NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5846 8.3049 120.3672 56.1582 32.8535 171.8418 2 I 2.8460 7.6857 126.8844 59.1821 38.0621 169.3777 3 V 3.3271 8.5314 124.5209 61.9980 32.9210 173.7316 4 P 4.2832 0.0000 0.0000 61.5829 31.1806 176.6952 5 V 3.6560 8.1460 123.8094 63.6835 32.1736 173.2793 6 R 3.7492 8.4662 127.8925 56.0902 29.8122 175.4317 7 C 3.9886 8.2815 121.1078 58.4714 31.7264 172.9824 8 F 4.1745 7.7033 124.1505 61.0782 38.3168 176.7688 9 S 4.0077 8.0840 118.3445 63.0971 63.7381 175.5459 10 C 4.3036 8.0227 117.2049 57.6075 42.0129 174.9592 11 G 3.7704 7.9080 107.0661 44.5827 0.0000 173.9702 12 K 3.9222 7.9737 121.5077 56.0174 32.7381 176.0224 13 V 3.8726 8.1502 125.1420 64.1576 31.6917 176.3274 14 V 4.3870 8.0654 120.5103 63.6514 34.6059 175.4558 15 G 3.6822 8.0664 107.9814 48.3889 0.0000 174.9320 16 D 4.5390 8.1830 119.6966 56.1973 40.1853 178.7103 17 K 4.0650 7.4813 116.6395 57.6284 32.1462 178.3329 18 W 4.7182 9.1649 130.8664 59.8317 30.5489 177.5871 19 E 3.7294 8.3579 117.3871 59.6944 29.3016 179.3903 20 S 4.0765 8.1937 114.3471 61.9875 62.6964 176.1387 21 Y 3.9087 7.5390 119.8901 60.7872 38.6567 177.1918 22 L 3.5046 8.1516 121.4831 58.3168 41.7634 178.9271 23 N 4.3129 8.3995 116.5623 56.0065 38.3344 177.0351 24 L 4.0528 7.4479 117.4985 56.0089 41.3725 177.9643 25 L 4.2287 7.6569 119.0059 56.3099 42.8669 178.4514 26 Q 3.8846 7.2292 116.8024 59.1171 29.5027 176.6861 27 E 3.9259 7.7098 118.1243 58.1610 29.2292 177.8992 28 D 4.1689 8.8425 119.6731 56.7130 41.5450 178.5155 29 E 3.7655 7.9835 112.9808 57.6891 25.6697 174.4284 30 L 4.8427 7.8468 125.5543 52.6369 46.0741 175.3665 31 D 4.9357 7.9940 117.9751 52.3592 41.7764 175.9375 32 E 3.3414 9.0061 115.4090 57.6773 30.3249 180.9510 33 G 3.9374 8.2730 110.6719 47.8118 0.0000 175.7562 34 T 3.9868 8.1509 118.1592 66.1602 68.5078 176.7433 35 A 3.9736 7.8346 121.5399 55.6464 18.5511 179.0871 36 L 4.1007 8.2307 116.4162 58.4866 41.6156 179.6253 37 S 4.1201 7.8484 113.9352 62.1509 62.6233 177.1848 38 R 3.9778 7.7183 120.1485 59.0273 29.9652 177.9389 39 L 4.2539 8.0848 117.5208 55.6816 41.8467 177.8962 40 G 3.9209 7.7003 107.3637 44.8663 0.0000 173.8389 41 L 4.2161 7.6345 119.6216 54.4047 41.0524 176.1655 42 K 4.3263 8.6709 123.6535 57.6692 33.8563 177.2495 43 R 4.6939 7.7204 116.4538 53.9966 31.1304 176.4473 44 Y 4.2800 9.4225 120.4415 60.4557 37.4054 177.9773 45 C 3.9646 7.7147 114.6264 61.6504 29.6066 175.5260 46 C 4.6050 7.9784 116.4718 56.5556 34.8519 175.3371 47 R 4.2153 7.6669 120.9008 58.9160 29.8391 178.4491 48 R 3.9761 8.5545 115.4888 59.4077 29.1920 177.7817 49 M 4.0539 8.0807 118.5305 58.8526 32.0648 178.0214 50 I 3.7986 7.4731 119.3742 64.1648 37.3312 178.0234 51 L 3.9777 7.7663 119.5389 57.7791 41.7883 177.7309 52 T 4.4794 7.4282 112.6529 64.6436 70.4253 174.0790 53 H 3.7862 6.9246 116.6153 56.4530 30.0521 173.8690 54 V 4.1893 8.2848 126.5422 61.0686 32.5763 176.7906 55 D 4.7933 8.4034 132.2973 53.3444 40.1087 177.5227 56 L 3.7268 8.2562 121.4167 58.1889 41.6680 178.8399 57 I 4.2608 8.1218 117.8905 64.7086 37.7176 177.0548 58 E 3.8612 8.0888 117.8644 59.5447 29.3928 179.3736 59 K 4.0549 8.7540 119.3504 59.1769 31.8956 179.3322 60 F 4.6461 7.6835 116.5206 60.9197 39.3934 176.8920 61 L 4.2669 9.1236 119.6150 58.1265 41.2237 179.3624 62 R 4.0803 7.4284 113.5462 55.7956 29.9936 175.2742 63 Y 4.5357 8.2412 120.1388 58.0185 36.0359 176.1116 64 N 4.9254 9.0072 125.4372 53.8732 41.8961 171.2922 65 P 4.4926 0.0000 0.0000 62.9162 31.7336 176.3774 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 8.30 4.58 0.00 2.05 2.32 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.58 0.00 2 I 7.69 2.85 1.81 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.15 0.81 0.00 0.00 3 V 8.53 3.33 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 0.75 0.00 0.00 0.21 0.00 0.00 4 P 0.00 4.28 0.00 1.75 1.63 0.00 3.54 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.86 0.00 5 V 8.15 3.66 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 0.77 0.00 0.00 0.89 0.00 0.00 6 R 8.47 3.75 0.00 1.91 2.03 0.00 3.24 0.00 0.00 3.14 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 7 C 8.28 3.99 0.00 2.87 2.77 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 8 F 7.70 4.17 0.00 3.08 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 9 S 8.08 4.01 0.00 3.93 3.93 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 10 C 8.02 4.30 0.00 3.08 3.22 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 11 G 7.91 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 0.00 0.00 0.00 12 K 7.97 3.92 0.00 1.79 1.68 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.43 7.81 13 V 8.15 3.87 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 0.81 0.00 0.00 0.92 0.00 0.00 14 V 8.07 4.39 