NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 18 A 4.3267 8.2493 123.5787 52.2082 20.0197 176.1775 19 D 5.5799 8.4616 120.4897 52.4326 42.1801 174.3599 20 R 5.2652 8.7525 118.1030 54.5283 33.3678 176.5361 21 H 4.8483 9.4007 119.5767 54.3239 32.2614 172.6138 22 T 4.7263 8.5589 120.0600 62.3200 69.9622 174.2805 23 V 4.4101 8.6279 126.5068 61.1124 34.4190 174.4034 24 F 4.8550 9.1986 127.5441 56.4256 39.1128 175.9637 25 W 4.5335 9.0930 135.0000 56.0477 28.6413 174.7073 26 N 5.5097 7.9928 119.9776 50.8723 42.6307 175.5754 27 S 4.1756 9.8033 116.8288 60.3321 63.4892 175.1032 28 S 4.4801 7.9651 114.5252 58.0685 63.4903 173.2289 29 N 4.5917 8.0312 121.8806 52.2918 38.5730 173.8730 30 P 4.4712 0.0000 0.0000 64.5688 31.6331 178.4955 31 K 3.5444 8.2920 119.1045 59.0490 31.9883 177.9237 32 F 4.3615 7.8512 116.0945 58.0470 39.3133 177.4801 33 R 3.9273 7.9297 118.1211 59.0128 29.0170 177.2751 34 N 4.7597 8.1475 112.5733 51.9714 38.6449 174.2205 35 E 3.9970 8.2036 116.2427 57.4776 27.6772 174.8008 36 D 4.9868 8.1040 113.0634 52.8723 40.7237 174.2580 37 Y 4.3664 8.2500 121.6199 59.3690 39.4179 175.2211 38 T 5.2712 8.8381 122.2829 61.7515 72.6208 173.0894 39 I 4.6302 8.5087 117.7388 59.2441 41.4519 173.5925 40 H 5.1730 8.6110 122.2898 54.6129 31.9338 172.9117 41 V 4.2809 8.6364 118.2507 59.5009 36.2329 174.1065 42 Q 4.7773 8.6970 122.4626 53.8322 31.4857 174.7239 43 L 4.1402 8.3035 125.6721 56.9835 42.4472 177.1997 44 N 4.3774 9.1744 121.6448 53.1743 37.2418 174.2043 45 D 4.8258 7.7624 118.7567 54.4917 42.7507 174.5320 46 Y 5.2744 9.5107 117.5608 56.2634 41.6248 175.3431 47 V 4.6997 8.9835 122.8894 60.1562 34.1517 174.3076 48 D 5.0614 9.1074 125.9011 52.6591 42.5622 175.4448 49 I 4.5401 8.6796 126.6453 60.4741 38.6881 175.2515 50 I 4.5640 8.8762 129.3147 59.8369 38.5371 175.2482 51 C 5.0835 9.0183 125.3170 55.8411 41.1264 172.0876 52 P 4.6121 0.0000 0.0000 63.7223 31.6372 175.4541 53 H 5.1061 8.1084 121.4599 54.9900 33.1193 171.9193 54 Y 4.6731 8.3989 122.1081 55.9122 40.9280 175.2634 55 E 3.8158 9.1469 124.6092 56.3850 30.4202 175.5406 56 D 3.9189 8.6452 117.5783 57.6316 41.6667 178.1932 57 H 4.7989 8.5625 119.1410 54.5551 30.6760 174.8731 58 S 5.4485 7.5197 121.5914 58.3309 59.1183 175.5920 59 V 4.3122 6.9652 121.6718 59.3541 33.9131 175.2736 60 A 4.1037 8.3075 129.1668 51.9482 19.3986 177.8000 61 D 4.2306 8.9145 121.0481 57.6355 40.9972 179.7584 62 A 3.9349 7.8992 119.3401 54.4324 18.4836 177.7258 63 A 4.2885 7.6676 116.7951 52.3478 19.4356 177.3491 64 M 3.6550 7.1971 116.5934 54.7833 32.4233 176.0800 65 E 3.8813 8.7591 123.7740 56.3097 30.5453 176.4244 66 Q 4.7494 8.3023 121.1476 54.5058 33.6501 173.5098 67 Y 5.3458 8.5815 118.2821 56.4288 42.7333 174.3271 68 I 4.4050 9.0477 123.8555 60.3114 39.0696 174.6832 69 L 4.9242 8.5896 127.1031 53.2491 44.1869 175.1746 70 Y 5.1149 9.1694 120.2960 56.1225 42.1722 174.1461 71 L 4.7835 8.5360 125.0795 53.8953 43.1373 175.7876 72 V 4.7287 8.6464 118.7885 59.7266 36.3995 174.9480 73 E 4.5315 9.0805 121.6241 55.5658 30.9050 177.5544 74 H 3.2609 8.8391 118.7045 59.4520 29.6483 176.5885 75 E 3.8570 8.1900 119.6728 59.8015 29.3476 179.2690 76 E 4.0418 8.0880 117.7459 59.3298 29.5579 178.6255 77 Y 4.0806 7.8362 119.6750 60.8325 38.6464 178.0575 78 Q 3.8098 8.0802 117.9918 58.8624 28.9548 178.4202 79 L 4.1552 7.8312 117.0153 54.3669 42.1338 175.8732 80 C 4.1605 7.8225 117.7598 56.9532 42.6198 172.4265 81 Q 4.4908 8.0612 117.4201 53.0412 31.7772 172.5388 82 P 4.2609 0.0000 0.0000 62.7830 31.9856 176.0548 83 Q 4.1563 9.1158 122.1479 58.3734 29.6332 176.0771 84 S 4.6829 7.7011 109.8350 56.4327 65.9768 174.7090 85 K 4.4101 8.7217 122.2208 58.9448 32.0580 178.3263 86 D 4.5329 7.7206 116.6817 57.0346 41.0749 176.9176 87 Q 4.4703 8.6119 117.7149 55.4270 29.2500 175.6087 88 V 3.5827 7.6007 119.4219 63.3726 31.8435 175.1606 89 R 4.5032 8.7826 128.4230 57.4675 31.5906 175.4193 90 W 4.2827 7.1411 126.2311 57.1340 34.1832 172.8726 91 Q 4.7905 7.6920 120.9390 54.2767 31.4462 177.2740 92 C 4.8006 9.3103 122.7185 