NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 Y 4.5252 8.1293 118.3808 57.9784 39.5085 174.5711 3 S 4.7524 8.2355 117.7689 55.3525 66.9842 174.1586 4 F 4.1851 9.6003 125.2944 61.8367 39.4466 178.1750 5 E 3.8127 8.3609 117.3941 59.7084 29.3036 179.3689 6 Q 4.0350 8.0571 117.4382 58.5749 28.6862 178.5653 7 A 3.9541 8.0788 121.9311 55.2159 18.4194 179.6504 8 I 3.4109 7.3771 118.2427 64.7838 37.1521 178.7570 9 T 3.7127 7.6542 116.4030 66.6883 67.8044 176.4626 10 Q 4.1666 8.2189 121.3934 58.9321 29.0963 177.8817 11 L 4.3192 8.0722 122.8266 57.8958 42.2007 178.8490 12 F 4.1202 8.8545 118.0402 60.9541 38.9414 177.8261 13 Q 4.1060 8.2870 117.4188 59.0813 28.2548 178.7646 14 Q 4.1570 8.3761 119.0322 58.2093 28.5393 177.5393 15 L 4.5340 7.7738 117.5761 53.6274 42.2377 176.4353 16 S 3.7793 7.7067 113.5478 59.6851 60.8202 171.8034 17 L 4.6494 8.2037 119.2869 52.3841 43.4366 177.2652 18 S 4.2157 8.5102 117.3575 58.5373 63.3882 173.8800 19 I 4.1481 8.3073 125.4095 59.8423 37.4760 174.1384 20 P 4.3530 0.0000 0.0000 62.6174 31.8051 176.0083 21 D 4.4584 8.8520 121.7497 56.8274 41.3857 176.7317 22 T 4.4638 7.5729 114.2693 61.6027 71.3083 173.5770 23 I 4.0317 8.2539 127.8295 59.8660 36.3601 175.6443 24 E 4.2803 8.4266 125.5414 55.2013 30.0186 176.8601 25 P 4.1627 0.0000 0.0000 64.8973 31.4612 176.3235 26 V 4.5469 7.2625 118.4314 61.2597 33.6903 174.7314 27 I 4.5265 9.2312 130.0258 59.8580 39.3556 175.1487 28 G 4.3506 8.7325 112.5446 44.3875 0.0000 172.3420 29 V 4.5102 8.8795 124.4462 60.7240 35.3675 173.9948 30 K 4.7651 8.5710 127.6989 54.7398 33.9955 175.4408 31 V 4.2163 8.7969 128.7497 61.6311 33.6024 175.9733 32 G 3.8035 8.2270 119.0859 47.0927 0.0000 174.3924 33 E 4.1068 8.7894 122.7147 55.8633 30.1582 175.4035 34 F 4.5749 8.1088 120.1583 55.8876 40.2877 174.3635 35 A 4.7615 8.6199 128.0790 51.3232 19.2959 176.0856 36 C 4.8310 9.4638 121.2172 58.9738 31.2636 172.9314 37 H 5.2209 8.5889 117.9253 53.9850 32.2415 172.6402 38 I 5.0398 8.8779 123.0933 60.0536 40.5276 174.5423 39 T 4.6080 9.0111 119.4787 61.4700 71.7225 171.6646 40 E 5.1101 7.8064 125.2527 54.5994 30.3095 174.8203 41 H 4.6431 8.3221 126.6731 54.8924 32.8980 171.9287 42 P 4.4673 0.0000 0.0000 61.7107 33.0070 174.9724 43 V 3.8548 8.0808 118.2333 64.9072 31.7330 176.6342 44 G 4.0518 9.9271 115.4915 45.0280 0.0000 172.2328 45 Q 4.9981 8.0135 118.1049 54.0008 32.9500 174.4074 46 I 4.6592 9.0882 125.3316 60.1228 38.7670 174.2895 47 L 5.2733 9.0505 130.5038 53.6764 44.3728 175.0325 48 M 5.4918 9.1102 125.0049 53.7542 35.9233 174.4713 49 F 5.6516 8.7074 116.2760 56.5801 42.0348 172.7441 50 T 5.0012 9.3181 113.3999 61.2861 71.4821 172.6111 51 L 5.0570 8.5920 125.7450 52.6132 42.2874 174.8327 52 P 4.7081 0.0000 0.0000 61.9532 32.8859 175.6312 53 S 4.6801 8.4577 114.1757 56.8177 63.7916 174.4891 54 L 4.4417 8.4191 125.4273 53.9757 42.7805 175.6213 55 D 4.9046 8.2920 119.6888 52.5171 42.7478 176.7899 56 N 4.3415 9.0490 124.3941 56.6934 38.8093 175.8118 57 N 4.3293 8.4638 114.4056 56.4122 38.8110 175.6645 58 D 4.3644 7.7421 117.9041 54.4917 41.2326 176.9160 59 E 4.4451 8.5284 124.1786 54.5858 32.4219 177.2987 60 K 3.8753 8.4412 118.9811 60.6249 32.3595 178.7944 61 E 3.9318 8.1150 119.2612 59.4291 29.2327 179.3923 62 T 3.8670 7.7568 113.9111 66.5306 68.5612 176.3706 63 L 4.2640 8.1398 121.0334 57.8437 41.8260 179.4896 64 L 4.1048 8.4083 118.8551 57.3108 41.0341 179.5632 65 S 4.1382 7.8610 115.2308 61.5513 62.4375 176.0883 66 H 4.2948 7.6931 