NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2004 8.1727 122.0520 56.2763 34.1403 173.9203 2 V 4.6815 8.1514 126.6194 60.7499 32.6265 174.5098 3 F 4.4652 9.2313 127.8438 57.2877 40.2655 175.5282 4 G 3.8663 9.0831 109.1375 45.7322 0.0000 174.8942 5 R 3.3512 8.7295 120.0073 59.6781 30.0745 178.7492 6 C 4.2003 7.9716 115.7743 62.4321 28.1445 175.5956 7 E 3.9292 8.0709 120.7796 59.1739 29.2634 178.4940 8 L 3.4115 7.9732 120.1643 57.7381 41.9929 178.5229 9 A 3.8945 7.8604 120.5355 55.1918 18.2214 179.3908 10 A 3.8797 8.1813 118.9863 55.3356 18.2656 179.6178 11 A 3.9242 7.6480 117.8152 55.6808 18.6977 179.5343 12 M 3.9620 8.2432 117.5061 58.2496 32.1378 178.7739 13 K 3.8358 8.2919 120.2195 59.6359 32.0884 178.7970 14 R 3.9338 8.0831 118.1118 58.9596 29.9490 177.1164 15 H 4.6651 7.7229 114.2125 54.9116 28.9467 175.2393 16 G 3.8261 7.6393 107.5659 46.6841 0.0000 175.4762 17 L 3.6221 7.5102 121.1955 55.6601 42.1236 176.1976 18 D 4.7099 7.8720 117.8943 55.6148 41.0661 175.3953 19 N 4.5203 9.6184 123.5639 53.5489 37.0927 173.6367 20 Y 4.1999 8.1828 121.1376 59.0875 39.0663 176.3423 21 R 3.5788 9.1943 124.5552 57.1831 27.8397 177.0133 22 G 3.7003 8.5090 104.2245 45.6517 0.0000 173.4433 23 Y 4.5492 7.9520 118.6219 55.5880 38.9277 175.8569 24 S 4.6312 8.6588 119.9396 58.0397 64.0170 174.8885 25 L 4.3055 9.0750 123.7947 58.7098 41.5757 179.6109 26 G 3.9756 8.3990 104.9459 48.1493 0.0000 175.0001 27 N 4.5222 8.3441 118.6193 56.1026 38.5931 177.5848 28 W 3.8788 7.9769 119.7085 59.6035 29.2338 178.6751 29 V 3.6169 8.0192 118.3220 66.1054 31.0954 177.2980 30 C 2.9982 8.3760 118.3392 59.0379 44.5391 175.4218 31 A 3.9800 8.1220 122.2822 55.1349 17.9791 179.4840 32 A 4.0085 7.9877 119.3332 54.9954 18.4360 179.7627 33 K 2.5081 7.7455 118.0743 59.1906 31.9228 178.7846 34 F 4.4708 7.1806 115.1663 59.1013 39.0893 177.5980 35 E 4.3506 8.1356 118.4619 58.3742 29.8827 177.4842 36 S 4.5398 7.6975 109.2225 56.6312 64.5675 173.2632 37 N 3.4309 8.5043 118.0341 54.9184 37.6943 174.1351 38 F 4.1104 7.8986 110.4145 58.0307 36.9001 173.9776 39 N 5.3037 7.9238 120.8790 52.0699 39.3051 176.0032 40 T 4.1350 8.8432 117.1151 64.1269 69.0964 175.8617 41 Q 4.3389 8.5294 119.7946 56.1205 29.5636 175.8126 42 A 4.2702 7.6777 121.2239 52.9634 19.3109 176.7891 43 T 5.0390 8.2817 110.6889 60.1230 72.4596 172.9453 44 N 4.8267 8.6436 122.0558 52.0066 42.2550 173.0958 45 R 4.4139 8.6706 127.1217 56.1160 31.0781 175.1842 46 N 5.1324 9.0422 123.8449 51.6646 41.1097 176.1192 47 T 4.1050 8.6447 110.4712 63.2584 69.0556 174.4913 48 D 4.6110 8.0531 121.0957 53.2012 39.6653 177.3249 49 G 3.8613 8.0742 109.2702 45.2075 0.0000 173.7050 50 S 4.7419 7.5633 114.0175 57.4417 66.1498 173.0488 51 T 5.0169 8.7329 115.0260 62.1513 73.1276 172.9943 52 D 5.4118 9.0969 125.2358 53.3299 43.0197 175.1235 53 Y 4.8682 9.2441 120.8970 57.2995 41.6642 177.2550 54 G 4.3494 8.8933 111.6145 44.9535 0.0000 173.7288 55 I 4.1953 8.3644 116.9563 62.7476 37.7595 176.6076 56 L 4.5543 7.8992 116.9421 53.4606 42.6190 176.5284 57 Q 3.4427 8.2004 116.6623 57.1033 26.7171 174.1987 58 I 4.2274 8.1801 119.5732 61.0273 39.4324 176.7427 59 N 5.4066 9.0901 125.8465 53.4196 39.7438 175.6739 60 S 4.6578 9.0404 120.6090 60.0553 63.3233 175.4503 61 R 3.6579 8.8692 122.7379 58.3755 30.3143 178.1903 62 W 4.5257 8.0253 116.0923 56.1764 31.9632 176.9177 63 W 4.7878 8.1194 117.4243 57.7356 29.3323 175.8310 64 C 5.5950 7.6946 110.3099 55.5250 32.4397 171.9718 65 N 4.9291 8.7727 119.9306 52.3983 39.1991 174.9082 66 D 4.8114 8.6245 123.7079 52.2894 39.9565 176.1847 67 G 4.0494 8.4961 106.2838 46.6122 0.0000 174.9048 68 R 4.5885 8.3593 113.2416 55.9480 30.1191 174.6621 69 T 4.4569 7.8123 115.1889 61.5615 70.3218 172.4394 70 P 4.1618 0.0000 0.0000 64.0145 32.1002 176.4466 71 G 3.9658 