NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2766 8.2644 123.5815 51.5128 19.0219 174.9171 2 R 3.6290 8.0867 120.5201 55.1464 30.8390 170.5639 3 V 4.1695 7.8163 125.4094 61.8533 32.5078 175.5704 4 K 3.9610 7.6488 124.7184 56.5689 33.9719 172.6568 5 R 3.6266 8.1800 131.2528 55.8534 30.4332 175.3860 6 G 4.2105 8.6615 122.1208 46.5541 0.0000 174.7137 7 V 3.6687 7.5333 115.0451 63.8564 31.3722 178.2472 8 I 3.8804 7.6599 111.7789 63.0251 37.6224 177.6989 9 A 3.8792 7.9264 122.4753 55.0972 18.1996 179.4557 10 R 4.0337 8.4918 114.3192 58.4118 29.5910 178.4580 11 A 3.9612 7.4079 121.3602 55.4210 18.5668 179.4997 12 R 4.0096 7.6518 115.7185 59.8464 30.1150 178.8561 13 H 4.0409 7.5016 114.5213 59.0190 28.7304 177.8090 14 K 3.9765 8.5616 121.5575 59.2697 31.7564 178.7061 15 K 4.3023 7.8719 119.2282 58.9838 32.2591 178.5121 16 I 4.0889 7.8718 120.0686 63.7446 37.4365 177.4979 17 L 4.0079 8.4518 119.8987 58.0981 41.7516 179.3971 18 K 3.8409 8.5053 119.4639 60.1569 31.8872 178.4603 19 Q 4.1237 8.1818 115.8660 57.8765 28.9143 177.6097 20 A 4.1833 8.0747 121.2733 51.4149 18.7462 177.1741 21 K 3.7206 6.8847 116.7859 58.2112 32.6356 176.2628 22 G 4.0713 8.8478 111.2188 45.7674 0.0000 173.4078 23 Y 4.6354 7.0796 116.0834 58.3906 38.6743 174.9022 24 Y 4.6913 8.7521 122.0494 57.6594 41.1004 175.0629 25 G 3.1053 7.8693 114.9352 46.2364 0.0000 176.9403 26 A 3.9246 8.2475 126.2750 54.5984 18.2723 179.4910 27 R 4.2170 7.6766 113.5109 57.8822 29.9980 177.1873 28 S 4.7572 8.2897 110.9365 57.7594 64.0932 173.8836 29 R 4.4198 7.7354 117.1894 57.7370 32.5056 176.5161 30 V 3.8607 7.4186 116.1453 62.3850 33.1391 175.8804 31 Y 4.0919 8.6389 127.1161 61.0330 38.6186 177.9304 32 R 3.7531 8.1349 117.5879 59.6553 30.2383 177.9048 33 V 3.7698 7.6798 116.8146 65.3956 31.7007 177.5060 34 A 4.0115 8.1687 121.0368 55.1612 18.0567 179.1069 35 F 3.8435 8.1861 119.2971 61.7856 38.9492 177.3868 36 Q 4.0056 7.7972 116.4884 58.6475 28.5432 178.9343 37 A 3.7672 7.9364 121.9605 54.6402 18.7931 179.7426 38 V 3.7174 7.5868 116.3044 65.8328 31.4342 178.2128 39 I 3.4974 7.2511 119.6151 64.2914 36.4304 178.3425 40 K 4.0203 7.7023 121.1150 58.5592 31.8458 178.3589 41 A 4.2823 7.9020 121.1129 55.3152 18.1871 179.6286 42 G 3.6514 8.5359 103.9601 48.9569 0.0000 174.8151 43 Q 3.7522 9.4980 118.9842 59.6587 28.6393 178.8911 44 Y 4.3390 9.3837 117.5199 61.9171 38.3349 178.8393 45 A 4.0492 8.6368 121.6281 55.5735 18.3010 178.7493 46 Y 3.7904 7.8640 116.0108 60.7383 39.2122 178.2162 47 R 4.1915 8.5401 118.7124 60.1478 30.3008 178.6383 48 D 4.3573 8.8055 118.5647 57.1994 40.5947 178.6943 49 R 3.6393 8.2214 118.3582 59.5435 30.0531 178.5735 50 R 4.1002 7.4529 116.9363 58.7043 30.5019 178.6986 51 Q 4.0439 8.7594 118.5227 59.2019 28.8001 178.2707 52 R 3.5688 7.8673 118.6796 59.7706 30.0065 177.9391 53 K 3.9967 8.0830 117.2730 59.8316 32.1552 179.0538 54 R 3.9064 8.3756 118.2930 59.2470 30.1631 178.5746 55 Q 3.7751 7.8435 117.0876 59.2097 28.6978 179.0267 56 F 3.7522 7.3641 118.0690 60.7013 38.9842 177.6412 57 R 3.3190 6.7887 116.5570 59.3730 29.5637 178.1156 58 Q 4.2906 7.5497 115.3021 58.4904 29.1775 177.2135 59 L 3.9852 8.0797 124.0908 56.8419 42.1088 178.2974 60 W 4.7297 8.4328 118.7297 60.3204 29.4432 178.6368 61 I 3.7387 8.3689 119.4374 64.5457 36.3361 178.4318 62 A 3.9957 8.2232 120.7822 54.7169 18.3750 179.7171 63 R 3.9643 7.9202 114.3926 59.6414 29.7505 178.6891 64 I 3.7040 7.8926 121.1809 64.2473 37.0945 177.8764 65 N 4.4615 