NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 G 3.9571 8.3549 109.7344 45.2195 0.0000 174.2236 6 K 3.7838 8.7589 124.0371 56.8974 33.0922 173.5940 7 E 3.7285 8.8648 118.8575 57.4550 27.5410 172.8904 8 L 5.3037 7.2785 118.3773 53.2167 45.4421 177.8232 9 V 4.9668 8.8323 114.3455 59.6159 36.3718 174.1054 10 L 5.1062 8.8639 125.3175 53.2000 44.3534 175.3141 11 A 4.6443 8.9401 128.9861 52.2443 18.6834 178.0383 12 L 3.9671 9.0592 123.7889 56.6750 42.5418 176.8085 13 Y 4.8985 7.6809 113.7230 55.9003 42.1514 174.9555 14 D 4.8940 8.9621 121.1802 55.1897 42.0314 175.4199 15 Y 4.8503 9.1330 122.2564 56.1045 42.5233 173.3074 16 Q 4.7800 7.8230 127.7739 53.7730 30.5944 174.9658 17 E 4.2968 8.7447 125.2186 56.7914 29.9954 176.9541 18 K 4.5102 9.0322 119.6877 56.1929 33.9139 175.8383 19 S 4.6139 7.4286 112.4693 56.4174 64.9561 173.0367 20 P 4.4697 0.0000 0.0000 64.5027 31.5304 176.4763 21 D 4.7191 8.0759 118.5107 53.4209 39.7305 175.3017 22 E 5.5931 7.9078 119.1030 54.6124 32.0629 175.3607 23 V 4.6855 8.3542 112.8624 60.0367 35.4985 175.4570 24 T 4.9468 8.6265 119.5325 63.0168 69.7638 174.0612 25 M 5.0422 9.2309 122.1105 53.7664 35.5741 173.8471 26 K 5.1510 9.2930 118.7973 53.9769 35.5347 176.0485 27 K 3.9801 9.2912 124.7985 58.6310 32.3797 177.1380 28 G 4.0170 8.9084 114.8766 45.1011 0.0000 173.5392 29 D 4.5532 8.1722 120.1442 54.5908 42.2119 175.5746 30 I 4.8039 8.3369 122.5273 59.9088 38.8217 174.9836 31 L 4.9263 8.9566 127.5937 53.2567 45.0451 175.7171 32 T 4.7785 8.3917 118.1962 62.4676 70.1807 173.8589 33 L 4.4286 8.8004 129.7400 54.9616 42.2119 175.9472 34 L 4.4853 8.8428 126.4735 56.1709 43.7198 176.8828 35 N 4.6890 7.7890 118.1747 52.2779 41.9519 174.8491 36 S 4.0947 8.2071 121.6213 57.8431 63.3728 175.4398 37 T 4.0025 8.3091 114.0961 64.6263 68.8916 174.2555 38 N 4.8655 8.0719 120.2064 52.1699 39.9737 174.9640 39 K 4.3607 8.7573 123.4357 59.1086 33.4212 177.2318 40 D 4.5192 8.1664 118.5176 54.3065 43.4112 176.3448 41 W 5.2116 8.1364 117.1041 54.6197 32.3382 174.9453 42 W 5.4240 9.3807 124.8766 54.9341 31.7553 174.8505 43 K 4.6960 9.0637 125.4760 55.7042 33.2314 175.9302 44 V 5.0432 8.9402 119.7307 59.6592 36.9613 173.7049 45 E 5.2232 9.2563 123.0035 54.4289 32.6008 174.9631 46 V 4.4336 8.6344 126.1301 61.1382 34.0478 177.8438 47 N 4.0276 9.2462 125.9967 54.7226 37.5643 175.2139 48 D 4.9187 9.3240 120.1832 54.5760 41.8897 175.3509 49 R 4.7668 7.9982 119.6416 54.6177 33.2959 174.2406 50 Q 5.0091 8.9127 123.0964 53.7760 32.5746 175.0669 51 G 3.8108 7.8815 107.7431 46.5656 0.0000 171.4327 52 F 5.5055 8.4303 118.6271 57.0973 40.6810 175.9822 53 V 4.6338 8.9964 114.0568 58.7926 36.7065 173.3081 54 P 3.5190 0.0000 0.0000 61.7896 31.8196 177.8019 55 A 2.8595 7.9943 126.1043 54.7815 18.2122 179.5110 56 A 3.9618 7.3946 116.8068 54.5146 18.7547 177.4828 57 Y 4.6383 7.9638 112.8473 58.3394 38.4124 175.1396 58 V 5.0811 7.3422 112.1061 59.3361 36.1224 174.8295 59 K 4.6871 8.7697 122.5221 54.3552 35.3313 175.6042 60 K 4.5186 9.0611 126.8559 56.9210 32.8057 177.4223 61 L 4.4557 8.8025 126.2959 53.3834 40.9090 176.5874 62 D 4.8694 8.4024 121.7080 53.3901 39.7372 175.0061 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 5 G 8.35 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 0.00 0.00 0.00 6 K 8.76 3.78 0.00 1.84 1.88 0.00 1.91 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.52 7.81 7 E 8.86 3.73 0.00 2.14 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.43 0.00 8 L 7.28 5.30 0.00 1.59 1.57 0.93 0.85 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 9 V 8.83 4.97 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 0.93 0.00 0.00 1.11 0.00 0.00 10 L 8.86 5.11 0.00 1.74 1.52 0.97 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 11 A 8.94 4.64 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 12 L 9.06 3.97 0.00 1.38 1.11 0.87 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 13 Y 7.68 4.90 0.00 2.58 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 14 D 8.96 4.89 0.00 2.68 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 15 Y 9.13 4.85 0.00 3.14 2.85 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 0.00 0.00 0.00 16 Q 7.82 4.78 0.00 1.95 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.70 0.00 0.00 0.00 0.00 0.00 2.17 2.27 0.00 17 E 8.74 4.30 0.00 2.20 1.91 0.00 0.00 0.00 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 