NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.4103 8.3049 120.3287 55.2439 33.3478 174.6124 3 N 4.6303 8.2845 118.2038 51.5157 40.4270 171.8666 4 E 4.4485 9.4335 119.8465 56.8446 32.0575 175.8761 5 K 5.2414 9.5442 122.0339 55.1553 34.7099 175.5724 6 I 4.8686 8.8374 125.0428 59.3720 40.5090 174.0172 7 L 5.1747 8.9717 129.6738 53.5467 44.2088 174.8863 8 I 4.7044 9.0493 127.6131 59.6902 39.5529 174.6447 9 V 4.7908 8.5245 128.4369 61.4201 33.7501 173.9087 10 D 5.0537 8.9233 125.7648 53.6888 44.5439 175.9657 11 D 4.5459 8.6623 124.0288 55.1046 40.3613 177.0585 12 Q 4.2739 8.8917 120.7307 54.7581 29.1720 175.9211 13 S 4.2245 8.8760 120.9053 61.5332 62.2960 176.3886 14 G 3.5137 7.9908 107.4524 47.9734 0.0000 175.4073 15 I 3.7445 7.7171 121.5401 63.3576 38.0550 177.7755 16 R 3.9563 8.1648 119.6238 59.6758 30.0200 178.6872 17 I 3.7868 7.8247 119.5794 63.9906 36.9077 178.3210 18 L 3.9348 7.9066 121.4068 58.2513 42.0361 179.0461 19 L 3.8782 8.0993 118.9522 57.5716 41.4275 178.9929 20 N 4.3934 8.3321 117.0867 56.7712 38.9062 176.4696 21 E 3.8890 8.2667 120.6112 59.1757 29.4819 178.7145 22 V 3.4144 7.5245 117.2429 66.2894 31.9142 177.8156 23 F 4.6550 7.9275 116.8105 60.0126 38.6857 177.4933 24 N 4.6194 8.5479 117.4494 56.4466 38.5851 176.3549 25 K 4.2688 8.1196 117.2900 57.5667 32.4191 177.9433 26 E 4.3883 7.7967 118.3669 55.9072 30.0692 176.5579 27 G 3.9054 7.4469 105.1775 45.1815 0.0000 173.7599 28 Y 4.6131 7.7851 117.8963 57.6467 39.8666 174.6287 29 Q 4.5594 8.8598 121.9745 55.8184 29.7894 175.3080 30 T 5.2008 8.3379 114.3017 60.1506 71.6462 173.7247 31 F 4.9713 9.0611 120.2719 56.0588 43.7279 173.7154 32 Q 5.3109 8.8851 118.9113 54.3401 32.3684 174.7602 33 A 4.8143 9.1368 122.9433 50.6577 22.6214 176.6697 34 A 4.9926 10.0391 123.2899 51.7095 20.3914 176.4989 35 N 4.9890 7.5539 112.8887 50.6386 41.3491 175.4042 36 G 3.6002 8.5556 106.4980 47.7551 0.0000 175.4362 37 L 4.1295 7.9449 121.9515 57.5962 42.1714 178.6644 38 Q 4.0066 9.0108 118.5073 58.6625 28.4985 178.6368 39 A 3.9605 7.8970 121.3152 55.3396 18.4986 179.7204 40 L 3.9017 8.2780 117.8278 57.8577 41.5131 179.6775 41 D 4.3033 8.2194 118.8745 57.5798 40.8669 178.8597 42 I 3.5877 7.9881 120.5307 64.1685 36.9409 178.7613 43 V 3.4490 7.9923 119.4074 66.1463 31.1531 178.0754 44 T 3.7902 7.6761 114.1746 66.6621 68.4311 176.2340 45 K 4.0446 8.0192 120.0087 59.2402 32.3920 177.9885 46 E 4.1475 8.3895 116.9961 55.2637 31.4354 176.2625 47 R 3.7481 7.6693 116.5786 56.5444 27.6693 174.0659 48 P 4.4303 0.0000 0.0000 62.5274 32.8291 176.8260 49 D 4.6048 8.7783 120.2477 56.5232 42.1478 176.4695 50 L 5.2459 7.6635 118.6205 53.2149 46.1319 175.2020 51 V 4.7944 8.8252 124.4322 61.0976 35.0471 174.2627 52 L 4.8463 8.9936 128.3054 53.3481 43.2163 175.3268 53 L 4.7021 8.6873 128.3740 53.0377 43.4997 175.0868 54 D 4.8557 8.8737 128.1961 54.7157 41.1128 176.0534 55 M 4.2682 9.2453 126.3477 56.4332 32.5063 177.4653 56 K 4.5061 8.4704 118.5970 53.8540 32.3892 173.5572 57 I 4.4271 7.5315 120.6503 58.2190 39.5803 173.5385 58 P 4.2882 0.0000 0.0000 64.5809 31.3847 176.8650 59 G 3.9540 9.1083 111.3735 45.2669 0.0000 172.4018 60 M 4.4387 8.0914 119.8058 53.6409 34.1072 175.3593 61 D 4.7396 8.4906 125.4894 52.7182 41.6582 176.6084 62 G 3.7982 8.6099 114.8795 48.0996 0.0000 173.4396 63 I 3.7037 7.6363 122.0318 63.9921 37.1319 178.1694 64 E 3.9162 8.2703 119.5988 59.2728 29.5363 178.5250 65 I 3.6494 7.6374 119.8075 64.3636 37.1893 177.9161 66 L 3.8854 7.8134 120.9212 58.0668 41.8718 178.7085 67 K 