8.2787 117.1554 56.5905 38.5368 176.8516 66 A 3.9508 7.9270 121.4778 55.0640 18.7230 179.1555 67 A 3.8120 7.7999 118.8177 55.0558 18.0506 179.1284 68 A 3.7577 8.3877 117.8898 55.6389 18.4095 179.5333 69 R 4.4630 8.5841 117.9406 58.8386 29.8837 178.3149 70 Q 4.1425 8.3956 118.1827 57.7088 29.0835 175.7738 71 N 4.7656 9.1134 116.8243 52.9007 38.6029 175.0298 72 G 3.9204 7.8451 105.3505 46.4837 0.0000 173.9961 73 I 4.6859 7.3768 117.9366 57.7614 41.3751 174.4184 74 S 4.6269 8.5090 121.5530 57.9813 65.1693 174.3417 75 Y 4.3639 8.8539 125.3983 61.8052 38.4343 178.3981 76 S 4.1611 8.6113 114.7355 62.0680 62.8479 176.6038 77 K 3.8322 8.9748 120.5547 59.9586 32.0092 178.6854 78 F 4.1178 9.0002 121.2982 62.1648 39.0866 177.0116 79 I 3.1051 8.2371 118.9101 64.1348 36.9700 177.6557 80 N 4.1419 8.0809 117.5255 57.7093 38.6014 176.3073 81 G 3.6367 8.6584 104.9645 49.0496 0.0000 175.0828 82 L 3.4437 7.7741 123.7961 56.7124 41.9082 179.5657 83 K 3.9594 7.8150 119.4658 59.2708 32.2772 178.4234 84 K 4.0236 8.3304 118.5801 58.1748 32.2274 177.6326 85 A 3.6446 8.8029 122.3743 54.3122 18.6496 178.6097 86 S 3.4980 8.8073 117.5935 59.0808 59.4049 178.3198 87 V 2.4738 8.6621 122.0294 59.5896 33.7963 171.2406 88 E 3.5947 7.0687 135.0000 55.6784 28.3432 173.0936 89 I 4.4636 7.7663 116.7378 58.0969 40.4318 175.2620 90 D 4.6805 8.3430 122.0557 52.8229 43.7037 176.9579 91 R 4.0871 7.9356 126.3074 56.6553 32.1793 177.6890 92 K 4.2169 8.5015 119.5166 59.4940 32.0706 179.4395 93 I 2.0000 7.0252 117.6296 63.3826 37.4326 177.2326 94 L 3.9246 7.1357 119.8021 57.2571 42.4403 177.4386 95 A 4.4462 7.5564 121.5183 51.8289 16.9032 177.7690 96 D 4.6224 7.6486 122.8015 53.7661 40.8912 177.3368 97 I 3.4428 7.5084 114.9223 63.8424 37.0234 177.6810 98 A 3.5876 8.0917 122.7076 54.3495 18.4632 178.2521 99 V 3.8285 8.1367 115.1857 63.6965 32.2286 176.5563 100 F 5.1743 7.8953 115.9818 57.8938 40.4413 175.4687 101 D 4.7866 8.1712 119.8424 51.3319 41.4319 175.4547 102 K 4.1172 8.2263 123.2577 58.3521 32.5059 178.5679 103 V 3.6561 7.9290 118.6105 65.7157 31.7791 177.2461 104 A 4.2629 8.4301 119.4579 53.6990 18.3235 179.1580 105 F 4.1863 7.8817 119.7709 61.3185 39.5901 177.4796 106 T 3.8876 8.0623 114.9649 66.7376 68.2652 176.1891 107 A 3.9874 7.9528 122.1130 55.1779 18.2712 179.7698 108 L 3.8993 7.3580 116.3220 57.8457 41.7557 179.5355 109 V 3.8607 7.8585 118.5291 66.1620 31.1939 178.0536 110 E 3.9188 8.3088 118.2551 59.3690 29.4777 178.9566 111 K 3.7776 7.9554 119.3243 59.5352 31.8732 178.6393 112 A 3.8223 8.0835 120.3226 55.1585 18.3620 179.1518 113 K 3.9395 8.7125 117.1979 59.8042 32.0340 179.3045 114 A 4.0106 8.3355 120.7042 55.0319 18.3215 179.2570 115 A 4.1068 7.6567 116.0831 53.6941 18.5271 178.0307 116 L 4.4691 7.2065 117.1405 55.0843 43.6567 176.3647 117 A 4.2852 7.9449 124.8947 52.5865 18.4721 176.7915 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 A 8.26 4.28 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 2 R 8.09 3.63 0.00 1.86 1.85 0.00 3.36 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 3 V 7.82 4.17 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 0.90 0.00 0.00 0.97 0.00 0.00 4 K 7.65 3.96 0.00 1.91 1.78 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.48 7.81 5 R 8.18 3.63 0.00 1.93 2.03 0.00 3.28 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.58 0.00 6 G 8.66 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 0.00 0.00 0.00 0.00 7 V 7.53 3.67 