NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3709 8.2649 123.5845 51.7009 20.6823 178.2052 3 P 4.1687 0.0000 0.0000 64.6936 31.5580 175.9346 4 T 4.0493 7.8776 111.9830 62.0249 70.1552 174.0838 5 L 4.1186 8.3599 127.2669 57.8152 42.5491 178.9436 6 T 3.9275 8.0096 109.1814 64.7542 68.4434 176.0016 7 A 4.0781 7.9771 122.8556 55.3385 18.6074 179.7771 8 R 4.0573 7.7625 116.3123 59.1131 30.1138 179.2855 9 L 3.7004 8.2330 119.4381 57.7889 41.5677 179.0021 10 Y 4.1953 8.1221 119.3283 60.7186 38.6116 177.6138 11 S 3.8479 8.3114 113.1190 61.3642 62.5853 175.6785 12 L 4.1972 7.6776 119.9743 56.3457 41.6717 177.7649 13 L 4.6053 7.4470 115.3974 55.0898 44.2425 177.4816 14 F 5.2102 7.8510 115.3210 59.1240 40.0604 176.8805 15 R 3.6987 7.6172 120.4621 59.0353 30.0227 177.2566 16 R 4.4695 7.6310 116.4307 55.2582 32.3022 177.6413 17 T 4.1404 8.4730 120.2006 66.5046 68.5696 177.1794 18 S 4.1596 8.0592 115.8569 61.9142 63.1431 176.5127 19 T 3.9090 7.9583 119.4509 66.0157 68.2125 175.9518 20 F 4.4939 8.9251 122.7389 61.5859 39.3513 177.1589 21 A 3.9013 8.5524 120.5251 54.9599 18.2367 179.2656 22 L 3.8929 8.4292 119.3420 58.7187 42.1975 179.2286 23 T 3.9450 8.4309 113.2381 64.8482 67.1281 176.4530 24 I 3.6016 7.4530 121.7362 64.1980 37.2599 178.5482 25 V 3.5517 7.8723 119.1227 65.9590 31.2320 178.0871 26 V 3.8442 7.9639 118.1982 66.1824 31.3932 178.1666 27 G 3.6983 8.3129 105.1140 47.8200 0.0000 175.4909 28 A 4.1772 8.2958 123.1677 54.5224 18.3085 179.3521 29 L 3.8428 7.9080 118.5967 58.6846 42.2416 179.4543 30 F 4.1871 8.2386 117.3243 60.0039 38.7826 177.7353 31 F 4.2106 8.4452 120.7837 61.2252 39.3312 176.7188 32 E 3.9708 8.3847 119.0763 59.2015 29.3722 178.7365 33 R 3.7837 7.7989 118.2593 59.5916 30.3288 178.5114 34 A 4.1045 7.8115 120.0750 54.7461 18.3086 179.5026 35 F 3.8857 8.2142 119.7507 61.5378 39.3495 177.3942 36 D 4.2249 7.8888 118.0419 57.0271 40.6419 178.4630 37 Q 4.0093 8.4944 120.7879 59.1467 28.9770 178.8439 38 G 3.3931 7.7231 105.6817 47.8929 0.0000 175.6667 39 A 3.7630 8.0209 124.3591 54.3190 18.1812 179.5826 40 D 4.2518 7.7360 117.4783 57.6135 41.0569 178.8121 41 A 4.1732 7.8208 120.7229 55.0435 18.2598 179.8963 42 I 3.6842 8.0894 118.8485 64.7682 37.0291 177.9651 43 Y 4.1115 7.6909 118.6194 60.7766 38.5104 177.6317 44 E 4.1275 8.8611 120.0712 59.6463 29.3673 178.8087 45 H 4.1824 7.9413 116.9998 59.0318 30.0392 176.7513 46 I 3.9420 7.8208 118.8902 61.8488 39.1221 175.6166 47 N 4.8099 6.9908 116.1362 51.0723 38.4299 173.5103 48 E 3.9813 8.3740 122.2994 58.7596 31.9789 177.3696 49 G 3.6270 8.0615 104.6858 45.0285 0.0000 173.9945 50 K 4.2501 9.4964 124.9823 56.8358 30.9277 176.0950 51 L 4.5640 7.3650 117.9202 54.2740 41.8834 177.3649 52 W 4.1220 8.8511 129.2945 60.2432 30.2792 178.1298 53 K 3.9016 8.2040 118.5533 59.3518 31.7210 177.4322 54 H 4.5935 8.0957 115.4337 57.4942 29.5070 177.2609 55 I 3.6001 7.5873 121.3654 63.5376 36.7937 177.9173 56 K 3.0602 7.1106 121.0775 59.6508 31.7114 178.0650 57 H 4.1640 7.4997 112.7103 58.0555 28.5744 177.1069 58 K 3.8313 7.3475 121.0437 57.3876 31.9362 176.6343 59 Y 4.8103 6.4186 116.6704 55.8507 40.0933 175.9738 60 E 4.3712 8.5989 122.9925 55.5982 32.1226 176.3863 61 N 4.5370 8.6047 115.6313 54.0592 38.7670 175.0544 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 A 8.26 4.37 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 P 0.00 4.17 0.00 2.14 2.13 0.00 3.69 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 4 T 7.88 4.05 4.25 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 1.23 0.00 0.00 5 L 8.36 4.12 0.00 1.76 1.64 0.92 0.69 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 6 T 8.01 3.93 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 7 A 7.98 4.08 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.76 4.06 0.00 1.81 1.95 0.00 3.27 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 9 L 8.23 3.70 0.00 1.89 1.42 0.96 0.21 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 10 Y 8.12 4.20 0.00 3.34 3.27 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 11 S 8.31 3.85 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 12 L 7.68 4.20 0.00 1.71 1.60 0.87 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.45 4.61 0.00 1.29 1.52 0.76 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 14 F 7.85 5.21 0.00 3.25 