NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3125 8.1933 115.3393 57.9798 64.4466 174.7525 2 W 4.2793 7.6320 122.7129 59.5662 30.1186 177.6828 3 Q 4.0953 8.7278 120.7474 59.1210 29.3011 177.7306 4 A 3.9724 7.6478 121.1851 55.0183 18.2856 179.3186 5 Y 4.2804 7.6397 115.5116 61.6581 38.0675 178.8137 6 T 4.0518 8.1224 110.2538 64.8895 68.9797 176.1856 7 D 4.3794 8.3690 121.8032 57.1110 40.6027 178.3046 8 N 4.3446 8.3850 116.4707 56.3534 39.0081 177.0455 9 L 4.1863 8.1050 120.3724 58.0170 41.8523 179.8156 10 I 4.8499 7.3894 113.9707 63.2083 37.3217 178.2421 11 G 3.7112 8.0334 107.1756 47.4549 0.0000 175.3428 12 T 4.1301 7.7310 110.9323 62.7588 69.0985 176.0065 13 G 4.0097 8.0034 109.2575 45.3635 0.0000 174.3596 14 K 4.2133 7.8394 117.9420 57.6120 32.6985 177.2635 15 V 4.6561 7.5547 118.4629 61.0458 34.6620 174.9634 16 D 4.8507 9.0088 124.7027 53.3789 40.9379 175.9784 17 K 5.1916 7.7805 119.2146 55.0837 36.7294 174.8765 18 A 5.2485 9.1198 125.4946 50.6141 23.0993 175.0951 19 V 4.8164 9.2164 120.5523 61.2014 35.9042 174.0796 20 I 4.8033 8.9096 127.4707 59.8539 39.6626 174.4764 21 Y 4.7723 8.8013 124.8286 55.5406 41.5123 175.5715 22 S 3.1326 7.9869 115.6238 57.5639 63.9959 175.1537 23 R 3.6675 8.4170 122.1717 59.6483 29.7443 177.7243 24 A 4.0299 7.8344 118.2870 52.8695 18.7676 177.8414 25 G 3.6971 8.3056 104.2039 46.3340 0.0000 173.9225 26 D 4.7450 7.7020 116.2769 52.6144 40.1621 175.8512 27 A 4.6404 7.5263 119.7314 51.3378 22.6423 175.4232 28 V 4.0170 8.4478 121.4930 61.5515 31.9672 175.6458 29 W 4.8593 8.9260 128.0772 58.0694 30.2939 176.4761 30 A 4.7640 7.6681 118.2410 51.6291 21.8646 175.4059 31 T 5.1362 8.6735 116.5643 62.4926 73.0612 173.7487 32 S 4.6146 9.1737 120.7685 58.2362 67.3708 175.5248 33 G 4.1941 8.5621 110.4735 46.1772 0.0000 174.0505 34 G 3.7970 8.0338 106.5705 45.8966 0.0000 173.2032 35 L 4.0613 7.9015 121.6847 54.3426 42.5511 176.2965 36 S 4.5073 8.3664 119.8113 56.3998 64.6525 173.8016 37 L 4.4297 8.4145 125.1529 54.1794 42.4736 177.0878 38 Q 4.3439 10.5579 120.1477 54.8347 29.6373 175.9946 39 P 4.1444 0.0000 0.0000 65.9243 31.2867 176.7876 40 N 4.8374 7.9862 113.7355 52.6101 39.5383 176.4222 41 E 3.9197 8.5175 120.8075 59.5162 29.4165 179.0013 42 I 3.5675 7.6827 118.2920 63.7543 37.8653 178.0339 43 G 3.4950 7.8577 106.2878 47.7409 0.0000 175.3735 44 E 3.9177 7.8586 121.2753 59.0347 29.3073 179.5920 45 I 3.4162 7.5280 119.5804 64.2620 36.9914 178.4259 46 V 3.8204 7.6121 117.8323 66.3930 31.6369 177.5602 47 Q 4.1902 8.3779 119.3806 59.0299 28.6380 178.1351 48 G 3.5823 7.9795 106.4131 47.8630 0.0000 175.1758 49 F 4.4933 7.7212 119.9019 60.4876 38.7114 177.1014 50 D 4.8452 8.0974 116.3990 55.0148 42.1450 176.3333 51 N 4.9043 8.0824 117.9341 49.8334 39.6963 172.3764 52 P 4.2306 0.0000 0.0000 65.3436 31.2944 177.8952 53 A 4.0208 8.2237 120.1523 55.0264 17.8361 179.4193 54 G 3.7146 7.6010 102.7753 48.1052 0.0000 175.4394 55 L 4.1027 8.0018 121.3878 57.9226 41.5376 179.8367 56 Q 3.8882 7.9540 116.9864 56.9531 28.9366 180.3106 57 S 4.3571 8.0939 113.0637 58.9647 62.7755 174.9518 58 N 4.1113 9.4906 116.5455 54.9837 37.4490 175.0099 59 G 3.7527 7.9388 102.7770 44.2536 0.0000 172.0643 60 L 4.5343 8.0660 120.0064 53.5418 42.9057 174.7843 61 H 5.4664 8.8186 122.7944 54.0191 31.7415 173.2349 62 I 4.6767 8.7652 124.4739 60.9479 40.0376 175.6181 63 Q 3.5038 10.3551 123.4159 56.7219 26.5740 173.6246 64 G 4.2863 8.5741 107.6403 45.7472 0.0000 175.3310 65 Q 3.9426 7.8327 120.7498 55.4959 29.6133 174.9587 66 K 4.6297 8.1171 125.6960 55.5049 33.5961 175.5240 67 F 4.8824 9.1765 123.1014 55.4270 43.0044 174.2520 68 M 4.1771 9.3432 123.4255 55.8276 33.4652 