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 0.84 0.00 0.00 0.92 0.00 0.00 8 I 7.66 3.88 1.85 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 1.55 0.64 0.90 0.00 0.00 9 A 7.93 3.88 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 10 R 8.49 4.03 0.00 2.01 2.28 0.00 2.81 0.00 0.00 3.17 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 11 A 7.41 3.96 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 12 R 7.65 4.01 0.00 1.77 1.94 0.00 3.10 0.00 0.00 3.07 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.87 0.00 13 H 7.50 4.04 0.00 3.25 3.24 0.00 5.64 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 14 K 8.56 3.98 0.00 1.98 1.93 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.47 7.81 15 K 7.87 4.30 0.00 1.97 2.12 0.00 1.92 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.51 7.81 16 I 7.87 4.09 2.43 0.00 0.00 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 2.14 0.56 1.04 0.00 0.00 17 L 8.45 4.01 0.00 1.83 1.82 1.05 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 18 K 8.51 3.84 0.00 1.93 2.04 0.00 1.52 0.00 0.00 1.65 0.00 0.00 3.08 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.57 7.81 19 Q 8.18 4.12 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.73 0.00 0.00 0.00 0.00 0.00 2.41 2.76 0.00 20 A 8.07 4.18 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 K 6.88 3.72 0.00 1.70 1.71 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.59 7.81 22 G 8.85 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 23 Y 7.08 4.64 0.00 3.13 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 24 Y 8.75 4.69 0.00 3.03 2.90 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 25 G 7.87 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 0.00 0.00 0.00 26 A 8.25 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 27 R 7.68 4.22 0.00 2.07 2.11 0.00 3.14 0.00 0.00 3.11 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 28 S 8.29 4.76 0.00 3.93 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 29 R 7.74 4.42 0.00 1.78 1.93 0.00 3.13 0.00 0.00 3.13 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 30 V 7.42 3.86 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 1.17 0.00 0.00 0.93 0.00 0.00 31 Y 8.64 4.09 0.00 3.06 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 32 R 8.13 3.75 0.00 1.88 1.97 0.00 3.29 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.73 0.00 33 V 7.68 3.77 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 0.98 0.00 0.00 0.92 0.00 0.00 34 A 8.17 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 35 F 8.19 3.84 0.00 2.15 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 36 Q 7.80 4.01 0.00 2.40 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.44 2.59 0.00 37 A 7.94 3.77 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 38 V 7.59 3.72 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 1.11 0.00 0.00 1.13 0.00 0.00 39 I 7.25 3.50 1.66 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.17 0.78 0.00 0.00 40 K 7.70 4.02 0.00 1.56 1.68 0.00 1.64 0.00 0.00 1.77 0.00 0.00 2.88 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.14 0.66 7.81 41 A 7.90 4.28 1.50 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 0.00 0.00 0.00 42 G 8.54 3.65 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 0.00 0.00 0.00 43 Q 9.50 3.75 0.00 1.92 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.64 0.00 0.00 0.00 0.00 0.00 2.26 2.54 0.00 44 Y 9.38 4.34 0.00 3.21 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 