3.8277 8.0372 119.2635 59.7157 32.0350 178.5884 68 R 3.8747 8.3696 118.3745 59.7377 30.0438 178.7409 69 M 3.9881 8.6125 118.5002 58.6810 31.8619 179.1360 70 K 3.9784 8.2163 118.3316 59.1246 31.8891 179.7269 71 V 3.5815 7.4252 117.9798 66.1232 31.6586 177.5723 72 I 4.0657 7.6458 118.5256 63.3200 37.8854 175.8973 73 D 4.5525 8.2717 120.3327 52.1271 41.7386 175.0604 74 E 4.2950 8.4553 123.0770 57.8832 29.8299 178.2794 75 N 4.5316 7.7709 115.5386 54.1617 39.0825 175.2752 76 I 3.8540 7.4348 119.3166 61.2087 38.8183 175.1876 77 R 4.7212 8.6398 126.6101 54.4006 33.2693 175.1227 78 V 4.9018 8.1100 121.0708 61.1880 35.6213 173.8890 79 I 5.0085 8.8119 127.5859 59.5069 40.2760 174.6911 80 I 4.7617 8.3517 120.3609 59.9907 40.1680 174.4291 81 M 5.3770 9.2253 124.1218 53.9633 34.9697 175.2823 82 T 5.0035 9.4254 113.7335 59.5999 72.4575 173.2829 83 A 4.5913 8.4375 123.2113 51.3613 19.8656 178.0883 84 Y 4.4099 8.9375 121.2292 56.6042 37.5580 177.7191 85 G 3.6827 8.5654 117.3291 46.9960 0.0000 173.0002 86 E 3.3787 7.9491 121.6844 56.1957 27.1764 175.9109 87 L 3.7708 8.0765 130.6126 59.3989 41.9594 178.5022 88 D 4.3370 10.1169 119.0724 57.3813 40.8280 178.5722 89 M 4.0060 8.7675 119.2186 58.7497 32.2513 178.3676 90 I 3.6063 7.7394 119.8848 64.4310 37.2373 178.2618 91 Q 3.9669 8.0219 120.3537 59.0928 28.7569 178.1510 92 E 4.1364 8.3415 120.0425 59.3216 29.4397 179.3301 93 S 4.0907 8.3306 114.6428 61.3826 62.9038 176.7990 94 K 3.9183 8.0754 122.0133 59.3486 31.6169 179.2355 95 E 3.9844 7.8918 117.5048 58.8960 29.4299 178.4883 96 L 4.3659 7.7469 116.8385 54.5168 42.1346 177.4142 97 G 3.9550 8.1855 106.8374 44.6067 0.0000 174.2286 98 A 4.0872 7.8857 123.0561 52.7471 18.8460 177.8125 99 L 3.9613 9.0840 123.3394 57.8413 42.4944 176.8731 100 T 4.1910 7.1411 110.5981 62.2689 71.2554 170.9113 101 H 5.3785 8.2992 115.7644 54.0911 31.7162 172.7814 102 F 5.0214 9.2611 118.4631 55.8010 42.6044 174.0085 103 A 5.6875 8.9218 123.6065 50.0409 21.0105 176.2827 104 K 4.9031 8.9651 120.1762 53.9565 34.0659 175.1919 105 P 4.0802 0.0000 0.0000 62.4935 32.0066 175.7091 106 F 4.9517 7.0437 115.7796 55.0316 40.3346 175.0329 107 D 4.6163 8.5640 121.1222 53.7746 42.0221 177.2837 108 I 3.7997 8.4263 128.3581 64.5139 37.1899 178.0613 109 D 4.3172 8.0603 119.7057 57.2206 40.7410 178.3012 110 E 4.1858 8.7529 118.0632 58.8573 29.7494 179.2547 111 I 3.0456 7.3064 121.0842 63.8743 37.0218 178.0826 112 R 3.9962 8.0345 119.7234 59.8095 29.9218 178.3667 113 D 4.3024 8.5173 118.7599 57.0296 40.8378 178.6551 114 A 3.7595 8.1757 121.7660 55.1969 18.4422 179.9395 115 V 3.4657 8.0155 117.0987 65.8998 31.0869 177.9659 116 K 4.4325 8.3537 118.6866 57.3470 31.6699 178.9612 117 K 4.0093 7.0404 118.6189 59.3847 32.4565 177.9082 118 Y 4.5902 7.3536 115.3856 59.5562 39.1003 176.1294 119 L 4.9277 8.0892 118.3046 52.1101 41.9714 174.9943 120 P 4.5492 0.0000 0.0000 62.1887 32.4355 177.1546 121 L 4.1610 8.4922 120.7033 55.1474 41.5346 176.9396 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 M 8.30 4.41 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.58 0.00 3 N 8.28 4.63 0.00 2.86 2.71 0.00 0.00 6.97 6.78 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 4 E 9.43 4.45 0.00 2.27 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 2.49 2.50 0.00 5 K 9.54 5.24 0.00 1.77 1.88 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.74 1.71 7.81 6 I 8.84 4.87 1.70 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.70 0.51 0.00 0.00 7 L 8.97 5.17 0.00 1.71 1.49 1.04 