NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1727 8.1727 122.0504 56.3073 34.1738 174.1371 2 V 4.5246 8.1390 126.5213 60.7632 32.1706 174.6086 3 F 4.3093 9.9956 128.9965 57.5555 40.2062 174.8388 4 E 4.2815 8.8986 120.8183 55.4728 31.0135 176.8869 5 R 3.2533 8.9368 121.5675 60.7732 30.0326 179.4155 6 C 4.3389 8.0290 115.3616 59.5932 38.8821 175.7162 7 E 3.9047 8.1019 120.7348 59.2896 29.2612 178.4730 8 L 3.5807 8.0244 120.0900 57.8129 42.0727 178.6135 9 A 3.9353 7.8348 120.7024 55.4479 18.3651 179.9197 10 R 3.9000 8.0933 116.4480 59.5023 30.1494 179.5185 11 T 3.8258 7.8261 115.5965 66.6662 68.4840 176.6951 12 L 3.8533 8.0832 121.2464 57.5845 41.5741 179.5171 13 K 3.8994 7.9618 119.4965 59.5663 31.9295 178.8815 14 R 3.9192 7.7472 117.8115 58.9754 30.0435 177.5131 15 L 4.3476 7.4893 116.1936 54.1076 41.8045 176.8214 16 G 3.8440 7.9383 106.9702 46.9909 0.0000 175.1930 17 M 3.8893 7.8380 121.4593 56.5667 32.3925 175.8654 18 D 4.4788 8.0100 117.9168 55.9804 41.2169 175.9292 19 G 3.9336 9.3570 115.6964 45.3545 0.0000 171.4282 20 Y 4.1646 8.2847 121.9677 58.6822 38.8392 176.3525 21 R 3.6689 8.9792 127.2917 57.2984 27.7224 177.3834 22 G 3.8083 8.3007 103.7660 45.5862 0.0000 174.0199 23 I 4.0905 7.5646 122.0018 59.0691 37.9484 175.8601 24 S 4.6560 8.3269 120.3914 57.7048 63.9843 174.8803 25 L 4.1883 9.1184 123.4641 58.7032 41.7645 179.4172 26 A 4.1802 8.1857 119.9140 55.2391 18.2894 179.2302 27 N 4.4858 8.2839 115.2848 56.2693 38.5942 177.7144 28 W 4.2197 8.0610 119.9810 59.8704 29.1886 178.3868 29 M 4.1710 8.4470 118.8855 58.5407 31.4442 177.9066 30 C 3.1052 8.0961 118.5989 59.0744 44.7881 175.3992 31 L 3.9590 8.0630 121.6372 58.2605 41.7656 178.8088 32 A 4.1726 8.3283 120.8014 54.9121 18.3775 179.4674 33 K 2.8247 8.0629 118.0680 59.3486 32.0582 179.1391 34 W 4.2370 7.6785 117.1875 59.0122 29.0686 178.4113 35 E 4.3232 8.2983 118.6794 58.6104 29.6469 177.7064 36 S 4.5234 7.9348 109.9877 56.6165 64.4384 174.8295 37 G 3.3937 7.9708 108.6837 46.6211 0.0000 173.1428 38 Y 3.6569 7.6451 113.9101 58.7437 35.5028 168.4877 39 N 5.3509 7.5908 117.9497 51.9398 40.2859 175.5590 40 T 4.1186 8.9889 117.1303 63.7572 69.2326 175.9186 41 R 4.5239 7.9858 116.9397 55.6031 30.0263 176.1222 42 A 4.3369 7.6042 121.5064 52.6986 19.2630 177.1284 43 T 5.0085 8.3822 111.3710 60.0281 72.5294 173.2119 44 N 4.8357 8.7718 121.9361 52.3923 42.2264 172.4668 45 Y 4.5841 8.7498 128.3322 57.3542 40.7317 173.8347 46 N 4.7844 8.5274 124.8375 51.2651 38.9068 175.4526 47 A 3.7320 8.3966 127.9830 54.7613 18.9457 178.9885 48 G 3.7897 8.1245 104.3408 48.2265 0.0000 173.8718 49 D 4.7375 7.5015 116.0693 51.9377 40.1837 176.0092 50 R 3.8302 8.0720 116.1085 57.0034 28.2082 175.8803 51 S 4.9708 7.1845 108.9930 57.0322 66.4860 172.7576 52 T 5.0678 8.7734 116.0279 61.9567 72.7477 172.7953 53 D 5.4523 8.9719 125.4858 53.3607 43.0855 175.0612 54 Y 5.0767 9.2203 120.8984 57.4852 41.6136 177.1622 55 G 4.1789 9.1282 112.1487 45.3851 0.0000 173.4027 56 I 3.8275 8.1542 116.7561 62.8636 37.7996 177.0313 57 F 4.7779 7.9428 115.4764 56.3998 39.8756 175.2863 58 Q 3.6023 7.9657 119.1808 57.1325 26.5494 174.1110 59 I 4.3813 8.1194 119.0015 61.1205 39.2895 176.8453 60 N 5.3077 9.2029 125.9295 53.3416 39.6978 175.7767 61 S 4.6708 9.0429 120.8425 60.3382 63.2120 175.5018 62 R 3.7117 8.7555 122.1409 58.6573 30.3700 177.8185 63 Y 4.1671 7.5669 114.0734 57.9986 40.8065 177.2091 64 W 4.7181 8.0872 119.2115 57.9547 30.2477 173.7699 65 C 5.5913 7.9277 110.6068 53.4444 45.5635 171.8256 66 N 4.8221 8.8930 119.7463 52.1733 39.7138 174.8312 67 D 4.7958 8.5339 123.0568 52.2708 40.5066 177.9272 68 G 4.1179 8.4153 110.3034 46.0282 0.0000 174.8401 69 K 4.3293 7.8946 116.0467 56.8663 33.3226 176.3633 70 T 4.4662 7.5234 116.7321 61.9271 68.8920 173.1153 71 P 4.2998 0.0000 0.0000 