NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.1745 8.0976 119.6944 57.2343 30.9424 174.5359 3 H 4.0368 8.9073 116.1343 55.4725 27.9829 173.6848 4 L 4.4153 8.7133 122.9545 55.8045 42.4951 179.3235 5 K 4.2298 7.6345 113.3516 57.7477 31.6606 176.2244 6 S 4.7861 7.8735 113.8370 55.5824 65.7002 173.8860 7 G 3.5341 8.5536 110.3598 46.1980 0.0000 175.1741 8 R 3.7055 8.6049 122.2244 56.2818 29.9517 174.7946 9 K 4.7097 7.9144 113.6949 56.2755 35.4999 175.1631 10 L 4.4246 8.0358 117.4558 54.0921 45.3379 174.4683 11 N 4.6052 8.3779 120.4029 52.6005 41.0045 174.7658 12 R 3.9264 9.8036 120.0785 55.3454 30.3953 176.9343 13 H 4.8343 7.8082 120.7588 56.5555 27.2562 175.3708 14 S 4.5582 8.1918 109.6598 58.9837 63.3363 175.9555 15 S 4.1750 8.1033 117.3911 61.6505 62.7654 175.8862 16 H 4.1634 8.2896 121.6128 58.5270 29.6338 176.8840 17 R 3.6823 7.7957 117.2365 59.2943 29.1352 178.6308 18 L 4.0593 8.6472 120.7652 58.1348 42.1904 178.9327 19 A 4.0247 7.9649 120.4731 54.6963 18.1219 179.4465 20 L 3.7398 8.0401 119.5870 58.4889 42.0903 178.6654 21 Y 3.8713 7.5898 116.6872 61.0298 37.6408 178.7907 22 R 3.8890 7.8169 118.7493 59.6348 30.1895 178.9727 23 N 4.3498 8.4858 116.3560 56.1640 38.4514 177.7098 24 Q 3.9097 8.2817 119.4807 58.8269 28.8043 178.2214 25 A 4.0366 8.1697 122.0619 55.3024 18.1894 179.4235 26 K 3.8281 8.0792 115.6760 60.1061 32.4327 179.2096 27 S 4.3011 7.8952 114.5143 61.7012 62.7455 176.6830 28 L 3.9908 8.5822 123.2045 57.8428 41.6292 178.2150 29 L 4.3259 8.1675 116.7316 55.9889 41.9451 177.9917 30 T 4.3153 7.8793 115.2604 64.3327 69.4474 174.9614 31 H 4.7820 7.9983 115.6283 54.2782 31.5433 175.2776 32 G 4.2052 8.6752 110.1758 45.0650 0.0000 173.0937 33 R 5.0535 8.0186 117.4669 54.3984 32.9923 175.4160 34 I 4.7207 8.6828 125.2121 59.4989 40.8161 174.7462 35 T 4.9429 8.4232 116.7113 60.8618 70.5977 173.5913 36 T 4.5915 8.4286 118.5790 61.2398 71.9197 172.4597 37 T 4.4016 8.3709 113.0843 61.2547 69.7373 175.0519 38 V 3.5746 8.2088 124.3579 66.1584 31.5496 176.6553 39 P 4.2225 0.0000 0.0000 65.6782 31.2602 178.4062 40 K 3.8228 7.8050 116.7485 59.7461 32.0104 179.0495 41 A 3.9851 8.1440 120.5170 55.3178 17.3156 179.6495 42 K 3.9874 8.1343 116.7447 59.7778 31.7440 179.4411 43 E 4.2079 8.2105 118.1893 59.2663 29.6465 178.8210 44 L 4.1331 8.2951 120.4291 58.1882 41.9512 178.4481 45 R 3.9851 8.7145 119.1594 60.0465 30.0246 178.7029 46 G 3.6697 7.8408 105.3150 47.4211 0.0000 175.4200 47 F 4.0262 7.8504 122.7600 61.1942 39.3489 177.5069 48 V 3.7420 8.0633 117.9596 66.1427 31.3685 177.4937 49 D 4.3258 7.9338 118.3599 57.9132 40.7007 178.5644 50 H 4.0850 7.7906 117.1916 59.0279 29.7939 177.3872 51 L 3.8449 7.2617 119.5708 57.5394 41.3736 179.4464 52 I 3.3250 7.6850 120.1264 64.5012 36.8477 177.8749 53 H 3.9163 7.3636 117.9967 58.9545 29.9408 176.7259 54 L 4.0179 7.5811 121.9026 57.8330 41.7666 178.5771 55 A 3.5520 7.5282 119.3139 54.1470 18.1876 179.0468 56 K 3.9017 7.9835 118.2117 60.7999 32.6493 178.9300 57 R 4.3989 7.9185 122.1664 56.0320 29.8449 175.4496 58 G 4.2496 8.7884 102.5831 45.0623 0.0000 173.8817 59 D 4.4315 8.0378 119.8505 53.5449 40.8779 177.7729 60 L 3.8704 8.4659 121.6321 58.9878 40.1749 179.0911 61 H 4.1112 8.2077 118.7593 59.3288 29.9429 176.8852 62 A 4.0090 7.8859 121.5721 55.0314 18.2553 179.4562 63 R 3.9158 7.9029 117.3008 59.8459 29.9857 178.9229 64 R 3.9556 8.4796 117.7683 59.0693 30.1891 178.6892 65 L 4.0419 8.0895 120.5281 58.2322 42.0874 179.2363 66 V 3.7380 