NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3061 8.3049 120.3239 54.2695 34.5004 175.6187 2 E 3.5496 8.1462 115.2311 56.8059 26.7383 173.8580 3 L 4.2054 7.5045 119.1777 54.7657 43.6044 178.4653 4 T 4.2969 8.7014 115.1448 60.3813 71.1956 173.9112 5 P 4.2763 0.0000 0.0000 65.6940 31.3635 179.1751 6 R 3.9751 7.9450 114.4957 59.3166 29.1605 178.6955 7 E 3.9882 7.6171 117.7227 59.0983 29.5693 179.0964 8 K 4.1247 7.9567 118.2156 59.1563 31.9848 179.0260 9 D 4.3332 8.1147 118.6364 57.3404 41.2142 178.4861 10 K 4.0335 8.0261 118.4657 59.1478 31.9433 179.2804 11 L 4.0680 7.6029 119.5224 57.3527 41.4503 179.1643 12 L 4.0004 8.0839 120.8684 57.8211 42.0506 178.7123 13 L 3.9374 7.7901 119.8575 58.1348 42.2389 178.3224 14 F 4.1597 8.3958 120.6387 61.8667 39.2478 177.2822 15 T 3.7262 8.1469 114.9316 66.5216 68.3059 176.5723 16 A 3.9695 8.1403 122.4883 55.1372 18.2729 179.5820 17 A 3.9157 8.0664 119.2790 55.0267 18.5031 179.7859 18 L 3.7153 7.4285 117.5624 57.7864 41.5186 179.7852 19 V 3.5082 7.5014 117.4048 66.0102 31.4206 177.9565 20 A 3.9453 7.7193 119.8716 55.0822 18.2357 178.9951 21 E 3.8173 8.4100 118.2293 59.7729 29.5154 179.4420 22 R 3.9721 7.8788 117.5013 59.1009 30.0611 179.2951 23 R 3.9384 7.7741 118.2780 58.9753 30.0066 178.6813 24 L 3.9233 8.1695 120.1453 58.1053 41.8425 178.8784 25 A 3.9677 7.7529 119.7813 55.1235 18.3853 179.3178 26 R 4.1342 7.5160 115.0116 57.2287 30.2230 177.5470 27 G 3.8869 8.1382 107.1175 45.4870 0.0000 173.2867 28 L 4.4800 7.4400 118.5071 53.3584 43.0993 176.9053 29 K 4.4346 8.4652 121.8477 55.6927 32.6749 177.1143 30 L 4.4354 8.7861 126.1590 55.1614 43.2449 176.9735 31 N 4.7913 8.5902 119.3920 51.9947 40.4309 174.5837 32 Y 4.1253 8.9018 118.3142 60.8677 38.9244 176.7200 33 P 3.9449 0.0000 0.0000 65.6686 31.4203 178.1991 34 E 3.9205 8.7108 118.7654 59.1871 29.3427 179.3781 35 S 4.0263 8.0672 115.1885 61.5848 62.9718 176.7823 36 V 3.4455 7.3766 120.4820 66.0207 31.1314 177.9098 37 A 3.9633 7.7432 120.0041 54.8643 18.2450 179.3569 38 L 3.8473 7.8869 118.7791 58.5366 42.3817 179.3345 39 I 3.7676 7.7060 119.7173 64.3344 37.0537 178.6904 40 S 4.1353 8.2256 115.7870 61.6873 62.7419 176.5612 41 A 4.0679 8.2249 123.4829 54.9920 18.0389 179.2836 42 F 4.0582 8.2206 118.9998 61.7872 39.5168 177.4070 43 I 3.5347 7.8351 118.9329 64.5727 36.8570 178.3429 44 M 3.9363 7.9286 119.3016 58.5502 31.8527 178.7622 45 E 4.0452 8.1629 118.6122 58.8477 29.5049 179.6909 46 G 3.2927 7.6200 105.9420 47.6676 0.0000 175.6808 47 A 3.2701 7.6224 123.5929 54.3590 17.8995 179.6589 48 R 3.7111 7.3575 116.4415 59.6716 30.2067 178.3126 49 D 4.4917 7.8503 117.6995 55.5688 40.7550 177.3853 50 G 4.1238 7.4094 106.8697 45.1948 0.0000 173.9106 51 K 4.2447 7.6526 118.6824 55.6320 32.9276 177.8537 52 S 4.5285 8.3791 116.7148 57.8291 65.3618 175.5888 53 V 3.5415 8.0475 121.2590 66.1831 30.8378 177.9135 54 A 4.0380 7.9466 119.9685 55.1583 18.1255 179.6931 55 S 3.9982 7.8844 113.6367 61.9124 62.9389 176.8781 56 L 4.0862 7.9203 121.3862 58.1801 41.1326 179.4821 57 M 4.1031 8.0725 117.7064 57.9566 32.0695 178.0528 58 E 4.2051 7.6631 119.1884 59.0413 30.1594 178.2172 59 E 4.2557 8.6836 118.8856 59.3180 29.3233 179.5622 60 G 3.8548 8.4935 105.1283 46.9373 0.0000 174.3135 61 R 4.8256 7.5611 117.8591 56.0227 30.1588 176.2443 62 H 4.9474 7.8236 114.4072 55.5874 30.0471 175.0260 63 V 3.5715 7.8555 120.9674 64.5789 31.7469 176.2439 64 L 4.9069 7.4560 117.1168 52.9789 45.1547 175.9269 65 T 4.5146 8.6672 112.6369 59.5015 71.3607 175.5838 66 R 3.8402 8.3603 121.5443 59.2176 30.0561 177.2565 67 E 4.3398 7.6483 113.1815 56.7157 29.9422 176.5625 68 Q 4.5938 8.2248 118.1784 56.0817 30.4170 175.3031 69 V 5.0406 7.2350 110.7853 