NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 F 4.7872 8.1833 119.3921 57.2458 40.1111 175.0445 4 K 3.7889 8.0301 124.7811 58.3944 32.4331 177.0690 5 K 3.9142 8.2315 119.5649 59.5110 32.5716 178.3340 6 V 3.5582 7.9237 117.7354 66.0450 31.4464 177.5245 7 A 4.0104 8.2466 120.4381 55.2051 18.2135 179.8189 8 K 3.9536 8.2789 116.9622 59.7566 32.1831 179.5623 9 E 4.0256 8.4439 119.0106 59.6408 29.2809 179.6190 10 T 3.8803 8.2550 115.8646 66.5410 68.5375 176.6936 11 A 4.0681 8.2146 122.7794 55.0576 18.3636 179.8151 12 I 3.6935 7.8296 118.4094 64.8333 37.1357 178.7059 13 T 3.8838 7.9962 116.5451 66.6451 68.2886 176.3797 14 L 4.0123 8.3564 122.6014 58.1231 42.0676 178.8407 15 Q 3.9934 8.2660 119.4757 59.3575 29.0732 178.3110 16 S 4.2374 8.0883 117.5291 61.2755 62.8705 176.1282 17 Y 4.0866 8.3913 122.3557 60.7441 38.5128 178.0841 18 L 4.0709 8.3849 119.8307 57.5791 41.6674 179.5919 19 T 3.8278 7.9525 116.2060 66.7250 68.4032 175.8374 20 Y 3.9520 7.8803 121.3352 60.8187 38.7348 178.2696 21 Q 3.4345 7.9054 118.6271 58.6374 28.7818 178.5454 22 A 3.9079 8.0069 121.9006 55.0857 18.3272 179.8763 23 V 3.5074 7.7584 116.7320 65.9689 31.7375 178.0678 24 R 3.7077 7.6400 118.4134 59.4182 29.8431 178.4052 25 L 3.9253 7.8238 118.5172 57.8914 41.6667 179.5629 26 I 3.6670 7.7597 119.6280 64.3393 37.0479 178.1447 27 S 4.0865 8.3275 114.3028 61.7043 61.9236 176.2602 28 Q 3.9932 7.6354 118.5083 59.2384 28.7244 178.7487 29 Q 4.1394 8.0903 118.8597 58.9655 28.6986 178.8583 30 L 4.0308 8.5428 120.6380 57.7494 41.4370 179.5928 31 S 4.1653 7.9915 113.2687 61.2127 62.7417 175.7443 32 E 4.3956 7.9009 120.4290 57.1404 29.8882 176.7753 33 T 4.5791 7.4613 105.2229 61.2419 70.9862 173.9834 34 N 4.8839 8.6201 118.8994 51.0333 41.0970 172.4456 35 P 4.3943 0.0000 0.0000 65.3982 31.9862 178.1837 36 G 3.7304 8.1381 103.9396 48.1703 0.0000 175.6080 37 Q 4.1398 8.0254 119.1258 58.3276 28.6912 178.4899 38 A 4.0650 8.0334 122.3405 55.2440 18.3842 179.7592 39 I 3.8062 7.9552 111.6669 63.5872 37.7377 178.1140 40 W 4.0462 8.2318 130.0222 60.3647 30.4858 177.7153 41 L 4.3143 8.6609 120.5093 58.0351 41.1336 179.0166 42 G 3.6941 8.2389 105.7495 48.0705 0.0000 175.5500 43 E 3.9207 8.4808 121.7699 58.7753 29.4262 179.2270 44 F 3.7485 8.1333 121.1511 61.3008 39.1795 177.4232 45 S 4.7070 8.2918 113.2908 61.1261 62.6707 176.2708 46 K 4.1503 7.4915 120.0755 58.4759 31.9476 178.6085 47 R 4.2879 7.1161 115.6624 55.9001 30.5405 176.0393 48 H 4.6620 7.4130 115.6040 52.6098 30.8448 171.7174 49 P 4.3739 0.0000 0.0000 62.5664 31.4703 177.3468 50 I 3.1783 8.4019 123.7171 63.3818 38.3053 176.6393 51 Q 4.1071 8.2097 118.6809 58.9332 28.8097 177.3253 52 E 4.4369 7.8178 119.7898 55.1706 28.0854 176.9601 53 S 4.2500 8.1818 118.4490 61.1985 63.6073 176.1368 54 D 4.5090 8.1423 122.0400 57.3216 40.6531 178.7132 55 L 4.0478 7.9840 118.8608 57.7240 41.6795 178.5579 56 Y 4.2008 8.3993 119.7525 61.0884 38.7760 178.5467 57 L 4.1407 8.4600 119.7681 57.7841 41.5099 179.3858 58 E 4.0098 8.4073 117.7970 59.1497 29.6831 178.7646 59 A 4.2090 8.4948 121.3262 55.6784 18.4246 179.5037 60 M 3.9142 8.1229 116.4041 58.6532 31.9350 177.8598 61 M 3.7772 7.9520 117.9005 58.3890 32.3504 177.5291 62 L 4.3313 7.9245 117.5873 55.9875 42.2309 177.7683 63 E 4.7595 7.9002 116.3106 56.4453 32.4484 176.0131 64 N 4.5787 8.4153 115.8249 51.1906 41.0868 174.2303 65 K 3.8786 8.0576 123.8305 58.9971 32.7045 177.5404 66 E 3.8936 7.9354 118.3882 59.3223 29.3754 178.9670 67 L 3.9179 7.6891 120.7451 57.9515 42.0636 179.3813 68 V 3.5898 7.6980 119.2920 64.6450 31.3481 178.3837 69 L 3.9550 7.9442 119.6897 57.4792 41.3871 179.3786 70 R 3.8648 7.7775 118.1252 59.5052 29.9597 178.4926 71 I 3.7040 7.9048 119.6440 64.5747 37.2568 178.4603 72 L 4.0106 8.3343 120.0713 57.9443 41.4288 179.8001 73 T 3.8630 8.0219 115.7263 66.7004 68.4166 176.9855 74 V 3.5961 8.1396 120.5879 65.9424 31.4373 178.0214 75 R 3.8695 8.2790 118.7570 59.3352 29.8996 178.1821 76 E 3.9666 8.1290 118.7697 59.2837 29.6697 178.4852 