55.3620 39.6101 173.4297 93 N 5.2685 8.3099 120.5908 52.3381 38.2462 176.2885 94 R 4.7236 7.7653 115.4234 54.8632 30.7115 174.2946 95 P 4.7115 0.0000 0.0000 65.0045 32.2852 178.8646 96 S 5.0660 7.9616 113.3840 57.8380 62.9474 173.7160 97 A 4.0952 7.7990 123.9162 52.5236 18.6411 179.4855 98 K 3.9319 9.0322 122.7393 59.8879 32.1332 177.9083 99 H 4.4550 8.2860 110.4353 55.7064 29.1398 174.0345 100 G 4.1629 6.9628 104.4931 41.9956 0.0000 171.7544 101 P 4.1461 0.0000 0.0000 62.5515 31.9290 176.2988 102 E 4.2991 8.7207 122.5638 56.6043 30.8816 175.3646 103 K 4.9443 8.5193 125.8533 54.6959 35.8888 174.6766 104 L 3.9703 8.6790 129.1610 53.4254 43.9614 175.2280 105 S 5.0287 8.3218 123.4063 57.1055 63.7631 172.8436 106 E 4.3799 8.9906 127.4076 54.5989 31.0818 174.5057 107 K 4.3183 8.3944 128.4313 54.7936 33.5132 177.2893 108 F 3.5098 8.8253 129.3714 56.0590 37.0436 174.3237 109 Q 4.8161 7.6963 119.3621 54.4133 31.0720 178.3202 110 R 4.4413 8.5028 121.0901 58.2171 30.3931 176.7905 111 F 5.4083 7.7099 113.8558 55.7855 42.2689 174.0943 112 T 4.7369 9.1530 118.2692 59.8048 69.9864 172.0650 113 P 4.4823 0.0000 0.0000 62.9899 32.1114 175.3901 114 F 4.6652 8.2168 123.3133 56.3880 39.7661 175.0581 115 T 4.1998 7.5927 118.2463 62.4201 69.3526 173.7641 116 L 4.0705 8.4617 123.3488 55.0051 40.2900 175.5484 117 G 4.0586 7.8005 106.3787 44.3217 0.0000 172.1803 118 K 4.3053 8.1468 119.2839 54.2251 34.4041 174.6856 119 E 4.4378 8.0256 124.2960 54.7343 31.6984 175.2350 120 F 4.5550 8.4629 120.8685 55.4603 42.3737 174.2752 121 K 4.9241 9.3044 121.9801 54.1075 35.5005 175.8049 122 E 4.0870 8.8392 123.3379 58.4088 29.7898 177.6332 123 G 3.9596 9.3135 111.9770 45.4245 0.0000 172.3856 124 H 4.9374 7.9472 115.5180 53.8419 32.5694 172.9650 125 S 5.0451 8.0338 114.7846 57.0688 66.2228 173.0191 126 Y 4.5727 8.5431 118.7604 56.5820 42.8617 173.8649 127 Y 5.2984 8.3675 116.9799 56.7144 42.5704 173.9043 128 Y 5.5943 9.5235 120.8012 56.4365 41.4964 174.7701 129 I 5.8433 9.0270 115.3006 59.6255 41.8753 173.7311 130 S 5.5965 9.0200 116.4934 56.6858 66.5550 173.3191 131 K 5.0179 9.3217 119.4918 53.8341 35.5400 174.3130 132 P 4.7031 0.0000 0.0000 63.2295 31.5677 176.2282 133 I 4.2129 8.4533 123.8371 63.5008 38.0838 176.6343 134 H 4.3517 8.1075 116.0193 55.6681 28.8441 174.9886 135 Q 4.3725 8.5614 117.4258 56.6019 29.3540 175.6931 136 H 4.7031 8.0138 113.3657 55.3372 29.1751 174.9125 137 E 4.3655 7.6040 118.8126 55.9357 30.4115 173.9352 138 D 4.7622 9.7505 123.4241 52.2919 43.0825 173.5839 139 R 4.2557 8.1982 120.9696 54.7487 31.4726 174.3807 140 C 4.4834 8.4987 127.1411 56.2725 38.6004 172.0747 141 L 4.8187 8.4172 127.6270 52.9157 43.5534 175.8321 142 R 5.5369 8.6423 118.7126 55.7282 32.8022 173.8958 143 L 4.9470 9.8081 121.0789 53.8624 46.1216 173.9673 144 K 4.8553 9.1565 127.3443 54.5994 35.0609 174.7742 145 V 4.6402 8.5432 126.5862 61.4054 34.5281 173.9781 146 T 4.7313 8.5927 124.9135 61.8636 70.8108 173.6241 147 V 4.5945 8.7749 127.6605 61.4216 32.9405 175.5773 148 K 4.5722 8.8834 128.1237 56.5089 33.9946 177.2850 149 I 4.0057 8.1286 120.7030 61.6997 37.2473 175.9882 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 18 A 8.25 4.33 1.19 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 0.00 0.00 0.00 19 D 8.46 5.58 0.00 2.95 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 20 R 8.75 5.27 0.00 1.63 1.98 0.00 2.88 0.00 0.00 3.08 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.55 0.00 21 H 9.40 4.85 0.00 2.88 3.10 0.00 5.60 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.56 4.73 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 0.65 0.00 0.00 23 V 8.63 4.41 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 1.22 0.00 0.00 0.82 0.00 0.00 24 F 9.20 4.86 0.00 3.07 3.08 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 25 W 9.09 4.53 0.00 3.59 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 26 N 7.99 5.51 0.00 2.82 2.75 0.00 0.00 6.76 7.34 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 27 S 9.80 4.18 0.00 4.00 