7.8500 117.4376 65.3006 31.2092 177.7200 67 L 4.3711 7.4886 118.8926 56.8821 41.4025 179.1933 68 R 4.1024 7.5610 117.8027 59.4429 30.0873 178.3142 69 D 4.6094 7.9816 116.9606 55.9834 41.3315 176.3480 70 L 4.3309 7.6110 118.9979 54.4129 42.4953 177.8039 71 Q 4.1216 8.5765 123.9026 57.5215 30.1227 175.6063 72 D 4.4472 7.9414 117.9126 53.8538 41.9591 176.6145 73 V 3.6511 8.4679 127.1788 66.0686 31.5689 177.9738 74 K 3.9951 8.2238 117.8991 59.1862 31.9747 178.9509 75 L 3.9643 7.8090 120.6222 58.1595 42.0866 179.4686 76 V 3.7027 7.8741 119.2153 64.5648 30.8879 178.1619 77 R 3.9775 8.3162 119.6685 59.4317 29.9265 178.4529 78 K 3.9959 8.2565 119.2597 59.1310 32.0107 178.6234 79 L 3.8430 7.7928 120.8256 58.1856 41.9407 178.7506 80 F 4.2784 8.1901 114.9457 59.3594 38.8734 176.0482 81 D 4.7311 7.5775 116.9312 55.5956 41.9420 177.5138 82 E 4.2687 8.1857 118.6350 58.7094 30.0379 178.3336 83 I 3.8204 7.6926 117.5408 64.3790 37.5558 177.7294 84 A 4.1540 8.2765 121.6456 54.8749 18.2118 177.6862 85 P 4.2070 0.0000 0.0000 66.0672 31.2379 178.7706 86 R 3.7194 7.3969 115.3325 58.9779 29.8654 177.5419 87 Y 4.6855 7.5342 114.1246 56.7014 39.2469 175.7736 88 R 3.9626 8.1270 121.7417 57.9146 30.5844 177.7626 89 D 4.6871 8.8092 121.9292 54.9998 39.6799 174.9322 90 R 4.2081 7.5107 120.7932 54.3316 28.3125 174.2130 91 Q 3.9166 7.8558 117.6990 56.6782 29.2297 177.5512 92 G 3.8136 8.5449 109.5413 45.6134 0.0000 172.1353 93 G 3.7968 8.0916 104.1867 46.8890 0.0000 174.3582 94 Y 4.1395 7.6743 114.0462 58.9260 39.1306 176.3734 95 T 4.8531 7.5297 112.9831 60.5481 71.1147 172.6428 96 R 4.8335 9.5337 125.5058 54.5750 33.9895 174.3514 97 V 5.0984 8.3482 116.0790 59.6050 35.1976 174.9959 98 L 4.7867 8.9608 124.6847 52.5289 45.3793 176.0838 99 K 4.3160 8.8160 123.9630 56.6166 32.3823 176.8649 100 L 4.5339 8.4877 125.3531 54.0300 42.4981 177.1245 101 A 4.2890 8.5708 123.1839 53.5077 19.7819 178.0014 102 E 4.3200 7.8989 115.5907 56.3588 31.0639 176.0964 103 R 4.7435 8.2057 120.1741 53.9980 33.6607 175.3810 104 R 3.9437 8.8755 125.0485 56.4469 30.9679 176.1774 105 R 4.1646 8.5527 126.6037 57.6145 31.0216 175.0280 106 G 4.3918 9.2360 117.4284 45.6062 0.0000 174.1959 107 D 4.6487 7.7428 115.7667 51.5723 40.5134 176.6207 108 G 3.8793 8.2419 107.3348 46.2393 0.0000 173.5541 109 A 4.1543 8.5509 122.4315 51.0883 19.5778 176.0897 110 P 4.5943 0.0000 0.0000 62.4915 32.7202 175.9769 111 L 4.7600 8.2222 123.2384 53.8568 44.6175 175.1327 112 A 4.9704 8.7894 121.7473 51.1308 23.6995 174.5921 113 L 5.0451 8.8759 120.0056 53.5650 45.5702 175.5109 114 V 4.7323 9.1240 127.2437 61.6269 32.7998 173.5387 115 E 5.1241 9.0310 130.3747 54.0411 31.9245 174.7890 116 L 4.5405 8.8888 128.0479 54.4729 41.8977 177.4676 117 V 3.8494 7.9835 123.7491 62.3284 32.1049 176.1979 118 E 4.2746 8.5136 122.1482 57.0221 29.3396 174.8836 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 R 8.10 4.17 0.00 1.74 1.84 0.00 3.43 0.00 0.00 3.35 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 3 H 8.91 4.04 0.00 3.49 3.54 0.00 5.45 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 8.71 4.42 0.00 1.70 1.63 0.98 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 5 K 7.63 4.23 0.00 1.83 1.85 0.00 1.58 0.00 0.00 1.83 0.00 0.00 3.13 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.43 7.81 6 S 7.87 4.79 0.00 3.93 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 7 G 8.55 3.53 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 0.00 0.00 