59.1676 35.3046 175.4147 70 M 4.3295 8.9846 122.2400 54.9844 33.2518 175.9335 71 E 3.9856 8.5773 121.6133 57.7498 30.3713 176.8397 72 G 4.1264 8.9471 113.8543 44.7715 0.0000 175.6330 73 V 3.6749 7.5587 119.5003 65.5523 31.4219 176.2943 74 P 4.3397 0.0000 0.0000 65.5573 31.0984 178.1746 75 E 4.1256 8.0343 117.4566 58.9017 29.6002 178.2743 76 M 4.3409 7.7302 116.4706 56.5901 31.3555 176.8087 77 I 4.6732 7.3336 119.8469 58.3848 37.6562 173.8618 78 P 4.6207 0.0000 0.0000 65.2186 32.6171 176.1221 79 D 5.0012 7.2893 117.8671 52.8870 42.7163 175.2103 80 I 4.7604 8.6388 119.4513 59.7702 41.3497 174.6319 81 Q 5.6324 8.8578 124.3413 53.2364 32.3481 174.9859 82 V 4.5473 8.1757 120.1603 60.8493 34.5501 172.1896 83 E 5.6193 9.0216 121.0083 54.3117 32.7842 174.6615 84 A 4.6060 8.3486 121.9810 51.1828 23.4321 175.3188 85 T 4.3615 8.2653 116.0769 62.9857 68.9922 175.6156 86 F 4.4220 9.1498 126.6312 55.3705 40.5334 175.3538 87 P 4.4147 0.0000 0.0000 64.9086 31.1681 177.0078 88 D 4.8376 8.2465 117.8446 52.6001 39.8996 176.6275 89 G 3.9332 7.9229 106.8779 45.5194 0.0000 173.0550 90 S 5.3195 8.1513 114.3742 58.2504 63.4671 174.5315 91 K 4.6602 8.8026 121.9496 54.6267 36.8473 174.5674 92 L 4.8255 8.4217 124.4209 53.7926 43.5851 175.5155 93 V 4.4041 8.6852 126.5686 61.5261 33.6363 174.2034 94 T 4.9712 8.5810 124.3314 61.7064 70.9670 173.5527 95 V 4.3168 8.7703 126.9723 61.4161 33.7863 174.0211 96 H 4.8168 8.9433 125.3994 55.5471 28.9923 175.4477 97 N 4.1590 9.0178 119.4995 53.6445 36.6103 173.5515 98 P 4.3189 0.0000 0.0000 64.8967 32.1307 176.8976 99 I 4.5741 7.0458 116.8243 59.4318 38.2839 175.6435 100 I 4.1202 8.2372 125.2763 61.4252 37.5760 175.4073 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 M 8.30 4.31 0.00 2.00 2.18 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 2 E 8.15 3.55 0.00 2.14 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 2.21 2.45 0.00 3 L 7.50 4.21 0.00 1.62 1.60 0.89 0.96 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 4 T 8.70 4.30 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 1.25 0.00 0.00 5 P 0.00 4.28 0.00 2.18 2.14 0.00 3.60 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 6 R 7.95 3.98 0.00 2.04 2.19 0.00 2.97 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 7 E 7.62 3.99 0.00 2.20 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 2.31 2.33 0.00 8 K 7.96 4.12 0.00 1.95 1.86 0.00 1.66 0.00 0.00 1.57 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.57 7.81 9 D 8.11 4.33 0.00 2.99 2.78 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 10 K 8.03 4.03 0.00 1.98 1.85 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.70 1.62 7.81 11 L 7.60 4.07 0.00 1.95 1.75 0.90 0.27 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 12 L 8.08 4.00 0.00 1.76 1.89 0.93 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.79 3.94 0.00 1.82 1.90 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 14 F 8.40 4.16 0.00 3.14 3.19 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 0.00 15 T 8.15 3.73 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 1.21 0.00 0.00 16 A 8.14 3.97 1.35 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 0.00 0.00 0.00 17 A 8.07 3.92 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 7.43 3.72 0.00 1.76 1.58 0.76 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 19 V 7.50 3.51 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 0.98 0.00 0.00 0.92 0.00 0.00 20 A 7.72 3.95 1.29 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 0.00 0.00 21 E 8.41 3.82 0.00 2.07 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 0.00 2.27 2.33 0.00 22 R 7.88 3.97 0.00 2.04 1.93 0.00 3.26 0.00 0.00 3.14 