77 N 4.3732 8.1466 116.5377 56.1860 38.5153 177.3607 78 L 3.9690 8.1567 120.1354 57.7382 41.8024 179.1336 79 A 4.0367 8.3114 121.0027 55.5714 18.0961 179.5428 80 E 4.0552 8.4646 115.9210 59.4916 29.5780 179.6748 81 G 3.7878 8.1620 104.8330 47.4810 0.0000 175.4448 82 V 4.5466 8.1034 114.0185 62.2642 32.5791 178.3294 83 L 4.0451 7.9460 119.1220 58.0633 41.3801 179.2627 84 E 4.1081 8.0123 115.2745 58.4079 29.7823 178.7068 85 F 4.4108 8.1174 118.5277 60.1013 38.9543 177.5724 86 L 4.0562 8.0555 118.9269 57.3760 41.4608 177.6040 87 P 4.2878 0.0000 0.0000 65.7342 31.2840 178.5587 88 E 4.0010 8.1225 116.7740 59.5134 29.4462 179.0056 89 M 4.0500 8.0003 118.5709 58.4801 31.9952 179.0899 90 V 3.5578 8.2449 118.6507 65.9067 31.7683 177.8022 91 L 3.9485 7.9070 120.3880 58.1339 41.9205 179.1205 92 S 4.1664 8.1706 114.3429 61.4421 62.9276 176.4140 93 Q 3.9782 8.4082 122.0235 58.7954 28.4528 179.0111 94 I 3.7054 8.0259 120.9198 64.2538 37.0780 178.5606 95 K 3.9073 8.0611 119.3183 59.5161 31.8315 179.1466 96 Q 3.9160 8.0142 119.6353 59.2875 29.0684 178.1922 97 S 4.0848 8.4056 114.5147 61.4513 62.3873 175.8158 98 N 4.4606 8.9342 119.6653 56.2598 38.2560 177.6179 99 G 3.5985 8.3503 107.2517 47.9415 0.0000 175.4511 100 N 4.3091 8.3533 119.3712 56.4057 38.4718 177.2708 101 H 4.2731 8.2027 117.4253 58.5979 28.8102 178.1026 102 R 3.9251 8.2086 120.0771 59.2410 29.9325 179.2584 103 R 3.8954 8.1338 117.9003 59.3890 29.8764 179.0283 104 S 4.0962 8.1866 112.9190 61.2352 62.3494 176.0540 105 L 3.9610 8.1634 123.1716 58.1014 42.0293 178.6718 106 L 3.9844 8.3646 120.7363 58.2350 41.9933 178.7897 107 E 4.0729 8.3468 118.5367 58.9587 29.1358 179.5531 108 R 3.9142 7.5059 117.5534 59.3691 30.2975 178.7750 109 L 4.1087 7.7158 117.2535 57.4535 41.6307 178.6315 110 T 4.3438 7.6385 111.0058 63.0534 67.9896 174.3882 111 Q 4.0892 8.1265 123.7422 56.0566 29.9956 174.4350 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 3 F 8.18 4.79 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 4 K 8.03 3.79 0.00 1.89 1.88 0.00 1.66 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.55 7.81 5 K 8.23 3.91 0.00 1.89 1.84 0.00 1.64 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.58 7.81 6 V 7.92 3.56 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 1.02 0.00 0.00 0.94 0.00 0.00 7 A 8.25 4.01 1.44 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 0.00 0.00 8 K 8.28 3.95 0.00 1.92 1.89 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.74 1.64 7.81 9 E 8.44 4.03 0.00 2.01 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 2.34 2.45 0.00 10 T 8.26 3.88 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 1.20 0.00 0.00 11 A 8.21 4.07 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 12 I 7.83 3.69 2.03 0.00 0.00 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 1.54 0.74 0.93 0.00 0.00 13 T 8.00 3.88 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 1.21 0.00 0.00 14 L 8.36 4.01 0.00 1.95 1.89 0.99 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 15 Q 8.27 3.99 0.00 2.31 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.57 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 16 S 8.09 4.24 0.00 4.12 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 17 Y 8.39 4.09 0.00 3.18 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 18 L 8.38 4.07 0.00 1.79 1.73 0.99 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 19 T 7.95 3.83 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 1.20 0.00 0.00 20 Y 7.88 3.95 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 21 Q 7.91 3.43 0.00 2.08 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 1.96 2.43 0.00 22 A 8.01 3.91 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 23 V 7.76 3.51 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 1.12 0.00 0.00 1.04 0.00 0.00 24 R 7.64 3.71 0.00 1.36 1.72 0.00 2.96 0.00 0.00 2.69 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.53 0.00 25 L 7.82 3.93 0.00 1.82 1.66 0.88 