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 0.00 28 S 7.97 4.48 0.00 4.03 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 29 N 8.03 4.59 0.00 2.86 3.18 0.00 0.00 6.94 8.95 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 30 P 0.00 4.47 0.00 2.19 2.25 0.00 3.69 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 1.98 1.94 0.00 31 K 8.29 3.54 0.00 0.81 0.74 0.00 1.43 0.00 0.00 1.20 0.00 0.00 2.84 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.01 1.07 7.81 32 F 7.85 4.36 0.00 3.13 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 33 R 7.93 3.93 0.00 1.91 2.19 0.00 3.04 0.00 0.00 3.19 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.61 0.00 34 N 8.15 4.76 0.00 2.91 2.88 0.00 0.00 7.01 7.66 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 35 E 8.20 4.00 0.00 2.11 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 0.00 2.28 2.25 0.00 36 D 8.10 4.99 0.00 2.80 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 37 Y 8.25 4.37 0.00 2.84 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 38 T 8.84 5.27 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 1.18 0.00 0.00 39 I 8.51 4.63 1.70 0.00 0.00 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 0.85 0.50 0.74 0.00 0.00 40 H 8.61 5.17 0.00 3.03 3.17 0.00 5.86 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.64 4.28 1.81 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 0.02 0.00 0.00 0.29 0.00 0.00 42 Q 8.70 4.78 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.93 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 43 L 8.30 4.14 0.00 1.61 1.54 1.02 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 44 N 9.17 4.38 0.00 2.83 2.97 0.00 0.00 7.02 8.12 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 45 D 7.76 4.83 0.00 2.59 2.68 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 46 Y 9.51 5.27 0.00 2.85 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 47 V 8.98 4.70 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 0.92 0.00 0.00 0.88 0.00 0.00 48 D 9.11 5.06 0.00 2.47 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 49 I 8.68 4.54 1.73 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.41 0.98 0.00 0.00 50 I 8.88 4.56 1.69 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.22 1.00 0.00 0.00 51 C 9.02 5.08 0.00 3.06 3.20 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 52 P 0.00 4.61 0.00 2.32 2.14 0.00 3.96 0.00 0.00 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.66 0.00 53 H 8.11 5.11 0.00 3.09 3.09 0.00 5.86 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 8.40 4.67 0.00 2.82 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 55 E 9.15 3.82 0.00 2.01 1.88 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 2.31 2.36 0.00 56 D 8.65 3.92 0.00 2.68 2.58 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 0.00 0.00 0.00 0.00 57 H 8.56 4.80 0.00 3.10 3.23 0.00 5.97 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 7.52 5.45 0.00 4.15 4.15 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 59 V 6.97 4.31 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 0.59 0.00 0.00 1.10 0.00 0.00 60 A 8.31 4.10 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 61 D 8.91 4.23 0.00 2.65 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 62 A 7.90 3.93 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 63 A 7.67 4.29 1.19 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 0.00 0.00 0.00 64 M 7.20 3.65 0.00 1.66 1.87 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 1.13 0.00 65 E 8.76 3.88 0.00 2.05 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 2.06 2.34 0.00 66 Q 8.30 4.75 0.00 1.89 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.84 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 67 Y 8.58 5.35 0.00 2.92 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 68 I 9.05 4.40 1.95 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 1.19 0.77 0.38 0.00 0.00 69 L 8.59 4.92 0.00 1.59 1.37 0.66 -0.13 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 