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 23 R 7.77 3.94 0.00 1.91 1.95 0.00 3.18 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.84 0.00 24 L 8.17 3.92 0.00 1.80 1.81 0.90 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 25 A 7.75 3.97 1.40 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 0.00 0.00 26 R 7.52 4.13 0.00 1.95 1.99 0.00 3.16 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 27 G 8.14 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 0.00 0.00 0.00 28 L 7.44 4.48 0.00 1.67 1.59 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 29 K 8.47 4.43 0.00 1.64 1.75 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.46 7.81 30 L 8.79 4.44 0.00 1.60 1.57 0.89 0.38 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 31 N 8.59 4.79 0.00 2.93 3.00 0.00 0.00 6.78 7.45 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 32 Y 8.90 4.13 0.00 3.09 3.04 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 33 P 0.00 3.94 0.00 2.26 2.29 0.00 3.95 0.00 0.00 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.12 0.00 34 E 8.71 3.92 0.00 2.17 1.99 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 2.30 2.39 0.00 35 S 8.07 4.03 0.00 3.92 3.86 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 36 V 7.38 3.45 1.74 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 0.90 0.00 0.00 0.47 0.00 0.00 37 A 7.74 3.96 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.89 3.85 0.00 1.89 1.74 0.89 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 39 I 7.71 3.77 1.87 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.09 0.93 0.00 0.00 40 S 8.23 4.14 0.00 4.08 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 41 A 8.22 4.07 1.40 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 0.00 0.00 42 F 8.22 4.06 0.00 3.24 3.28 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 0.00 43 I 7.84 3.53 2.05 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 1.66 1.03 0.96 0.00 0.00 44 M 7.93 3.94 0.00 2.04 2.24 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.56 0.00 45 E 8.16 4.05 0.00 1.99 1.91 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 2.54 2.50 0.00 46 G 7.62 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 0.00 0.00 0.00 47 A 7.62 3.27 0.08 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 48 R 7.36 3.71 0.00 1.68 2.03 0.00 3.23 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 49 D 7.85 4.49 0.00 2.78 2.66 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 0.00 0.00 0.00 50 G 7.41 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 51 K 7.65 4.24 0.00 1.88 1.80 0.00 1.65 0.00 0.00 1.86 0.00 0.00 3.21 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.33 7.81 52 S 8.38 4.53 0.00 4.04 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 53 V 8.05 3.54 1.90 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 1.02 0.00 0.00 0.32 0.00 0.00 54 A 7.95 4.04 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 55 S 7.88 4.00 0.00 4.05 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 56 L 7.92 4.09 0.00 1.97 1.81 1.08 0.77 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 57 M 8.07 4.10 0.00 2.03 2.31 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.95 2.73 0.00 58 E 7.66 4.21 0.00 2.08 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 2.33 2.48 0.00 59 E 8.68 4.26 0.00 2.32 2.35 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 2.47 2.63 0.00 60 G 8.49 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 0.00 0.00 0.00 61 R 7.56 4.83 0.00 1.59 1.84 0.00 3.07 0.00 0.00 3.05 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.75 0.00 62 H 7.82 4.95 0.00 3.06 3.18 0.00 5.65 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 