2.30 0.00 18 K 9.03 4.51 0.00 1.86 1.84 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.43 7.81 19 S 7.43 4.61 0.00 3.77 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 20 P 0.00 4.47 0.00 2.22 2.16 0.00 3.80 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 21 D 8.08 4.72 0.00 3.00 2.99 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 0.00 0.00 0.00 22 E 7.91 5.59 0.00 2.16 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 0.00 2.49 2.15 0.00 23 V 8.35 4.69 2.16 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 0.77 0.00 0.00 1.03 0.00 0.00 24 T 8.63 4.95 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 1.31 0.00 0.00 25 M 9.23 5.04 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.73 0.00 26 K 9.29 5.15 0.00 1.95 1.75 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.82 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.52 7.81 27 K 9.29 3.98 0.00 1.67 1.75 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.42 7.81 28 G 8.91 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 29 D 8.17 4.55 0.00 2.72 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.34 4.80 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.59 0.93 0.00 0.00 31 L 8.96 4.93 0.00 1.67 1.70 1.04 0.54 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 32 T 8.39 4.78 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 1.20 0.00 0.00 33 L 8.80 4.43 0.00 1.60 1.60 0.79 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.84 4.49 0.00 1.59 1.63 0.91 0.80 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 35 N 7.79 4.69 0.00 2.69 2.63 0.00 0.00 6.74 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 36 S 8.21 4.09 0.00 2.72 2.63 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 0.00 0.00 0.00 0.00 37 T 8.31 4.00 4.27 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 1.24 0.00 0.00 38 N 8.07 4.87 0.00 2.85 3.25 0.00 0.00 7.01 6.68 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 39 K 8.76 4.36 0.00 1.97 2.01 0.00 1.60 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.45 7.81 40 D 8.17 4.52 0.00 2.62 2.35 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 41 W 8.14 5.21 0.00 2.97 2.98 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 42 W 9.38 5.42 0.00 3.31 3.03 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 0.00 0.00 0.00 43 K 9.06 4.70 0.00 1.55 1.56 0.00 1.19 0.00 0.00 1.47 0.00 0.00 2.64 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.16 0.80 7.81 44 V 8.94 5.04 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 0.88 0.00 0.00 1.08 0.00 0.00 45 E 9.26 5.22 0.00 1.96 1.75 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 2.22 2.21 0.00 46 V 8.63 4.43 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 0.73 0.00 0.00 0.97 0.00 0.00 47 N 9.25 4.03 0.00 2.87 2.35 0.00 0.00 7.05 8.06 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 48 D 9.32 4.92 0.00 2.65 2.65 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 49 R 8.00 4.77 0.00 1.88 1.73 0.00 3.05 0.00 0.00 3.20 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 50 Q 8.91 5.01 0.00 1.87 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.80 0.00 0.00 0.00 0.00 0.00 2.21 2.30 0.00 51 G 7.88 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 0.00 0.00 0.00 52 F 8.43 5.51 0.00 3.01 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 53 V 9.00 4.63 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 0.81 0.00 0.00 1.03 0.00 0.00 54 P 0.00 3.52 0.00 1.37 0.93 0.00 2.39 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.75 0.00 55 A 7.99 2.86 0.01 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 0.00 0.00 0.00 0.00 0.00 56 A 7.39 3.96 1.21 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 0.00 0.00 0.00 57 Y 7.96 4.64 0.00 2.96 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 V 7.34 5.08 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 0.72 0.00 0.00 1.01 0.00 0.00 59 K 8.77 4.69 0.00 1.79 1.61 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.41 7.81 60 K 9.06 4.52 0.00 1.79 1.80 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.42 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.54 1.80 7.81 61 L 8.80 4.46 0.00 1.64 1.65 0.94 1.24 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 62 D 8.40 4.87 0.00 2.95 2.85 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 0.00 0.00 0.00