NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4654 8.1633 120.3272 54.5136 33.5503 175.0281 2 K 3.6350 7.6792 118.3992 59.2910 32.8061 177.8047 3 A 4.0292 8.7473 128.1173 55.2953 20.3470 180.0230 4 K 3.9393 7.2711 116.0854 59.5333 32.4779 178.0164 5 E 4.0759 8.1502 117.9321 59.1358 29.7048 177.3563 6 L 4.0299 7.5121 117.8986 55.4247 41.3985 178.4801 7 R 3.9382 8.6261 116.5859 57.3438 29.5024 177.4908 8 E 3.9488 8.1113 115.5656 57.3983 29.9350 173.5097 9 K 3.8620 7.2118 128.1867 55.7719 33.6670 175.7521 10 S 3.8556 8.1296 119.6752 61.8403 62.5594 177.1693 11 V 3.4619 7.5109 121.6217 66.4547 31.9524 177.7461 12 E 4.8548 8.1130 118.7079 59.0334 29.4019 178.9324 13 E 4.1787 7.9647 119.6551 58.8585 29.4550 179.3307 14 L 3.9824 7.9174 118.9138 58.0207 41.5351 179.2323 15 N 4.5440 8.0832 115.3809 55.6580 37.3773 176.9741 16 T 4.0153 7.9813 119.5754 66.4037 68.4771 176.2602 17 E 3.9515 8.0305 118.8644 59.2363 29.5966 178.4192 18 L 3.8808 7.6563 121.2306 58.3113 41.2312 179.0564 19 L 4.0494 7.6415 118.1826 57.8300 41.5419 178.9735 20 N 4.2139 7.7855 116.7881 56.4369 38.0594 177.2755 21 L 4.2113 8.1160 120.6430 57.7254 40.8243 175.8154 22 L 3.7884 8.4171 127.0359 55.3842 41.8603 176.8712 23 R 4.4975 9.0071 130.7571 57.9907 28.8894 177.8480 24 E 3.9286 7.0418 117.7088 59.7862 29.2927 178.6051 25 Q 3.9492 8.7038 118.7067 59.3712 29.4374 178.0093 26 F 4.2449 7.9443 120.3159 61.7413 38.6475 176.4583 27 N 3.8561 9.8996 115.3759 56.5310 38.5675 177.0309 28 L 4.1404 7.9278 119.8806 58.2361 41.7878 180.0495 29 R 3.8318 8.0386 117.5174 59.4658 29.9986 178.6861 30 M 3.7791 8.0901 118.6191 58.5469 31.7398 178.3953 31 Q 4.0762 8.8860 117.9720 59.2963 29.2200 178.3150 32 A 4.1670 7.7158 119.5908 55.2642 18.5804 179.0432 33 A 4.0438 8.1783 118.1221 54.7520 19.5300 179.2558 34 S 4.5121 8.7863 115.6027 57.1017 61.0131 175.7189 35 G 3.6933 8.5982 117.9434 45.5829 0.0000 177.0702 36 Q 2.6865 9.7348 122.8086 57.2643 28.3033 170.4755 37 L 3.4165 8.3886 123.8074 56.3900 42.5387 173.8658 38 Q 4.4334 8.5316 119.9524 57.5929 31.0356 175.9591 39 Q 4.3150 7.9958 115.7829 55.5393 29.6507 176.4846 40 S 4.5982 8.5946 117.5345 59.6780 64.4947 175.6669 41 H 4.3528 8.2520 117.7332 57.7117 27.7873 177.1034 42 L 3.9128 7.4599 121.4190 57.7994 40.7919 178.5885 43 L 4.1127 8.3345 119.4905 57.3885 41.4359 179.1414 44 K 3.7452 7.9398 119.1919 59.7197 32.1863 177.3862 45 Q 4.2294 7.7942 116.0394 56.1143 31.2354 175.6341 46 V 3.6944 8.5819 123.6611 64.8033 31.2750 173.8084 47 R 3.8704 7.3320 119.0400 59.7585 29.7342 178.7471 48 R 3.9340 7.5639 117.0421 59.3811 30.2194 178.6021 49 D 4.0309 8.1644 118.2151 57.5416 40.6261 179.1918 50 V 3.6101 8.3021 118.7499 65.6182 31.3013 177.7236 51 A 4.0521 7.9810 120.5809 55.4728 18.1614 179.0036 52 R 4.1957 8.8428 117.8222 59.9706 29.8109 178.3745 53 V 3.6435 7.5277 116.6097 66.3292 31.6764 178.1785 54 K 4.1147 8.5191 116.9441 59.4745 31.7718 179.3499 55 T 4.0359 8.8599 117.3229 66.8971 68.4795 175.0811 56 L 4.5733 8.1606 120.7327 54.5222 44.1414 175.7578 57 L 4.1574 8.5359 123.8386 56.3779 41.2717 175.2239 58 N 4.4092 6.9090 115.8523 55.3347 39.1972 176.6061 59 E 3.9237 8.2258 116.1731 59.6504 30.0837 179.6442 60 K 3.7577 7.9414 117.4905 59.0887 32.2320 177.5597 61 A 3.9139 7.8513 120.7748 52.3791 18.4602 175.7596 62 G 3.2299 8.3726 113.5421 44.9501 0.0000 173.4066 63 A 4.3026 7.6944 129.4084 51.9909 19.2703 177.3155 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 M 8.16 4.47 0.00 2.14 2.25 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.63 0.00 2 K 7.68 3.64 0.00 1.94 1.66 0.00 1.56 0.00 0.00 1.82 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.56 7.81 3 A 8.75 4.03 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 4 K 7.27 3.94 0.00 1.76 2.01 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.43 7.81 5 E 8.15 4.08 0.00 2.22 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 2.73 2.42 0.00 6 L 7.51 4.03 0.00 1.87 1.62 0.92 0.77 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 7 R 8.63 3.94 0.00 2.05 1.99 0.00 3.23 0.00 0.00 3.34 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 8 E 8.11 3.95 0.00 2.34 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 2.42 0.00 9 K 7.21 3.86 0.00 2.19 2.04 0.00 1.56 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.32 1.44 7.81 10 S 8.13 3.86 0.00 3.90 3.83 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 0.00 0.00 0.00 0.00 11 V 7.51 3.46 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 0.86 0.00 0.00 0.93 0.00 0.00 12 E 8.11 4.85 0.00 2.50 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 2.40 2.33 0.00 13 E 7.96 4.18 0.00 2.22 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 2.51 2.38 0.00 14 L 7.92 