63.5052 32.0818 176.1625 72 G 3.9094 8.3757 107.8165 46.6343 0.0000 172.6115 73 A 4.7283 7.6809 118.2922 50.1323 21.9412 176.9387 74 V 4.3685 8.2848 112.2267 59.2684 35.7345 176.1212 75 N 4.9882 8.0865 116.9504 51.9620 37.5702 174.2821 76 A 4.0320 9.0436 123.8531 54.7907 19.2318 178.7178 77 C 4.4196 8.8291 110.9541 56.3439 40.9041 173.7393 78 H 4.1184 7.8938 115.5839 56.6335 26.4308 174.4335 79 L 4.8263 8.3506 117.3591 52.8330 46.4140 176.8241 80 S 4.5972 8.3728 115.6839 58.1139 63.2928 176.0052 81 C 4.1513 8.6103 123.5937 59.5343 40.7175 176.3246 82 S 3.9246 7.8288 114.7922 61.3316 61.6384 175.9712 83 A 4.0815 7.7357 122.4014 54.6102 17.8647 177.9917 84 L 4.4240 7.7891 116.0355 55.1776 41.7163 177.6850 85 L 5.2719 7.6849 116.6086 53.6947 42.3814 176.7352 86 Q 4.3596 7.8224 117.8303 55.4241 29.5263 175.9425 87 D 4.3999 8.5056 119.5940 57.0343 41.1496 176.7159 88 N 4.5799 8.0371 118.2020 53.0995 39.0479 174.6264 89 I 4.2049 8.4614 119.0418 61.0818 37.9746 176.9690 90 A 3.9415 8.3631 124.8028 56.0190 18.1768 180.0941 91 D 4.2889 8.0735 116.4377 57.3707 40.9121 178.6295 92 A 4.1024 7.9982 120.8949 55.1584 18.3674 179.7532 93 V 3.4035 8.1936 116.8175 66.0949 31.5541 178.1510 94 A 3.8279 8.0390 120.5423 55.2202 18.1114 178.8059 95 C 4.2446 8.4255 116.8980 59.5611 37.8772 175.5931 96 A 3.9281 8.1910 122.7140 55.0419 17.6225 179.7437 97 K 3.7670 7.6719 116.2557 59.4280 32.3840 179.2384 98 R 4.0719 7.6631 118.7623 59.2577 30.1046 178.5817 99 V 2.3617 7.4747 118.0360 65.7934 30.9202 178.0578 100 V 3.8970 7.6399 109.5891 62.7585 31.2826 177.8623 101 R 4.2024 7.6813 117.2628 56.8339 30.5994 176.3544 102 D 4.7523 7.4380 119.3605 52.6524 42.0087 175.3998 103 P 4.2272 0.0000 0.0000 66.1821 31.7509 178.1994 104 Q 4.0343 8.1473 116.3639 56.7204 30.1138 177.3472 105 G 3.6960 7.9456 106.9402 47.1317 0.0000 176.7705 106 I 3.5944 7.7760 121.9090 63.2572 37.8971 177.7025 107 R 4.1802 7.3524 117.5041 57.9791 29.9669 177.5321 108 A 3.9101 7.5692 120.4135 54.0067 18.7656 177.4623 109 W 4.7387 8.0237 117.0935 55.2917 30.0350 177.5236 110 V 3.7582 8.6991 123.6830 65.9315 30.9118 177.6243 111 A 4.0640 8.3023 120.2704 54.7649 18.1134 179.2045 112 W 3.9754 8.3716 126.6391 60.6786 30.5707 178.4603 113 R 3.6773 8.1613 116.4572 59.2340 29.6657 178.4079 114 N 4.3518 7.9304 115.1197 55.7270 38.7381 176.8928 115 R 4.0864 7.7604 115.8800 55.9090 31.5320 176.0266 116 C 4.5650 7.6599 115.6374 57.6698 42.7187 174.4404 117 Q 3.2784 6.4961 119.1790 57.2791 28.7027 175.4111 118 N 4.1870 8.7041 120.0140 54.0919 36.2175 173.7575 119 R 4.4669 7.3195 115.8641 54.0530 32.7960 175.7116 120 D 4.5443 8.4123 118.8571 54.1450 40.3796 175.8690 121 V 4.4954 8.1864 119.0662 61.3309 32.4411 178.3804 122 R 4.0444 8.0539 122.2056 59.4152 29.3787 178.6254 123 Q 3.9858 8.1040 116.8788 59.6140 28.0585 178.3609 124 Y 4.0497 7.7365 117.1950 59.8089 38.0742 176.8073 125 V 4.4199 7.8437 110.9992 60.6616 33.2629 175.4717 126 Q 4.0699 7.5385 120.4272 57.1505 28.7732 176.9699 127 G 3.9695 8.9280 110.4356 45.9271 0.0000 174.6317 128 C 4.3785 8.0974 117.0076 56.9832 40.5855 174.6154 129 G 4.0521 8.0350 106.7100 46.3379 0.0000 173.5280 130 A 4.2720 7.4308 128.2897 51.8974 19.0028 178.0670 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 K 8.17 4.17 0.00 1.81 1.67 0.00 1.31 0.00 0.00 1.18 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.92 1.15 7.81 2 V 8.14 4.52 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 0.91 0.00 0.00 0.95 0.00 0.00 3 F 10.00 4.31 0.00 2.85 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 4 E 8.90 4.28 0.00 1.93 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 2.31 2.25 0.00 5 R 8.94 3.25 0.00 1.93 1.92 0.00 3.45 0.00 0.00 3.48 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.79 0.00 6 C 8.03 4.34 0.00 3.00 