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 8 I 9.05 4.70 1.96 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.65 1.00 0.00 0.00 9 V 8.52 4.79 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 1.09 0.00 0.00 0.95 0.00 0.00 10 D 8.92 5.05 0.00 2.79 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 D 8.66 4.55 0.00 2.99 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 12 Q 8.89 4.27 0.00 2.24 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 13 S 8.88 4.22 0.00 3.90 3.90 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 14 G 7.99 3.51 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 0.00 15 I 7.72 3.74 1.88 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.41 1.08 0.00 0.00 16 R 8.16 3.96 0.00 2.10 2.08 0.00 3.27 0.00 0.00 3.47 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.73 0.00 17 I 7.82 3.79 2.08 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 1.42 0.69 0.92 0.00 0.00 18 L 7.91 3.93 0.00 1.90 1.86 0.89 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.10 3.88 0.00 1.99 1.88 1.11 0.43 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 20 N 8.33 4.39 0.00 2.99 3.06 0.00 0.00 6.81 7.03 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 21 E 8.27 3.89 0.00 2.23 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 2.30 2.45 0.00 22 V 7.52 3.41 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 0.32 0.00 0.00 0.81 0.00 0.00 23 F 7.93 4.65 0.00 3.22 3.14 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 0.00 24 N 8.55 4.62 0.00 3.18 2.92 0.00 0.00 7.07 6.67 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 25 K 8.12 4.27 0.00 1.89 1.83 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.67 1.70 7.81 26 E 7.80 4.39 0.00 2.47 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 0.00 2.63 2.69 0.00 27 G 7.45 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 28 Y 7.79 4.61 0.00 3.18 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 29 Q 8.86 4.56 0.00 2.22 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.72 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 30 T 8.34 5.20 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 1.36 0.00 0.00 31 F 9.06 4.97 0.00 3.01 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 32 Q 8.89 5.31 0.00 1.94 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.70 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 33 A 9.14 4.81 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 34 A 10.04 4.99 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 35 N 7.55 4.99 0.00 2.97 2.92 0.00 0.00 6.13 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.56 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 0.00 0.00 0.00 37 L 7.94 4.13 0.00 1.73 1.67 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 9.01 4.01 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.40 2.68 0.00 39 A 7.90 3.96 1.42 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 0.00 0.00 0.00 0.00 0.00 0.00 40 L 8.28 3.90 0.00 1.66 1.72 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 41 D 8.22 4.30 0.00 2.94 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 42 I 7.99 3.59 1.93 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.74 0.62 0.00 0.00 43 V 7.99 3.45 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 1.05 0.00 0.00 0.90 0.00 0.00 44 T 7.68 3.79 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 1.19 0.00 0.00 45 K 8.02 4.04 0.00 1.71 1.86 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.46 7.81 46 E 8.39 4.15 