NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4515 8.3049 118.1918 54.6420 32.8257 174.4732 2 N 4.2498 9.2361 116.7579 51.5432 39.1520 173.7802 3 T 4.4751 8.9054 114.1536 60.5534 72.4361 173.8565 4 P 4.1468 0.0000 0.0000 65.7415 31.3778 178.7566 5 E 3.8935 8.0793 116.8767 59.8358 29.4925 178.8168 6 H 4.1214 7.9513 117.5299 59.5418 30.0294 177.2387 7 M 3.5058 7.9764 120.5840 58.4145 31.6493 178.9320 8 T 3.8559 8.2799 116.2518 66.3438 68.5781 176.7538 9 A 3.9498 8.0108 122.8743 55.0341 18.2954 179.8999 10 V 3.5322 7.7693 116.8535 65.9989 31.6466 178.4780 11 V 3.3390 7.6053 117.5374 66.1144 31.4521 178.0362 12 Q 3.9419 8.0489 117.7048 59.0408 28.4971 179.1552 13 R 3.9824 7.9697 119.2221 59.0219 30.0957 178.4333 14 Y 4.0820 8.1577 119.6673 60.7215 38.9290 178.2306 15 V 3.3995 7.8749 118.9109 65.8680 31.6188 177.8037 16 A 3.9389 7.8555 119.8454 55.2001 18.1550 179.5430 17 A 3.9374 8.0487 119.2907 55.0231 18.4742 179.6190 18 L 3.7873 7.6796 118.9606 58.2609 41.8583 179.0620 19 N 4.4896 7.8059 115.4235 55.9406 38.5905 176.3837 20 A 4.4659 7.8514 119.3168 50.9309 18.7140 177.1008 21 G 3.8949 7.3962 104.5823 46.9973 0.0000 175.0838 22 D 4.5745 8.0569 120.6251 52.2960 40.6161 175.3988 23 L 3.9351 8.1002 127.7604 58.0358 42.4527 178.0640 24 D 4.4917 8.1160 118.5305 57.2306 40.6135 178.7444 25 G 3.6629 8.1899 105.4895 47.8400 0.0000 175.5575 26 I 3.8652 7.5262 122.0805 64.3278 37.0543 178.6995 27 V 3.7429 7.8473 118.3967 65.9668 31.0772 177.8653 28 A 4.0992 8.0338 119.5035 54.5717 18.4468 179.1465 29 L 4.0099 8.2123 117.9072 56.3718 41.7149 177.3045 30 F 4.6889 7.2857 116.4842 56.0812 40.2862 175.5309 31 A 4.3102 8.6580 126.7203 51.7884 19.1361 178.8111 32 D 4.4346 8.7933 120.0655 56.7520 41.0577 177.9710 33 D 4.6592 7.8619 116.4242 52.7310 39.8853 176.1072 34 A 4.5722 7.9971 121.9724 52.9441 19.8909 177.3688 35 T 4.9776 8.6842 109.7943 59.7906 72.1472 173.1725 36 V 4.5965 8.9054 123.8980 61.1243 34.6845 173.6855 37 E 4.6236 9.0437 129.5441 54.4719 31.3032 174.3010 38 N 5.0889 8.2237 125.7748 51.4025 41.4917 171.9545 39 P 4.7817 0.0000 0.0000 61.2910 33.9950 175.2222 40 V 3.8786 7.9851 120.6725 65.0029 31.1167 174.9481 41 G 3.5595 8.5285 117.6000 45.3056 0.0000 173.4108 42 S 4.5723 7.5944 115.1451 56.1672 65.0267 173.1866 43 E 4.0819 8.3537 121.6364 55.0802 29.8212 174.4756 44 P 4.6373 0.0000 0.0000 62.9904 32.6615 175.5466 45 R 4.6491 8.7699 120.8166 54.5817 32.6528 175.3326 46 S 5.0307 8.9120 119.1067 57.8662 66.3491 174.6185 47 G 3.9828 9.1573 110.7672 46.0839 0.0000 174.6609 48 T 3.8502 8.4193 112.7470 64.6660 68.4274 176.7999 49 A 3.9394 7.9207 122.7847 55.1168 18.6090 179.3518 50 A 4.0334 7.9093 118.6946 54.8885 18.4805 179.9215 51 I 3.5395 7.6965 118.7186 64.6167 37.2749 178.3103 52 R 3.9969 8.3296 119.9623 59.6860 29.8239 178.0951 53 E 3.9571 8.3705 118.9392 59.0527 29.6283 178.5671 54 F 3.9525 8.1788 120.6960 61.6195 39.4256 176.8546 55 Y 3.8975 8.1585 116.1033 60.6714 37.3817 178.2563 56 A 3.9732 7.9619 121.1807 55.1875 18.9267 179.0595 57 N 4.3112 7.9805 114.9531 56.6560 38.3894 177.8096 58 S 3.8709 7.3572 115.1068 61.2108 61.6552 175.8680 59 L 4.3555 7.7987 119.6750 54.9185 41.1326 178.9158 60 K 4.2011 7.7612 120.3569 58.3866 32.2472 177.2019 61 L 4.7618 6.8048 117.3300 51.9488 43.7995 174.3750 62 P 4.4540 0.0000 0.0000 62.4133 31.9492 175.7016 63 L 5.0984 8.4548 122.4911 52.9171 44.3366 175.6538 64 A 4.8270 8.9705 125.2180 50.4214 20.8876 175.6323 65 V 5.4431 9.4879 122.9951 60.6685 34.2369 174.7741 66 E 4.8868 8.6408 123.5612 54.9328 33.0637 173.9453 67 L 4.9139 8.6554 122.6488 55.1825 42.1801 176.8389 68 T 4.5517 8.5410 112.8755 61.8439 