117.8136 57.9985 28.4591 176.3649 67 N 4.6206 7.5487 116.1385 52.1854 39.0778 175.1202 68 I 3.6598 6.7426 121.4326 60.3049 38.6492 175.7353 69 F 4.5485 7.8585 122.0360 56.9310 38.7813 174.9810 70 S 4.6584 8.1638 115.2744 57.6627 64.9749 173.2938 71 Q 4.1362 8.7976 116.3284 57.3619 29.3572 174.8078 72 D 4.7023 7.9489 120.3269 52.4747 41.0427 176.5878 73 I 3.9807 8.2942 120.4511 62.5041 37.7925 176.5536 74 L 4.3580 8.1692 120.6180 54.5243 41.9613 176.7024 75 K 3.9226 7.7263 121.8116 55.6497 32.3943 174.7269 76 P 4.4921 0.0000 0.0000 63.0019 32.5021 175.3402 77 I 4.1784 8.2770 122.6167 59.3391 39.4027 174.4603 78 L 4.7870 8.3715 129.3090 54.3146 43.3488 175.5018 79 S 4.9532 9.1470 119.8282 57.0109 67.2305 172.0231 80 W 5.2409 8.7349 128.0994 56.0454 33.7516 174.7771 81 D 4.5823 8.7456 128.1415 52.5120 40.1515 176.1083 82 E 4.2701 9.1123 126.0359 59.2105 30.0198 178.4887 83 V 3.7359 8.0800 116.5888 65.8259 31.5478 176.9028 84 G 3.7246 8.0198 105.4447 45.2409 0.0000 173.5497 85 G 4.0074 8.1771 108.0912 47.0422 0.0000 173.2934 86 H 4.4279 6.9789 114.4656 52.4408 33.1889 171.6362 87 P 4.5068 0.0000 0.0000 62.5137 32.7343 175.6404 88 V 4.5849 9.0050 121.3843 61.2438 34.8084 173.6199 89 L 5.2553 9.1282 130.9163 53.3225 43.7760 175.1087 90 W 6.0245 8.7894 122.6037 55.3183 32.3490 173.1732 91 N 5.3299 9.3091 117.5623 51.9378 40.9162 172.7860 92 R 5.7776 8.7564 117.2158 56.6168 33.1919 173.5063 93 Q 4.7588 8.4254 120.7101 54.2490 32.3381 171.8932 94 P 4.9071 0.0000 0.0000 62.3317 32.1408 177.6732 95 L 4.0090 8.9966 126.0550 58.0286 42.1751 178.1945 96 N 4.7120 8.2055 113.7105 54.1172 37.4879 175.2214 97 S 4.7565 7.6453 112.6737 57.9030 63.5939 174.1992 98 L 4.1265 7.6381 121.2306 55.0538 41.6037 175.9829 99 D 5.2832 8.5420 121.4935 51.3266 42.1954 176.0556 100 N 4.5456 8.8511 114.5463 55.6945 38.6539 175.6889 101 N 4.7999 8.4611 113.2298 53.1701 39.6426 176.8221 102 S 4.0999 7.9820 115.7868 61.9023 62.8784 176.6423 103 L 3.9857 7.7871 120.9146 57.7238 41.3392 178.8515 104 Y 3.9234 7.9854 119.1269 60.9910 38.7801 177.9941 105 T 3.9943 8.1166 116.7069 66.7624 68.5724 176.3302 106 Q 3.9447 8.3697 121.6610 59.1493 29.0341 178.1970 107 L 3.8930 8.1229 121.4822 57.9174 42.0213 178.4508 108 E 3.7956 8.2087 119.3752 59.6879 29.5962 178.7988 109 M 4.0029 8.2800 118.8651 58.0478 31.9164 178.6409 110 L 3.8380 7.7821 120.5722 58.2524 42.2870 179.4675 111 V 3.2382 7.7343 112.3688 64.4360 31.5002 178.5730 112 Q 4.0135 8.2865 118.1235 58.8177 28.2739 179.3121 113 G 3.4611 7.9079 106.5926 47.5749 0.0000 175.6646 114 A 3.8530 7.4349 122.2683 54.7691 18.5817 178.9832 115 E 4.1444 8.0070 118.1667 59.5059 29.4501 179.1490 116 R 3.9940 7.6259 117.0801 59.2226 30.2632 178.4012 117 L 4.0924 7.4002 115.3144 54.8953 41.6180 177.1954 118 Q 4.0588 8.2559 124.3275 56.4808 29.3287 173.2460 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 Y 8.13 4.53 0.00 2.99 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 3 S 8.24 4.75 0.00 4.18 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.60 4.19 0.00 3.34 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 5 E 8.36 3.81 0.00 2.11 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 2.43 2.51 0.00 6 Q 8.06 4.03 0.00 2.23 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 7 A 8.08 3.95 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 8 I 7.38 3.41 1.36 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 -0.32 0.24 0.00 0.00 9 T 7.65 3.71 