NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.4512 0.0000 0.0000 61.6915 32.8668 175.6982 3 L 4.1060 8.3119 119.2519 53.6812 42.1638 176.3099 4 T 4.7060 9.6455 114.4361 59.8934 72.9945 173.9896 5 P 4.3884 0.0000 0.0000 65.9145 31.2585 178.5293 6 N 4.3833 8.1769 115.3908 56.5421 38.8045 176.4171 7 D 4.3553 8.1778 120.4710 57.4776 40.7224 178.8702 8 I 3.6498 7.3115 118.3250 64.7011 37.1929 177.6614 9 H 4.2809 8.0080 117.7759 59.1670 29.8100 176.4144 10 N 4.5043 8.3084 116.2511 53.0117 38.9981 175.5670 11 K 3.8009 7.2224 122.7318 56.4509 32.7143 175.8376 12 T 4.4385 7.7727 114.8433 59.6262 71.6912 173.0178 13 F 4.9777 8.0740 119.3923 55.5738 42.8740 175.2634 14 T 4.0318 8.6282 120.0994 63.8932 68.8915 173.7492 15 K 4.5361 8.4641 123.9285 55.0206 33.6831 176.2943 16 S 4.7865 8.2729 118.7334 56.1440 65.7252 173.8806 17 A 4.1141 8.6514 125.6646 54.8531 18.0888 178.3892 18 R 4.5977 7.5508 113.2916 54.6219 33.1002 174.6052 19 G 3.8964 7.9357 111.5732 45.4148 0.0000 171.6790 20 Y 4.4927 8.0858 117.2805 57.1982 38.8296 175.6193 21 D 4.3836 8.8796 122.5888 55.0422 42.2071 177.3395 22 E 4.0267 8.8547 126.4671 59.7191 29.6889 179.0314 23 D 4.3810 8.1551 118.4396 57.3341 40.9094 178.5964 24 E 3.9721 8.6436 119.1452 59.2844 29.4011 179.4859 25 V 3.5728 7.7611 118.2109 66.2126 31.6611 177.7953 26 N 4.4131 8.4682 116.3744 56.4527 38.4188 177.2982 27 E 4.0265 8.4115 119.9966 59.3155 29.4701 179.2308 28 F 4.1937 8.4748 120.7678 61.3647 39.4295 177.2971 29 L 3.9068 8.4699 118.6539 57.5105 41.3525 179.3842 30 A 3.9728 8.0445 121.0866 54.9752 18.2974 179.5281 31 Q 3.7998 7.8263 118.0308 59.2447 29.1159 178.3987 32 V 3.3814 7.5619 119.6504 65.9233 31.3930 177.8586 33 R 3.8839 8.0912 118.5322 59.2418 29.9002 178.1890 34 K 3.8814 8.0674 119.2509 59.7949 32.2342 178.4124 35 D 4.3410 8.1075 118.9145 57.4289 40.6921 178.0675 36 Y 4.0850 8.3656 120.3958 60.8986 38.7367 177.9633 37 E 3.8555 8.5557 120.2609 59.1836 29.7119 178.8099 38 I 3.6398 7.8729 119.8859 64.4853 37.2152 178.6625 39 V 3.5596 7.7208 119.0650 65.6494 31.2384 177.7828 40 L 3.7299 7.8694 120.3747 57.9970 41.8217 178.9403 41 R 3.8910 7.9416 120.0195 58.7609 30.0555 178.4623 42 K 3.8668 7.9592 118.2460 59.3289 31.9916 178.9875 43 K 3.8569 8.0684 119.9257 59.9186 31.6909 178.9037 44 T 3.8508 8.1986 110.2780 64.7554 68.7136 176.2828 45 E 3.9749 8.5194 121.8235 59.0271 29.4669 179.0628 46 L 3.9287 7.9802 120.3048 58.2277 42.1577 178.6324 47 E 3.9246 8.4855 118.6717 59.5562 29.3330 179.3531 48 A 4.0060 8.1050 120.5556 55.1397 18.4326 179.9027 49 K 4.1906 7.9423 118.0983 58.9279 32.0105 179.8768 50 V 3.5651 7.9904 118.6862 65.9254 31.3956 177.6863 51 N 4.2875 8.4872 116.6584 56.5903 37.9785 177.1615 52 E 4.0987 8.3297 119.8439 59.2941 29.5365 179.3357 53 L 3.9639 7.9324 120.3405 58.1341 42.0025 178.3678 54 D 4.3302 8.0341 116.8451 57.5797 41.2706 177.9936 55 E 3.9792 8.3792 117.7328 57.2507 29.4496 177.2449 56 R 4.2531 7.7565 122.3100 56.6481 30.7869 175.8279 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 P 0.00 4.45 0.00 2.18 2.17 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.15 0.00 3 L 8.31 4.11 0.00 1.58 1.52 0.81 0.54 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 4 T 9.65 4.71 4.30 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 1.25 0.00 0.00 5 P 0.00 4.39 0.00 2.23 2.23 0.00 3.68 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.32 0.00 6 N 8.18 4.38 0.00 2.80 2.83 0.00 0.00 7.21 8.49 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 7 D 8.18 4.36 0.00 2.89 2.69 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 8 I 7.31 3.65 2.01 0.00 0.00 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 1.25 0.45 0.87 0.00 0.00 9 H 8.01 4.28 0.00 3.16 3.50 0.00 5.74 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 N 8.31 4.50 0.00 2.75 2.81 0.00 0.00 7.00 7.26 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 11 K 7.22 3.80 0.00 1.67 1.65 0.00 1.40 0.00 0.00 1.64 0.00 0.00 3.11 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.21 0.48 7.81 12 T 7.77 4.44 4.14 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 0.00 0.00 0.00 1.11 0.00 