45 A 8.64 4.05 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 0.00 0.00 46 Y 7.86 3.79 0.00 2.94 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 47 R 8.54 4.19 0.00 2.02 2.24 0.00 3.23 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.79 0.00 48 D 8.81 4.36 0.00 2.73 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 49 R 8.22 3.64 0.00 1.77 1.91 0.00 3.10 0.00 0.00 3.21 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 50 R 7.45 4.10 0.00 1.88 1.94 0.00 3.11 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 51 Q 8.76 4.04 0.00 2.10 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.62 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 52 R 7.87 3.57 0.00 1.85 1.95 0.00 3.37 0.00 0.00 3.66 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.73 0.00 53 K 8.08 4.00 0.00 1.87 1.90 0.00 1.77 0.00 0.00 1.88 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.74 1.52 7.81 54 R 8.38 3.91 0.00 1.77 1.88 0.00 3.11 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.84 0.00 55 Q 7.84 3.78 0.00 1.61 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.83 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 56 F 7.36 3.75 0.00 2.60 1.62 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 57 R 6.79 3.32 0.00 1.83 2.03 0.00 3.12 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 58 Q 7.55 4.29 0.00 2.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.77 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 59 L 8.08 3.99 0.00 1.59 1.59 1.09 1.01 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 60 W 8.43 4.73 0.00 3.69 3.38 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 61 I 8.37 3.74 1.97 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 1.47 1.37 0.47 0.00 0.00 62 A 8.22 4.00 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 63 R 7.92 3.96 0.00 2.03 2.18 0.00 3.15 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.11 0.00 64 I 7.89 3.70 2.32 0.00 0.00 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 1.66 1.07 1.37 0.00 0.00 65 N 8.28 4.46 0.00 2.90 2.80 0.00 0.00 7.13 8.23 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 66 A 7.93 3.95 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 67 A 7.80 3.81 0.50 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 0.00 0.00 0.00 68 A 8.39 3.76 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 69 R 8.58 4.46 0.00 2.08 2.16 0.00 3.20 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 1.65 1.59 0.00 70 Q 8.40 4.14 0.00 2.24 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 7.11 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 71 N 9.11 4.77 0.00 2.90 2.83 0.00 0.00 7.00 7.53 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 72 G 7.85 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 0.00 0.00 0.00 73 I 7.38 4.69 1.93 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.43 0.97 0.00 0.00 74 S 8.51 4.63 0.00 4.18 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 75 Y 8.85 4.36 0.00 3.21 3.18 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 76 S 8.61 4.16 0.00 3.99 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 77 K 8.97 3.83 0.00 1.93 1.91 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.50 7.81 78 F 9.00 4.12 0.00 3.01 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 79 I 8.24 3.11 1.69 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 -0.14 0.75 0.00 0.00 80 N 8.08 4.14 0.00 2.74 2.93 