NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 K 4.3046 8.3149 119.9968 57.4423 34.5125 176.1521 7 M 4.5721 7.7694 115.6851 52.4724 32.0221 173.5002 8 P 4.4323 0.0000 0.0000 62.4051 33.8015 176.5430 9 Q 4.3722 8.2970 120.8571 55.4235 30.0326 175.4962 10 V 4.4701 7.9437 121.5927 59.9893 34.3900 174.0912 11 N 4.8314 8.7301 120.4162 51.4356 40.2619 174.1108 12 L 4.5723 8.0760 122.6334 52.7136 44.0299 176.1151 13 R 4.4450 8.4492 121.0806 54.4627 31.5914 174.4299 14 W 5.2956 8.3882 123.9729 53.3228 33.2217 174.2694 15 P 4.3661 0.0000 0.0000 62.7617 32.3140 177.2433 16 R 3.9250 8.8170 122.2935 60.0193 29.6264 178.3371 17 E 3.9327 8.2316 118.1134 59.1760 29.5936 178.7253 18 V 3.6911 7.6470 117.9452 65.4323 31.6679 177.6558 19 L 4.1685 8.1541 120.2050 58.4783 41.9569 178.7575 20 D 4.3691 8.3971 118.9043 57.1953 40.6487 178.6150 21 L 3.9677 7.6715 120.8487 58.0189 42.1102 179.1733 22 V 3.6705 8.0059 118.3434 65.9938 31.5024 178.2801 23 R 3.9292 8.3410 118.1117 58.9970 29.9174 178.6426 24 K 3.8609 8.2438 119.5958 60.0121 32.1102 179.2604 25 V 3.6951 8.0639 112.1209 64.1516 31.3935 178.4892 26 A 4.2768 8.0753 122.1352 54.6652 18.1818 179.5607 27 E 3.9884 8.3711 117.1731 59.4809 29.2915 179.3439 28 E 3.9874 7.8827 117.7803 59.4189 29.7052 178.4786 29 N 4.6963 8.3523 113.3734 52.6675 38.9162 175.2848 30 G 3.9233 7.9772 108.7071 46.4262 0.0000 173.4194 31 R 4.7068 8.2758 115.3704 52.8581 33.0547 175.0880 32 S 4.4072 8.2280 112.5455 58.0079 65.1050 175.1985 33 V 3.6322 8.2231 121.8688 65.9324 31.2990 177.7182 34 N 4.2749 8.0995 116.5299 56.9472 38.7725 176.9301 35 S 4.2036 8.0319 116.3079 61.2986 62.6663 176.1938 36 E 3.9737 8.2509 122.1055 59.5643 29.4317 179.0713 37 I 3.9284 8.0635 119.9100 64.3908 37.0636 177.7853 38 Y 4.0246 8.2169 120.4834 60.6792 38.6566 177.9256 39 Q 4.0443 8.5964 120.6810 59.4289 29.3091 178.5114 40 R 4.1900 8.0163 120.3088 58.7957 29.8870 179.3135 41 V 3.5346 7.7324 116.9179 66.2567 31.7446 177.7220 42 M 4.3282 8.1779 118.6268 58.3948 31.6810 178.6293 43 E 4.1260 8.3456 119.2211 59.2407 29.3983 179.2728 44 S 4.1192 7.6318 113.3611 61.4426 62.7543 176.3320 45 F 4.2969 7.5165 119.1340 59.6643 38.9398 175.4359 46 K 4.1840 8.0074 123.2455 56.6113 31.9973 176.1636 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 6 K 8.31 4.30 0.00 1.88 1.98 0.00 1.48 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.47 7.81 7 M 7.77 4.57 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.52 0.00 8 P 0.00 4.43 0.00 2.18 2.06 0.00 3.85 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 9 Q 8.30 4.37 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.73 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 10 V 7.94 4.47 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.94 0.00 0.00 11 N 8.73 4.83 0.00 2.68 2.73 0.00 0.00 6.90 7.85 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 12 L 8.08 4.57 0.00 0.83 0.60 0.28 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.45 4.45 0.00 1.73 1.87 0.00 3.21 0.00 0.00 3.25 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 14 W 8.39 5.30 0.00 3.31 2.90 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 15 P 0.00 4.37 0.00 2.17 2.00 0.00 3.64 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 2.08 2.17 0.00 16 R 8.82 3.93 0.00 1.95 1.98 0.00 3.26 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.93 0.00 17 E 8.23 3.93 0.00 2.09 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 2.38 2.38 0.00 18 V 7.65 3.69 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 0.83 0.00 0.00 0.87 0.00 0.00 19 L 8.15 4.17 0.00 1.98 1.89 0.90 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.40 4.37 0.00 2.82 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.67 3.97 0.00 1.94 1.92 0.93 0.75 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 22 V 8.01 3.67 2.39 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 1.08 0.00 0.00 1.23 0.00 0.00 23 R 8.34 3.93 0.00 2.06 1.98 0.00 3.34 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 1.66 1.79 0.00 24 K 8.24 3.86 0.00 1.83 2.09 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.51 7.81 25 V 8.06 3.70 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 0.75 0.00 0.00 1.07 0.00 0.00 26 A 8.08 4.28 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.37 3.99 0.00 2.30 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 2.33 2.36 0.00 28 E 7.88 3.99 0.00 2.17 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 2.35 2.50 0.00 29 N 8.35 4.70 0.00 2.85 2.87 0.00 0.00 7.06 8.51 0.00 0.00 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 G 7.98 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 31 R 8.28 4.71 0.00 1.83 1.90 0.00 3.10 0.00 0.00 3.30 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 32 S 8.23 4.41 0.00 4.06 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 33 V 8.22 3.63 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 1.06 0.00 0.00 0.94 0.00 0.00 34 N 8.10 4.27 0.00 2.85 2.78 0.00 0.00 7.25 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 35 S 8.03 4.20 0.00 3.96 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 36 E 8.25 3.97 0.00 2.23 2.14 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 2.36 2.46 0.00 37 I 8.06 3.93 1.95 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.70 1.06 0.00 0.00 38 Y 8.22 4.02 0.00 3.17 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 39 Q 8.60 4.04 0.00 2.41 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.41 2.61 0.00 40 R 8.02 4.19 0.00 1.96 1.98 0.00 3.25 0.00 0.00 3.22 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.53 0.00 41 V 7.73 3.53 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 0.89 0.00 0.00 1.05 0.00 0.00 42 M 8.18 4.33 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 43 E 8.35 4.13 0.00 2.20 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 2.34 2.33 0.00 44 S 7.63 4.12 0.00 3.82 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.52 4.30 0.00 3.12 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 46 K 8.01 4.18 0.00 1.80 1.86 0.00 1.85 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.41 7.81