NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.6402 8.2649 123.6072 51.3727 20.6897 176.9480 3 D 4.4647 7.8817 116.4643 53.4725 41.6821 174.1842 4 R 4.5741 9.0172 118.4300 55.4787 32.8466 173.4441 5 I 4.4231 8.2367 121.2414 59.6480 39.5484 174.5562 6 E 4.9608 8.6735 125.8538 54.3948 32.0938 174.8495 7 L 4.7110 9.1545 127.3015 53.2932 44.5356 175.2673 8 R 4.8427 8.2502 124.0145 55.1386 33.7334 175.3794 9 G 3.7222 9.4042 111.4852 45.8284 0.0000 172.9709 10 L 4.0674 8.1471 122.7393 55.4472 42.9336 175.7750 11 T 5.1249 8.5080 123.4557 61.8312 70.7918 174.2733 12 V 4.5248 8.7951 125.9110 61.4099 35.2734 173.5914 13 H 4.9391 9.1469 128.1861 56.6535 30.8626 174.1967 14 G 4.0885 9.1173 111.0596 45.4450 0.0000 173.3517 15 R 5.0041 7.8856 116.7180 55.9622 31.1453 175.9792 16 H 4.5214 8.0011 114.8193 55.1459 29.4470 175.1349 17 G 4.5649 7.9971 117.7858 45.4212 0.0000 174.0211 18 V 3.3540 8.2070 122.7061 65.0362 31.9784 175.9282 19 Y 4.6943 7.5274 117.1545 56.3265 39.8969 176.2446 20 D 4.4713 8.8783 125.3750 57.7813 41.5613 179.1349 21 H 4.2838 8.3418 114.8576 58.7924 28.2021 177.1079 22 E 4.1660 8.8197 121.1552 58.4100 29.0132 178.6182 23 R 4.1273 7.7102 116.6810 56.9044 30.6868 177.9816 24 V 3.6965 7.7028 118.1801 65.4158 31.6401 176.5421 25 A 4.4448 8.1086 119.4102 51.1521 20.6572 177.1048 26 G 3.8907 9.0571 103.1362 45.5368 0.0000 171.6113 27 Q 4.5527 8.1071 114.9515 55.1650 32.3157 173.2893 28 R 4.3773 8.4339 120.6064 56.2682 30.7438 175.3636 29 F 5.0777 9.5075 125.0129 55.6879 42.8160 174.5498 30 V 4.9252 8.8538 120.9391 61.3613 34.6041 174.1525 31 I 5.1747 8.9703 128.7480 59.7137 40.1387 174.3043 32 D 5.4803 9.0523 125.4294 52.5308 44.3776 175.2561 33 V 4.9045 8.8559 121.5224 61.4206 35.4089 174.2166 34 T 4.7065 8.8973 123.5805 61.5927 71.7697 172.9357 35 V 4.4218 8.4693 127.0968 60.7441 33.9232 174.3581 36 W 4.8387 9.2037 129.5677 56.0678 30.1727 175.6167 37 I 4.6719 7.8578 122.7409 59.6015 41.0283 173.7464 38 D 4.4173 8.8442 128.9946 54.6366 41.7631 175.6405 39 L 4.6467 9.0359 124.8223 54.6006 42.6857 178.2905 40 A 3.9997 8.7616 124.0930 55.1827 18.2739 179.9447 41 E 3.8684 8.2283 117.1981 59.4151 29.6764 178.6317 42 A 4.0077 8.0724 120.0676 55.2584 18.2310 179.2827 43 A 4.1091 7.6139 117.6438 54.8917 18.4909 179.3971 44 N 4.4608 7.8731 115.0359 56.1585 38.8018 177.0953 45 S 4.4116 8.0757 113.6562 57.9225 63.7430 173.8993 46 D 4.3850 8.2425 120.3863 54.9306 40.2042 171.9366 47 D 4.8510 7.7658 116.2664 51.3897 42.9031 176.4236 48 L 3.8511 8.6975 128.3719 58.1257 42.1886 178.7728 49 A 4.0319 8.2874 120.6517 54.8170 18.3148 177.7188 50 D 4.6323 8.0966 113.7185 54.9702 41.1314 175.3441 51 T 4.6125 7.5770 113.3830 60.2658 70.6485 171.7032 52 Y 4.2295 8.3293 123.1181 55.9878 38.9032 174.0859 53 D 4.3636 8.1473 127.9366 54.2816 42.1389 176.0766 54 Y 4.3268 8.3140 126.7085 60.1168 38.0478 178.4434 55 V 3.8944 8.0205 114.6702 64.0691 31.6719 178.6217 56 R 3.9822 7.7995 117.5371 58.6524 29.8953 178.4478 57 L 4.0647 7.8272 120.1503 58.2951 42.0475 179.0291 58 A 4.0370 8.2916 120.6829 54.9739 18.3159 179.4976 59 S 4.0165 8.0866 111.7430 61.7239 62.5235 176.5275 60 R 3.8774 8.2553 121.2354 59.1324 29.8081 178.1841 61 A 3.9793 8.3097 120.6388 55.0098 18.3986 179.3930 62 A 3.9612 8.3129 119.5121 55.5052 18.2800 179.5956 63 E 3.9391 7.9432 115.6810 59.6634 29.6893 179.5600 64 I 3.8365 7.7483 119.7206 64.4747 37.0122 178.7530 65 V 3.5576 7.7229 117.4361 65.3640 31.4258 177.0454 66 