.90 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 99 V 8.24 4.82 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 0.35 0.00 0.00 0.84 0.00 0.00 100 T 8.43 4.97 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 1.19 0.00 0.00 101 R 8.71 3.94 0.00 1.91 2.05 0.00 3.15 0.00 0.00 3.35 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.66 0.00 102 E 7.57 4.03 0.00 2.08 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 0.00 2.36 2.45 0.00 103 D 7.92 4.45 0.00 2.47 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 0.00 104 T 8.06 4.42 4.35 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 1.40 0.00 0.00 105 G 8.03 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 0.00 0.00 0.00 106 T 7.69 5.12 4.28 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 0.00 0.00 0.00 1.30 0.00 0.00 107 Y 9.78 5.04 0.00 3.19 3.44 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 0.00 108 T 9.15 4.84 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 1.17 0.00 0.00 109 C 8.72 4.18 0.00 1.23 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 0.00 0.00 0.00 0.00 110 M 8.88 5.10 0.00 1.84 1.79 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 111 V 8.52 4.26 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 -0.67 0.00 0.00 0.40 0.00 0.00 112 S 8.32 5.32 0.00 3.95 3.70 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 0.00 0.00 0.00 113 E 9.29 5.05 0.00 2.27 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 2.27 2.40 0.00 114 E 7.92 4.23 0.00 2.11 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 2.67 2.43 0.00 115 G 9.64 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 0.00 116 G 7.74 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 0.00 117 N 8.26 4.72 0.00 2.81 2.98 0.00 0.00 6.01 7.64 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 0.00 118 S 7.93 4.41 0.00 3.56 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 0.00 119 Y 7.76 5.43 0.00 2.95 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 0.00 120 G 9.04 4.48 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 0.00 0.00 0.00 121 E 8.60 5.39 0.00 1.92 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 2.06 2.15 0.00 122 V 8.29 4.57 2.23 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 0.69 0.00 0.00 0.96 0.00 0.00 123 K 8.67 5.13 0.00 1.69 1.82 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.69 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.41 7.81 124 V 9.44 4.55 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 1.08 0.00 0.00 1.15 0.00 0.00 125 K 8.64 5.12 0.00 1.92 1.71 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.45 7.81 126 L 9.24 4.94 0.00 1.48 1.48 0.70 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 127 I 8.60 4.67 1.87 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 1.29 1.19 0.92 0.00 0.00 128 V 8.05 4.28 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 0.71 0.00 0.00 0.85 0.00 0.00 129 L 8.61 4.33 0.00 1.64 1.53 0.91 0.53 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