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 1.20 0.00 0.00 10 Q 8.22 4.17 0.00 2.36 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.80 0.00 0.00 0.00 0.00 0.00 2.42 2.44 0.00 11 L 8.07 4.32 0.00 1.91 1.97 0.99 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 12 F 8.85 4.12 0.00 3.21 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 13 Q 8.29 4.11 0.00 2.35 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.67 0.00 14 Q 8.38 4.16 0.00 2.47 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.39 2.67 0.00 15 L 7.77 4.53 0.00 1.63 1.57 0.73 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 16 S 7.71 3.78 0.00 4.04 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 17 L 8.20 4.65 0.00 1.35 1.27 0.07 0.75 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 18 S 8.51 4.22 0.00 4.02 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 19 I 8.31 4.15 1.90 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 1.51 0.63 0.86 0.00 0.00 20 P 0.00 4.35 0.00 1.96 2.00 0.00 3.48 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.22 0.00 21 D 8.85 4.46 0.00 2.64 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 22 T 7.57 4.46 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 1.32 0.00 0.00 23 I 8.25 4.03 1.84 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.38 0.81 0.00 0.00 24 E 8.43 4.28 0.00 2.05 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 2.42 2.27 0.00 25 P 0.00 4.16 0.00 2.09 2.13 0.00 3.73 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 26 V 7.26 4.55 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 0.88 0.00 0.00 0.95 0.00 0.00 27 I 9.23 4.53 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 1.39 0.72 1.10 0.00 0.00 28 G 8.73 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 0.00 0.00 0.00 0.00 29 V 8.88 4.51 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 0.75 0.00 0.00 0.85 0.00 0.00 30 K 8.57 4.77 0.00 1.71 1.62 0.00 1.80 0.00 0.00 1.60 0.00 0.00 3.03 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.27 1.42 7.81 31 V 8.80 4.22 2.12 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 0.90 0.00 0.00 0.85 0.00 0.00 32 G 8.23 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 33 E 8.79 4.11 0.00 1.72 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 1.47 1.47 0.00 34 F 8.11 4.57 0.00 3.15 3.02 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 35 A 8.62 4.76 1.23 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 0.00 0.00 0.00 36 C 9.46 4.83 0.00 2.74 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 37 H 8.59 5.22 0.00 1.47 2.73 0.00 5.75 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 I 8.88 5.04 2.00 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 1.13 0.72 1.07 0.00 0.00 39 T 9.01 4.61 4.29 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 1.33 0.00 0.00 40 E 7.81 5.11 0.00 1.60 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 2.29 2.26 0.00 41 H 8.32 4.64 0.00 3.05 3.11 0.00 5.98 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 42 P 0.00 4.47 0.00 2.20 2.08 0.00 3.67 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.87 0.00 43 V 8.08 3.85 2.07 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 0.86 0.00 0.00 0.91 0.00 0.00 44 G 9.93 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 45 Q 8.01 5.00 0.00 2.10 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.76 0.00 0.00 0.00 0.00 0.00 2.27 2.45 0.00 46 I 9.09 4.66 1.95 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.31 