NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 K 4.3296 8.3144 120.1876 56.0356 33.8485 174.9678 6 S 4.1912 8.5560 112.7615 59.2350 63.7896 174.4266 7 G 3.8598 9.6857 116.2206 48.2780 0.0000 175.7531 8 T 3.9950 8.0083 117.6302 66.5026 68.0168 175.8978 9 Y 3.8365 8.0309 121.0395 60.6501 38.7754 178.2577 10 W 4.1035 8.4613 119.3238 59.4591 29.2226 178.4876 11 A 4.0689 8.2152 121.0077 55.4707 17.8457 179.8529 12 T 3.7563 8.0316 114.3914 66.5179 68.4050 176.7617 13 L 3.7039 7.7193 122.5165 57.9813 41.9802 179.0006 14 I 3.9313 8.0019 119.9068 64.8889 37.0445 178.4417 15 T 4.3427 8.0849 117.0345 66.1157 68.2939 176.4694 16 A 3.8207 7.9695 122.5272 55.0002 18.3929 179.4384 17 F 3.9943 8.6150 119.4894 61.5409 39.6389 177.4136 18 L 4.0641 8.5786 118.9628 57.7864 41.4597 179.7206 19 K 3.9326 8.2038 118.7678 59.4449 31.9704 179.6810 20 T 3.7757 7.7251 116.1394 66.7048 68.2308 177.1433 21 V 3.6749 7.2802 112.0986 63.2903 31.8805 177.7611 22 S 4.4540 7.8473 113.5602 57.4254 63.4664 173.9475 23 K 3.7607 7.8740 120.7390 57.1657 29.8887 175.8752 24 V 4.0331 7.7322 118.5224 62.6149 31.6920 174.9313 25 E 4.0293 9.0799 127.9454 59.5441 29.4637 177.8996 26 E 4.0206 7.9399 117.8193 55.7752 29.8205 176.3601 27 L 4.1524 8.3327 124.8920 53.9255 41.3024 176.8904 28 D 4.5228 8.2868 125.3154 52.3998 39.6078 175.2257 29 C 3.6418 8.1464 119.3100 60.1094 28.5836 174.3517 30 V 4.4932 7.8663 116.0276 58.4239 35.5077 175.2811 31 D 4.5529 8.2962 120.7584 54.4413 42.5527 177.8218 32 S 4.0774 8.5628 114.8554 61.3520 62.4557 176.1691 33 A 3.9752 7.9742 123.2425 55.1342 18.1093 179.5805 34 V 3.4743 7.6263 117.4762 65.4792 31.5750 178.0549 35 L 3.9047 7.6148 118.7015 57.7985 41.4867 179.4460 36 V 3.5791 7.9076 118.2350 66.4362 31.3192 177.8764 37 D 4.3683 8.0833 118.2531 57.1206 40.6309 178.8649 38 V 3.6613 7.9374 119.1136 65.9904 31.5301 178.0034 39 S 4.1169 8.4269 113.2053 61.4388 62.2875 176.2861 40 K 4.0090 8.0789 121.1348 59.6316 31.7653 179.4732 41 I 3.8362 8.0976 120.2279 64.2640 36.8296 178.5948 42 I 3.9926 8.1299 120.7885 64.7286 37.0109 178.5596 43 T 3.9273 7.9582 116.5018 66.5996 68.3272 176.5346 44 L 4.0944 8.1081 121.0201 58.2693 41.7130 179.7986 45 T 4.2916 8.2676 109.4260 65.0024 68.6040 176.2768 46 Q 4.1218 8.0419 120.7838 58.4386 28.9135 178.0021 47 E 3.9671 8.2202 120.5133 59.1179 29.7368 178.4083 48 F 3.9855 8.8180 121.1374 61.5626 39.4357 177.0870 49 R 4.1892 8.6389 118.2962 59.4501 29.5287 178.3722 50 R 3.9598 7.9645 118.3306 59.7882 30.1750 178.3167 51 H 4.2701 8.1015 115.7288 58.9496 28.6407 177.0626 52 Y 4.0460 8.0925 121.4189 60.9408 38.4179 177.9508 53 D 4.6538 8.4049 118.5997 56.9818 41.0076 178.5508 54 S 4.2522 7.5056 115.3063 61.0571 62.9080 176.2323 55 V 3.5118 7.3271 119.7084 63.9364 31.7448 175.6021 56 Y 4.8230 6.8928 113.9183 56.1548 40.6764 175.8706 57 R 4.2082 8.6526 120.6378 58.4146 30.9721 177.7404 58 A 4.1537 7.9277 118.9650 52.3196 18.9024 176.1597 59 D 4.8475 8.3272 120.0714 52.9322 43.3301 176.1390 60 Y 4.2037 7.8857 118.0297 60.1678 37.8009 178.2516 61 G 4.0658 7.7400 107.2936 48.4367 0.0000 172.7316 62 P 4.3572 0.0000 0.0000 64.9931 31.5570 178.9355 63 A 4.1029 7.9559 118.5608 54.6007 18.4763 177.8360 64 L 4.6871 7.5952 114.5148 54.6934 41.6375 177.9751 65 K 4.3566 7.7171 119.0020 58.7541 33.0940 177.2330 66 N 4.9834 7.9004 117.7995 52.2287 39.6111 176.5589 67 W 4.2221 8.5543 117.9713 59.6067 28.1494 178.0784 68 K 2.9244 6.5253 116.6054 57.8285 31.3209 177.2928 69 R 4.5039 7.6456 114.6511 55.6300 31.8507 175.3763 70 D 4.7435 7.5186 115.4599 52.5825 43.4826 176.8937 71 L 3.6098 8.1974 122.0191 58.3972 41.8854 179.0488 72 S 4.0716 7.8142 114.2883 61.4009 62.7894 176.6651 73 K 3.9642 7.7516 120.7871 59.2410 31.8636 178.9132 74 L 3.8360 7.7431 120.5510 58.2353 41.7574 179.1388 75 F 4.3161 7.5208 116.4664 60.6203 39.0455 177.6153 76 T 4.4511 