0.00 13 F 8.07 4.98 0.00 3.02 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 14 T 8.63 4.03 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 1.23 0.00 0.00 15 K 8.46 4.54 0.00 1.75 1.75 0.00 1.73 0.00 0.00 1.86 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.49 7.81 16 S 8.27 4.79 0.00 3.91 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 17 A 8.65 4.11 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 18 R 7.55 4.60 0.00 1.69 1.71 0.00 3.24 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.56 0.00 19 G 7.94 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 0.00 0.00 0.00 20 Y 8.09 4.49 0.00 2.90 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 21 D 8.88 4.38 0.00 2.73 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 22 E 8.85 4.03 0.00 2.09 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 2.46 2.44 0.00 23 D 8.16 4.38 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 24 E 8.64 3.97 0.00 2.13 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 2.32 2.48 0.00 25 V 7.76 3.57 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 1.06 0.00 0.00 0.89 0.00 0.00 26 N 8.47 4.41 0.00 2.85 2.90 0.00 0.00 7.11 8.50 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 27 E 8.41 4.03 0.00 2.25 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 2.36 2.53 0.00 28 F 8.47 4.19 0.00 3.14 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 29 L 8.47 3.91 0.00 1.93 1.74 1.20 1.12 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 30 A 8.04 3.97 1.41 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 0.00 0.00 0.00 31 Q 7.83 3.80 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.73 0.00 0.00 0.00 0.00 0.00 2.20 2.30 0.00 32 V 7.56 3.38 1.82 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 0.86 0.00 0.00 0.19 0.00 0.00 33 R 8.09 3.88 0.00 1.96 2.11 0.00 3.33 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.90 0.00 34 K 8.07 3.88 0.00 1.86 1.95 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.48 7.81 35 D 8.11 4.34 0.00 2.74 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 36 Y 8.37 4.08 0.00 3.00 3.13 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 0.00 0.00 0.00 37 E 8.56 3.86 0.00 2.18 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 2.29 2.34 0.00 38 I 7.87 3.64 1.99 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 1.39 0.70 0.89 0.00 0.00 39 V 7.72 3.56 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 0.93 0.00 0.00 0.96 0.00 0.00 40 L 7.87 3.73 0.00 1.41 1.61 0.76 0.86 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 41 R 7.94 3.89 0.00 1.96 2.01 0.00 3.18 0.00 0.00 3.24 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.50 0.00 42 K 7.96 3.87 0.00 1.96 1.82 0.00 1.70 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.56 7.81 43 K 8.07 3.86 0.00 1.77 1.99 0.00 1.59 0.00 0.00 1.63 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.42 7.81 44 T 8.20 3.85 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 1.21 0.00 0.00 45 E 8.52 3.97 0.00 2.16 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 2.31 2.53 0.00 46 L 7.98 3.93 0.00 1.87 1.77 0.91 0.76 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 47 E 8.49 3.92 0.00 2.21 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 2.32 2.42 0.00 48 A 8.11 4.01 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 49 K 7.94 4.19 0.00 1.95 1.86 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.45 7.81 50 V 7.99 3.57 2.19 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 1.10 0.00 0.00 0.96 0.00 0.00 51 N 8.49 4.29 0.00 2.93 3.02 0.00 0.00 7.07 7.22 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 52 E 8.33 4.10 0.00 2.18 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 2.32 2.41 0.00 53 L 7.93 3.96 0.00 1.77 1.79 0.92 1.20 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 54 D 8.03 4.33 0.00 2.76 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 55 E 8.38 3.98 0.00 2.09 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 2.45 0.00 56 R 7.76 4.25 0.00 1.96 1.93 0.00 3.59 0.00 0.00 3.37 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00