0.00 8 R 8.60 3.71 0.00 2.23 2.04 0.00 3.04 0.00 0.00 3.33 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 9 K 7.91 4.71 0.00 1.80 1.78 0.00 1.68 0.00 0.00 1.94 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.57 7.81 10 L 8.04 4.42 0.00 1.65 1.64 0.98 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.38 4.61 0.00 2.62 2.65 0.00 0.00 7.09 7.65 0.00 0.00 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 R 9.80 3.93 0.00 1.80 1.66 0.00 2.90 0.00 0.00 2.62 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.32 0.00 13 H 7.81 4.83 0.00 3.38 3.28 0.00 5.64 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.19 4.56 0.00 4.12 4.06 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 15 S 8.10 4.18 0.00 4.10 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 0.00 16 H 8.29 4.16 0.00 2.78 2.96 0.00 5.69 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 7.80 3.68 0.00 2.05 2.36 0.00 2.96 0.00 0.00 3.38 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.76 0.00 18 L 8.65 4.06 0.00 1.79 1.98 0.97 1.14 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 19 A 7.96 4.02 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 20 L 8.04 3.74 0.00 1.58 1.49 0.77 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 7.59 3.87 0.00 2.77 1.61 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 22 R 7.82 3.89 0.00 2.02 2.01 0.00 3.16 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.90 0.00 23 N 8.49 4.35 0.00 2.83 2.84 0.00 0.00 7.11 6.88 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 24 Q 8.28 3.91 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 25 A 8.17 4.04 1.54 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 0.00 0.00 26 K 8.08 3.83 0.00 1.91 1.92 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.14 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.74 7.81 27 S 7.90 4.30 0.00 4.01 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 28 L 8.58 3.99 0.00 1.78 1.86 0.95 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 29 L 8.17 4.33 0.00 1.64 1.69 0.90 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 30 T 7.88 4.32 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 0.93 0.00 0.00 31 H 8.00 4.78 0.00 3.16 3.28 0.00 5.68 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 8.68 4.21 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 0.00 33 R 8.02 5.05 0.00 1.68 1.86 0.00 3.20 0.00 0.00 3.26 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 34 I 8.68 4.72 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 1.33 0.97 0.92 0.00 0.00 35 T 8.42 4.94 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 36 T 8.43 4.59 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 1.21 0.00 0.00 37 T 8.37 4.40 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 38 V 8.21 3.57 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 1.03 0.00 0.00 0.93 0.00 0.00 39 P 0.00 4.22 0.00 2.19 2.08 0.00 3.61 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 40 K 7.80 3.82 0.00 1.88 2.00 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.45 7.81 41 A 8.14 3.99 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 42 K 8.13 3.99 0.00 1.97 1.92 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.75 7.81 43 E 8.21 4.21 0.00 2.30 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 2.53 2.43 0.00 44 L 8.30 4.13 0.00 1.90 1.99 0.99 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.71 3.99 0.00 1.97 2.12 0.00 3.16 0.00 0.00 