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 26 I 7.76 3.67 2.05 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 0.53 0.92 0.00 0.00 27 S 8.33 4.09 0.00 3.94 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 28 Q 7.64 3.99 0.00 2.25 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.73 0.00 0.00 0.00 0.00 0.00 2.38 2.53 0.00 29 Q 8.09 4.14 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 30 L 8.54 4.03 0.00 1.80 1.89 0.96 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 31 S 7.99 4.17 0.00 4.05 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 32 E 7.90 4.40 0.00 2.06 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 2.29 2.44 0.00 33 T 7.46 4.58 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 34 N 8.62 4.88 0.00 2.64 2.67 0.00 0.00 7.02 8.26 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 35 P 0.00 4.39 0.00 2.21 2.11 0.00 3.67 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.33 0.00 36 G 8.14 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.03 4.14 0.00 2.34 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 38 A 8.03 4.07 1.41 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 0.00 0.00 0.00 39 I 7.96 3.81 1.92 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 1.71 1.36 0.95 0.00 0.00 40 W 8.23 4.05 0.00 3.61 3.42 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 41 L 8.66 4.31 0.00 2.14 2.04 1.11 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 42 G 8.24 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 0.00 0.00 0.00 43 E 8.48 3.92 0.00 1.85 1.82 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 2.48 2.40 0.00 44 F 8.13 3.75 0.00 1.76 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.29 4.71 0.00 4.14 4.11 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 46 K 7.49 4.15 0.00 1.83 1.81 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.66 7.81 47 R 7.12 4.29 0.00 1.41 1.61 0.00 2.88 0.00 0.00 3.07 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.60 0.00 48 H 7.41 4.66 0.00 2.66 3.08 0.00 5.66 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.37 0.00 2.24 2.21 0.00 3.71 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.96 0.00 50 I 8.40 3.18 1.53 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 1.19 -0.03 0.88 0.00 0.00 51 Q 8.21 4.11 0.00 2.05 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.15 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 52 E 7.82 4.44 0.00 2.04 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 2.31 2.26 0.00 53 S 8.18 4.25 0.00 4.07 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 0.00 54 D 8.14 4.51 0.00 2.84 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 55 L 7.98 4.05 0.00 1.94 1.80 0.99 0.80 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 56 Y 8.40 4.20 0.00 3.30 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 57 L 8.46 4.14 0.00 1.98 1.78 1.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 58 E 8.41 4.01 0.00 2.06 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 2.38 2.44 0.00 59 A 8.49 4.21 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 60 M 8.12 3.91 0.00 1.88 1.25 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.47 0.00 61 M 7.95 3.78 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.64 0.00 62 L 7.92 4.33 0.00 1.84 1.75 0.96 0.79 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 63 E 7.90 4.76 0.00 2.32 2.43 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 2.40 2.72 0.00 64 N 8.42 4.58 0.00 1.58 2.10 0.00 0.00 6.67 6.03 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 65 K 8.06 3.88 0.00 1.80 1.72 0.00 1.75 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.50 7.81 66 E 7.94 3.89 0.00 1.96 1.89 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 2.31 2.36 0.00 67 L 7.69 3.92 0.00 1.57 1.57 0.89 0.92 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 68 V 7.70 3.59 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 0.93 0.00 0.00 0.92 0.00 0.00 69 L 7.94 3.95 0.00 