70 Y 9.17 5.11 0.00 3.01 2.91 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 71 L 8.54 4.78 0.00 1.65 1.61 0.66 0.76 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 72 V 8.65 4.73 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 0.86 0.00 0.00 1.13 0.00 0.00 73 E 9.08 4.53 0.00 2.27 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 2.34 2.41 0.00 74 H 8.84 3.26 0.00 3.02 3.24 0.00 5.69 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 75 E 8.19 3.86 0.00 2.06 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 2.40 2.48 0.00 76 E 8.09 4.04 0.00 2.23 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 2.45 2.40 0.00 77 Y 7.84 4.08 0.00 2.98 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 78 Q 8.08 3.81 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.68 0.00 0.00 0.00 0.00 0.00 2.29 2.22 0.00 79 L 7.83 4.16 0.00 1.67 1.67 0.89 0.70 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 80 C 7.82 4.16 0.00 3.02 3.09 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 81 Q 8.06 4.49 0.00 1.94 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.67 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 82 P 0.00 4.26 0.00 1.80 1.00 0.00 3.59 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.66 0.00 83 Q 9.12 4.16 0.00 1.99 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.69 0.00 0.00 0.00 0.00 0.00 2.35 2.28 0.00 84 S 7.70 4.68 0.00 4.02 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 85 K 8.72 4.41 0.00 1.88 1.90 0.00 1.76 0.00 0.00 1.84 0.00 0.00 2.90 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.56 1.55 7.81 86 D 7.72 4.53 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 87 Q 8.61 4.47 0.00 2.39 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.97 0.00 0.00 0.00 0.00 0.00 2.39 2.35 0.00 88 V 7.60 3.58 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 0.57 0.00 0.00 0.90 0.00 0.00 89 R 8.78 4.50 0.00 1.96 2.05 0.00 3.54 0.00 0.00 3.28 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.75 0.00 90 W 7.14 4.28 0.00 3.33 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 91 Q 7.69 4.79 0.00 1.63 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 7.14 0.00 0.00 0.00 0.00 0.00 2.10 2.12 0.00 92 C 9.31 4.80 0.00 3.27 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 93 N 8.31 5.27 0.00 2.73 2.80 0.00 0.00 6.09 7.66 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 94 R 7.77 4.72 0.00 1.93 1.92 0.00 3.19 0.00 0.00 3.63 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 95 P 0.00 4.71 0.00 2.41 2.50 0.00 3.80 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.02 0.00 96 S 7.96 5.07 0.00 3.90 3.92 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.80 4.10 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 98 K 9.03 3.93 0.00 1.81 1.95 0.00 1.77 0.00 0.00 1.79 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.49 7.81 99 H 8.29 4.45 0.00 3.28 3.45 0.00 5.52 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 0.00 100 G 6.96 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 0.00 0.00 0.00 101 P 0.00 4.15 0.00 2.06 2.24 0.00 3.62 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.11 0.00 102 E 8.72 4.30 0.00 2.23 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 2.60 2.68 0.00 103 K 8.52 4.94 0.00 1.71 1.53 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.78 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.19 1.32 7.81 104 L 8.68 3.97 0.00 1.37 1.28 0.36 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.32 5.03 0.00 3.65 3.79 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 0.00 106 E 8.99 4.38 0.00 2.07 1.85 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 1.54 1.75 0.00 107 K 8.39 4.32 0.00 1.56 1.51 0.00 1.57 0.00 0.00 1.55 0.00 0.00 2.75 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.97 0.28 7.81 108 F 8.83 3.51 0.00 2.83 2.68 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 0.00 109 Q 7.70 4.82 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.91 0.00 0.00 0.00 