NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.5602 0.0000 0.0000 62.9146 32.1601 174.3824 3 R 4.3475 8.4735 127.5239 54.2708 31.7176 172.7417 4 L 4.7637 9.5403 129.2911 53.4523 44.7319 174.5820 5 K 4.4949 9.1234 129.1945 55.2691 32.9444 174.6789 6 V 4.4751 8.9939 129.0718 61.0572 33.5983 174.2811 7 K 5.0689 8.3854 129.0196 54.2084 34.7278 174.7296 8 L 4.2614 8.5951 131.1870 55.5341 42.2969 177.4197 9 V 4.2924 8.5722 118.9446 61.3405 34.2806 175.7462 10 K 4.4535 7.9090 119.9649 54.3277 33.1133 175.0940 11 S 4.5536 8.1946 117.7545 56.7227 63.7540 174.1532 12 P 4.1586 0.0000 0.0000 65.1183 31.4094 174.5247 13 I 3.6887 6.8564 117.7951 65.5044 36.5114 175.3155 14 G 4.0212 8.8659 112.6493 45.3675 0.0000 171.9171 15 Y 4.5987 8.6123 117.7997 55.2189 40.3444 174.3201 16 P 4.3187 0.0000 0.0000 62.9568 33.2903 177.4262 17 K 3.8777 8.8258 121.1010 59.9304 32.0467 178.6785 18 D 4.3894 8.2339 118.4197 57.0198 38.9440 178.4477 19 Q 4.0088 7.9497 119.7378 58.4046 28.7696 179.5992 20 K 3.9280 7.9767 118.4154 59.4394 32.0127 179.1800 21 A 3.9825 8.3917 121.2113 55.2144 18.2911 179.1077 22 A 3.9713 8.4608 119.5511 55.4251 18.4536 179.4784 23 L 3.9041 8.2124 116.4800 58.1660 41.5682 180.0415 24 K 3.8792 8.3186 117.3125 59.5555 32.1092 178.9288 25 A 4.0676 8.4435 120.5131 55.7111 18.5540 179.0323 26 L 3.8644 7.9448 114.2852 55.5152 41.5067 178.1085 27 G 5.0543 7.5167 124.1472 46.8801 0.0000 172.4075 28 L 4.3567 7.5494 121.8328 53.5710 40.8543 176.3213 29 R 4.3628 8.4698 122.8999 56.7951 31.6345 177.4187 30 R 4.6080 7.6666 114.5226 54.0115 32.5140 175.7027 31 L 4.1027 8.0454 121.8676 55.9481 42.8481 178.0621 32 Q 3.8617 8.9722 123.7354 56.4861 29.9773 173.7832 33 Q 4.2020 7.7133 118.9602 56.6238 30.2132 174.8607 34 E 5.1616 8.6298 123.2013 54.6803 32.9634 175.7474 35 R 4.4538 9.6698 124.2270 55.1664 33.4551 173.9757 36 V 4.6446 8.4403 120.5283 60.6328 32.6803 175.6512 37 L 4.9097 10.0471 124.4595 52.4464 46.3852 175.7106 38 E 4.0868 8.7727 121.5073 56.2030 30.4559 175.5148 39 D 4.7821 8.4325 123.3585 54.2999 41.7940 176.6346 40 T 4.0558 7.7674 107.3894 60.5228 69.3924 172.7258 41 P 4.1140 0.0000 0.0000 65.8779 31.0514 177.8290 42 A 4.0791 7.2576 119.8123 53.7743 19.0470 179.7422 43 I 3.5564 7.5210 114.0397 63.7987 37.6359 177.7969 44 R 3.9471 8.0294 119.2190 59.7576 29.6775 178.4561 45 G 3.8281 7.9226 103.8148 48.0078 0.0000 175.0374 46 N 4.4947 8.1444 118.4270 56.1603 38.2041 177.5829 47 V 3.5835 8.2765 119.9276 66.2549 31.4443 177.6915 48 E 3.8074 9.0449 118.3376 58.2322 29.0879 179.1387 49 K 4.0052 8.1044 120.1922 58.9512 32.4763 178.4599 50 V 4.3556 7.0987 110.5209 61.0044 31.9635 177.6190 51 A 3.7637 8.0786 123.3915 54.6673 18.2282 178.7333 52 H 4.7282 8.3063 109.2173 55.6728 29.6423 175.5525 53 L 4.4618 8.5198 120.4449 54.3160 42.3694 175.3511 54 V 4.8286 7.3150 117.4462 61.2481 35.6324 174.8059 55 R 4.5097 8.6582 121.3152 54.4874 32.8447 174.9023 56 V 4.5733 8.3484 123.9883 61.6688 33.3142 174.5371 57 E 4.7702 8.8342 125.8451 54.7778 33.5589 173.7359 58 V 4.6486 8.2653 123.7343 61.7818 33.9612 175.3357 59 V 4.3831 8.2482 124.9680 62.3985 35.0839 174.1723 60 E 4.2556 8.7363 117.2326 56.6983 29.7692 175.5207 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 4.56 0.00 2.09 2.18 0.00 3.71 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.97 0.00 3 R 8.47 4.35 0.00 1.87 1.90 0.00 3.06 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.77 0.00 4 L 9.54 4.76 0.00 1.76 1.50 0.96 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 5 K 9.12 4.49 0.00 1.84 1.83 0.00 1.66 0.00 0.00 1.83 0.00 0.00 2.87 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.36 1.36 7.81 6 V 8.99 4.48 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 0.85 0.00 0.00 0.99 0.00 0.00 7 K 8.39 5.07 0.00 1.81 1.61 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.29 1.60 7.81 8 L 8.60 4.26 0.00 1.73 1.51 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 9 V 8.57 4.29 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 0.78 0.00 0.00 0.90 0.00 0.00 10 K 7.91 4.45 0.00 1.65 1.54 0.00 1.80 0.00 0.00 1.68 0.00 0.00 3.18 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.38 7.81 11 S 8.19 4.55 0.00 3.97 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 12 P 0.00 4.16 0.00 2.23 2.25 0.00 3.72 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 13 I 6.86 3.69 1.93 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 1.26 0.83 0.94 0.00 0.00 14 G 8.87 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 0.00 0.00 0.00 15 Y 8.61 