NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 4.2917 8.0093 121.4506 60.8910 39.5986 174.4208 2 P 4.5071 0.0000 0.0000 62.4002 31.8430 177.7159 3 L 4.8959 9.0973 120.7958 53.0054 44.3144 177.3689 4 A 4.3293 8.5871 119.8680 53.2902 19.3079 176.8517 5 R 4.4906 8.3114 123.5312 54.4524 31.6940 175.5177 6 T 4.0655 8.3877 120.2913 61.9774 67.9804 173.3020 7 V 4.6580 8.0808 127.1566 61.1740 35.5024 174.7084 8 R 4.5244 9.0684 124.1713 54.9410 31.8825 173.4026 9 C 5.1075 8.5758 122.3753 55.0929 44.0265 174.5851 10 N 4.3742 9.3120 118.5246 56.3653 38.3354 175.6860 11 C 4.6209 7.9729 114.4681 56.2608 41.2078 172.5828 12 I 4.1780 8.4425 124.0245 62.8369 38.6270 175.5517 13 H 4.8808 7.7657 115.2843 54.1428 30.2495 174.4447 14 I 4.5115 8.0236 123.5200 59.2140 38.8258 175.2530 15 D 4.4150 9.1995 126.5538 54.3689 41.1988 174.3145 16 D 4.4896 7.8280 124.7773 55.0690 42.5853 176.0999 17 G 3.9353 7.6677 113.6820 44.3254 0.0000 171.7036 18 P 4.5671 0.0000 0.0000 63.6295 32.6584 174.5843 19 V 4.2318 7.6307 108.9152 62.2509 35.7498 171.5394 20 R 4.6674 8.0758 119.5360 55.7422 33.1752 176.5703 21 M 3.8764 8.8331 120.7607 58.7283 32.2240 178.8851 22 R 3.8693 8.2949 117.0948 59.5143 30.2971 177.1422 23 A 4.1656 7.9338 119.6618 54.4524 18.8215 177.6282 24 I 4.0913 7.3499 117.4577 61.1667 36.7893 175.5186 25 G 3.7902 8.6273 116.3807 46.6940 0.0000 173.0687 26 K 4.8472 7.9201 117.5607 53.4212 36.6109 174.4567 27 L 4.8290 8.4952 124.6513 53.4220 44.2005 175.1765 28 E 4.6150 9.2869 126.9063 54.8950 31.5060 174.9147 29 I 4.7803 8.3334 125.7620 59.7015 39.3431 175.4790 30 I 4.4547 8.9879 127.5200 58.6717 39.6761 173.4645 31 P 4.6513 0.0000 0.0000 62.4520 32.0392 176.4035 32 A 4.6017 8.8720 123.8896 52.0222 19.0176 176.9166 33 S 4.7530 8.5324 115.5800 56.0614 66.3413 173.7750 34 L 4.1014 8.4990 120.9643 58.4285 42.0744 178.4281 35 S 4.2622 8.0525 114.3534 60.6819 63.2377 173.4875 36 C 4.9165 8.1071 120.0966 53.5416 43.9264 173.3625 37 P 4.7899 0.0000 0.0000 61.0323 29.8602 176.5809 38 R 4.4809 7.1471 111.9307 56.4194 32.5018 174.6026 39 V 4.1715 8.4911 120.8398 62.7864 32.6872 174.8031 40 E 4.7462 9.0335 126.7271 54.5966 32.4941 175.0031 41 I 4.8627 8.3642 124.0800 59.7828 40.5418 174.4093 42 I 4.8511 9.0949 129.2744 59.4987 39.3971 174.8231 43 A 5.0681 8.9564 129.7830 50.7037 21.6276 175.8722 44 T 4.8337 8.5780 118.3689 61.9254 70.5790 173.8276 45 M 4.5712 9.1458 128.3138 54.7931 32.5371 177.8135 46 K 3.7478 8.6638 125.8278 58.8429 33.0841 177.4885 47 K 4.1051 8.1027 121.0576 56.9781 30.2204 175.8394 48 N 4.3113 8.8982 117.6445 52.7332 36.5067 174.1245 49 D 5.0390 7.8304 114.8059 54.3476 38.4767 173.8244 50 E 4.1752 7.9303 120.0334 56.2019 30.9622 175.8055 51 Q 5.0204 8.6885 126.7533 55.2243 30.1034 175.5034 52 R 4.6727 9.0797 120.2641 54.5959 33.0804 173.5354 53 C 4.9899 8.8554 120.4454 56.4665 41.6901 172.8212 54 L 4.9543 9.0452 123.5168 52.8500 44.7374 175.5235 55 N 4.6916 8.4278 118.9523 51.6626 39.2048 174.0297 56 P 4.3251 0.0000 0.0000 65.3397 31.7282 177.0564 57 E 4.0699 8.2347 118.5848 57.4853 29.9954 176.9232 58 S 4.3079 7.8321 114.3579 58.0404 63.5862 173.7132 59 K 3.8129 8.8223 129.2873 60.3166 31.9137 178.7832 60 T 3.8611 7.9464 114.7335 67.0702 68.4161 176.0855 61 I 3.6956 7.8696 120.7163 64.6445 37.2403 178.3605 62 K 3.9677 8.3433 119.2668 59.4644 31.6563 179.0305 63 N 4.2838 8.1407 115.7972 56.2728 38.6139 176.6969 64 L 4.0815 8.1028 120.5085 59.1882 42.2524 177.9112 65 M 4.0505 8.2794 116.1981 58.6379 32.7935 177.3000 66 K 4.0557 8.1460 126.0032 57.1075 30.4863 177.3580 67 A 4.0640 8.2462 124.9809 52.4552 18.5943 177.4445 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 I 8.01 4.29 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.06 0.91 0.00 0.00 2 P 0.00 4.51 0.00 2.22 1.39 0.00 3.70 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 1.88 2.02 0.00 3 L 9.10 4.90 0.00 1.64 1.40 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 4 A 8.59 4.33 1.25 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 0.00 0.00 0.00 5 R 8.31 4.49 0.00 1.76 1.82 0.00 3.24 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 6 T 8.39 4.07 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 1.21 0.00 0.00 7 V 8.08 4.66 2.07 0.00 0.00 0.00 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 0.96 0.00 0.00 8 R 9.07 4.52 0.00 1.77 1.77 0.00 3.41 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 1.52 1.72 0.00 9 C 8.58 5.11 0.00 2.93 3.28 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 0.00 10 N 9.31 4.37 0.00 2.82 2.87 0.00 0.00 6.97 7.82 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 11 C 7.97 4.62 0.00 3.20 3.01 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 12 I 8.44 4.18 1.66 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.52 0.64 0.00 0.00 13 H 7.77 4.88 0.00 3.15 3.19 0.00 5.65 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 I 8.02 4.51 