8.4336 109.4371 46.3593 0.0000 173.2878 72 S 4.5590 7.6433 111.2559 56.7985 64.9146 173.4627 73 R 4.5859 8.2110 122.1395 54.7118 32.9514 175.4783 74 N 4.9803 8.1078 120.7949 51.8839 38.3352 175.0326 75 L 4.1043 8.3755 120.6403 57.2269 42.3195 177.9621 76 C 4.6370 8.2665 113.8181 56.1193 40.9337 172.6660 77 N 4.1387 8.0247 117.7491 53.7568 37.5019 173.2589 78 I 4.6445 7.3217 108.7133 58.6049 41.0624 172.2072 79 P 4.8529 0.0000 0.0000 62.4539 32.2069 177.1127 80 C 3.7552 8.5176 119.8221 62.9722 27.8188 176.7328 81 S 4.0183 7.8871 114.9683 61.2200 62.2396 176.0776 82 A 4.1452 7.9061 123.2865 54.0274 18.0009 178.4412 83 L 4.4078 8.0319 116.8285 55.1096 41.6544 177.5832 84 L 5.2215 7.7642 118.1696 53.6957 40.6683 176.6658 85 S 4.6289 7.7196 114.1340 57.3555 64.3325 174.9835 86 S 4.0523 8.4883 116.0760 60.0356 62.9093 173.8636 87 D 4.8306 7.3254 120.5924 52.6927 41.5555 176.5288 88 I 4.0338 8.3427 119.9735 61.7211 37.9480 177.3555 89 T 3.6766 8.6292 119.3684 67.1322 68.3604 175.5502 90 A 3.9784 7.9632 121.5080 55.4653 18.4309 179.6713 91 S 4.0675 7.9581 113.0119 61.6990 62.8930 177.0068 92 V 3.3319 7.8801 121.1197 66.0215 31.1022 177.8696 93 N 4.1860 8.1326 116.2519 56.3411 38.3104 176.6662 94 C 4.2086 8.2414 119.8084 59.4868 43.8504 175.3950 95 A 4.0953 8.4070 122.8829 55.2295 17.7315 179.7491 96 K 3.7388 7.8498 116.1915 59.2116 32.1187 179.1310 97 K 4.1695 7.4885 119.6946 59.2501 32.1202 178.9935 98 I 2.9829 7.3574 120.3747 64.0359 36.7170 178.8059 99 V 3.9133 8.1001 118.5174 64.0418 31.6186 177.4464 100 S 4.7570 7.6134 114.9930 58.3010 62.6876 174.0426 101 D 4.6395 7.8339 121.0686 54.5284 40.6339 176.9161 102 G 4.0732 8.3937 103.8020 45.3479 0.0000 174.0948 103 N 4.9163 7.6525 113.9287 51.4508 41.7295 175.5279 104 G 3.9997 7.9297 107.3657 46.8295 0.0000 175.0439 105 M 4.0000 7.3126 121.0733 55.7792 31.6638 177.7325 106 N 4.8072 7.8324 116.9064 55.3008 38.8073 176.2382 107 A 3.7695 7.2443 120.1967 53.7111 18.6762 177.8054 108 W 4.6090 8.0504 117.0017 55.0401 30.0846 177.2220 109 V 3.7486 8.5026 125.6809 64.8978 30.7417 178.0910 110 A 3.9858 8.5025 121.4016 54.4192 18.1967 179.4594 111 W 3.9545 8.3054 126.5563 60.6533 30.7204 177.9489 112 R 3.5748 8.1305 117.2319 59.6003 29.5998 177.8933 113 N 4.4548 8.2554 115.1681 55.0349 38.7261 176.0143 114 R 4.3179 7.8717 115.7138 55.5441 32.2029 175.2640 115 C 4.6948 8.0786 115.3605 57.4906 42.5812 174.5206 116 K 3.2958 6.7446 119.9004 57.6096 31.7038 176.8178 117 G 3.8505 8.7491 113.7896 45.8009 0.0000 173.0843 118 T 4.3646 7.3501 110.0083 60.4272 70.9668 175.9591 119 D 4.6799 8.1412 120.7263 53.2272 38.6839 176.5240 120 V 4.2357 7.8351 115.7795 62.9856 32.1567 177.0678 121 Q 4.1373 8.3302 119.3100 58.7435 28.9269 177.5725 122 A 3.9826 7.8799 121.5931 54.6221 18.1166 178.9916 123 W 4.3678 7.9464 115.5563 58.3489 29.4693 176.7894 124 I 4.4667 7.6289 119.5118 60.5110 37.4998 175.6428 125 R 4.0554 7.6646 118.4544 57.4497 29.4890 177.5284 126 G 3.9486 8.8223 108.4487 45.8245 0.0000 173.1698 127 C 4.4369 7.6628 117.2989 59.2894 29.0369 174.7429 128 R 4.4249 8.2145 123.9667 54.8181 28.6261 176.4392 129 L 4.2456 7.8822 120.5466 54.6759 41.8061 176.8564 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 K 8.17 4.20 0.00 1.74 1.62 0.00 1.32 0.00 0.00 1.19 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.96 1.19 7.81 2 V 8.15 4.68 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 0.95 0.00 0.00 0.98 0.00 0.00 3 F 9.23 4.47 0.00 2.87 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 4 G 9.08 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 0.00 0.00 0.00 5 R 8.73 3.35 0.00 2.03 1.98 0.00 3.74 0.00 0.00 3.82 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.87 0.00 6 C 7.97 4.20 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 7 E 8.07 