175.3074 69 L 4.7029 8.4679 127.9437 54.1938 41.1265 175.5465 70 L 4.2939 8.7467 129.1174 57.5941 42.9674 176.7154 71 R 4.6971 7.7801 116.4848 55.2557 33.7974 174.1856 72 A 4.7694 8.1379 124.3125 51.7854 21.2617 175.0099 73 D 4.6676 9.0058 122.8076 52.3545 42.5172 175.5038 74 D 4.4416 9.1405 117.1054 55.3754 39.3102 177.1068 75 R 4.4502 8.1120 114.2966 55.6757 32.2799 175.8659 76 S 5.4326 9.6458 116.0862 56.7141 67.1487 173.5022 77 I 4.7898 9.0947 123.6971 60.0370 40.9870 173.6469 78 Y 5.3533 8.7579 125.7183 56.3156 40.2520 175.3621 79 G 4.4775 9.4240 111.8214 44.7233 0.0000 172.3947 80 R 5.2782 9.0522 121.6592 55.0261 34.1047 173.7692 81 H 4.9881 9.2351 125.6575 54.1548 30.5345 174.0484 82 D 4.1691 8.5829 126.9495 55.0031 40.0114 177.1169 83 A 4.1921 8.6819 132.8480 54.6626 18.5372 176.9155 84 E 4.6092 7.7270 114.4340 54.9908 33.2960 175.1722 85 G 3.9956 6.3778 105.0820 46.0693 0.0000 172.4451 86 V 4.8690 8.0337 118.0391 59.9369 35.2490 174.4055 87 V 4.7886 9.2404 123.0061 61.4229 34.3634 173.7772 88 C 5.5077 9.4602 125.9035 58.0785 31.0963 173.2468 89 V 5.0880 9.1154 123.7171 61.0306 34.7850 173.8951 90 R 4.7077 8.6350 127.7039 54.8428 31.7053 175.3637 91 T 4.7955 8.1090 117.9284 60.0957 71.2336 173.7558 92 K 4.0964 8.6851 118.9850 59.6623 32.3444 177.4489 93 Q 4.7749 8.4181 114.4558 55.3445 31.3482 175.0210 94 T 4.6894 8.1138 109.2076 59.6200 73.3858 172.9439 95 V 4.6105 8.4143 120.7083 61.3209 34.5939 173.8485 96 I 4.9240 9.1027 129.5347 59.7712 39.5575 174.8263 97 I 5.0598 8.9980 127.3153 59.5189 40.3419 174.4284 98 A 5.2859 9.2954 128.6944 50.2772 22.8394 173.9126 99 H 5.2767 9.3992 120.5527 54.3149 33.0598 172.0488 100 Y 5.2146 7.6977 123.0457 54.4194 40.8204 173.9311 101 P 4.6031 0.0000 0.0000 61.4444 32.7941 175.2169 102 P 4.5599 0.0000 0.0000 65.3148 31.0789 178.2610 103 T 4.0429 7.9349 104.9343 63.0083 68.9931 174.0347 104 V 4.1962 7.5254 122.8121 61.1928 33.0875 175.2420 105 Q 4.0045 8.4307 125.7292 55.4420 29.5225 176.4863 106 A 2.6744 8.7774 125.4636 55.1866 18.2125 179.7836 107 G 3.4839 7.8255 103.2084 47.9566 0.0000 175.6136 108 E 3.9214 8.0123 120.4098 59.0031 29.6068 179.2404 109 A 3.9314 7.5739 120.3431 55.4276 18.4445 179.5951 110 T 3.6909 7.7091 114.2576 66.4696 68.4655 176.7024 111 K 3.8875 7.9536 121.4695 59.6365 32.1087 178.8352 112 I 3.7162 7.5014 119.6413 64.4234 37.0303 178.7006 113 V 3.6556 7.7317 118.6627 66.1030 31.3490 178.0215 114 E 4.1009 8.5184 118.5178 59.4692 29.2380 179.3710 115 Q 4.0382 8.2983 118.2658 58.4591 28.6392 178.3626 116 L 3.9759 7.6914 121.5835 57.9728 42.0846 178.7416 117 A 3.9869 8.0598 120.7133 55.3751 18.3431 179.2432 118 D 4.3086 8.3748 117.5482 57.6400 40.4733 178.4404 119 Y 4.0770 8.0710 119.7980 60.7009 38.7826 177.8466 120 L 3.7740 8.0623 119.9325 57.9624 41.8069 179.5435 121 I 3.7786 7.9689 119.6710 64.5229 36.9533 178.6649 122 G 3.7916 7.9253 104.2963 46.2683 0.0000 174.2806 123 V 4.2296 6.7109 119.0300 61.4632 31.5372 176.4903 124 Q 3.7389 8.2392 116.7750 56.8780 26.9103 173.3197 125 Y 4.4191 8.2994 122.5185 58.1794 38.2896 175.4992 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 S 8.19 4.31 0.00 3.75 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 2 W 7.63 4.28 0.00 3.81 3.53 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 3 Q 8.73 4.10 0.00 2.23 2.12 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 2.45 2.67 0.00 4 A 7.65 3.97 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 5 Y 7.64 4.28 0.00 3.46 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 6 T 8.12 4.05 4.32 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 1.35 0.00 0.00 7 D 8.37 4.38 0.00 2.86 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 8 N 8.38 4.34 0.00 3.00 2.95 0.00 0.00 7.09 7.43 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 9 L 8.11 4.19 0.00 1.93 1.77 1.