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 0.81 0.00 0.00 0.93 0.00 0.00 15 G 8.07 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 0.00 0.00 0.00 16 D 8.18 4.54 0.00 2.96 2.96 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 17 K 7.48 4.06 0.00 1.96 1.97 0.00 1.58 0.00 0.00 1.60 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.56 7.81 18 W 9.16 4.72 0.00 3.29 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 19 E 8.36 3.73 0.00 2.07 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 2.56 2.58 0.00 20 S 8.19 4.08 0.00 3.91 3.95 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.54 3.91 0.00 2.87 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 22 L 8.15 3.50 0.00 0.82 1.37 0.61 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 23 N 8.40 4.31 0.00 2.92 2.75 0.00 0.00 6.95 6.66 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 24 L 7.45 4.05 0.00 1.58 1.57 0.90 0.52 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 25 L 7.66 4.23 0.00 1.59 1.46 0.67 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 7.23 3.88 0.00 1.97 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 7.04 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 27 E 7.71 3.93 0.00 2.13 1.71 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 2.35 2.28 0.00 28 D 8.84 4.17 0.00 2.57 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 29 E 7.98 3.77 0.00 1.95 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 2.24 2.54 0.00 30 L 7.85 4.84 0.00 1.74 1.50 0.88 0.92 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 31 D 7.99 4.94 0.00 2.79 2.75 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 0.00 0.00 0.00 32 E 9.01 3.34 0.00 2.15 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.63 0.00 33 G 8.27 3.94 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 0.00 0.00 0.00 34 T 8.15 3.99 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 35 A 7.83 3.97 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 36 L 8.23 4.10 0.00 1.90 1.78 0.96 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.85 4.12 0.00 4.16 3.97 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 38 R 7.72 3.98 0.00 1.85 2.16 0.00 3.25 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 39 L 8.08 4.25 0.00 1.86 1.76 1.17 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 40 G 7.70 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.63 4.22 0.00 1.68 1.68 0.94 0.89 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 42 K 8.67 4.33 0.00 1.88 1.95 0.00 1.58 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.45 7.81 43 R 7.72 4.69 0.00 2.15 2.19 0.00 3.02 0.00 0.00 3.42 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 44 Y 9.42 4.28 0.00 3.20 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 45 C 7.71 3.96 0.00 3.00 2.91 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 0.00 0.00 0.00 46 C 7.98 4.61 0.00 2.96 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 47 R 7.67 4.22 0.00 2.14 2.05 0.00 3.21 0.00 0.00 3.29 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 48 R 8.55 3.98 0.00 1.98 2.15 0.00 3.23 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 2.02 0.00 49 M 8.08 4.05 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 50 I 7.47 3.80 1.65 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 1.34 0.66 0.44 0.00 0.00 51 L 7.77 3.98 0.00 1.62 1.76 1.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 52 T 7.43 4.48 4.33 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 1.26 0.00 0.00 53 H 6.92 3.79 0.00 3.02 3.08 0.00 5.75 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 8.28 4.19 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 0.87 0.00 0.00 1.05 0.00 0.00 55 D 8.40 4.79 0.00 2.72 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.26 3.73 0.00 1.85 1.07 0.98 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 57 I 8.12 4.26 2.04 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.50 1.08 0.00 0.00 58 E 8.09 3.86 0.00 2.17 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 2.64 2.61 0.00 59 K 8.75 4.05 0.00 1.38 1.68 0.00 1.60 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.42 7.81 60 F 7.68 4.65 0.00 3.27 3.12 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 0.00 0.00 0.00 61 L 9.12 4.27 0.00 1.87 1.81 1.00 0.86 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 62 R 7.43 4.08 0.00 1.85 1.80 0.00 3.19 0.00 0.00 3.10 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 63 Y 8.24 4.54 0.00 3.22 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 0.00 0.00 0.00 64 N 9.01 4.93 0.00 2.68 2.60 0.00 0.00 6.83 7.69 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 65 P 0.00 4.49 0.00 2.23 2.03 0.00 3.90 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00