4.60 0.00 2.98 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 16 P 0.00 4.32 0.00 2.25 2.06 0.00 3.81 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.23 0.00 17 K 8.83 3.88 0.00 1.77 1.90 0.00 1.72 0.00 0.00 1.89 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.56 1.48 7.81 18 D 8.23 4.39 0.00 2.88 2.97 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 0.00 0.00 0.00 0.00 19 Q 7.95 4.01 0.00 2.30 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.83 0.00 0.00 0.00 0.00 0.00 2.46 2.52 0.00 20 K 7.98 3.93 0.00 2.02 1.87 0.00 1.71 0.00 0.00 1.68 0.00 0.00 3.31 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.51 7.81 21 A 8.39 3.98 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.46 3.97 1.36 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 0.00 0.00 23 L 8.21 3.90 0.00 1.86 1.73 0.89 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.32 3.88 0.00 1.86 1.88 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.16 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.50 7.81 25 A 8.44 4.07 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 26 L 7.94 3.86 0.00 1.78 1.56 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 27 G 7.52 5.05 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 0.00 0.00 0.00 0.00 0.00 0.00 28 L 7.55 4.36 0.00 1.76 1.64 0.89 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 29 R 8.47 4.36 0.00 1.77 1.95 0.00 3.18 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 1.54 1.61 0.00 30 R 7.67 4.61 0.00 1.77 1.82 0.00 3.20 0.00 0.00 3.15 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 31 L 8.05 4.10 0.00 1.71 1.51 0.92 0.56 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 32 Q 8.97 3.86 0.00 2.17 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.64 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 33 Q 7.71 4.20 0.00 2.17 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.51 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 34 E 8.63 5.16 0.00 1.84 1.80 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 2.18 2.42 0.00 35 R 9.67 4.45 0.00 1.72 1.82 0.00 3.12 0.00 0.00 3.16 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 36 V 8.44 4.64 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 0.75 0.00 0.00 0.93 0.00 0.00 37 L 10.05 4.91 0.00 1.54 1.48 0.91 0.62 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 38 E 8.77 4.09 0.00 1.95 1.85 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 2.29 2.37 0.00 39 D 8.43 4.78 0.00 2.65 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 40 T 7.77 4.06 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 41 P 0.00 4.11 0.00 2.19 2.16 0.00 3.60 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 42 A 7.26 4.08 1.27 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 0.00 0.00 0.00 0.00 0.00 0.00 43 I 7.52 3.56 1.94 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 1.52 1.03 0.91 0.00 0.00 44 R 8.03 3.95 0.00 2.04 2.08 0.00 3.12 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.67 0.00 45 G 7.92 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 0.00 0.00 0.00 46 N 8.14 4.49 0.00 2.92 2.87 0.00 0.00 6.63 7.42 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 47 V 8.28 3.58 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 1.02 0.00 0.00 0.98 0.00 0.00 48 E 9.04 3.81 0.00 2.12 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 2.55 0.00 49 K 8.10 4.01 0.00 1.87 2.05 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.49 7.81 50 V 7.10 4.36 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 0.81 0.00 0.00 1.00 0.00 0.00 51 A 8.08 3.76 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 H 8.31 4.73 0.00 3.29 3.42 0.00 5.49 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 L 8.52 4.46 0.00 1.42 1.40 0.56 -1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.32 4.83 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 0.84 0.00 0.00 0.95 0.00 0.00 55 R 8.66 4.51 0.00 1.76 1.79 0.00 3.15 0.00 0.00 3.08 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.52 0.00 56 V 8.35 4.57 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 0.75 0.00 0.00 0.92 0.00 0.00 57 E 8.83 4.77 0.00 2.05 1.69 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 2.19 2.24 0.00 58 V 8.27 4.65 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 0.83 0.00 0.00 0.93 0.00 0.00 59 V 8.25 4.38 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 0.94 0.00 0.00 60 E 8.74 4.26 0.00 2.10 1.90 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 2.19 2.22 0.00