3.93 0.00 2.07 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 2.82 2.49 0.00 8 L 7.97 3.41 0.00 1.31 1.31 0.07 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.86 3.89 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 10 A 8.18 3.88 1.37 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 11 A 7.65 3.92 1.26 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 0.00 0.00 12 M 8.24 3.96 0.00 1.83 1.99 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.28 0.00 13 K 8.29 3.84 0.00 1.88 2.04 0.00 1.52 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.48 7.81 14 R 8.08 3.93 0.00 1.96 2.15 0.00 3.27 0.00 0.00 3.18 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 15 H 7.72 4.67 0.00 2.96 3.13 0.00 5.99 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.64 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 17 L 7.51 3.62 0.00 1.38 0.62 0.11 -0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 18 D 7.87 4.71 0.00 2.65 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 19 N 9.62 4.52 0.00 3.08 3.02 0.00 0.00 6.23 7.39 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 20 Y 8.18 4.20 0.00 3.24 3.01 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 21 R 9.19 3.58 0.00 2.32 2.11 0.00 3.27 0.00 0.00 3.04 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 1.66 0.00 22 G 8.51 3.70 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 0.00 0.00 0.00 23 Y 7.95 4.55 0.00 3.40 2.63 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 0.00 24 S 8.66 4.63 0.00 4.12 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 25 L 9.08 4.31 0.00 2.10 1.84 0.95 1.22 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 26 G 8.40 3.98 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 0.00 0.00 0.00 27 N 8.34 4.52 0.00 2.90 2.62 0.00 0.00 7.04 7.75 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 28 W 7.98 3.88 0.00 3.43 3.05 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 29 V 8.02 3.62 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 1.12 0.00 0.00 1.04 0.00 0.00 30 C 8.38 3.00 0.00 2.59 3.10 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 0.00 0.00 0.00 0.00 31 A 8.12 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.99 4.01 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 33 K 7.75 2.51 0.00 1.08 0.74 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.66 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.30 0.85 7.81 34 F 7.18 4.47 0.00 3.04 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 35 E 8.14 4.35 0.00 2.01 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 2.58 2.56 0.00 36 S 7.70 4.54 0.00 4.11 4.16 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 37 N 8.50 3.43 0.00 2.72 2.81 0.00 0.00 7.14 6.51 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 38 F 7.90 4.11 0.00 3.35 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 39 N 7.92 5.30 0.00 2.87 2.88 0.00 0.00 6.98 7.28 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 40 T 8.84 4.14 4.50 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 41 Q 8.53 4.34 0.00 2.15 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.78 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 42 A 7.68 4.27 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 43 T 8.28 5.04 3.98 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 1.29 0.00 0.00 44 N 8.64 4.83 0.00 2.80 2.61 0.00 0.00 6.80 7.79 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 45 R 8.67 4.41 0.00 1.82 1.77 0.00 3.41 0.00 0.00 3.41 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 46 N 9.04 5.13 0.00 2.84 2.72 0.00 0.00 6.51 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 47 T 8.64 4.11 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 1.21 0.00 0.00 48 D 8.05 4.61 0.00 