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 10 I 7.39 4.85 1.91 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 1.70 1.07 1.00 0.00 0.00 11 G 8.03 3.71 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 0.00 0.00 0.00 12 T 7.73 4.13 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 1.34 0.00 0.00 13 G 8.00 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 0.00 0.00 0.00 14 K 7.84 4.21 0.00 1.78 1.85 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.73 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.44 1.37 7.81 15 V 7.55 4.66 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 1.27 0.00 0.00 1.00 0.00 0.00 16 D 9.01 4.85 0.00 2.90 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 17 K 7.78 5.19 0.00 1.72 1.71 0.00 1.58 0.00 0.00 1.81 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.64 1.48 7.81 18 A 9.12 5.25 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 19 V 9.22 4.82 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 0.77 0.00 0.00 0.93 0.00 0.00 20 I 8.91 4.80 1.93 0.00 0.00 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 1.28 0.59 0.66 0.00 0.00 21 Y 8.80 4.77 0.00 2.77 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 22 S 7.99 3.13 0.00 3.84 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 23 R 8.42 3.67 0.00 1.66 1.95 0.00 3.38 0.00 0.00 3.17 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.45 0.00 24 A 7.83 4.03 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 25 G 8.31 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 26 D 7.70 4.75 0.00 2.78 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 27 A 7.53 4.64 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 28 V 8.45 4.02 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 0.61 0.00 0.00 0.39 0.00 0.00 29 W 8.93 4.86 0.00 2.86 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 30 A 7.67 4.76 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 31 T 8.67 5.14 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 1.24 0.00 0.00 32 S 9.17 4.61 0.00 3.75 3.71 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 33 G 8.56 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 0.00 0.00 0.00 0.00 34 G 8.03 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.90 4.06 0.00 1.62 1.61 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 36 S 8.37 4.51 0.00 3.97 3.82 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 37 L 8.41 4.43 0.00 1.73 1.66 0.91 1.06 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 38 Q 10.56 4.34 0.00 2.12 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.59 0.00 0.00 0.00 0.00 0.00 2.64 2.50 0.00 39 P 0.00 4.14 0.00 2.17 2.20 0.00 3.73 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.04 0.00 40 N 7.99 4.84 0.00 2.75 2.81 0.00 0.00 7.10 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 41 E 8.52 3.92 0.00 2.06 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 0.00 2.33 2.43 0.00 42 I 7.68 3.57 1.43 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 1.00 0.76 0.00 0.00 43 G 7.86 3.50 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 0.00 44 E 7.86 3.92 0.00 2.03 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 2.49 2.46 0.00 45 I 7.53 3.42 1.87 0.00 0.00 0.76 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 0.69 0.72 0.00 0.00 46 V 7.61 3.82 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 0.89 0.00 0.00 0.98 0.00 0.00 47 Q 8.38 4.19 