1.05 0.00 0.00 47 L 9.05 5.27 0.00 1.81 1.76 1.00 0.69 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 48 M 9.11 5.49 0.00 2.01 2.22 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 2.57 2.49 0.00 49 F 8.71 5.65 0.00 3.31 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 50 T 9.32 5.00 4.31 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 1.26 0.00 0.00 51 L 8.59 5.06 0.00 1.58 1.62 1.02 0.90 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 52 P 0.00 4.71 0.00 2.26 2.16 0.00 3.97 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.03 0.00 53 S 8.46 4.68 0.00 3.91 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 54 L 8.42 4.44 0.00 1.79 1.70 1.18 1.14 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 55 D 8.29 4.90 0.00 2.70 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 56 N 9.05 4.34 0.00 2.77 2.89 0.00 0.00 7.07 8.00 0.00 0.00 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 N 8.46 4.33 0.00 2.80 2.92 0.00 0.00 7.14 8.89 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 58 D 7.74 4.36 0.00 2.85 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 59 E 8.53 4.45 0.00 1.99 1.95 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 2.35 2.51 0.00 60 K 8.44 3.88 0.00 1.95 2.05 0.00 1.49 0.00 0.00 1.79 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.53 7.81 61 E 8.12 3.93 0.00 2.06 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 2.38 2.45 0.00 62 T 7.76 3.87 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 1.25 0.00 0.00 63 L 8.14 4.26 0.00 1.87 1.77 0.95 0.55 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 64 L 8.41 4.10 0.00 1.69 1.71 0.92 0.65 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 65 S 7.86 4.14 0.00 3.93 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 66 H 7.69 4.29 0.00 3.23 3.32 0.00 5.64 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 N 7.55 4.62 0.00 2.84 2.82 0.00 0.00 6.93 7.13 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 68 I 6.74 3.66 1.69 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 -0.05 0.78 0.00 0.00 69 F 7.86 4.55 0.00 3.13 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 70 S 8.16 4.66 0.00 3.96 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 71 Q 8.80 4.14 0.00 2.20 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.92 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 72 D 7.95 4.70 0.00 2.72 2.60 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 73 I 8.29 3.98 1.89 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 1.43 0.73 0.92 0.00 0.00 74 L 8.17 4.36 0.00 1.80 1.75 0.94 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 75 K 7.73 3.92 0.00 1.79 1.70 0.00 1.78 0.00 0.00 1.82 0.00 0.00 3.22 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.34 7.81 76 P 0.00 4.49 0.00 1.99 1.96 0.00 3.71 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.05 0.00 77 I 8.28 4.18 0.56 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.18 -0.10 0.72 0.00 0.00 78 L 8.37 4.79 0.00 1.62 1.58 0.99 0.99 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 79 S 9.15 4.95 0.00 4.11 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 0.00 80 W 8.73 5.24 0.00 3.48 2.97 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 81 D 8.75 4.58 0.00 2.62 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 0.00 0.00 0.00 82 E 9.11 4.27 0.00 2.14 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 0.00 2.38 2.45 0.00 83 