A 4.4674 7.9490 118.3909 54.1463 19.4087 178.5912 67 G 3.8411 7.6045 103.8385 42.4978 0.0000 171.3033 68 P 4.3471 0.0000 0.0000 61.8840 31.9332 174.6663 69 P 4.3569 0.0000 0.0000 62.7794 32.1574 175.9034 70 R 4.5772 8.3661 118.7484 54.5031 32.5744 177.7940 71 K 4.3143 8.4681 117.5779 58.3575 32.0801 177.8551 72 L 4.7923 7.4715 117.7318 52.8209 44.0148 177.4986 73 I 3.7963 8.1566 115.0388 63.7605 37.7037 178.0414 74 E 3.9323 8.2871 120.5688 59.7447 29.2773 179.0895 75 T 3.9923 7.6445 108.7209 64.1014 69.1103 177.2168 76 V 3.5561 7.6783 120.9798 65.8375 31.5040 178.0849 77 G 3.5729 8.2464 105.3007 47.8032 0.0000 175.5569 78 A 3.9967 8.2111 123.4130 54.6368 18.3401 179.4026 79 E 3.8692 8.2484 118.0111 59.4496 29.7606 179.0700 80 I 3.6964 7.8571 119.5744 64.3946 37.2333 178.1811 81 A 4.0443 8.2628 121.7604 55.4533 17.9813 179.4510 82 D 4.3430 8.2988 116.6144 57.6646 41.0615 178.0818 83 H 4.3096 8.2624 118.7986 59.3900 29.8812 177.5544 84 V 3.9080 7.7832 121.3419 65.6084 31.1883 177.5461 85 M 4.3078 7.9919 116.5293 57.1415 31.8966 177.7969 86 D 4.6925 7.6421 118.6694 55.4304 41.2214 175.6481 87 D 4.6283 7.9110 120.1477 53.2766 40.7671 176.4978 88 Q 4.3101 8.6099 125.1487 57.1287 28.8880 177.5145 89 R 4.1644 8.1830 117.6535 57.9349 30.5623 177.2715 90 V 3.9225 7.6288 118.7052 63.1606 31.6810 175.4314 91 H 4.5621 9.6467 125.2914 58.7663 29.7954 175.0892 92 A 4.7158 7.9323 116.7621 51.5660 22.5427 175.5071 93 V 5.2107 8.6291 117.9160 60.6058 35.4019 173.3507 94 E 5.2882 9.4914 122.2311 54.6686 33.0785 174.8305 95 V 4.7927 9.0699 124.4478 61.0679 34.3015 173.8025 96 A 5.0825 9.2184 130.5715 50.3133 21.3903 175.3368 97 V 4.5076 8.8909 123.8662 61.7199 33.5545 174.0940 98 H 5.2827 9.5060 126.3538 54.1464 30.9905 174.7389 99 K 5.0751 9.0250 124.1821 54.0305 30.9192 174.7477 100 P 4.3739 0.0000 0.0000 64.6498 32.0295 178.1208 101 Q 4.3992 7.7865 116.3465 55.2266 28.9010 174.9771 102 A 3.9519 7.9287 121.0873 52.6267 19.0595 178.0583 103 P 4.6700 0.0000 0.0000 61.4544 30.2621 175.2813 104 I 4.4836 7.2081 113.7783 59.0872 40.3378 174.8543 105 P 4.4672 0.0000 0.0000 63.9755 31.7836 176.4486 106 Q 4.3192 7.7667 118.0856 55.8536 29.6049 174.8963 107 T 4.6484 8.2675 116.3374 62.1699 69.6737 174.5673 108 F 5.0091 8.1212 119.8507 55.6662 40.9304 174.1777 109 D 4.3021 8.7799 121.6542 56.9028 41.0872 176.6072 110 D 4.8242 7.7405 114.8706 52.9213 44.3151 174.2165 111 V 4.8039 8.3698 122.9650 60.3244 34.9287 173.9395 112 A 5.0421 8.4361 122.3488 51.3276 22.1931 175.6221 113 V 4.5313 8.6242 112.1560 59.4575 35.6772 175.1566 114 V 4.8586 8.3214 122.1264 61.3441 33.9105 174.4934 115 I 4.4937 8.8842 129.4903 59.6361 39.1341 174.7606 116 R 5.2572 8.6105 126.9028 54.8618 32.7815 175.0403 117 R 4.8980 8.6691 122.1492 55.1368 35.1162 174.5623 118 S 4.9191 8.2843 114.6634 57.8331 66.0214 174.3380 119 R 4.1928 8.3524 118.2664 56.4576 30.1303 176.3818 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 A 8.26 4.64 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 3 D 7.88 4.46 0.00 2.76 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 4 R 9.02 4.57 0.00 1.15 1.05 0.00 2.33 0.00 0.00 3.02 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.37 0.00 5 I 8.24 4.42 1.82 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.59 0.97 0.00 0.00 6 E 8.67 4.96 0.00 1.70 1.73 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 1.95 2.06 0.00 7 L 9.15 4.71 0.00 1.70 1.49 0.90 