NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 5.1446 8.1200 121.1852 56.6714 34.1022 177.5316 3 L 3.7982 8.0270 118.5119 57.2316 41.6855 176.9117 4 S 4.2110 8.8043 113.9751 61.6344 63.0152 175.4334 5 E 4.0602 8.2510 120.4912 59.1278 29.0500 179.6784 6 V 3.5638 7.5774 118.4888 65.9791 31.6882 178.1998 7 R 3.9774 7.6351 114.6569 59.8422 28.9901 178.0378 8 K 3.9950 8.4043 118.9152 58.4644 31.9654 179.3694 9 Q 3.8229 8.3416 117.6667 58.9193 28.6876 180.2505 10 L 3.9335 7.7820 119.5971 57.8928 41.5151 179.1002 11 E 3.9967 7.9060 117.0243 59.8907 29.6868 179.1527 12 E 4.0266 8.5626 118.2475 59.2436 29.4909 178.8565 13 A 3.9891 8.6222 120.7383 55.6961 18.3559 179.7921 14 R 4.0561 9.3483 113.9580 57.8362 30.5572 177.2257 15 K 4.7218 8.2363 118.1855 56.7075 33.3130 176.5477 16 L 4.5835 7.9796 117.0603 55.6711 41.8181 176.1707 17 S 3.5966 7.9686 115.7867 57.2233 63.3894 170.8535 18 P 4.2906 0.0000 0.0000 65.9420 31.5153 178.6928 19 V 3.5563 7.6610 118.3608 65.2064 31.3702 177.1200 20 E 3.9242 8.1857 119.1176 59.3440 29.4111 178.7652 21 L 4.0095 7.4566 117.4958 57.9027 41.8278 179.1931 22 E 3.9040 8.0531 118.0657 59.5431 29.3893 179.3688 23 K 3.8563 7.9808 118.3434 59.6335 32.1381 178.6334 24 L 4.1976 7.5600 121.4319 57.6778 42.0402 178.8328 25 V 3.5651 7.6340 117.9621 66.2685 31.2975 177.9380 26 R 3.8894 7.8389 117.1502 59.6074 30.0310 178.8470 27 E 3.9768 7.7683 116.5657 59.4175 29.4674 179.5981 28 K 4.0596 8.4199 118.9072 59.4960 32.0745 179.5365 29 K 4.0519 8.6552 119.0282 59.1412 31.8123 179.4456 30 R 3.8803 8.3041 119.7515 59.1144 29.8777 178.5253 31 E 3.8849 8.2706 118.5880 59.2769 29.5244 178.7390 32 L 3.9053 7.7586 120.3253 58.6528 42.0860 178.7947 33 M 4.0218 8.0167 117.8695 58.3684 31.6618 177.9124 34 E 3.8217 7.8133 119.5676 59.0226 29.7621 178.5665 35 L 3.9263 8.0643 119.1526 57.9842 41.6765 179.5670 36 R 4.0514 7.9993 117.7941 59.4959 29.9362 178.7346 37 F 4.3379 7.9926 114.3158 58.4533 38.7852 176.2215 38 Q 4.5259 7.3642 116.9878 56.9515 30.8589 177.1891 39 A 4.1810 8.7686 122.8013 55.7364 17.8221 178.7148 40 S 4.2424 8.7839 114.3754 60.0633 62.7542 175.8563 41 I 3.6560 7.7207 121.1483 60.7198 38.2354 177.7601 42 G 3.4888 8.0546 110.4245 47.6536 0.0000 177.6939 43 Q 3.2926 7.2837 121.0760 56.0583 26.4646 175.0871 44 L 5.1259 7.4839 116.8361 55.2585 46.1647 172.6166 45 S 4.4781 7.5751 108.8452 57.8010 65.0352 175.2191 46 Q 4.3258 7.7409 121.2892 55.0842 30.0775 177.5773 47 N 3.3613 7.5600 116.0678 52.4327 40.5549 176.0817 48 H 3.9203 8.7094 119.9690 59.1468 28.5870 177.3236 49 K 3.9827 8.4828 121.1333 58.5584 31.6843 178.8822 50 I 4.0225 8.7937 121.3654 63.5644 37.4966 177.8286 51 R 4.1799 7.8070 112.7186 57.4539 28.5386 176.9377 52 D 4.5319 7.5309 118.4378 56.8190 41.7481 177.9270 53 L 4.0173 7.6292 120.3722 58.5148 41.5822 178.6115 54 K 3.9482 8.6997 117.9751 60.2320 31.9209 178.9292 55 R 3.9929 7.8112 114.9488 59.1303 29.9857 179.1932 56 Q 4.0960 8.2744 118.5337 59.2830 28.7099 178.8156 57 I 3.6913 7.9255 119.7667 64.6226 37.0563 177.9369 58 A 3.9648 7.6121 120.3670 55.3688 18.2924 179.3952 59 R 3.8292 8.8576 116.7386 59.5345 30.2643 178.8509 60 L 3.9394 8.3646 118.5319 58.2683 41.7661 179.8324 61 L 3.9536 8.1682 118.4073 58.3691 41.7598 179.6364 62 T 3.8985 8.4914 115.8008 66.6396 68.2757 176.6841 63 V 3.7373 7.8021 119.9385 65.9162 31.7964 177.5406 64 L 3.9261 8.3530 120.3820 58.8528 41.4689 178.5603 65 N 4.3549 8.8175 116.0773 55.8258 38.6294 176.6591 66 E 4.0229 8.0109 118.7693 60.0197 29.6833 179.4146 67 K 4.0644 8.2651 119.1688 59.0998 32.1761 179.3983 68 R 3.9426 