7.8682 115.4250 66.9863 67.8722 176.7504 77 S 4.1478 8.2087 114.9005 61.1985 62.0938 175.9056 78 L 3.8583 7.7702 122.4723 56.8298 40.3481 177.3940 79 F 5.3751 7.9150 115.1620 56.1896 39.7417 177.4621 80 V 3.8132 7.6290 122.6253 64.5351 30.9995 176.9652 81 D 4.6243 7.7829 117.7820 53.5579 40.3958 175.7328 82 V 4.2273 6.7700 116.6177 61.5190 34.2862 170.9941 83 I 4.9443 8.2381 120.0848 58.9557 40.5282 175.1463 84 N 5.1636 8.5786 121.3066 50.3945 41.7790 175.4394 85 S 4.5639 8.9556 116.7597 62.0511 62.9703 177.3070 86 G 3.8895 8.3184 107.7163 48.0995 0.0000 175.8114 87 R 4.1385 9.0140 120.7664 58.8038 30.0776 179.1932 88 I 3.8946 7.7658 119.6124 64.2276 36.9401 178.5675 89 V 3.8554 8.2123 119.4617 65.9006 31.3445 178.3819 90 G 2.3738 7.5894 105.3199 46.9161 0.0000 175.4580 91 F 3.9665 7.9218 122.9096 61.3823 39.3613 177.3677 92 F 3.7810 8.0606 117.1389 60.1386 38.5317 177.3259 93 D 4.5213 8.2152 118.2489 57.2087 40.9659 178.4142 94 V 3.7599 8.0131 119.2576 65.7548 31.4531 178.3585 95 G 3.5698 7.6675 104.9809 47.7920 0.0000 175.7182 96 R 3.9697 8.6957 121.9312 59.1352 29.9949 177.9662 97 Y 3.8630 8.4144 119.5904 60.6261 38.8559 178.0978 98 V 3.3427 7.7971 119.1075 66.3175 31.3084 177.8320 99 C 4.0444 7.6936 114.9597 62.5674 28.0001 175.3830 100 E 4.1372 8.1558 119.1809 57.8348 29.4293 177.6644 101 E 4.1566 8.0253 117.5178 58.2915 30.7360 177.4538 102 V 3.6807 7.2347 117.1252 65.2261 32.2660 176.2373 103 L 4.1803 8.2581 121.0339 54.4345 41.1382 176.3381 104 C 4.3561 8.3657 120.8623 57.8415 32.2924 170.8810 105 P 4.7410 0.0000 0.0000 62.7965 31.5749 175.4160 106 G 4.3128 8.4679 111.9018 45.7500 0.0000 173.6784 107 S 4.6233 7.4862 113.7755 56.0275 65.2422 173.3661 108 W 4.2358 8.6911 135.0000 55.9912 30.5490 175.5676 109 T 4.4474 7.3796 117.4999 60.1188 72.0200 174.7048 110 E 4.3611 8.3577 120.2742 59.2550 29.2600 179.1508 111 D 4.4271 7.7666 117.7881 57.5058 40.7479 178.5083 112 H 3.7019 7.6986 116.2805 58.7478 28.4464 177.5116 113 E 3.7559 7.5590 120.1593 59.1506 29.2198 179.2820 114 L 3.9807 7.9767 120.5420 57.9436 42.1133 178.7702 115 L 4.1661 8.2187 120.4395 58.2431 41.9962 178.1560 116 N 4.4611 8.9083 117.8318 57.2149 38.8507 176.4995 117 D 4.5522 8.5976 120.3591 57.3659 40.9938 178.2437 118 C 4.2351 8.3287 119.2229 62.9480 31.6560 175.6615 119 M 4.4227 8.5859 120.3794 58.8127 31.6397 178.8816 120 T 4.0454 8.5918 116.2837 67.0527 68.6200 176.3887 121 H 4.1918 8.9203 118.4188 58.9625 28.8223 177.6763 122 F 3.8954 8.4580 122.2032 61.0349 39.2356 176.7412 123 F 3.5399 8.5446 120.2654 61.4281 39.2675 177.2819 124 I 3.7736 7.8995 119.1232 64.3701 36.6985 178.3046 125 E 3.9087 8.2324 118.8583 59.0534 29.3065 178.2052 126 N 4.3258 7.3570 113.4385 51.6929 39.4004 174.6915 127 N 3.9689 7.6061 116.7691 54.1429 36.9999 176.5199 128 L 3.4030 6.9570 118.9958 57.2151 41.8225 179.8428 129 M 3.6717 6.9333 114.7078 57.2965 31.2300 177.1631 130 N 4.4413 7.6142 116.0913 55.4240 38.8527 175.4720 131 H 4.8969 7.8878 113.7887 55.2578 29.5976 174.4266 132 F 4.9588 7.7082 121.4629 55.9086 39.1824 171.0306 133 P 4.5136 0.0000 0.0000 61.3501 30.9700 176.4421 134 L 3.9046 8.4093 122.3489 53.8575 41.4196 177.1526 135 E 4.0598 7.8000 125.8864 56.7726 31.0974 174.1749 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 5 K 8.31 4.33 0.00 1.73 1.71 0.00 1.04 0.00 0.00 1.37 0.00 0.00 2.65 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.22 1.41 7.81 6 S 8.56 4.19 0.00 4.04 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 7 G 9.69 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 0.00 0.00 0.00 8 T 8.01 4.