NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9423 8.3501 109.7403 45.9438 0.0000 174.8935 3 A 4.3813 8.0254 131.8169 49.5113 19.2995 175.4306 4 R 3.9644 8.6180 125.1175 59.3420 31.7703 174.8344 5 A 4.2673 7.6045 115.3538 51.3098 21.6115 175.9454 6 S 4.2060 8.8519 119.6491 59.2145 63.6607 174.3184 7 V 4.1266 8.2500 120.7443 63.5885 33.1279 175.9430 8 L 4.8001 7.4491 117.5247 53.0470 43.6963 176.7114 9 S 4.6647 8.7423 117.5438 57.0662 65.7699 175.3955 10 G 3.9502 8.7128 108.0116 48.1509 0.0000 175.9816 11 G 3.6592 7.9543 107.1274 47.7938 0.0000 175.6806 12 E 4.0653 7.8603 120.8673 58.6532 29.2490 179.2989 13 L 4.0388 8.5501 120.9252 58.4014 41.9681 178.8499 14 D 4.4523 7.6051 116.1793 57.2678 41.0678 178.5688 15 K 4.1969 7.9772 118.6175 58.5991 32.2008 179.2535 16 W 4.1897 8.4779 129.4689 60.3604 30.4927 177.2912 17 E 4.8932 7.9634 116.8397 56.9569 29.1429 177.9732 18 K 4.3746 7.4911 117.3413 55.3781 33.1013 176.1486 19 I 4.1005 6.9511 121.8612 59.9310 38.2027 175.0962 20 R 4.5324 8.2949 125.7165 55.6018 30.9363 177.1096 21 L 3.7895 8.6232 125.2789 56.5008 41.7483 177.6331 22 R 4.6771 7.3230 114.9730 53.2997 32.9132 174.4097 23 P 4.5776 0.0000 0.0000 65.0008 31.5401 177.7309 24 G 3.7967 7.8968 105.8777 45.8871 0.0000 173.8068 25 G 3.8773 7.8297 107.6459 45.7725 0.0000 173.1283 26 K 4.4913 8.2154 115.6931 55.6503 34.0902 176.1930 27 K 4.2611 7.7984 120.2034 55.7093 33.1133 177.0454 28 Q 4.5754 8.4448 124.7222 55.3736 30.7598 174.8655 29 Y 4.2114 8.2402 117.2102 57.3772 39.5817 175.6869 30 K 5.2407 9.0058 120.1706 53.6135 36.7792 176.9332 31 L 4.0535 8.9639 121.5090 58.7353 41.7609 178.8647 32 K 3.9677 8.3879 118.7508 60.1098 31.9099 178.0309 33 H 4.6233 8.9707 116.6278 58.5879 28.8288 177.7605 34 I 3.8433 7.7926 121.1036 64.4691 37.3535 178.1078 35 V 3.6168 8.1884 119.4718 66.0743 30.9345 177.8903 36 W 4.1468 7.8070 125.9885 60.4093 30.8445 177.5990 37 A 3.7502 7.8652 119.4216 55.2089 16.2721 179.6372 38 S 4.0310 8.4193 114.1023 61.7550 62.7174 176.5903 39 R 3.7121 7.5668 117.4648 57.1215 30.2501 177.6185 40 E 4.0232 7.9390 120.3279 58.4314 29.9079 177.6391 41 L 3.9241 7.7084 118.4785 58.1458 41.4373 179.2039 42 E 4.4830 7.3801 117.4100 58.5960 29.4233 178.8126 43 R 4.2182 8.1875 117.5102 57.6134 28.9587 177.0445 44 F 4.4499 8.4603 117.4392 56.9009 39.4960 175.8460 45 A 3.8324 8.1153 118.4294 53.0293 16.2199 178.1459 46 V 4.4146 7.1440 116.3552 62.2745 34.2776 174.5239 47 N 4.7413 8.5610 125.4955 52.6047 39.8478 173.6906 48 P 4.4411 0.0000 0.0000 64.3416 31.6536 177.6982 49 G 3.8889 7.8646 107.1353 46.7413 0.0000 174.4478 50 L 4.2650 7.7124 120.4905 56.7580 42.1728 179.0621 51 L 4.0912 7.3643 116.6964 57.0236 41.5873 178.1185 52 E 4.3018 8.1262 115.6710 57.6996 30.2691 176.6275 53 T 4.4782 7.7405 111.2463 59.0980 71.0551 174.9399 54 S 4.2053 8.7171 120.8988 61.8996 62.6776 176.4781 55 E 4.0705 8.2460 122.2344 58.8512 29.4643 178.7384 56 G 3.6525 8.1287 105.8182 48.0454 0.0000 175.3251 57 C 4.0991 8.0681 119.1021 62.5825 28.1723 175.7969 58 R 3.5568 7.8734 120.1041 59.7125 29.2027 178.1469 59 Q 3.9642 7.7349 117.7755 58.8675 29.3762 177.7805 60 I 3.8533 7.7303 120.8463 64.4843 37.2383 178.4317 61 L 4.2614 8.5000 120.2776 57.7408 41.2076 179.7445 62 G 3.9785 7.7206 104.6479 47.2588 0.0000 175.0212 63 Q 4.3039 7.7105 119.3083 58.3162 29.4877 177.7649 64 L 4.1406 7.8383 119.4731 57.4391 41.7726 178.7605 65 Q 3.5306 8.5798 118.8021 58.6136 28.5757 177.6454 66 P 4.3856 0.0000 0.0000 64.6325 31.9677 176.9267 67 S 4.5435 8.0108 115.0915 58.7273 63.4635 175.9332 68 L 3.9123 7.3603 120.5300 57.5866 41.6548 178.5172 69 Q 4.1015 8.1915 118.7704 58.8911 29.1668 177.4557 70 T 4.6082 7.5710 112.5301 62.9489 69.2934 174.4881 71 G 3.9761 8.0215 110.7379 43.4891 0.0000 174.3191 72 S 4.3532 8.5685 120.2048 58.0237 63.6997 174.8826 73 E 4.0014 9.0072 118.8299 59.9659 29.0529 179.3162 74 E 4.2743 8.4479 117.8069 