3.98 0.00 1.90 1.73 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 15 N 8.08 4.54 0.00 3.00 3.07 0.00 0.00 7.04 7.75 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 16 T 7.98 4.02 4.47 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 1.21 0.00 0.00 17 E 8.03 3.95 0.00 2.24 2.21 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 2.36 2.64 0.00 18 L 7.66 3.88 0.00 2.03 1.85 0.91 1.09 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 19 L 7.64 4.05 0.00 1.97 1.72 0.96 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 20 N 7.79 4.21 0.00 2.79 2.90 0.00 0.00 6.82 6.59 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 21 L 8.12 4.21 0.00 1.88 1.93 0.97 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 22 L 8.42 3.79 0.00 1.44 1.83 0.90 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 23 R 9.01 4.50 0.00 2.12 2.17 0.00 3.45 0.00 0.00 3.29 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 24 E 7.04 3.93 0.00 2.26 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 0.00 2.49 2.35 0.00 25 Q 8.70 3.95 0.00 2.32 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.50 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 26 F 7.94 4.24 0.00 3.10 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 27 N 9.90 3.86 0.00 2.98 2.80 0.00 0.00 7.12 6.62 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 28 L 7.93 4.14 0.00 1.94 1.72 0.88 0.85 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 29 R 8.04 3.83 0.00 1.95 1.94 0.00 3.19 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.90 0.00 30 M 8.09 3.78 0.00 1.65 1.76 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.34 0.00 31 Q 8.89 4.08 0.00 2.07 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.95 0.00 0.00 0.00 0.00 0.00 2.39 2.52 0.00 32 A 7.72 4.17 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 33 A 8.18 4.04 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 34 S 8.79 4.51 0.00 3.81 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 35 G 8.60 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.73 2.69 0.00 2.29 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 5.97 0.00 0.00 0.00 0.00 0.00 2.27 2.47 0.00 37 L 8.39 3.42 0.00 1.69 1.57 0.92 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 8.53 4.43 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.71 0.00 0.00 0.00 0.00 0.00 2.23 2.27 0.00 39 Q 8.00 4.32 0.00 2.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.90 0.00 0.00 0.00 0.00 0.00 2.41 2.36 0.00 40 S 8.59 4.60 0.00 4.02 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 41 H 8.25 4.35 0.00 3.44 3.62 0.00 5.65 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 7.46 3.91 0.00 1.52 1.70 0.57 0.93 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 43 L 8.33 4.11 0.00 1.75 1.71 0.90 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 44 K 7.94 3.75 0.00 1.87 2.00 0.00 1.62 0.00 0.00 1.82 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.62 7.81 45 Q 7.79 4.23 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 5.68 0.00 0.00 0.00 0.00 0.00 2.42 2.69 0.00 46 V 8.58 3.69 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 0.99 0.00 0.00 0.98 0.00 0.00 47 R 7.33 3.87 0.00 2.40 1.92 0.00 3.15 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 48 R 7.56 3.93 0.00 2.03 1.96 0.00 3.27 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 49 D 8.16 4.03 0.00 2.88 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 50 V 8.30 3.61 2.33 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 1.01 0.00 0.00 1.01 0.00 0.00 51 A 7.98 4.05 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 52 R 8.84 4.20 0.00 1.93 1.95 0.00 3.12 0.00 0.00 3.10 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 53 V 7.53 3.64 2.21 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 0.92 0.00 0.00 1.05 0.00 0.00 54 K 8.52 4.11 0.00 2.00 1.86 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.48 7.81 55 T 8.86 4.04 4.42 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 1.21 0.00 0.00 56 L 8.16 4.57 0.00 1.78 1.65 0.92 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 57 L 8.54 4.16 0.00 1.94 1.83 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 58 N 6.91 4.41 0.00 3.13 2.73 0.00 0.00 6.76 7.54 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 59 E 8.23 3.92 0.00 2.18 2.24 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 2.37 2.42 0.00 60 K 7.94 3.76 0.00 1.86 1.93 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.55 7.81 61 A 7.85 3.91 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 62 G 8.37 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 0.00 0.00 0.00 63 A 7.69 4.30 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00