0.00 0.00 7.18 7.97 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 81 G 8.66 3.64 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 0.00 82 L 7.77 3.44 0.00 1.34 1.83 0.19 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 83 K 7.82 3.96 0.00 1.63 1.91 0.00 1.79 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.43 7.81 84 K 8.33 4.02 0.00 1.87 1.83 0.00 1.83 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.44 1.43 7.81 85 A 8.80 3.64 1.16 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 86 S 8.81 3.50 0.00 3.91 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 87 V 8.66 2.47 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 0.70 0.00 0.00 0.91 0.00 0.00 88 E 7.07 3.59 0.00 2.38 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 0.00 2.15 2.30 0.00 89 I 7.77 4.46 1.85 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 1.27 0.83 0.88 0.00 0.00 90 D 8.34 4.68 0.00 2.78 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 91 R 7.94 4.09 0.00 1.78 1.69 0.00 3.14 0.00 0.00 3.30 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.72 0.00 92 K 8.50 4.22 0.00 2.13 2.16 0.00 1.91 0.00 0.00 2.02 0.00 0.00 3.12 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.79 1.64 7.81 93 I 7.03 2.00 0.56 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 -0.30 0.42 0.00 0.00 94 L 7.14 3.92 0.00 1.73 1.79 0.89 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 95 A 7.56 4.45 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.65 4.62 0.00 2.75 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 97 I 7.51 3.44 1.97 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.95 1.02 0.00 0.00 98 A 8.09 3.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 V 8.14 3.83 1.66 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 0.03 0.00 0.00 0.70 0.00 0.00 100 F 7.90 5.17 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 0.00 101 D 8.17 4.79 0.00 2.74 2.56 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 0.00 102 K 8.23 4.12 0.00 1.86 1.85 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.50 7.81 103 V 7.93 3.66 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 1.07 0.00 0.00 0.98 0.00 0.00 104 A 8.43 4.26 1.52 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 0.00 0.00 0.00 0.00 0.00 0.00 105 F 7.88 4.19 0.00 3.23 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 0.00 106 T 8.06 3.89 4.41 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 1.29 0.00 0.00 107 A 7.95 3.99 1.40 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 0.00 0.00 108 L 7.36 3.90 0.00 1.71 1.70 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 109 V 7.86 3.86 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 1.05 0.00 0.00 0.58 0.00 0.00 110 E 8.31 3.92 0.00 2.20 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 2.51 2.46 0.00 111 K 7.96 3.78 0.00 1.99 1.86 0.00 1.49 0.00 0.00 1.62 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.47 7.81 112 A 8.08 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 0.00 113 K 8.71 3.94 0.00 2.00 1.91 0.00 1.80 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.50 1.60 7.81 114 A 8.34 4.01 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 0.00 115 A 7.66 4.11 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 0.00 116 L 7.21 4.47 0.00 1.85 1.74 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 117 A 7.94 4.29 1.25 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 0.00 0.00 0.00