59.6972 29.4565 179.1889 75 L 3.9737 8.0694 120.2195 57.9965 42.0663 178.7958 76 R 3.9527 7.9650 118.2147 59.7108 30.1094 178.2232 77 S 4.2256 8.5162 114.9398 61.8277 62.8732 176.9556 78 L 4.1781 8.1465 120.8549 58.0281 41.4462 178.6003 79 Y 4.1064 8.3107 119.4576 61.0188 38.8516 177.8076 80 N 4.2860 8.6269 117.3011 57.0561 38.7461 177.1605 81 T 4.0209 8.3239 116.7676 66.9765 68.6811 176.3881 82 I 3.6858 8.6263 121.4171 64.6340 37.1250 178.1880 83 A 3.8568 8.2848 121.6646 55.3273 17.9672 179.9271 84 V 3.5192 7.4118 114.8831 65.7742 31.7831 177.8335 85 L 4.2207 8.0302 120.2625 58.3599 42.0411 177.9546 86 Y 4.1897 8.4846 119.8783 61.2376 38.5738 177.9869 87 C 3.8260 7.9345 116.9723 62.7726 28.1350 176.3506 88 V 3.5349 7.5935 119.5263 66.4625 30.9466 177.7426 89 H 4.4900 7.9498 113.2972 58.1567 28.6696 175.6349 90 Q 4.1989 7.5286 117.9804 55.2855 28.6115 175.0009 91 R 3.8108 7.8166 114.2916 57.2809 28.8705 175.9454 92 I 4.3627 8.0528 117.2955 59.0954 39.1730 175.1580 93 D 4.7194 8.6266 125.1746 51.8429 40.3279 176.4883 94 V 4.2953 8.0612 117.2378 59.6866 33.7225 175.9148 95 K 4.1972 8.2192 119.7737 57.8227 32.8309 176.3250 96 D 4.5627 7.3094 116.4756 51.9436 41.2170 176.8179 97 T 4.1340 8.0119 115.7125 65.5191 67.9769 176.5783 98 K 4.0493 7.9676 122.0916 59.2682 32.6687 178.1142 99 E 4.0153 8.7317 119.1566 58.7057 29.6129 178.7821 100 A 3.9963 8.0531 121.3124 55.1490 18.2682 179.5561 101 L 3.9558 7.2824 115.6264 58.0071 41.9781 179.0009 102 D 4.4983 8.0388 117.8020 57.1487 41.0674 178.3538 103 K 4.0076 8.2503 119.1674 59.5928 31.9387 179.3107 104 I 3.9383 7.7953 119.2885 63.8393 36.9468 177.9053 105 E 4.0573 8.1489 120.5676 58.8338 28.4594 178.4562 106 E 4.0567 8.0192 118.4780 59.2316 29.5189 178.7434 107 E 4.2658 7.9676 117.3371 58.7169 29.9781 177.7602 108 Q 4.2239 7.9023 119.7356 57.8042 29.8550 176.9753 109 N 4.2818 8.3299 116.8929 56.7106 38.6168 176.8484 110 K 4.0296 7.3796 119.1061 59.7925 32.8008 178.8178 111 S 4.2435 7.8466 114.0858 61.0710 62.6599 175.7096 112 K 3.9312 8.3045 122.4309 59.4724 31.5951 178.8203 113 K 4.0441 7.6966 117.9288 59.2168 31.9602 179.0536 114 K 4.1931 8.0826 117.9218 57.7799 32.4972 177.1338 115 A 4.7851 7.7083 121.5556 51.8485 19.0588 175.7649 116 Q 4.5965 7.9281 117.5847 57.0916 29.6996 177.0691 117 Q 3.8316 8.1005 117.3377 57.5725 29.3522 177.3829 118 A 4.1629 8.0500 119.7265 54.5916 19.1915 178.1182 119 A 4.0054 8.2155 117.2017 54.9876 18.3303 177.7048 120 A 4.4371 7.5157 117.5453 51.5068 20.2227 176.3935 121 D 4.9001 8.6241 115.3678 55.4279 38.5725 174.5115 122 T 4.0877 7.3229 112.3657 62.2673 68.2901 174.5309 123 G 4.1922 8.1928 114.2723 43.9936 0.0000 174.4843 124 N 4.6226 7.6266 115.9218 51.8650 40.0185 172.0910 125 N 4.3436 8.4507 120.9730 53.3172 37.9829 175.5463 126 S 4.5172 8.2456 119.9958 56.9001 64.1863 174.3282 127 Q 4.0425 8.4315 119.9739 56.4046 28.6712 175.7591 128 V 4.2435 8.2423 121.7468 61.0817 33.1773 174.3270 129 S 4.9099 8.0126 120.5796 57.2919 65.4955 173.1522 130 Q 4.5250 8.0282 115.0342 55.2704 28.0417 174.4542 131 N 4.8123 8.2161 117.6409 52.6802 39.3661 174.4539 132 Y 4.0608 8.4919 123.1091 57.6372 38.9253 175.2809 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 G 8.35 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 0.00 0.00 0.00 0.00 3 A 8.03 4.38 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 4 R 8.62 3.96 0.00 1.75 1.94 0.00 3.34 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 5 A 7.60 4.27 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 6 S 8.85 4.21 0.00 3.84 3.81 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 7 V 8.25 4.13 1.92 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 0.76 0.00 0.00 0.85 0.00 0.00 8 L 7.45 4.80 0.00 1.50 1.48 0.56 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 9 S 8.74 4.66 0.00 4.05 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 10 G 8.71 