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 48 G 7.98 3.58 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 0.00 0.00 0.00 49 F 7.72 4.49 0.00 3.17 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 50 D 8.10 4.85 0.00 2.67 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 N 8.08 4.90 0.00 2.74 2.61 0.00 0.00 6.78 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 52 P 0.00 4.23 0.00 2.26 2.25 0.00 3.76 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.02 0.00 53 A 8.22 4.02 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 54 G 7.60 3.71 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 0.00 0.00 0.00 55 L 8.00 4.10 0.00 1.83 1.68 0.74 0.89 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 56 Q 7.95 3.89 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 7.00 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 57 S 8.09 4.36 0.00 4.00 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 58 N 9.49 4.11 0.00 2.85 3.04 0.00 0.00 6.16 7.00 0.00 0.00 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 G 7.94 3.75 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 0.00 0.00 0.00 60 L 8.07 4.53 0.00 1.81 1.76 0.85 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 61 H 8.82 5.47 0.00 3.11 3.31 0.00 5.89 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 62 I 8.77 4.68 1.84 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.10 0.85 0.00 0.00 63 Q 10.36 3.50 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.58 0.00 0.00 0.00 0.00 0.00 2.52 2.35 0.00 64 G 8.57 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 0.00 0.00 0.00 0.00 65 Q 7.83 3.94 0.00 2.12 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.84 0.00 0.00 0.00 0.00 0.00 1.75 1.40 0.00 66 K 8.12 4.63 0.00 1.59 1.52 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.27 1.20 7.81 67 F 9.18 4.88 0.00 2.89 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 68 M 9.34 4.18 0.00 2.21 1.96 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 2.62 2.53 0.00 69 L 8.47 4.70 0.00 1.68 1.60 0.95 0.93 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 70 L 8.75 4.29 0.00 1.83 2.00 1.10 0.98 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 71 R 7.78 4.70 0.00 1.86 1.49 0.00 3.11 0.00 0.00 2.27 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.46 0.00 72 A 8.14 4.77 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 73 D 9.01 4.67 0.00 2.82 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 74 D 9.14 4.44 0.00 2.79 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 75 R 8.11 4.45 0.00 1.77 2.11 0.00 2.78 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.73 0.00 76 S 9.65 5.43 0.00 3.44 3.36 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 77 I 9.09 4.79 1.61 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.35 0.73 0.00 0.00 78 Y 8.76 5.35 0.00 2.90 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 79 G 9.42 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 9.05 5.28 0.00 2.03 1.81 0.00 3.33 0.00 0.00 3.26 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.73 0.00 81 H 9.24 4.99 0.00 2.51 2.85 0.00 5.81 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 D 8.58 4.17 0.00 2.71 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 0.00 0.00 0.00 83 A 8.68 4.19 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 84 E 7.73 4.61 0.00 2.09 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 2.38 2.32 0.00 85 G 6.38 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 86 V 8.03 4.87 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 0.18 0.00 0.00 0.81 0.00 0.00 87 V 9.24 4.79 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 