2.75 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 49 G 8.07 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 50 S 7.56 4.74 0.00 3.86 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 51 T 8.73 5.02 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 0.68 0.00 0.00 52 D 9.10 5.41 0.00 2.52 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 53 Y 9.24 4.87 0.00 2.93 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 54 G 8.89 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 55 I 8.36 4.20 1.94 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 1.43 0.54 0.88 0.00 0.00 56 L 7.90 4.55 0.00 1.73 1.78 0.79 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 57 Q 8.20 3.44 0.00 2.38 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.39 6.84 0.00 0.00 0.00 0.00 0.00 2.40 2.74 0.00 58 I 8.18 4.23 2.05 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 1.24 0.73 1.09 0.00 0.00 59 N 9.09 5.41 0.00 3.08 3.10 0.00 0.00 6.97 7.14 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 60 S 9.04 4.66 0.00 4.02 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 0.00 61 R 8.87 3.66 0.00 1.44 0.66 0.00 2.65 0.00 0.00 2.78 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.50 0.00 62 W 8.03 4.53 0.00 2.54 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 0.00 0.00 0.00 63 W 8.12 4.79 0.00 3.70 3.33 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 64 C 7.69 5.59 0.00 3.20 3.03 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 65 N 8.77 4.93 0.00 2.81 2.70 0.00 0.00 7.05 7.86 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 66 D 8.62 4.81 0.00 2.79 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 67 G 8.50 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 68 R 8.36 4.59 0.00 1.89 1.95 0.00 3.04 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.62 0.00 69 T 7.81 4.46 4.17 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 1.06 0.00 0.00 70 P 0.00 4.16 0.00 1.96 1.95 0.00 3.74 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 1.98 2.05 0.00 71 G 8.43 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 0.00 0.00 0.00 72 S 7.64 4.56 0.00 4.01 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 73 R 8.21 4.59 0.00 1.73 1.76 0.00 3.21 0.00 0.00 3.08 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.49 0.00 74 N 8.11 4.98 0.00 2.79 2.65 0.00 0.00 7.08 6.66 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 75 L 8.38 4.10 0.00 1.68 1.83 0.42 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 76 C 8.27 4.64 0.00 3.46 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 77 N 8.02 4.14 0.00 2.89 2.87 0.00 0.00 6.91 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 78 I 7.32 4.64 1.87 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 1.50 0.51 0.97 0.00 0.00 79 P 0.00 4.85 0.00 2.18 2.17 0.00 3.70 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 2.04 1.96 0.00 80 C 8.52 3.76 0.00 2.15 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 81 S 7.89 4.02 0.00 4.02 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 82 A 7.91 4.15 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 83 L 8.03 4.41 0.00 1.89 1.79 1.01 0.81 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 84 L 7.76 5.22 0.00 1.80 1.72 1.11 1.08 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 85 S 7.72 4.63 0.00 4.02 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 86 S 8.49 4.05 0.00 3.88 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 87 D 7.33 4.83 0.00 2.73 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 88 I 8.34 4.03 1.70 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.32 0.78 0.00 0.00 89 T 8.63 3.68 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 1.21 0.00 0.00 90 A 7.96 3.98 