3.19 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 46 G 7.84 3.67 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 0.00 0.00 0.00 47 F 7.85 4.03 0.00 2.97 3.16 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 48 V 8.06 3.74 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 1.03 0.00 0.00 1.11 0.00 0.00 49 D 7.93 4.33 0.00 2.96 2.85 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 50 H 7.79 4.09 0.00 3.17 3.21 0.00 5.78 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.26 3.84 0.00 1.82 1.56 1.03 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.68 3.33 1.21 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.46 0.05 0.00 0.00 53 H 7.36 3.92 0.00 3.02 3.24 0.00 5.75 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 7.58 4.02 0.00 1.82 1.60 0.83 1.30 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 55 A 7.53 3.55 0.54 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 0.00 0.00 56 K 7.98 3.90 0.00 1.59 1.86 0.00 1.76 0.00 0.00 1.67 0.00 0.00 3.66 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.39 1.47 7.81 57 R 7.92 4.40 0.00 1.90 1.89 0.00 3.61 0.00 0.00 3.25 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.59 0.00 58 G 8.79 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 0.00 0.00 0.00 0.00 59 D 8.04 4.43 0.00 2.90 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 60 L 8.47 3.87 0.00 1.81 1.90 0.89 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 61 H 8.21 4.11 0.00 3.19 3.58 0.00 5.68 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 7.89 4.01 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 63 R 7.90 3.92 0.00 1.31 1.86 0.00 2.82 0.00 0.00 3.03 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.37 0.00 64 R 8.48 3.96 0.00 1.90 1.97 0.00 3.21 0.00 0.00 3.14 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 65 L 8.09 4.04 0.00 1.86 1.78 0.86 0.90 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 66 V 7.85 3.74 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 0.96 0.00 0.00 0.99 0.00 0.00 67 L 7.49 4.37 0.00 1.83 1.74 1.01 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 68 R 7.56 4.10 0.00 1.87 2.02 0.00 3.16 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.83 0.00 69 D 7.98 4.61 0.00 2.77 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 L 7.61 4.33 0.00 1.71 1.62 0.93 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.58 4.12 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.99 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 72 D 7.94 4.45 0.00 2.80 2.56 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 73 V 8.47 3.65 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 1.10 0.00 0.00 0.94 0.00 0.00 74 K 8.22 4.00 0.00 2.18 1.85 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.54 1.50 7.81 75 L 7.81 3.96 0.00 1.91 1.80 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 76 V 7.87 3.70 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 0.92 0.00 0.00 1.22 0.00 0.00 77 R 8.32 3.98 0.00 2.09 2.18 0.00 3.12 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.69 0.00 78 K 8.26 4.00 0.00 1.88 2.05 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.46 7.81 79 L 7.79 3.84 0.00 1.90 1.46 0.68 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 80 F 8.19 4.28 0.00 3.09 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 81 D 7.58 4.73 0.00 2.69 2.70 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 82 E 8.19 4.27 0.00 2.06 