V 8.08 3.74 2.07 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 0.83 0.00 0.00 0.94 0.00 0.00 84 G 8.02 3.72 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 0.00 0.00 0.00 85 G 8.18 4.01 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 0.00 0.00 0.00 86 H 6.98 4.43 0.00 2.76 2.85 0.00 5.62 0.00 0.00 0.00 0.00 6.57 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 4.51 0.00 2.14 2.21 0.00 3.41 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 88 V 9.00 4.58 2.15 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 1.06 0.00 0.00 0.85 0.00 0.00 89 L 9.13 5.26 0.00 1.83 1.57 0.89 0.96 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 90 W 8.79 6.02 0.00 3.72 3.25 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 91 N 9.31 5.33 0.00 2.83 2.85 0.00 0.00 6.71 7.38 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 92 R 8.76 5.78 0.00 2.19 2.13 0.00 3.09 0.00 0.00 3.97 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 93 Q 8.43 4.76 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.88 0.00 0.00 0.00 0.00 0.00 2.50 2.42 0.00 94 P 0.00 4.91 0.00 2.23 2.04 0.00 3.63 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.10 0.00 95 L 9.00 4.01 0.00 1.76 1.82 1.03 0.48 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 96 N 8.21 4.71 0.00 2.89 2.97 0.00 0.00 5.80 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 S 7.65 4.76 0.00 3.95 3.96 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 98 L 7.64 4.13 0.00 1.40 1.29 0.70 0.88 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 99 D 8.54 5.28 0.00 2.88 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 0.00 100 N 8.85 4.55 0.00 2.74 3.09 0.00 0.00 7.19 8.00 0.00 0.00 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 N 8.46 4.80 0.00 2.75 2.76 0.00 0.00 6.93 7.17 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 0.00 102 S 7.98 4.10 0.00 3.78 4.08 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 0.00 103 L 7.79 3.99 0.00 1.68 1.72 0.88 0.77 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 0.00 104 Y 7.99 3.92 0.00 3.19 3.02 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 0.00 105 T 8.12 3.99 4.44 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 1.25 0.00 0.00 106 Q 8.37 3.94 0.00 2.21 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 107 L 8.12 3.89 0.00 1.79 1.62 0.84 0.64 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 0.00 108 E 8.21 3.80 0.00 2.09 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 0.00 2.31 2.33 0.00 109 M 8.28 4.00 0.00 2.13 2.20 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 2.62 2.83 0.00 110 L 7.78 3.84 0.00 1.84 1.77 0.95 1.05 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 0.00 111 V 7.73 3.24 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 0.69 0.00 0.00 0.89 0.00 0.00 112 Q 8.29 4.01 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.62 0.00 113 G 7.91 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.43 3.85 0.61 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 0.00 0.00 115 E 8.01 4.14 0.00 1.93 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 2.35 2.49 0.00 116 R 7.63 3.99 0.00 1.98 1.98 0.00 3.22 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.82 0.00 117 L 7.40 4.09 0.00 1.78 1.72 0.89 0.61 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 0.00 118 Q 8.26 4.06 0.00 2.21 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.55 0.00 0.00 0.00 0.00 0.00 2.32 2.53 0.00