NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0252 8.3549 109.7472 45.7371 0.0000 174.5130 2 R 4.5633 8.5352 120.3657 55.4333 34.7513 173.3840 3 R 4.2201 9.3310 118.4067 56.5325 30.0814 176.6175 4 R 4.5667 9.0389 127.4171 56.3268 32.5118 175.6431 5 R 4.7233 7.8431 114.2272 56.7270 30.1921 176.9321 6 S 5.0728 7.9151 111.1383 58.8596 64.4502 174.8376 7 V 3.9794 7.0856 114.3810 62.2773 35.0451 174.7689 8 Q 3.9463 7.2588 122.6949 53.1928 29.5469 174.4053 9 W 5.3535 7.9540 120.7443 56.9320 30.0043 177.8653 10 C 4.6121 10.0983 113.7056 57.8347 40.6249 174.9338 11 A 4.6454 8.4381 124.4198 52.4589 15.2993 177.8200 12 V 3.8086 7.8959 121.7117 62.9702 32.3228 177.9242 13 S 4.7582 8.0063 116.9503 56.8310 64.5352 174.5330 14 Q 4.0622 8.5395 123.8471 56.8732 28.8467 175.9978 15 P 4.4044 0.0000 0.0000 64.9091 31.6741 177.0980 16 E 4.4304 8.0449 116.0598 58.0175 30.6226 177.4207 17 A 4.1563 7.5617 121.2367 54.6532 18.3455 179.2836 18 T 3.8904 8.4725 107.4229 65.1005 68.6853 175.7402 19 K 4.2701 8.2649 122.4025 59.4091 31.8724 178.4453 20 C 4.6431 7.9840 113.6469 57.7518 41.8457 173.3081 21 F 4.5471 7.9758 121.1602 59.4212 41.5411 176.9976 22 Q 4.3424 9.4432 120.4379 58.1571 28.9295 177.6760 23 W 4.2404 8.8747 129.7458 60.9225 30.4495 177.9661 24 Q 3.2844 8.6032 116.1606 58.4867 28.2129 177.9533 25 R 4.1634 7.1750 118.0414 58.2153 30.5852 177.5278 26 N 4.5081 8.2850 116.5366 55.4069 38.5375 176.3594 27 M 4.1761 8.1018 119.0146 55.9313 31.9255 176.6364 28 R 4.1478 7.5308 114.6846 57.6615 30.7713 177.1438 29 K 4.3412 7.9438 115.8409 57.4023 35.0398 176.9152 30 V 3.7960 7.9849 111.3127 60.8858 31.4533 177.1467 31 R 3.9672 8.5795 121.6569 57.3506 31.3173 177.2041 32 G 4.0161 8.4989 107.7764 44.7412 0.0000 171.8499 33 P 4.5465 0.0000 0.0000 61.8196 32.2150 173.8528 34 P 4.9178 0.0000 0.0000 61.5777 31.8368 175.9801 35 V 4.1324 8.7677 123.1755 61.2003 31.8233 173.0636 36 S 4.6628 8.3459 119.5862 56.5941 61.5878 172.3683 37 C 5.0637 8.1422 121.8901 53.2200 40.1974 172.8970 38 I 4.6976 7.7797 118.5898 63.1561 41.9884 177.7982 39 K 4.4776 8.4108 116.5695 56.0444 33.0300 176.3450 40 R 4.8720 7.5297 116.5416 54.9696 31.7388 175.9724 41 D 4.4071 7.8991 118.6922 51.8048 39.4280 175.3759 42 S 4.1345 8.1834 115.9976 59.0363 63.3057 174.0144 43 P 4.3022 0.0000 0.0000 64.2726 30.2618 176.7625 44 I 4.3748 8.0371 117.8065 61.6560 36.8518 175.4425 45 Q 4.3586 7.2442 117.9608 57.3064 31.4553 177.7230 46 C 4.2789 7.9631 117.6264 58.7062 43.9076 173.7926 47 I 4.1877 6.9790 120.6794 59.4528 37.2297 174.9319 48 Q 4.3310 8.5338 127.5692 54.4412 29.1829 175.2340 49 A 4.2450 8.2657 127.5540 52.4148 19.3912 175.2246 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 G 8.35 4.03 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 0.00 0.00 0.00 2 R 8.54 4.56 0.00 1.84 1.90 0.00 3.20 0.00 0.00 3.24 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.73 0.00 3 R 9.33 4.22 0.00 1.79 1.54 0.00 3.31 0.00 0.00 3.23 7.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 4 R 9.04 4.57 0.00 1.73 1.77 0.00 3.25 0.00 0.00 3.35 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.46 0.00 5 R 7.84 4.72 0.00 2.04 2.09 0.00 3.11 0.00 0.00 3.28 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.73 0.00 6 S 7.92 5.07 0.00 3.91 3.85 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 7 V 7.09 3.98 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 0.60 0.00 0.00 0.91 0.00 0.00 8 Q 7.26 3.95 0.00 1.73 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.73 0.00 0.00 0.00 0.00 0.00 2.17 2.11 0.00 9 W 7.95 5.35 0.00 3.42 2.95 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 10 C 10.10 4.61 0.00 2.72 3.14 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 0.00 0.00 0.00 11 A 8.44 4.65 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 