0.00 0.00 2.49 2.41 0.00 110 R 8.50 4.44 0.00 1.47 1.51 0.00 2.82 0.00 0.00 3.61 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.50 0.00 111 F 7.71 5.41 0.00 3.05 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 0.00 112 T 9.15 4.74 4.40 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 1.26 0.00 0.00 113 P 0.00 4.48 0.00 2.29 2.18 0.00 3.86 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.00 0.00 114 F 8.22 4.67 0.00 3.11 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 0.00 115 T 7.59 4.20 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 1.10 0.00 0.00 116 L 8.46 4.07 0.00 1.78 1.97 1.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 117 G 7.80 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 0.00 0.00 0.00 118 K 8.15 4.31 0.00 1.41 1.23 0.00 1.30 0.00 0.00 1.47 0.00 0.00 3.05 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.32 0.21 7.81 119 E 8.03 4.44 0.00 1.71 1.85 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 2.23 2.23 0.00 120 F 8.46 4.55 0.00 2.95 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 0.00 121 K 9.30 4.92 0.00 1.61 1.66 0.00 1.49 0.00 0.00 1.55 0.00 0.00 2.80 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.24 1.32 7.81 122 E 8.84 4.09 0.00 1.98 1.93 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 2.47 2.33 0.00 123 G 9.31 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 0.00 0.00 0.00 124 H 7.95 4.94 0.00 3.34 2.92 0.00 5.56 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 0.00 125 S 8.03 5.05 0.00 3.45 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 0.00 126 Y 8.54 4.57 0.00 3.06 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 0.00 127 Y 8.37 5.30 0.00 3.19 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 0.00 128 Y 9.52 5.59 0.00 3.29 2.91 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 0.00 129 I 9.03 5.84 2.08 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 1.17 0.00 0.00 130 S 9.02 5.60 0.00 4.07 3.79 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 0.00 131 K 9.32 5.02 0.00 1.92 1.84 0.00 1.76 0.00 0.00 1.79 0.00 0.00 2.83 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.59 7.81 132 P 0.00 4.70 0.00 1.89 2.11 0.00 3.85 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.12 0.00 133 I 8.45 4.21 1.82 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 1.28 0.58 0.89 0.00 0.00 134 H 8.11 4.35 0.00 3.27 3.40 0.00 5.51 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 Q 8.56 4.37 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.97 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 136 H 8.01 4.70 0.00 3.31 3.46 0.00 5.54 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 E 7.60 4.37 0.00 2.07 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 2.28 2.49 0.00 138 D 9.75 4.76 0.00 2.65 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 0.00 139 R 8.20 4.26 0.00 2.07 2.05 0.00 3.31 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.38 0.00 140 C 8.50 4.48 0.00 2.97 2.99 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 0.00 141 L 8.42 4.82 0.00 1.52 0.55 0.16 0.27 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 0.00 142 R 8.64 5.54 0.00 2.26 2.03 0.00 2.21 0.00 0.00 2.84 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.78 0.00 143 L 9.81 4.95 0.00 1.99 2.08 0.11 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 144 K 9.16 4.86 0.00 1.76 1.64 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.70 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.18 0.89 7.81 145 V 8.54 4.64 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 0.12 0.00 0.00 1.07 0.00 0.00 146 T 8.59 4.73 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 1.18 0.00 0.00 147 V 8.77 4.59 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 1.07 0.00 0.00 1.10 0.00 0.00 148 K 8.88 4.57 0.00 1.84 1.91 0.00 1.55 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.45 1.48 7.81 149 I 8.13 4.01 1.88 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 1.29 0.58 1.02 0.00 0.00