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 0.00 0.00 0.00 11 G 7.95 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 12 E 7.86 4.07 0.00 2.10 2.01 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 2.34 2.33 0.00 13 L 8.55 4.04 0.00 1.87 1.82 1.03 1.17 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 14 D 7.61 4.45 0.00 2.92 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 15 K 7.98 4.20 0.00 1.98 1.89 0.00 1.80 0.00 0.00 1.59 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.50 7.81 16 W 8.48 4.19 0.00 3.45 3.30 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 17 E 7.96 4.89 0.00 2.02 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 2.71 2.39 0.00 18 K 7.49 4.37 0.00 1.93 1.82 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.63 7.81 19 I 6.95 4.10 1.62 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 1.08 1.08 0.84 0.00 0.00 20 R 8.29 4.53 0.00 1.98 1.90 0.00 3.18 0.00 0.00 3.29 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.77 0.00 21 L 8.62 3.79 0.00 1.37 1.34 0.69 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 22 R 7.32 4.68 0.00 1.69 1.77 0.00 3.16 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.50 0.00 23 P 0.00 4.58 0.00 2.17 2.17 0.00 3.32 0.00 0.00 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.91 0.00 24 G 7.90 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 25 G 7.83 3.88 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 0.00 0.00 0.00 26 K 8.22 4.49 0.00 1.66 1.72 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.30 1.40 7.81 27 K 7.80 4.26 0.00 1.55 1.62 0.00 1.61 0.00 0.00 1.77 0.00 0.00 2.80 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.34 7.81 28 Q 8.44 4.58 0.00 1.88 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.89 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 29 Y 8.24 4.21 0.00 2.27 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 30 K 9.01 5.24 0.00 1.86 1.76 0.00 1.71 0.00 0.00 1.78 0.00 0.00 2.85 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.49 1.49 7.81 31 L 8.96 4.05 0.00 1.84 1.76 0.91 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 32 K 8.39 3.97 0.00 1.91 1.76 0.00 1.67 0.00 0.00 1.81 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.63 7.81 33 H 8.97 4.62 0.00 4.12 3.90 0.00 5.86 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 34 I 7.79 3.84 1.67 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 0.32 0.24 0.65 0.00 0.00 35 V 8.19 3.62 2.17 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 1.18 0.00 0.00 0.99 0.00 0.00 36 W 7.81 4.15 0.00 3.59 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 37 A 7.87 3.75 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 38 S 8.42 4.03 0.00 3.93 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 39 R 7.57 3.71 0.00 1.84 1.90 0.00 3.29 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 40 E 7.94 4.02 0.00 1.44 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 1.86 1.47 0.00 41 L 7.71 3.92 0.00 1.66 1.88 0.87 0.87 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 42 E 7.38 4.48 0.00 1.92 2.01 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 2.34 2.31 0.00 43 R 8.19 4.22 0.00 1.93 2.02 0.00 3.40 0.00 0.00 3.16 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.80 0.00 44 F 8.46 4.45 0.00 3.16 3.04 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 0.00 0.00 0.00 45 A 8.12 3.83 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 46 V 7.14 4.41 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 0.91 0.00 0.00 1.05 0.00 0.00 47 N 8.56 4.74 0.00 2.76 2.65 0.00 0.00 6.97 7.70 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 48 P 0.00 4.44 0.00 2.22 2.47 0.00 3.72 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.93 0.00 49 G 7.86 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 50 L 7.71 4.27 0.00 1.66 1.70 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.36 