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.60 0.90 0.00 0.00 15 D 9.20 4.42 0.00 2.60 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 16 D 7.83 4.49 0.00 2.61 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.67 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 18 P 0.00 4.57 0.00 2.19 2.12 0.00 3.80 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 19 V 7.63 4.23 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 0.60 0.00 0.00 0.93 0.00 0.00 20 R 8.08 4.67 0.00 1.82 1.70 0.00 3.27 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 21 M 8.83 3.88 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.58 0.00 22 R 8.29 3.87 0.00 1.76 2.00 0.00 3.23 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 23 A 7.93 4.17 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.35 4.09 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.58 0.93 0.00 0.00 25 G 8.63 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 7.92 4.85 0.00 1.68 1.67 0.00 1.62 0.00 0.00 1.74 0.00 0.00 2.76 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.39 7.81 27 L 8.50 4.83 0.00 1.60 1.53 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 28 E 9.29 4.61 0.00 2.03 1.85 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 2.23 2.25 0.00 29 I 8.33 4.78 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.54 0.91 0.00 0.00 30 I 8.99 4.45 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.74 0.91 0.00 0.00 31 P 0.00 4.65 0.00 1.93 2.00 0.00 3.69 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 32 A 8.87 4.60 1.25 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 0.00 0.00 0.00 33 S 8.53 4.75 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 34 L 8.50 4.10 0.00 1.60 1.73 0.92 0.89 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 35 S 8.05 4.26 0.00 3.92 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 C 8.11 4.92 0.00 3.13 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 37 P 0.00 4.79 0.00 2.21 2.11 0.00 3.85 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 38 R 7.15 4.48 0.00 1.84 2.00 0.00 2.95 0.00 0.00 3.26 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.53 0.00 39 V 8.49 4.17 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 0.83 0.00 0.00 0.95 0.00 0.00 40 E 9.03 4.75 0.00 1.93 1.81 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 2.22 2.25 0.00 41 I 8.36 4.86 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.91 0.91 0.00 0.00 42 I 9.09 4.85 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.64 0.91 0.00 0.00 43 A 8.96 5.07 1.22 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 0.00 0.00 44 T 8.58 4.83 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 1.21 0.00 0.00 45 M 9.15 4.57 0.00 1.89 1.99 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.78 0.00 46 K 8.66 3.75 0.00 1.90 1.86 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.45 7.81 47 K 8.10 4.11 0.00 1.83 1.70 0.00 1.89 0.00 0.00 1.82 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.46 7.81 48 N 8.90 4.31 0.00 2.92 2.92 0.00 0.00 7.25 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 49 D 7.83 5.04 0.00 2.81 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 50 E 7.93 4.18 0.00 2.11 1.83 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 2.30 2.29 0.00 51 Q 8.69 5.02 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.46 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 52 R 9.08 4.67 0.00 1.80 1.98 0.00 2.76 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 53 C 8.86 4.99 0.00 3.05 3.05 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 0.00 0.00 0.00 0.00 54 L 9.05 4.95 0.00 1.45 1.57 0.92 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 55 N 8.43 4.69 0.00 2.72 2.70 0.00 0.00 6.63 7.71 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 56 P 0.00 4.33 0.00 2.22 2.17 0.00 3.81 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.25 0.00 57 E 8.23 4.07 0.00 2.04 2.01 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 2.32 2.29 0.00 58 S 7.83 4.31 0.00 3.89 3.91 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 59 K 8.82 3.81 0.00 1.83 1.87 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.54 1.57 7.81 60 T 7.95 3.86 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 1.21 0.00 0.00 61 I 7.87 3.70 2.09 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.14 0.92 0.00 0.00 62 K 8.34 3.97 0.00 1.97 1.86 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.70 7.81 63 N 8.14 4.28 0.00 2.84 2.88 0.00 0.00 7.02 7.53 0.00 0.00 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 L 8.10 4.08 0.00 1.58 1.86 0.92 1.02 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 65 M 8.28 4.05 0.00 2.14 2.06 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.60 0.00 66 K 8.15 4.06 0.00 1.83 1.78 0.00 1.91 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.47 1.72 7.81 67 A 8.25 4.06 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