1.84 1.74 0.89 0.63 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 70 R 7.78 3.86 0.00 1.84 2.07 0.00 3.08 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 71 I 7.90 3.70 2.03 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.61 0.97 0.00 0.00 72 L 8.33 4.01 0.00 1.81 1.72 0.93 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 73 T 8.02 3.86 4.36 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 1.21 0.00 0.00 74 V 8.14 3.60 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 0.97 0.00 0.00 0.95 0.00 0.00 75 R 8.28 3.87 0.00 1.99 2.06 0.00 3.17 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 76 E 8.13 3.97 0.00 2.12 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 2.32 2.36 0.00 77 N 8.15 4.37 0.00 2.95 2.86 0.00 0.00 7.04 6.75 0.00 0.00 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 L 8.16 3.97 0.00 1.94 1.74 0.89 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 79 A 8.31 4.04 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 80 E 8.46 4.06 0.00 2.03 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 2.35 2.43 0.00 81 G 8.16 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 82 V 8.10 4.55 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 1.06 0.00 0.00 1.06 0.00 0.00 83 L 7.95 4.05 0.00 1.79 1.75 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 84 E 8.01 4.11 0.00 1.70 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 2.26 2.25 0.00 85 F 8.12 4.41 0.00 3.34 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 86 L 8.06 4.06 0.00 1.84 1.75 0.98 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.29 0.00 2.16 2.11 0.00 3.72 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 88 E 8.12 4.00 0.00 2.11 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 2.42 2.47 0.00 89 M 8.00 4.05 0.00 2.12 2.16 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 2.88 2.59 0.00 90 V 8.24 3.56 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 1.06 0.00 0.00 0.94 0.00 0.00 91 L 7.91 3.95 0.00 1.90 1.71 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 92 S 8.17 4.17 0.00 4.12 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 93 Q 8.41 3.98 0.00 2.32 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.85 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 94 I 8.03 3.71 1.93 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.80 0.89 0.00 0.00 95 K 8.06 3.91 0.00 1.81 1.86 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.57 7.81 96 Q 8.01 3.92 0.00 2.21 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 97 S 8.41 4.08 0.00 3.93 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 98 N 8.93 4.46 0.00 2.99 2.86 0.00 0.00 6.92 7.78 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 99 G 8.35 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 0.00 100 N 8.35 4.31 0.00 2.85 2.77 0.00 0.00 7.09 8.53 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 0.00 101 H 8.20 4.27 0.00 3.27 3.34 0.00 5.82 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 0.00 102 R 8.21 3.93 0.00 1.94 1.98 0.00 3.27 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 103 R 8.13 3.90 0.00 2.07 1.97 0.00 3.12 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 104 S 8.19 4.10 0.00 3.87 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 0.00 105 L 8.16 3.96 0.00 2.03 1.75 0.93 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.36 3.98 0.00 1.88 1.84 0.92 0.95 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 0.00 107 E 8.35 4.07 0.00 2.12 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 0.00 2.32 2.44 0.00 108 R 7.51 3.91 0.00 1.94 1.99 0.00 3.17 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 109 L 7.72 4.11 0.00 1.64 1.73 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 110 T 7.64 4.34 4.36 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 1.26 0.00 0.00 111 Q 8.13 4.09 0.00 2.15 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.32 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00