12 V 7.90 3.81 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 0.74 0.00 0.00 0.96 0.00 0.00 13 S 8.01 4.76 0.00 3.92 3.82 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 0.00 0.00 0.00 0.00 14 Q 8.54 4.06 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.84 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 15 P 0.00 4.40 0.00 2.02 2.14 0.00 3.60 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.20 0.00 16 E 8.04 4.43 0.00 2.03 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 2.30 2.35 0.00 17 A 7.56 4.16 1.33 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 0.00 0.00 0.00 18 T 8.47 3.89 4.50 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 19 K 8.26 4.27 0.00 2.10 1.87 0.00 1.73 0.00 0.00 1.84 0.00 0.00 3.07 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.50 1.63 7.81 20 C 7.98 4.64 0.00 3.28 3.21 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 21 F 7.98 4.55 0.00 3.44 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 9.44 4.34 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.54 0.00 0.00 0.00 0.00 0.00 2.38 2.65 0.00 23 W 8.87 4.24 0.00 3.34 3.44 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.60 3.28 0.00 2.36 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.92 0.00 0.00 0.00 0.00 0.00 3.03 2.55 0.00 25 R 7.17 4.16 0.00 2.12 2.00 0.00 3.36 0.00 0.00 3.29 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 26 N 8.28 4.51 0.00 2.75 2.75 0.00 0.00 6.76 7.25 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 27 M 8.10 4.18 0.00 0.92 0.57 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 2.28 0.00 28 R 7.53 4.15 0.00 1.86 1.92 0.00 3.05 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 29 K 7.94 4.34 0.00 1.82 1.90 0.00 1.52 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.37 7.81 30 V 7.98 3.80 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 0.69 0.00 0.00 0.88 0.00 0.00 31 R 8.58 3.97 0.00 1.53 1.74 0.00 3.18 0.00 0.00 3.36 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.04 0.00 32 G 8.50 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 33 P 0.00 4.55 0.00 2.41 2.20 0.00 3.89 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.18 0.00 34 P 0.00 4.92 0.00 2.27 2.19 0.00 3.82 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 35 V 8.77 4.13 0.96 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 0.51 0.00 0.00 0.68 0.00 0.00 36 S 8.35 4.66 0.00 3.91 3.82 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 0.00 0.00 0.00 0.00 37 C 8.14 5.06 0.00 3.07 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.78 4.70 1.88 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.67 1.07 0.00 0.00 39 K 8.41 4.48 0.00 1.99 1.99 0.00 1.02 0.00 0.00 2.27 0.00 0.00 2.62 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.34 7.81 40 R 7.53 4.87 0.00 1.79 1.98 0.00 3.28 0.00 0.00 3.47 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 41 D 7.90 4.41 0.00 1.88 1.54 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.18 4.13 0.00 3.99 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 43 P 0.00 4.30 0.00 2.13 2.11 0.00 3.66 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.96 0.00 44 I 8.04 4.37 1.84 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 1.27 0.62 0.89 0.00 0.00 45 Q 7.24 4.36 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.16 6.86 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 46 C 7.96 4.28 0.00 2.70 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 47 I 6.98 4.19 2.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.98 0.88 0.00 0.00 48 Q 8.53 4.33 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.84 0.00 0.00 0.00 0.00 0.00 2.27 2.39 0.00 49 A 8.27 4.25 1.17 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 0.00 0.00