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 9 Y 8.03 3.84 0.00 2.99 3.11 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 10 W 8.46 4.10 0.00 3.65 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 11 A 8.22 4.07 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.03 3.76 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 1.01 0.00 0.00 13 L 7.72 3.70 0.00 1.11 1.59 0.79 0.67 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 14 I 8.00 3.93 2.11 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.82 1.09 0.00 0.00 15 T 8.08 4.34 4.19 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 1.04 0.00 0.00 16 A 7.97 3.82 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 17 F 8.62 3.99 0.00 3.06 3.41 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 18 L 8.58 4.06 0.00 2.21 2.19 1.26 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 19 K 8.20 3.93 0.00 1.46 1.51 0.00 1.11 0.00 0.00 0.99 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.73 7.81 20 T 7.73 3.78 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 1.11 0.00 0.00 21 V 7.28 3.67 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 0.21 0.00 0.00 0.67 0.00 0.00 22 S 7.85 4.45 0.00 4.26 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 23 K 7.87 3.76 0.00 1.96 1.84 0.00 1.64 0.00 0.00 1.55 0.00 0.00 2.80 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.47 7.81 24 V 7.73 4.03 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 0.77 0.00 0.00 1.09 0.00 0.00 25 E 9.08 4.03 0.00 1.99 2.01 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 2.31 2.36 0.00 26 E 7.94 4.02 0.00 1.91 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 2.30 2.32 0.00 27 L 8.33 4.15 0.00 1.57 1.58 0.95 1.08 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 28 D 8.29 4.52 0.00 2.51 2.53 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 29 C 8.15 3.64 0.00 2.91 2.88 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 30 V 7.87 4.49 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 0.68 0.00 0.00 0.85 0.00 0.00 31 D 8.30 4.55 0.00 2.69 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 32 S 8.56 4.08 0.00 3.87 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 33 A 7.97 3.98 1.39 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 34 V 7.63 3.47 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 1.08 0.00 0.00 0.57 0.00 0.00 35 L 7.61 3.90 0.00 1.80 1.67 0.89 0.91 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 36 V 7.91 3.58 2.25 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 1.02 0.00 0.00 0.99 0.00 0.00 37 D 8.08 4.37 0.00 2.85 2.64 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 0.00 0.00 0.00 0.00 38 V 7.94 3.66 2.25 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 1.02 0.00 0.00 0.98 0.00 0.00 39 S 8.43 4.12 0.00 3.91 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 40 K 8.08 4.01 0.00 2.00 1.85 0.00 1.84 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.78 7.81 41 I 8.10 3.84 1.94 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.87 0.05 0.00 0.00 42 I 8.13 3.99 2.07 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.82 0.96 0.00 0.00 43 T 7.96 3.93 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 1.26 0.00 0.00 44 L 8.11 4.09 0.00 2.01 1.91 1.06 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 45 T 8.27 4.29 4.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 46 Q 8.04 4.12 0.00 2.33 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.85 0.00 0.00 0.00 0.00 0.00 2.45 2.65 0.00 47 E 8.22 3.97 0.00 2.18 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 0.00 2.36 2.28 0.00 48 F 8.82 3.99 0.00 3.19 3.31 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 49 R 8.64 4.19 0.00 2.25 2.17 0.00 2.86 0.00 0.00 3.04 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.87 0.00 50 R 7.96 3.96 0.00 2.23 2.12 0.00 3.39 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.88 0.00 51 H 8.10 4.27 0.00 3.24 3.21 0.00 5.70 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 52 Y 8.09 4.05 0.00 3.16 3.27 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 