69.5914 174.1385 69 Q 4.6099 7.7918 119.6161 54.6816 32.7894 173.5268 70 E 4.0933 8.5820 117.5527 56.7032 29.9745 176.7656 71 V 4.0093 8.1225 120.5119 62.8492 32.7950 175.2457 72 R 4.6473 8.9494 126.6149 54.8403 31.6947 175.2463 73 A 5.2240 8.3286 125.5480 50.1865 22.1005 175.5432 74 V 4.0359 9.2044 119.0799 62.0876 35.0849 173.0448 75 A 3.9482 9.5264 125.5739 53.8575 15.8343 176.1400 76 N 4.3770 7.9591 111.5574 53.7346 37.1272 174.2798 77 E 5.6200 8.1184 114.9395 55.1069 34.5362 174.4192 78 A 5.4493 9.4290 122.6718 50.7098 23.3721 175.0807 79 A 5.2891 9.2485 121.6903 50.4260 23.1241 175.2523 80 F 5.2500 8.4337 114.8331 55.5140 42.1171 172.9652 81 A 5.3107 8.8084 122.6601 51.0298 20.9296 176.1489 82 F 5.6316 8.2648 115.1415 56.3242 42.0510 172.6726 83 I 4.6893 8.8180 110.8574 59.3558 41.3345 174.3638 84 V 4.9037 8.7899 124.3747 61.4137 34.0871 174.2453 85 S 5.3916 9.1572 124.4977 56.9117 66.1102 173.2239 86 F 5.1814 8.4360 117.5174 56.1691 41.8191 172.1779 87 E 5.0662 9.0011 120.3366 54.6540 31.2747 174.1825 88 Y 4.9117 8.9996 128.9252 57.2428 41.2392 175.3976 89 Q 3.2947 9.4425 125.3868 56.8712 27.2440 173.6081 90 G 3.9973 8.2444 110.0980 46.1257 0.0000 172.6734 91 R 4.5017 7.7292 120.3048 55.0124 31.9377 180.3902 92 K 4.4687 8.5936 125.7076 55.3849 32.9244 175.2362 93 T 4.7116 8.5268 125.5964 62.0492 70.7506 174.2671 94 V 4.6067 8.7565 125.5722 61.0736 34.4230 174.0977 95 V 4.5980 8.9496 128.3611 61.1965 33.6498 174.2942 96 A 4.8068 9.0270 131.0112 48.8218 18.6841 173.7903 97 P 4.8410 0.0000 0.0000 61.7779 35.0123 174.4001 98 I 4.9316 8.5006 119.6630 59.7601 39.9124 175.1660 99 D 5.1777 8.3139 127.2833 53.3942 43.1845 175.3070 100 H 5.1949 9.1218 120.6331 54.7351 32.9848 171.9701 101 F 5.5363 9.5161 125.0350 55.8685 41.9496 174.9008 102 R 5.1043 8.4908 120.8440 54.5419 33.2114 174.7515 103 F 5.2278 9.1598 122.4556 56.0994 41.7030 175.4952 104 N 4.8967 8.9276 119.7673 51.1226 39.6634 175.8028 105 G 3.5643 8.7207 105.9403 48.9853 0.0000 174.6642 106 A 4.0343 7.8984 120.4280 53.0216 18.5282 177.8747 107 G 4.4260 8.4114 104.0702 45.6108 0.0000 173.5521 108 K 4.5618 7.7652 117.7765 53.8189 34.9641 175.4663 109 V 3.5494 7.6729 121.2548 62.9064 31.6080 176.7628 110 V 4.1058 8.5867 121.8706 62.1899 33.4998 175.9520 111 S 5.1103 7.4131 114.5699 57.1887 66.0559 172.4921 112 M 5.4751 8.9563 125.7498 54.0350 35.9441 173.7850 113 R 5.1425 9.2439 123.8975 54.4247 34.3577 174.1285 114 A 5.2303 8.8567 126.2808 49.8819 20.7241 175.5966 115 L 4.8513 8.8490 126.3362 54.7774 43.3622 175.4263 116 F 5.0473 7.9948 118.7311 56.4396 40.3748 173.6535 117 G 4.3114 9.3505 111.0590 43.7608 0.0000 172.6861 118 E 3.9738 8.8881 117.3719 59.4101 29.4566 179.4396 119 K 4.1511 8.0417 115.7047 58.8872 32.9150 176.8256 120 N 4.7836 8.4098 117.1271 53.0391 39.9281 174.0537 121 I 4.6251 7.4499 120.5184 60.1506 38.5821 174.7691 122 H 5.1734 9.2822 124.0987 53.9256 32.6599 173.1138 123 A 5.0045 8.2591 120.5708 50.7248 22.1452 172.8876 124 G 4.0300 8.6797 113.9628 45.7477 0.0000 173.5064 125 A 4.2116 9.0001 128.4577 52.6102 19.0000 177.1189 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 4.45 0.00 2.14 2.39 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.56 0.00 2 N 9.24 4.25 0.00 2.74 2.55 0.00 0.00 7.65 6.58 0.00 0.00 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 T 8.91 4.48 4.43 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 1.17 0.00 0.00 4 P 0.00 4.15 0.00 2.14 2.12 0.00 3.57 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 5 E 8.08 3.89 0.00 2.02 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 2.38 2.41 0.00 6 H 7.95 4.12 0.00 3.20 3.30 0.00 