7.9554 117.8382 59.3484 30.2352 178.1731 69 R 4.2048 7.7499 118.5106 55.5901 29.8261 176.3972 70 Q 4.7668 7.3976 123.1566 56.4846 30.4569 174.0134 71 N 4.7663 8.0402 112.5984 52.7119 39.2861 174.5703 72 A 4.3314 7.8047 126.8591 52.2026 19.3634 176.7233 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 K 8.12 5.14 0.00 1.86 1.87 0.00 1.78 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.42 1.46 7.81 3 L 8.03 3.80 0.00 1.76 1.69 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 4 S 8.80 4.21 0.00 3.93 3.84 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 0.00 0.00 0.00 0.00 5 E 8.25 4.06 0.00 2.16 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 2.38 0.00 6 V 7.58 3.56 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 1.05 0.00 0.00 1.00 0.00 0.00 7 R 7.64 3.98 0.00 2.12 2.18 0.00 2.83 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.68 0.00 8 K 8.40 3.99 0.00 2.05 1.80 0.00 1.70 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.53 7.81 9 Q 8.34 3.82 0.00 2.32 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.71 0.00 10 L 7.78 3.93 0.00 1.83 1.71 0.92 1.30 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 11 E 7.91 4.00 0.00 2.12 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 0.00 2.35 2.52 0.00 12 E 8.56 4.03 0.00 2.15 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 2.33 2.33 0.00 13 A 8.62 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 14 R 9.35 4.06 0.00 1.99 2.03 0.00 3.28 0.00 0.00 3.50 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.82 0.00 15 K 8.24 4.72 0.00 1.77 1.80 0.00 1.56 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.70 1.39 7.81 16 L 7.98 4.58 0.00 1.62 1.67 0.92 0.85 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 17 S 7.97 3.60 0.00 3.99 3.77 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 18 P 0.00 4.29 0.00 2.30 2.27 0.00 3.75 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.01 0.00 19 V 7.66 3.56 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 1.02 0.00 0.00 0.93 0.00 0.00 20 E 8.19 3.92 0.00 2.13 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 0.00 2.30 2.42 0.00 21 L 7.46 4.01 0.00 2.05 1.70 0.94 0.90 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 22 E 8.05 3.90 0.00 2.13 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 2.33 2.58 0.00 23 K 7.98 3.86 0.00 1.99 1.89 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.68 7.81 24 L 7.56 4.20 0.00 1.71 1.97 0.91 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 25 V 7.63 3.57 2.22 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 0.97 0.00 0.00 0.92 0.00 0.00 26 R 7.84 3.89 0.00 2.06 1.96 0.00 3.17 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 27 E 7.77 3.98 0.00 2.19 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 2.31 2.45 0.00 28 K 8.42 4.06 0.00 1.82 1.85 0.00 1.67 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.60 1.62 7.81 29 K 8.66 4.05 0.00 1.86 1.83 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.67 1.54 7.81 30 R 8.30 3.88 0.00 1.79 2.05 0.00 3.06 0.00 0.00 3.13 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 31 E 8.27 3.88 0.00 2.21 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 2.31 2.48 0.00 32 L 7.76 3.91 0.00 1.89 1.75 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 33 M 8.02 4.02 0.00 2.08 2.07 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.30 0.00 34 E 7.81 3.82 0.00 2.14 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 0.00 2.30 2.40 0.00 35 L 8.06 3.93 0.00 1.95 1.74 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 36 R 