53 D 8.40 4.65 0.00 2.77 2.79 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 54 S 7.51 4.25 0.00 3.93 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 55 V 7.33 3.51 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 0.68 0.00 0.00 56 Y 6.89 4.82 0.00 2.48 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.65 4.21 0.00 1.85 2.02 0.00 3.41 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 58 A 7.93 4.15 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.33 4.85 0.00 2.69 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 60 Y 7.89 4.20 0.00 1.43 2.29 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 61 G 7.74 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.36 0.00 2.21 2.16 0.00 3.75 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 2.16 2.16 0.00 63 A 7.96 4.10 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 64 L 7.60 4.69 0.00 1.77 1.79 0.87 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 65 K 7.72 4.36 0.00 1.97 2.00 0.00 1.56 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.66 1.43 7.81 66 N 7.90 4.98 0.00 2.84 2.80 0.00 0.00 6.90 7.68 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 67 W 8.55 4.22 0.00 3.48 3.41 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 68 K 6.53 2.92 0.00 1.09 1.29 0.00 1.31 0.00 0.00 1.24 0.00 0.00 2.61 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.30 0.21 7.81 69 R 7.65 4.50 0.00 1.60 1.79 0.00 2.99 0.00 0.00 3.14 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.42 0.00 70 D 7.52 4.74 0.00 2.66 2.54 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 71 L 8.20 3.61 0.00 2.01 1.55 0.54 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 72 S 7.81 4.07 0.00 3.88 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 73 K 7.75 3.96 0.00 1.90 1.81 0.00 1.64 0.00 0.00 1.83 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.45 7.81 74 L 7.74 3.84 0.00 1.57 1.50 0.78 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 75 F 7.52 4.32 0.00 2.32 1.45 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 0.00 0.00 0.00 0.00 76 T 7.87 4.45 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 77 S 8.21 4.15 0.00 3.87 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 78 L 7.77 3.86 0.00 1.60 1.36 0.70 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 79 F 7.92 5.38 0.00 3.36 2.94 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 0.00 0.00 0.00 80 V 7.63 3.81 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 0.71 0.00 0.00 0.96 0.00 0.00 81 D 7.78 4.62 0.00 2.82 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 82 V 6.77 4.23 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 0.77 0.00 0.00 0.96 0.00 0.00 83 I 8.24 4.94 1.51 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.63 0.49 0.00 0.00 84 N 8.58 5.16 0.00 3.03 2.95 0.00 0.00 6.26 7.20 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 85 S 8.96 4.56 0.00 4.06 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 86 G 8.32 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 87 R 9.01 4.14 0.00 2.03 1.69 0.00 3.14 0.00 0.00 3.15 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.97 0.00 88 I 7.77 3.89 1.90 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.90 -0.07 0.00 0.00 89 V 8.21 3.86 2.41 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 1.21 0.00 0.00 1.37 0.00 0.00 90 G 7.59 2.37 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 0.00 91 F 7.92 3.97 0.00 3.07 3.07 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 0.00 0.00 0.00 0.00 92 F 8.06 3.78 0.00 3.10 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.22 4.52 0.00 2.79 2.67 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 94 V 8.01 3.76 2.23 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 0.91 0.00 0.00 0.70 0.00 0.00 95 G 7.67 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 