5.78 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 7 M 7.98 3.51 0.00 1.72 1.83 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 0.91 0.00 8 T 8.28 3.86 4.30 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 1.16 0.00 0.00 9 A 8.01 3.95 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 10 V 7.77 3.53 2.39 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 1.17 0.00 0.00 0.89 0.00 0.00 11 V 7.61 3.34 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 -0.32 0.00 0.00 0.66 0.00 0.00 12 Q 8.05 3.94 0.00 2.23 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.56 0.00 0.00 0.00 0.00 0.00 2.30 2.51 0.00 13 R 7.97 3.98 0.00 2.05 1.98 0.00 3.12 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.88 0.00 14 Y 8.16 4.08 0.00 3.15 3.12 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 15 V 7.87 3.40 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 0.95 0.00 0.00 0.81 0.00 0.00 16 A 7.86 3.94 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 17 A 8.05 3.94 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 18 L 7.68 3.79 0.00 1.85 1.66 0.82 0.26 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 19 N 7.81 4.49 0.00 2.94 2.86 0.00 0.00 7.06 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 20 A 7.85 4.47 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 21 G 7.40 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 22 D 8.06 4.57 0.00 2.68 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 23 L 8.10 3.94 0.00 1.80 1.65 1.00 1.25 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 24 D 8.12 4.49 0.00 2.81 2.71 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 25 G 8.19 3.66 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 0.00 0.00 0.00 26 I 7.53 3.87 1.88 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.81 0.36 0.00 0.00 27 V 7.85 3.74 2.28 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 1.05 0.00 0.00 0.96 0.00 0.00 28 A 8.03 4.10 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 29 L 8.21 4.01 0.00 1.88 1.28 0.97 1.07 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 30 F 7.29 4.69 0.00 2.94 2.93 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 31 A 8.66 4.31 1.28 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 0.00 0.00 32 D 8.79 4.43 0.00 2.73 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 33 D 7.86 4.66 0.00 2.75 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 34 A 8.00 4.57 1.51 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 0.00 0.00 0.00 0.00 0.00 0.00 35 T 8.68 4.98 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 1.19 0.00 0.00 36 V 8.91 4.60 1.78 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 0.49 0.00 0.00 0.69 0.00 0.00 37 E 9.04 4.62 0.00 2.02 1.77 0.00 0.00 0.00 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 2.27 0.00 38 N 8.22 5.09 0.00 2.44 2.13 0.00 0.00 7.32 8.05 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 39 P 0.00 4.78 0.00 1.63 1.55 0.00 3.75 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.78 0.00 40 V 7.99 3.88 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 0.69 0.00 0.00 0.93 0.00 0.00 41 G 8.53 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.59 4.57 0.00 3.97 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 43 E 8.35 4.08 0.00 1.91 1.87 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 2.27 2.36 0.00 44 P 0.00 4.64 0.00 1.93 1.92 0.00 3.65 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.08 0.00 45 R 8.77 4.65 0.00 1.59 1.71 0.00 2.79 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.55 0.00 46 S 8.91 5.03 0.00 3.68 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 