8.00 4.05 0.00 2.23 2.12 0.00 3.18 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.91 0.00 37 F 7.99 4.34 0.00 3.09 3.15 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 0.00 0.00 0.00 0.00 38 Q 7.36 4.53 0.00 2.00 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.98 0.00 0.00 0.00 0.00 0.00 2.36 2.63 0.00 39 A 8.77 4.18 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 40 S 8.78 4.24 0.00 3.92 3.96 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 41 I 7.72 3.66 1.85 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.59 0.93 0.00 0.00 42 G 8.05 3.49 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 Q 7.28 3.29 0.00 2.06 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 7.72 0.00 0.00 0.00 0.00 0.00 2.31 2.45 0.00 44 L 7.48 5.13 0.00 1.89 1.61 0.94 0.87 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 45 S 7.58 4.48 0.00 3.83 3.68 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 46 Q 7.74 4.33 0.00 2.11 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.17 0.00 0.00 0.00 0.00 0.00 2.35 2.30 0.00 47 N 7.56 3.36 0.00 2.82 2.71 0.00 0.00 6.75 8.16 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 48 H 8.71 3.92 0.00 3.35 3.59 0.00 5.46 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 K 8.48 3.98 0.00 2.12 1.89 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.39 1.63 7.81 50 I 8.79 4.02 2.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.88 0.92 0.00 0.00 51 R 7.81 4.18 0.00 1.97 2.06 0.00 3.04 0.00 0.00 3.16 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 52 D 7.53 4.53 0.00 2.99 2.62 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 53 L 7.63 4.02 0.00 1.95 1.63 0.97 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 54 K 8.70 3.95 0.00 1.77 1.82 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.61 1.64 7.81 55 R 7.81 3.99 0.00 1.84 1.98 0.00 3.40 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 1.65 1.67 0.00 56 Q 8.27 4.10 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.72 0.00 0.00 0.00 0.00 0.00 2.45 2.56 0.00 57 I 7.93 3.69 1.94 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 1.92 0.93 0.90 0.00 0.00 58 A 7.61 3.96 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 59 R 8.86 3.83 0.00 1.94 1.99 0.00 3.16 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 60 L 8.36 3.94 0.00 1.85 1.75 0.91 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 61 L 8.17 3.95 0.00 1.80 1.72 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 62 T 8.49 3.90 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 63 V 7.80 3.74 2.27 0.00 0.00 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 0.93 0.00 0.00 64 L 8.35 3.93 0.00 1.83 1.83 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 65 N 8.82 4.35 0.00 2.91 2.82 0.00 0.00 7.01 8.11 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 66 E 8.01 4.02 0.00 2.15 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 0.00 2.56 2.38 0.00 67 K 8.27 4.06 0.00 1.96 1.87 0.00 1.72 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.62 1.62 7.81 68 R 7.96 3.94 0.00 1.82 2.03 0.00 3.28 0.00 0.00 3.16 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.80 0.00 69 R 7.75 4.20 0.00 1.86 1.94 0.00 3.23 0.00 0.00 3.27 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.97 0.00 70 Q 7.40 4.77 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.98 0.00 0.00 0.00 0.00 0.00 2.40 2.19 0.00 71 N 8.04 4.77 0.00 2.76 2.86 0.00 0.00 6.79 7.23 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 72 A 7.80 4.33 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