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 91 S 7.96 4.07 0.00 3.97 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 92 V 7.88 3.33 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 0.75 0.00 0.00 0.69 0.00 0.00 93 N 8.13 4.19 0.00 2.74 2.81 0.00 0.00 6.70 7.26 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 94 C 8.24 4.21 0.00 3.11 3.22 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 95 A 8.41 4.10 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 96 K 7.85 3.74 0.00 1.70 1.66 0.00 1.36 0.00 0.00 1.00 0.00 0.00 2.15 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.30 1.11 7.81 97 K 7.49 4.17 0.00 1.97 1.89 0.00 1.79 0.00 0.00 1.98 0.00 0.00 3.29 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.60 1.59 7.81 98 I 7.36 2.98 1.55 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.12 0.00 0.00 99 V 8.10 3.91 2.63 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 1.27 0.00 0.00 0.99 0.00 0.00 100 S 7.61 4.76 0.00 3.93 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 0.00 101 D 7.83 4.64 0.00 2.90 2.72 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 0.00 102 G 8.39 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 0.00 103 N 7.65 4.92 0.00 2.62 2.73 0.00 0.00 6.94 7.61 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 0.00 104 G 7.93 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 0.00 0.00 0.00 105 M 7.31 4.00 0.00 0.51 0.57 0.00 0.00 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.98 0.00 106 N 7.83 4.81 0.00 2.98 2.97 0.00 0.00 6.87 7.36 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 0.00 107 A 7.24 3.77 0.60 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 0.00 108 W 8.05 4.61 0.00 3.61 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 0.00 109 V 8.50 3.75 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 0.93 0.00 0.00 0.97 0.00 0.00 110 A 8.50 3.99 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 0.00 111 W 8.31 3.95 0.00 3.38 3.54 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 0.00 112 R 8.13 3.57 0.00 2.12 2.22 0.00 3.46 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.90 0.00 113 N 8.26 4.45 0.00 2.62 2.74 0.00 0.00 6.86 8.52 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 0.00 114 R 7.87 4.32 0.00 1.02 0.81 0.00 2.21 0.00 0.00 2.25 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.14 0.00 115 C 8.08 4.69 0.00 1.95 2.89 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 0.00 116 K 6.74 3.30 0.00 0.79 1.36 0.00 1.79 0.00 0.00 1.58 0.00 0.00 3.00 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.24 1.17 7.81 117 G 8.75 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 0.00 118 T 7.35 4.36 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 1.27 0.00 0.00 119 D 8.14 4.68 0.00 2.82 2.61 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 0.00 120 V 7.84 4.24 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 1.04 0.00 0.00 1.09 0.00 0.00 121 Q 8.33 4.14 0.00 2.17 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.47 2.48 0.00 122 A 7.88 3.98 1.10 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 0.00 0.00 0.00 0.00 0.00 0.00 123 W 7.95 4.37 0.00 3.58 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 0.00 124 I 7.63 4.47 2.06 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 1.43 0.98 0.96 0.00 0.00 125 R 7.66 4.06 0.00 1.91 1.99 0.00 3.08 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.56 0.00 126 G 8.82 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 0.00 127 C 7.66 4.44 0.00 3.07 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 0.00 128 R 8.21 4.42 0.00 1.77 1.88 0.00 3.40 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.69 0.00 129 L 7.88 4.25 0.00 1.64 1.58 0.95 0.92 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