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.25 4.84 0.00 1.64 1.74 0.00 3.47 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.51 0.00 9 G 9.40 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 10 L 8.15 4.07 0.00 1.82 1.79 0.95 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.51 5.12 4.26 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 1.24 0.00 0.00 12 V 8.80 4.52 2.18 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 0.99 0.00 0.00 0.98 0.00 0.00 13 H 9.15 4.94 0.00 3.25 3.25 0.00 5.79 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 G 9.12 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 R 7.89 5.00 0.00 1.70 1.87 0.00 3.23 0.00 0.00 3.51 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 16 H 8.00 4.52 0.00 2.91 3.21 0.00 6.06 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 G 8.00 4.56 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 18 V 8.21 3.35 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 0.17 0.00 0.00 0.89 0.00 0.00 19 Y 7.53 4.69 0.00 2.93 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 20 D 8.88 4.47 0.00 2.77 2.77 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 0.00 0.00 0.00 21 H 8.34 4.28 0.00 3.36 3.60 0.00 5.46 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 22 E 8.82 4.17 0.00 2.23 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 0.00 2.41 2.35 0.00 23 R 7.71 4.13 0.00 1.98 1.99 0.00 3.17 0.00 0.00 3.15 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.64 0.00 24 V 7.70 3.70 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 0.76 0.00 0.00 0.97 0.00 0.00 25 A 8.11 4.44 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 26 G 9.06 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 27 Q 8.11 4.55 0.00 1.93 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.96 0.00 0.00 0.00 0.00 0.00 2.01 1.40 0.00 28 R 8.43 4.38 0.00 1.83 1.78 0.00 3.15 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 29 F 9.51 5.08 0.00 3.16 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 30 V 8.85 4.93 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 0.89 0.00 0.00 0.94 0.00 0.00 31 I 8.97 5.17 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 1.31 0.90 0.95 0.00 0.00 32 D 9.05 5.48 0.00 2.61 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 33 V 8.86 4.90 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 0.97 0.00 0.00 0.96 0.00 0.00 34 T 8.90 4.71 3.94 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 -0.11 0.00 0.00 35 V 8.47 4.42 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 0.61 0.00 0.00 0.66 0.00 0.00 36 W 9.20 4.84 0.00 3.47 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 37 I 7.86 4.67 1.87 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.73 0.89 0.00 0.00 38 D 8.84 4.42 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 39 L 9.04 4.65 0.00 1.85 1.63 0.91 0.71 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 40 A 8.76 4.00 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 41 E 8.23 3.87 0.00 2.03 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 0.00 2.39 2.34 0.00 42 A 8.07 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 43 A 7.61 4.11 1.36 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 0.00 0.00 0.00 44 N 7.87 4.46 0.00 3.07 2.89 0.00 0.00 6.97 7.57 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 45 S 8.08 4.41 0.00 4.03 3.99 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 0.00 0.00 0.00 0.00 46 D 8.24 