R 8.70 3.97 0.00 2.19 2.29 0.00 3.26 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.69 0.00 97 Y 8.41 3.86 0.00 3.32 3.23 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 98 V 7.80 3.34 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 -0.12 0.00 0.00 0.56 0.00 0.00 99 C 7.69 4.04 0.00 3.07 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 0.00 100 E 8.16 4.14 0.00 1.85 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 2.35 0.00 101 E 8.03 4.16 0.00 1.16 1.17 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 0.00 1.75 2.05 0.00 102 V 7.23 3.68 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 0.89 0.00 0.00 0.91 0.00 0.00 103 L 8.26 4.18 0.00 1.50 1.46 0.41 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 104 C 8.37 4.36 0.00 2.96 2.81 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 0.00 105 P 0.00 4.74 0.00 2.20 2.02 0.00 3.78 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.92 0.00 106 G 8.47 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 0.00 0.00 0.00 0.00 107 S 7.49 4.62 0.00 3.92 3.71 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.69 4.24 0.00 3.25 2.95 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 0.00 109 T 7.38 4.45 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 1.22 0.00 0.00 110 E 8.36 4.36 0.00 2.00 2.01 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 2.52 2.24 0.00 111 D 7.77 4.43 0.00 2.78 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 0.00 112 H 7.70 3.70 0.00 2.02 1.31 0.00 5.82 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 E 7.56 3.76 0.00 2.16 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 2.54 2.22 0.00 114 L 7.98 3.98 0.00 1.85 1.94 0.65 0.38 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 0.00 115 L 8.22 4.17 0.00 1.93 1.81 0.75 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 116 N 8.91 4.46 0.00 3.30 3.23 0.00 0.00 7.31 6.44 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 0.00 117 D 8.60 4.55 0.00 2.79 2.75 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 0.00 0.00 0.00 0.00 118 C 8.33 4.24 0.00 3.22 3.31 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 0.00 119 M 8.59 4.42 0.00 2.02 2.20 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.27 0.00 120 T 8.59 4.05 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 1.32 0.00 0.00 121 H 8.92 4.19 0.00 3.42 3.48 0.00 5.82 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 F 8.46 3.90 0.00 3.60 3.26 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 0.00 123 F 8.54 3.54 0.00 3.36 3.17 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 0.00 0.00 0.00 0.00 124 I 7.90 3.77 2.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.12 0.94 0.00 0.00 125 E 8.23 3.91 0.00 1.70 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 2.42 2.46 0.00 126 N 7.36 4.33 0.00 1.99 2.22 0.00 0.00 7.18 7.43 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 0.00 127 N 7.61 3.97 0.00 2.69 2.69 0.00 0.00 7.02 7.06 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 0.00 128 L 6.96 3.40 0.00 0.27 0.13 -0.06 -0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 129 M 6.93 3.67 0.00 1.17 2.02 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.42 0.00 130 N 7.61 4.44 0.00 2.81 2.75 0.00 0.00 6.77 7.43 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 0.00 131 H 7.89 4.90 0.00 2.95 3.26 0.00 5.79 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 F 7.71 4.96 0.00 2.84 2.87 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 0.00 133 P 0.00 4.51 0.00 2.19 1.99 0.00 3.64 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 2.11 2.11 0.00 134 L 8.41 3.90 0.00 1.57 1.61 0.73 1.05 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 0.00 135 E 7.80 4.06 0.00 2.05 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 2.22 2.22 0.00