63 V 7.86 3.57 1.85 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 0.55 0.00 0.00 0.13 0.00 0.00 64 L 7.46 4.91 0.00 1.56 1.46 0.88 0.77 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 65 T 8.67 4.51 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 1.20 0.00 0.00 66 R 8.36 3.84 0.00 1.95 1.97 0.00 3.17 0.00 0.00 3.39 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 67 E 7.65 4.34 0.00 2.08 2.03 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 2.27 2.41 0.00 68 Q 8.22 4.59 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.69 6.69 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 69 V 7.23 5.04 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 0.68 0.00 0.00 0.99 0.00 0.00 70 M 8.98 4.33 0.00 1.94 2.01 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.94 2.50 0.00 71 E 8.58 3.99 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 2.29 2.31 0.00 72 G 8.95 4.13 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 0.00 0.00 0.00 73 V 7.56 3.67 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 1.03 0.00 0.00 1.03 0.00 0.00 74 P 0.00 4.34 0.00 2.23 2.10 0.00 3.60 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.13 0.00 75 E 8.03 4.13 0.00 2.19 1.99 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 2.33 2.33 0.00 76 M 7.73 4.34 0.00 1.82 2.29 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.39 0.00 77 I 7.33 4.67 1.94 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 1.58 1.26 0.99 0.00 0.00 78 P 0.00 4.62 0.00 2.15 2.33 0.00 3.88 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.99 0.00 79 D 7.29 5.00 0.00 2.81 2.65 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 0.00 0.00 0.00 0.00 80 I 8.64 4.76 1.88 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 1.22 0.81 0.93 0.00 0.00 81 Q 8.86 5.63 0.00 1.89 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.68 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 82 V 8.18 4.55 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 0.75 0.00 0.00 0.95 0.00 0.00 83 E 9.02 5.62 0.00 1.88 1.99 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 2.25 2.15 0.00 84 A 8.35 4.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 T 8.27 4.36 4.20 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 1.22 0.00 0.00 86 F 9.15 4.42 0.00 3.32 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 87 P 0.00 4.41 0.00 2.09 2.14 0.00 3.82 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 2.08 2.09 0.00 88 D 8.25 4.84 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 89 G 7.92 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 90 S 8.15 5.32 0.00 3.81 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 91 K 8.80 4.66 0.00 0.89 1.27 0.00 1.49 0.00 0.00 1.65 0.00 0.00 2.80 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 0.73 7.81 92 L 8.42 4.83 0.00 1.82 1.55 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 93 V 8.69 4.40 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 0.99 0.00 0.00 1.17 0.00 0.00 94 T 8.58 4.97 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 1.09 0.00 0.00 95 V 8.77 4.32 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 1.11 0.00 0.00 0.98 0.00 0.00 96 H 8.94 4.82 0.00 3.10 3.21 0.00 5.90 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 N 9.02 4.16 0.00 2.80 2.80 0.00 0.00 6.55 8.01 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 98 P 0.00 4.32 0.00 2.19 2.31 0.00 3.85 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 99 I 7.05 4.57 1.88 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 1.27 0.61 0.88 0.00 0.00 100 I 8.24 4.12 1.88 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 1.27 0.60 0.92 0.00 0.00