4.09 0.00 1.67 1.69 0.86 0.87 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 52 E 8.13 4.30 0.00 2.02 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 2.37 2.35 0.00 53 T 7.74 4.48 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 1.17 0.00 0.00 54 S 8.72 4.21 0.00 4.07 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 55 E 8.25 4.07 0.00 2.07 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 2.39 2.40 0.00 56 G 8.13 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 57 C 8.07 4.10 0.00 3.29 3.04 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 0.00 0.00 0.00 58 R 7.87 3.56 0.00 2.10 1.90 0.00 3.35 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 1.43 0.99 0.00 59 Q 7.73 3.96 0.00 2.29 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.73 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 60 I 7.73 3.85 1.95 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 1.50 0.56 0.86 0.00 0.00 61 L 8.50 4.26 0.00 1.53 1.78 0.64 0.50 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 62 G 7.72 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 63 Q 7.71 4.30 0.00 2.24 2.19 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 2.38 2.40 0.00 64 L 7.84 4.14 0.00 1.81 1.68 0.89 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 65 Q 8.58 3.53 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.88 0.00 0.00 0.00 0.00 0.00 2.39 2.66 0.00 66 P 0.00 4.39 0.00 2.15 2.15 0.00 3.62 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.03 0.00 67 S 8.01 4.54 0.00 4.01 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 0.00 68 L 7.36 3.91 0.00 1.62 1.59 0.30 0.63 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 69 Q 8.19 4.10 0.00 1.97 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.50 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 70 T 7.57 4.61 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 1.21 0.00 0.00 71 G 8.02 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 72 S 8.57 4.35 0.00 4.08 4.11 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 73 E 9.01 4.00 0.00 2.07 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 0.00 2.45 2.40 0.00 74 E 8.45 4.27 0.00 2.18 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 0.00 2.68 2.63 0.00 75 L 8.07 3.97 0.00 1.84 1.82 1.03 0.93 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 76 R 7.96 3.95 0.00 2.00 1.98 0.00 3.47 0.00 0.00 3.43 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.70 0.00 77 S 8.52 4.23 0.00 4.18 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 0.00 78 L 8.15 4.18 0.00 1.99 1.69 0.77 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 79 Y 8.31 4.11 0.00 3.13 3.16 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 80 N 8.63 4.29 0.00 3.08 2.97 0.00 0.00 7.19 7.63 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 81 T 8.32 4.02 4.62 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 1.63 0.00 0.00 82 I 8.63 3.69 1.86 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 1.44 0.67 0.88 0.00 0.00 83 A 8.28 3.86 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 84 V 7.41 3.52 1.84 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 0.14 0.00 0.00 0.94 0.00 0.00 85 L 8.03 4.22 0.00 1.75 1.76 0.24 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 86 Y 8.48 4.19 0.00 3.00 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 87 C 7.93 3.83 0.00 3.15 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 88 V 7.59 3.53 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 1.28 0.00 0.00 1.12 0.00 0.00 89 H 7.95 4.49 0.00 3.25 3.26 0.00 5.79 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 Q 7.53 4.20 0.00 1.47 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.85 0.00 0.00 0.00 0.00 0.00 2.20 2.23 0.00 91 R 7.82 3.81 0.00 1.91 1.92 0.00 3.25 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 1.53 1.56 0.00 92 I 8.05 4.36 1.83 