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 7 E 8.10 3.90 0.00 2.06 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 0.00 2.59 2.42 0.00 8 L 8.02 3.58 0.00 1.36 1.39 -0.07 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.83 3.94 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 10 R 8.09 3.90 0.00 1.87 1.99 0.00 3.13 0.00 0.00 3.30 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 11 T 7.83 3.83 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 1.19 0.00 0.00 12 L 8.08 3.85 0.00 1.58 1.58 0.94 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 13 K 7.96 3.90 0.00 1.85 1.92 0.00 1.61 0.00 0.00 1.58 0.00 0.00 3.09 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.75 3.92 0.00 1.97 2.07 0.00 3.30 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.49 4.35 0.00 1.69 1.55 0.83 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.94 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 17 M 7.84 3.89 0.00 1.27 1.94 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.21 0.00 18 D 8.01 4.48 0.00 2.67 2.67 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 19 G 9.36 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 20 Y 8.28 4.16 0.00 3.34 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 21 R 8.98 3.67 0.00 1.87 1.84 0.00 3.22 0.00 0.00 2.99 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.33 0.00 22 G 8.30 3.81 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 0.00 0.00 0.00 23 I 7.56 4.09 1.80 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.75 -0.20 0.00 0.00 24 S 8.33 4.66 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 25 L 9.12 4.19 0.00 2.05 1.82 0.98 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.19 4.18 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.28 4.49 0.00 2.82 2.77 0.00 0.00 6.90 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 28 W 8.06 4.22 0.00 3.52 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 29 M 8.45 4.17 0.00 2.17 2.37 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.92 0.00 30 C 8.10 3.11 0.00 2.69 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 31 L 8.06 3.96 0.00 1.88 1.83 0.59 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.33 4.17 1.50 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 0.00 0.00 33 K 8.06 2.82 0.00 1.50 1.66 0.00 0.67 0.00 0.00 0.99 0.00 0.00 2.58 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.06 0.21 7.81 34 W 7.68 4.24 0.00 3.34 3.27 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 0.00 0.00 0.00 0.00 35 E 8.30 4.32 0.00 2.03 2.10 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 2.56 2.41 0.00 36 S 7.93 4.52 0.00 4.07 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 37 G 7.97 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 0.00 0.00 0.00 38 Y 7.65 3.66 0.00 3.25 2.99 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 39 N 7.59 5.35 0.00 2.89 2.81 0.00 0.00 7.02 7.10 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 40 T 8.99 4.12 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 41 R 7.99 4.52 0.00 2.00 2.09 0.00 3.08 0.00 0.00 3.25 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.70 0.00 42 A 7.60 4.34 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 43 T 8.38 5.01 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 1.33 0.00 0.00 44 N 8.77 4.84 0.00 3.03 2.67 0.00 0.00 6.87 6.84 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 45 Y 8.75 4.58 0.00 3.00 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 46 N 8.53 4.78 0.00 2.59 2.60 0.00 0.00 6.56 7.83 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 47 A 8.40 3.73 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 48 G 8.12 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 49 D 7.50 4.74 0.00 2.74 