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 0.00 2.26 2.33 0.00 83 I 7.69 3.82 2.02 0.00 0.00 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 1.81 0.92 1.00 0.00 0.00 84 A 8.28 4.15 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 85 P 0.00 4.21 0.00 2.17 2.14 0.00 3.71 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.22 0.00 86 R 7.40 3.72 0.00 1.60 1.58 0.00 3.09 0.00 0.00 3.30 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.78 0.00 87 Y 7.53 4.69 0.00 3.21 3.33 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 88 R 8.13 3.96 0.00 2.03 1.81 0.00 3.27 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 89 D 8.81 4.69 0.00 2.91 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 90 R 7.51 4.21 0.00 1.84 2.09 0.00 3.45 0.00 0.00 3.24 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 91 Q 7.86 3.92 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.60 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 92 G 8.54 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 93 G 8.09 3.80 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 0.00 0.00 0.00 94 Y 7.67 4.14 0.00 2.71 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 0.00 0.00 0.00 0.00 95 T 7.53 4.85 4.33 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 1.27 0.00 0.00 96 R 9.53 4.83 0.00 1.87 1.86 0.00 3.28 0.00 0.00 3.18 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 97 V 8.35 5.10 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 0.81 0.00 0.00 0.94 0.00 0.00 98 L 8.96 4.79 0.00 1.51 1.52 0.93 0.91 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 99 K 8.82 4.32 0.00 1.64 1.77 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.42 7.81 100 L 8.49 4.53 0.00 1.66 1.59 0.92 0.77 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 0.00 101 A 8.57 4.29 1.27 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 0.00 0.00 102 E 7.90 4.32 0.00 1.94 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 2.39 2.34 0.00 103 R 8.21 4.74 0.00 1.63 1.79 0.00 3.22 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 104 R 8.88 3.94 0.00 1.87 2.05 0.00 3.08 0.00 0.00 3.08 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 105 R 8.55 4.16 0.00 1.81 1.81 0.00 3.26 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 106 G 9.24 4.39 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 0.00 107 D 7.74 4.65 0.00 2.76 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 0.00 108 G 8.24 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 0.00 0.00 0.00 109 A 8.55 4.15 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 0.00 110 P 0.00 4.59 0.00 2.08 1.99 0.00 3.58 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.11 0.00 111 L 8.22 4.76 0.00 1.70 1.56 0.92 0.56 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 0.00 112 A 8.79 4.97 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 0.00 113 L 8.88 5.05 0.00 1.72 1.58 0.97 1.30 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 0.00 114 V 9.12 4.73 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 0.90 0.00 0.00 0.96 0.00 0.00 115 E 9.03 5.12 0.00 2.07 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 2.26 2.29 0.00 116 L 8.89 4.54 0.00 1.76 1.88 1.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 117 V 7.98 3.85 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 0.94 0.00 0.00 1.00 0.00 0.00 118 E 8.51 4.27 0.00 1.89 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 2.12 2.27 0.00