47 G 9.16 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 48 T 8.42 3.85 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 1.24 0.00 0.00 49 A 7.92 3.94 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.91 4.03 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 51 I 7.70 3.54 1.91 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 1.14 0.61 0.56 0.00 0.00 52 R 8.33 4.00 0.00 1.97 2.13 0.00 3.12 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 1.67 1.70 0.00 53 E 8.37 3.96 0.00 2.10 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 2.31 2.31 0.00 54 F 8.18 3.95 0.00 3.09 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 55 Y 8.16 3.90 0.00 3.15 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 56 A 7.96 3.97 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 57 N 7.98 4.31 0.00 2.77 2.65 0.00 0.00 6.99 7.18 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 58 S 7.36 3.87 0.00 3.78 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 59 L 7.80 4.36 0.00 1.70 1.65 0.93 0.99 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 60 K 7.76 4.20 0.00 1.78 1.83 0.00 1.59 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 1.61 7.81 61 L 6.80 4.76 0.00 1.57 1.55 0.70 1.11 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 62 P 0.00 4.45 0.00 2.08 2.01 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 63 L 8.45 5.10 0.00 1.53 1.63 0.94 0.73 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 64 A 8.97 4.83 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 65 V 9.49 5.44 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 1.29 0.00 0.00 1.01 0.00 0.00 66 E 8.64 4.89 0.00 2.09 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 2.33 2.42 0.00 67 L 8.66 4.91 0.00 1.60 1.73 0.85 0.81 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 68 T 8.54 4.55 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 1.27 0.00 0.00 69 Q 7.79 4.61 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.02 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 70 E 8.58 4.09 0.00 2.09 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 2.31 2.34 0.00 71 V 8.12 4.01 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 0.84 0.00 0.00 0.84 0.00 0.00 72 R 8.95 4.65 0.00 2.07 1.87 0.00 3.20 0.00 0.00 3.22 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 73 A 8.33 5.22 1.15 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 0.00 0.00 74 V 9.20 4.04 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 0.64 0.00 0.00 0.94 0.00 0.00 75 A 9.53 3.95 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.96 4.38 0.00 3.00 3.17 0.00 0.00 6.76 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 77 E 8.12 5.62 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 2.35 2.52 0.00 78 A 9.43 5.45 1.43 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 0.00 0.00 79 A 9.25 5.29 1.20 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 0.00 0.00 0.00 80 F 8.43 5.25 0.00 3.09 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 81 A 8.81 5.31 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 82 F 8.26 5.63 0.00 3.47 3.34 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.82 4.69 1.86 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 1.38 0.75 0.89 0.00 0.00 84 V 8.79 4.90 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 1.08 0.00 0.00 1.09 0.00 0.00 85 S 9.16 5.39 0.00 3.78 3.68 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 0.00 0.00 0.00 0.00 86 F 8.44 5.18 0.00 3.14 3.12 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 87 E 9.00 5.07 0.00 2.02 1.96 