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 50 R 8.07 3.83 0.00 2.04 2.19 0.00 3.12 0.00 0.00 3.20 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.53 0.00 51 S 7.18 4.97 0.00 3.83 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 52 T 8.77 5.07 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 0.64 0.00 0.00 53 D 8.97 5.45 0.00 2.69 2.83 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 54 Y 9.22 5.08 0.00 2.94 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 55 G 9.13 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 0.00 0.00 0.00 56 I 8.15 3.83 1.68 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 1.72 0.10 0.00 0.00 57 F 7.94 4.78 0.00 3.25 3.01 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 0.00 0.00 0.00 0.00 58 Q 7.97 3.60 0.00 2.52 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.84 0.00 0.00 0.00 0.00 0.00 2.53 2.79 0.00 59 I 8.12 4.38 2.15 0.00 0.00 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 1.39 1.15 1.15 0.00 0.00 60 N 9.20 5.31 0.00 3.08 3.05 0.00 0.00 6.97 7.59 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 61 S 9.04 4.67 0.00 4.08 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 62 R 8.76 3.71 0.00 1.56 1.23 0.00 2.70 0.00 0.00 2.90 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.07 0.00 63 Y 7.57 4.17 0.00 1.49 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 0.00 0.00 0.00 64 W 8.09 4.72 0.00 3.65 3.30 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 65 C 7.93 5.59 0.00 3.17 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 66 N 8.89 4.82 0.00 2.80 2.71 0.00 0.00 7.06 9.28 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 67 D 8.53 4.80 0.00 2.90 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 68 G 8.42 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 0.00 0.00 0.00 69 K 7.89 4.33 0.00 1.94 1.95 0.00 1.64 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.48 7.81 70 T 7.52 4.47 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 1.15 0.00 0.00 71 P 0.00 4.30 0.00 2.02 1.97 0.00 3.81 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 2.03 2.09 0.00 72 G 8.38 3.91 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 0.00 73 A 7.68 4.73 1.18 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 0.00 0.00 74 V 8.28 4.37 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 0.64 0.00 0.00 0.88 0.00 0.00 75 N 8.09 4.99 0.00 2.78 2.65 0.00 0.00 6.77 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 76 A 9.04 4.03 1.26 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 0.00 0.00 0.00 77 C 8.83 4.42 0.00 3.16 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 78 H 7.89 4.12 0.00 3.31 3.36 0.00 5.62 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.35 4.83 0.00 1.67 1.50 0.96 0.70 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 80 S 8.37 4.60 0.00 3.83 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 81 C 8.61 4.15 0.00 2.24 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 82 S 7.83 3.92 0.00 3.89 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 83 A 7.74 4.08 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 84 L 7.79 4.42 0.00 1.94 1.81 1.06 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.68 5.27 0.00 1.79 1.71 1.10 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.82 4.36 0.00 2.21 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.63 7.10 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 87 D 8.51 4.40 0.00 2.65 2.67 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 88 N 8.04 4.58 0.00 2.69 2.75 0.00 0.00 6.97 7.94 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 89 I 8.46 4.20 1.77 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.75 0.99 0.00 0.00 90 A 8.36 3.94 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 91 D 