4.38 0.00 2.76 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 47 D 7.77 4.85 0.00 2.69 2.49 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 48 L 8.70 3.85 0.00 1.63 1.62 0.83 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 49 A 8.29 4.03 1.29 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 0.00 0.00 50 D 8.10 4.63 0.00 2.85 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 51 T 7.58 4.61 4.27 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 1.25 0.00 0.00 52 Y 8.33 4.23 0.00 3.01 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 53 D 8.15 4.36 0.00 2.64 2.31 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 54 Y 8.31 4.33 0.00 3.23 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 55 V 8.02 3.89 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 0.48 0.00 0.00 0.89 0.00 0.00 56 R 7.80 3.98 0.00 1.71 1.92 0.00 2.98 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 57 L 7.83 4.06 0.00 2.10 1.94 1.12 1.09 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 58 A 8.29 4.04 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 59 S 8.09 4.02 0.00 3.93 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 60 R 8.26 3.88 0.00 1.90 1.94 0.00 3.12 0.00 0.00 3.02 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 1.49 0.00 61 A 8.31 3.98 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 62 A 8.31 3.96 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 63 E 7.94 3.94 0.00 2.13 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 2.51 0.00 64 I 7.75 3.84 1.98 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 1.53 1.47 0.93 0.00 0.00 65 V 7.72 3.56 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 0.77 0.00 0.00 1.00 0.00 0.00 66 A 7.95 4.47 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 67 G 7.60 3.84 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 0.00 0.00 0.00 68 P 0.00 4.35 0.00 2.04 1.99 0.00 3.67 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 2.02 2.07 0.00 69 P 0.00 4.36 0.00 2.15 1.95 0.00 3.72 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 70 R 8.37 4.58 0.00 2.00 1.84 0.00 3.27 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.54 0.00 71 K 8.47 4.31 0.00 1.70 1.78 0.00 1.72 0.00 0.00 2.49 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.35 1.37 7.81 72 L 7.47 4.79 0.00 1.66 1.77 0.90 0.74 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 73 I 8.16 3.80 1.92 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.66 1.08 0.00 0.00 74 E 8.29 3.93 0.00 2.06 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 0.00 2.40 2.45 0.00 75 T 7.64 3.99 4.21 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 0.00 0.00 0.00 1.23 0.00 0.00 76 V 7.68 3.56 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 0.85 0.00 0.00 0.46 0.00 0.00 77 G 8.25 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 78 A 8.21 4.00 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 79 E 8.25 3.87 0.00 2.05 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 0.00 2.30 2.35 0.00 80 I 7.86 3.70 2.01 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.83 0.96 0.00 0.00 81 A 8.26 4.04 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 82 D 8.30 4.34 0.00 2.70 2.77 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 0.00 0.00 0.00 83 H 8.26 4.31 0.00 3.31 3.58 0.00 5.78 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 84 V 7.78 3.91 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 