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 15 R 7.62 3.70 0.00 1.30 1.73 0.00 3.03 0.00 0.00 3.10 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.23 0.00 16 R 7.63 4.47 0.00 1.91 1.84 0.00 3.16 0.00 0.00 3.32 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 17 T 8.47 4.14 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 18 S 8.06 4.16 0.00 4.08 4.15 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 19 T 7.96 3.91 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 20 F 8.93 4.49 0.00 3.34 3.27 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 21 A 8.55 3.90 1.42 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 0.00 0.00 0.00 22 L 8.43 3.89 0.00 1.86 1.88 0.94 0.75 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 23 T 8.43 3.94 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 1.45 0.00 0.00 24 I 7.45 3.60 1.77 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.01 0.78 0.00 0.00 25 V 7.87 3.55 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 1.01 0.00 0.00 0.99 0.00 0.00 26 V 7.96 3.84 2.24 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 1.05 0.00 0.00 1.03 0.00 0.00 27 G 8.31 3.70 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 0.00 0.00 0.00 28 A 8.30 4.18 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.91 3.84 0.00 1.98 1.89 0.86 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 30 F 8.24 4.19 0.00 3.23 3.16 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 0.00 0.00 0.00 0.00 31 F 8.45 4.21 0.00 3.34 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 32 E 8.38 3.97 0.00 2.32 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 0.00 2.33 2.38 0.00 33 R 7.80 3.78 0.00 1.82 1.86 0.00 3.14 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 1.60 1.67 0.00 34 A 7.81 4.10 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 35 F 8.21 3.89 0.00 1.90 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.89 4.22 0.00 2.88 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 37 Q 8.49 4.01 0.00 2.18 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 38 G 7.72 3.39 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 0.00 39 A 8.02 3.76 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.74 4.25 0.00 2.70 2.87 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 0.00 0.00 0.00 41 A 7.82 4.17 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 42 I 8.09 3.68 1.87 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 1.63 0.90 0.94 0.00 0.00 43 Y 7.69 4.11 0.00 3.01 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 44 E 8.86 4.13 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 2.44 2.55 0.00 45 H 7.94 4.18 0.00 3.28 3.44 0.00 5.75 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.82 3.94 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 1.49 0.75 0.87 0.00 0.00 47 N 6.99 4.81 0.00 2.43 2.54 0.00 0.00 6.90 7.33 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 48 E 8.37 3.98 0.00 1.78 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 2.20 2.26 0.00 49 G 8.06 3.63 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 0.00 0.00 0.00 50 K 9.50 4.25 0.00 2.05 1.98 0.00 1.68 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.31 1.37 7.81 51 L 7.37 4.56 0.00 1.95 1.89 1.01 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 52 W 8.85 4.12 0.00 3.47 3.36 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 53 K 8.20 3.90 0.00 1.81 1.65 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.48 7.81 54 H 8.10 4.59 0.00 3.28 3.29 0.00 5.91 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 I 7.59 3.60 1.78 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.71 0.76 0.00 0.00 56 K 7.11 3.06 0.00 1.31 1.50 0.00 1.51 0.00 0.00 1.55 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.04 1.28 7.81 57 H 7.50 4.16 0.00 3.19 3.33 0.00 5.78 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 K 7.35 3.83 0.00 1.01 0.74 0.00 1.34 0.00 0.00 1.48 0.00 0.00 2.95 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.18 1.29 7.81 59 Y 6.42 4.81 0.00 2.94 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.60 4.37 0.00 2.09 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 2.32 2.36 0.00 61 N 8.60 4.54 0.00 2.74 2.77 0.00 0.00 6.62 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00