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 1.30 0.74 0.89 0.00 0.00 93 D 8.63 4.72 0.00 2.76 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 94 V 8.06 4.30 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 0.73 0.00 0.00 0.89 0.00 0.00 95 K 8.22 4.20 0.00 1.73 1.84 0.00 1.81 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.35 7.81 96 D 7.31 4.56 0.00 2.86 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 97 T 8.01 4.13 4.38 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 1.30 0.00 0.00 98 K 7.97 4.05 0.00 1.79 1.93 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.50 1.44 7.81 99 E 8.73 4.02 0.00 2.08 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 2.31 2.33 0.00 100 A 8.05 4.00 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 0.00 101 L 7.28 3.96 0.00 1.96 1.82 1.05 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.04 4.50 0.00 2.85 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 0.00 103 K 8.25 4.01 0.00 2.09 1.87 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.69 7.81 104 I 7.80 3.94 2.02 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 1.63 1.07 0.88 0.00 0.00 105 E 8.15 4.06 0.00 2.11 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 0.00 2.33 2.38 0.00 106 E 8.02 4.06 0.00 2.24 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 2.42 2.42 0.00 107 E 7.97 4.27 0.00 2.01 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 0.00 2.38 2.29 0.00 108 Q 7.90 4.22 0.00 2.32 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.66 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 109 N 8.33 4.28 0.00 3.15 2.83 0.00 0.00 6.81 6.21 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 0.00 110 K 7.38 4.03 0.00 2.15 1.95 0.00 1.68 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.61 1.47 7.81 111 S 7.85 4.24 0.00 3.93 4.02 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 0.00 112 K 8.30 3.93 0.00 1.86 1.94 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.49 7.81 113 K 7.70 4.04 0.00 1.93 1.87 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.58 7.81 114 K 8.08 4.19 0.00 1.95 1.87 0.00 1.65 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.46 7.81 115 A 7.71 4.79 1.24 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 0.00 0.00 0.00 116 Q 7.93 4.60 0.00 2.34 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.83 6.86 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 117 Q 8.10 3.83 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.30 0.00 118 A 8.05 4.16 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 0.00 119 A 8.22 4.01 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 0.00 120 A 7.52 4.44 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 0.00 121 D 8.62 4.90 0.00 2.81 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 T 7.32 4.09 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 1.21 0.00 0.00 123 G 8.19 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 0.00 124 N 7.63 4.62 0.00 2.62 2.69 0.00 0.00 7.31 7.79 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 0.00 125 N 8.45 4.34 0.00 2.75 2.80 0.00 0.00 7.22 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 0.00 126 S 8.25 4.52 0.00 3.86 3.81 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 0.00 127 Q 8.43 4.04 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.70 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 128 V 8.24 4.24 2.08 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 0.81 0.00 0.00 0.93 0.00 0.00 129 S 8.01 4.91 0.00 3.81 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 0.00 130 Q 8.03 4.52 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.74 0.00 0.00 0.00 0.00 0.00 2.19 2.34 0.00 131 N 8.22 4.81 0.00 2.71 2.82 0.00 0.00 7.14 7.47 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 0.00 132 Y 8.49 4.06 0.00 2.97 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