1.01 0.00 0.00 1.07 0.00 0.00 85 M 7.99 4.31 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.93 0.00 86 D 7.64 4.69 0.00 2.83 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 87 D 7.91 4.63 0.00 2.93 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 88 Q 8.61 4.31 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.87 0.00 0.00 0.00 0.00 0.00 2.38 2.34 0.00 89 R 8.18 4.16 0.00 2.02 2.05 0.00 3.21 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 90 V 7.63 3.92 2.18 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 0.84 0.00 0.00 0.85 0.00 0.00 91 H 9.65 4.56 0.00 3.33 3.33 0.00 5.72 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 92 A 7.93 4.72 1.05 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 93 V 8.63 5.21 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 0.75 0.00 0.00 0.99 0.00 0.00 94 E 9.49 5.29 0.00 2.20 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 2.59 0.00 95 V 9.07 4.79 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 1.06 0.00 0.00 0.99 0.00 0.00 96 A 9.22 5.08 1.21 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 0.00 0.00 0.00 0.00 0.00 0.00 97 V 8.89 4.51 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 1.04 0.00 0.00 1.00 0.00 0.00 98 H 9.51 5.28 0.00 3.21 3.41 0.00 5.61 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 K 9.03 5.08 0.00 1.88 1.74 0.00 1.84 0.00 0.00 1.79 0.00 0.00 2.93 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.34 1.12 7.81 100 P 0.00 4.37 0.00 2.13 2.13 0.00 3.90 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 1.91 1.95 0.00 101 Q 7.79 4.40 0.00 1.95 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.81 0.00 0.00 0.00 0.00 0.00 2.20 2.23 0.00 102 A 7.93 3.95 1.46 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 0.00 103 P 0.00 4.67 0.00 2.26 2.17 0.00 3.81 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 2.06 2.06 0.00 104 I 7.21 4.48 1.92 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.60 0.83 0.00 0.00 105 P 0.00 4.47 0.00 2.20 2.20 0.00 3.73 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 106 Q 7.77 4.32 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.78 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 107 T 8.27 4.65 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 1.22 0.00 0.00 108 F 8.12 5.01 0.00 3.13 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 0.00 109 D 8.78 4.30 0.00 2.70 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 0.00 110 D 7.74 4.82 0.00 2.62 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 0.00 111 V 8.37 4.80 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 0.91 0.00 0.00 0.90 0.00 0.00 112 A 8.44 5.04 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 0.00 113 V 8.62 4.53 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 0.76 0.00 0.00 0.96 0.00 0.00 114 V 8.32 4.86 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 0.87 0.00 0.00 0.94 0.00 0.00 115 I 8.88 4.49 1.89 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.86 0.92 0.00 0.00 116 R 8.61 5.26 0.00 1.80 1.77 0.00 3.26 0.00 0.00 3.16 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.69 0.00 117 R 8.67 4.90 0.00 1.76 1.74 0.00 3.57 0.00 0.00 3.22 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.73 0.00 118 S 8.28 4.92 0.00 3.85 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 0.00 119 R 8.35 4.19 0.00 1.77 1.83 0.00 3.56 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00