1.17 0.00 0.00 0.94 0.00 0.00 88 C 9.46 5.51 0.00 2.98 2.95 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 89 V 9.12 5.09 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 1.05 0.00 0.00 1.08 0.00 0.00 90 R 8.63 4.71 0.00 0.67 0.94 0.00 3.00 0.00 0.00 2.67 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.30 0.00 91 T 8.11 4.80 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 1.19 0.00 0.00 92 K 8.69 4.10 0.00 1.65 1.89 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.37 7.81 93 Q 8.42 4.77 0.00 2.27 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.59 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 94 T 8.11 4.69 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 0.94 0.00 0.00 95 V 8.41 4.61 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 0.97 0.00 0.00 0.90 0.00 0.00 96 I 9.10 4.92 1.91 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 1.24 0.57 0.96 0.00 0.00 97 I 9.00 5.06 1.97 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 1.22 0.85 0.91 0.00 0.00 98 A 9.30 5.29 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 99 H 9.40 5.28 0.00 3.08 3.10 0.00 5.53 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 Y 7.70 5.21 0.00 3.15 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 0.00 101 P 0.00 4.60 0.00 2.30 2.30 0.00 3.86 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.05 0.00 102 P 0.00 4.56 0.00 2.09 2.21 0.00 3.78 0.00 0.00 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.09 0.00 103 T 7.93 4.04 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 1.23 0.00 0.00 104 V 7.53 4.20 2.32 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 0.81 0.00 0.00 1.00 0.00 0.00 105 Q 8.43 4.00 0.00 2.06 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.56 0.00 0.00 0.00 0.00 0.00 2.41 2.32 0.00 106 A 8.78 2.67 1.12 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 0.00 0.00 107 G 7.83 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.01 3.92 0.00 2.08 1.94 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 2.28 2.25 0.00 109 A 7.57 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 0.00 110 T 7.71 3.69 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 0.85 0.00 0.00 111 K 7.95 3.89 0.00 1.92 1.93 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.48 7.81 112 I 7.50 3.72 2.09 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.38 0.94 0.00 0.00 113 V 7.73 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 1.10 0.00 0.00 0.99 0.00 0.00 114 E 8.52 4.10 0.00 2.10 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 2.57 2.63 0.00 115 Q 8.30 4.04 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.82 0.00 0.00 0.00 0.00 0.00 2.41 2.61 0.00 116 L 7.69 3.98 0.00 1.86 1.82 0.89 0.62 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 0.00 117 A 8.06 3.99 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 0.00 118 D 8.37 4.31 0.00 2.89 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 0.00 119 Y 8.07 4.08 0.00 3.14 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 0.00 120 L 8.06 3.77 0.00 1.88 1.85 0.99 0.98 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 0.00 121 I 7.97 3.78 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 1.43 0.77 0.89 0.00 0.00 122 G 7.93 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 0.00 0.00 0.00 123 V 6.71 4.23 1.70 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 0.71 0.00 0.00 0.95 0.00 0.00 124 Q 8.24 3.74 0.00 1.93 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.11 6.78 0.00 0.00 0.00 0.00 0.00 2.19 2.24 0.00 125 Y 8.30 4.42 0.00 3.14 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