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 2.24 2.34 0.00 88 Y 9.00 4.91 0.00 3.48 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 89 Q 9.44 3.29 0.00 2.06 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 5.42 0.00 0.00 0.00 0.00 0.00 1.85 2.14 0.00 90 G 8.24 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 91 R 7.73 4.50 0.00 1.52 1.81 0.00 3.26 0.00 0.00 3.09 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.43 0.00 92 K 8.59 4.47 0.00 1.80 1.70 0.00 1.64 0.00 0.00 1.77 0.00 0.00 2.79 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.41 1.43 7.81 93 T 8.53 4.71 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 1.05 0.00 0.00 94 V 8.76 4.61 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 0.78 0.00 0.00 0.87 0.00 0.00 95 V 8.95 4.60 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 0.48 0.00 0.00 0.98 0.00 0.00 96 A 9.03 4.81 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 0.00 0.00 0.00 0.00 0.00 97 P 0.00 4.84 0.00 2.09 2.20 0.00 2.20 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.44 0.00 98 I 8.50 4.93 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.83 0.87 0.00 0.00 99 D 8.31 5.18 0.00 1.58 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 0.00 0.00 0.00 100 H 9.12 5.19 0.00 3.15 3.13 0.00 5.56 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 F 9.52 5.54 0.00 3.03 2.42 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 0.00 102 R 8.49 5.10 0.00 1.65 1.78 0.00 3.08 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.44 0.00 103 F 9.16 5.23 0.00 2.90 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.93 4.90 0.00 2.88 2.98 0.00 0.00 7.15 6.52 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 0.00 105 G 8.72 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 A 7.90 4.03 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 0.00 107 G 8.41 4.43 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 0.00 0.00 0.00 108 K 7.77 4.56 0.00 1.79 1.72 0.00 1.67 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.41 7.81 109 V 7.67 3.55 0.75 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 0.04 0.00 0.00 -0.43 0.00 0.00 110 V 8.59 4.11 2.05 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 0.68 0.00 0.00 0.94 0.00 0.00 111 S 7.41 5.11 0.00 3.82 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 0.00 112 M 8.96 5.48 0.00 2.24 1.66 0.00 0.00 0.00 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 3.13 0.00 113 R 9.24 5.14 0.00 1.82 1.80 0.00 3.19 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 114 A 8.86 5.23 1.64 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 0.00 0.00 115 L 8.85 4.85 0.00 1.81 1.60 0.92 0.81 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 0.00 116 F 7.99 5.05 0.00 2.97 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 0.00 117 G 9.35 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 0.00 118 E 8.89 3.97 0.00 2.01 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 2.40 2.26 0.00 119 K 8.04 4.15 0.00 1.88 1.95 0.00 1.56 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.48 7.81 120 N 8.41 4.78 0.00 2.95 3.03 0.00 0.00 6.74 7.83 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 0.00 121 I 7.45 4.63 1.99 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.82 0.93 0.00 0.00 122 H 9.28 5.17 0.00 3.02 3.14 0.00 5.78 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 0.00 123 A 8.26 5.00 1.15 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 0.00 0.00 124 G 8.68 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 0.00 0.00 0.00 125 A 9.00 4.21 1.18 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 0.00 0.00