0.00 1.41 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 2.05 1.47 0.00 47 R 7.67 3.75 0.00 1.86 1.89 0.00 3.14 0.00 0.00 3.19 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.52 0.00 48 P 0.00 4.43 0.00 1.95 1.90 0.00 3.55 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.72 0.00 49 D 8.78 4.60 0.00 2.76 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 50 L 7.66 5.25 0.00 1.61 1.26 0.89 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.83 4.79 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 1.04 0.00 0.00 0.88 0.00 0.00 52 L 8.99 4.85 0.00 1.54 1.59 0.88 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 53 L 8.69 4.70 0.00 1.75 1.56 0.93 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 54 D 8.87 4.86 0.00 2.94 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 55 M 9.25 4.27 0.00 1.94 2.20 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 2.66 2.97 0.00 56 K 8.47 4.51 0.00 1.75 1.74 0.00 1.68 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.55 7.81 57 I 7.53 4.43 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.89 0.96 0.00 0.00 58 P 0.00 4.29 0.00 2.04 2.05 0.00 3.72 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 59 G 9.11 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 60 M 8.09 4.44 0.00 2.04 1.95 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.44 0.00 61 D 8.49 4.74 0.00 2.74 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 62 G 8.61 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 63 I 7.64 3.70 1.99 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 1.40 1.12 0.94 0.00 0.00 64 E 8.27 3.92 0.00 2.07 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 0.00 2.37 2.46 0.00 65 I 7.64 3.65 2.02 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 1.63 0.89 0.91 0.00 0.00 66 L 7.81 3.89 0.00 1.76 1.88 0.89 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 67 K 8.04 3.83 0.00 1.95 2.03 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.48 7.81 68 R 8.37 3.87 0.00 1.96 1.96 0.00 3.35 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.82 0.00 69 M 8.61 3.99 0.00 1.98 2.30 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.57 0.00 70 K 8.22 3.98 0.00 1.94 1.83 0.00 1.65 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.54 1.70 7.81 71 V 7.43 3.58 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 0.82 0.00 0.00 0.93 0.00 0.00 72 I 7.65 4.07 1.98 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 1.39 0.77 0.88 0.00 0.00 73 D 8.27 4.55 0.00 2.65 2.44 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 74 E 8.46 4.29 0.00 2.09 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 2.26 2.28 0.00 75 N 7.77 4.53 0.00 2.85 2.88 0.00 0.00 6.91 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 76 I 7.43 3.85 2.05 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 0.89 0.93 0.00 0.00 77 R 8.64 4.72 0.00 1.93 1.65 0.00 3.01 0.00 0.00 3.01 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.46 0.00 78 V 8.11 4.90 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 1.04 0.00 0.00 0.89 0.00 0.00 79 I 8.81 5.01 1.95 0.00 0.00 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 1.44 0.70 1.21 0.00 0.00 80 I 8.35 4.76 1.90 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 1.39 0.70 0.92 0.00 0.00 81 M 9.23 5.38 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.46 0.00 82 T 9.43 5.00 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 1.26 0.00 0.00 83 A 8.44 4.59 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 