8.07 4.29 0.00 2.75 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 92 A 8.00 4.10 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 93 V 8.19 3.40 2.19 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 0.79 0.00 0.00 0.90 0.00 0.00 94 A 8.04 3.83 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 95 C 8.43 4.24 0.00 3.16 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 96 A 8.19 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.67 3.77 0.00 1.63 1.40 0.00 1.30 0.00 0.00 0.83 0.00 0.00 2.28 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.30 0.98 7.81 98 R 7.66 4.07 0.00 1.93 2.13 0.00 3.28 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.95 0.00 99 V 7.47 2.36 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 -0.22 0.00 0.00 -0.72 0.00 0.00 100 V 7.64 3.90 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 1.13 0.00 0.00 1.47 0.00 0.00 101 R 7.68 4.20 0.00 2.10 2.05 0.00 3.24 0.00 0.00 3.31 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.79 0.00 102 D 7.44 4.75 0.00 3.07 2.61 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 0.00 103 P 0.00 4.23 0.00 2.03 2.13 0.00 3.95 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 2.02 0.00 104 Q 8.15 4.03 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.83 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 7.95 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 0.00 0.00 0.00 106 I 7.78 3.59 1.02 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.29 -0.48 0.00 0.00 107 R 7.35 4.18 0.00 2.06 2.03 0.00 3.21 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.55 0.00 108 A 7.57 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.02 4.74 0.00 3.51 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 0.00 110 V 8.70 3.76 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 1.10 0.00 0.00 1.00 0.00 0.00 111 A 8.30 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 112 W 8.37 3.98 0.00 3.49 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 0.00 113 R 8.16 3.68 0.00 2.08 1.98 0.00 3.57 0.00 0.00 3.43 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.10 0.00 114 N 7.93 4.35 0.00 2.69 2.71 0.00 0.00 6.95 7.81 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 0.00 115 R 7.76 4.09 0.00 0.75 0.75 0.00 2.84 0.00 0.00 2.87 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.94 0.00 116 C 7.66 4.56 0.00 1.66 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 0.00 117 Q 6.50 3.28 0.00 0.93 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.76 0.00 0.00 0.00 0.00 0.00 2.16 2.28 0.00 118 N 8.70 4.19 0.00 2.80 2.82 0.00 0.00 6.90 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 0.00 119 R 7.32 4.47 0.00 1.84 1.81 0.00 3.19 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.52 0.00 120 D 8.41 4.54 0.00 2.64 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 0.00 121 V 8.19 4.50 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.06 0.00 0.00 122 R 8.05 4.04 0.00 1.93 2.02 0.00 3.30 0.00 0.00 3.24 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 123 Q 8.10 3.99 0.00 2.09 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.91 0.00 0.00 0.00 0.00 0.00 2.05 1.56 0.00 124 Y 7.74 4.05 0.00 3.23 3.15 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 0.00 125 V 7.84 4.42 2.14 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 1.10 0.00 0.00 1.07 0.00 0.00 126 Q 7.54 4.07 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.69 0.00 0.00 0.00 0.00 0.00 2.55 2.45 0.00 127 G 8.93 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 0.00 128 C 8.10 4.38 0.00 3.04 3.13 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 0.00 129 G 8.04 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 0.00 130 A 7.43 4.27 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