84 Y 8.94 4.41 0.00 3.22 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 85 G 8.57 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 E 7.95 3.38 0.00 2.04 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 0.00 2.31 2.24 0.00 87 L 8.08 3.77 0.00 1.71 1.61 0.90 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 88 D 10.12 4.34 0.00 2.69 2.68 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 0.00 0.00 0.00 0.00 89 M 8.77 4.01 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.57 0.00 90 I 7.74 3.61 1.91 0.00 0.00 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 1.14 0.52 0.78 0.00 0.00 91 Q 8.02 3.97 0.00 2.16 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 92 E 8.34 4.14 0.00 2.05 1.96 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 2.31 2.30 0.00 93 S 8.33 4.09 0.00 4.01 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 0.00 94 K 8.08 3.92 0.00 2.01 1.87 0.00 1.62 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.43 1.47 7.81 95 E 7.89 3.98 0.00 2.11 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 2.33 2.49 0.00 96 L 7.75 4.37 0.00 1.77 1.68 0.90 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 97 G 8.19 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 98 A 7.89 4.09 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 99 L 9.08 3.96 0.00 1.46 1.41 0.70 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 100 T 7.14 4.19 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 1.16 0.00 0.00 101 H 8.30 5.38 0.00 3.08 3.14 0.00 5.72 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 F 9.26 5.02 0.00 2.96 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 0.00 103 A 8.92 5.69 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.97 4.90 0.00 1.72 1.71 0.00 1.82 0.00 0.00 1.86 0.00 0.00 3.36 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.88 1.79 7.81 105 P 0.00 4.08 0.00 1.98 1.87 0.00 3.45 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 1.80 1.76 0.00 106 F 7.04 4.95 0.00 3.08 3.40 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 0.00 107 D 8.56 4.62 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 0.00 108 I 8.43 3.80 1.86 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.77 0.82 0.00 0.00 109 D 8.06 4.32 0.00 2.85 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 0.00 110 E 8.75 4.19 0.00 2.26 2.24 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 2.64 2.32 0.00 111 I 7.31 3.05 1.75 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.34 0.67 0.00 0.00 112 R 8.03 4.00 0.00 1.92 2.11 0.00 3.23 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 113 D 8.52 4.30 0.00 2.70 2.68 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 0.00 0.00 0.00 0.00 114 A 8.18 3.76 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 0.00 115 V 8.02 3.47 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 0.54 0.00 0.00 0.82 0.00 0.00 116 K 8.35 4.43 0.00 1.87 1.91 0.00 1.89 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.69 1.63 7.81 117 K 7.04 4.01 0.00 1.82 1.63 0.00 1.67 0.00 0.00 1.56 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.44 7.81 118 Y 7.35 4.59 0.00 3.01 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 0.00 119 L 8.09 4.93 0.00 1.69 1.91 0.61 0.96 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 0.00 120 P 0.00 4.55 0.00 2.08 2.06 0.00 3.90 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 121 L 8.49 4.16 0.00 1.57 1.47 0.65 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00