NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8634 8.3393 109.7365 45.6802 0.0000 172.5800 2 S 4.3607 8.5085 117.6063 56.0070 63.9410 172.3718 3 S 4.0525 8.8977 120.9969 61.6697 63.3671 175.8796 4 G 4.0672 8.5872 106.8165 45.4877 0.0000 172.7858 5 S 4.5595 8.2216 117.4571 56.3855 65.2043 173.2921 6 S 4.0670 8.8316 123.3388 58.5349 62.3009 174.3955 7 G 4.6760 7.3622 120.7840 44.7827 0.0000 171.0797 8 P 4.4607 0.0000 0.0000 63.2741 31.6530 176.2073 9 S 4.7656 7.3564 113.2311 56.5166 64.3499 173.7442 10 R 4.2843 8.2669 125.4968 54.7261 30.8552 174.9235 11 P 4.5903 0.0000 0.0000 62.5545 32.5992 176.0357 12 V 4.0305 7.9307 109.7046 61.7792 31.3601 177.1454 13 R 4.1509 7.6739 117.9703 55.1011 30.9103 175.5895 14 P 4.5794 0.0000 0.0000 62.9581 32.3964 175.9772 15 N 4.9373 8.5221 114.1259 53.2297 39.1721 175.3747 16 N 4.8336 7.7092 119.0572 51.1996 36.7823 173.6445 17 R 4.7845 7.6622 122.3615 56.2429 34.5165 173.1430 18 C 4.5409 8.1519 122.8583 58.4338 32.9618 173.5902 19 F 4.8052 8.9851 128.0923 58.5875 38.8387 175.9323 20 S 4.4878 8.2389 114.2998 58.9894 64.6776 174.5555 21 C 4.6650 7.9215 111.4179 56.9020 30.7097 174.0772 22 N 4.4384 8.2957 116.6913 54.0812 36.1700 173.9281 23 K 4.1352 7.5575 121.2689 54.9753 31.9623 175.8465 24 K 4.6074 8.4787 125.3831 57.3493 32.2850 176.3995 25 V 4.2658 8.5063 116.9661 60.6123 32.7950 177.2698 26 G 3.8925 7.6173 109.0838 47.3094 0.0000 175.2648 27 V 4.3628 8.2945 117.5693 61.4734 31.8301 175.6129 28 M 4.6447 7.8704 118.1272 55.0025 32.8973 176.1080 29 G 3.9772 8.0060 106.6901 45.7580 0.0000 173.7721 30 F 4.7015 9.1858 118.9046 55.4556 40.4514 175.2065 31 K 4.6903 8.5565 125.8688 55.9314 32.9665 176.1432 32 C 4.6707 9.1914 127.8058 58.0132 32.8381 174.2494 33 K 3.9538 8.7746 123.1402 59.6133 31.7433 178.4284 34 C 4.4553 8.2066 112.8438 60.8970 29.6483 174.0364 35 G 4.2620 7.7617 109.5083 45.8078 0.0000 173.3395 36 S 4.5365 8.1962 114.1076 56.4244 66.7484 173.2534 37 T 4.6372 7.7397 118.5260 62.1198 70.6413 173.7497 38 F 5.3675 8.6748 123.1548 55.4382 44.1275 174.2097 39 C 4.8041 8.9731 112.7201 58.6718 30.1269 174.3311 40 G 4.0814 8.7839 113.3580 46.9366 0.0000 175.9468 41 S 4.3692 7.8066 113.7838 60.4048 62.1918 174.5243 42 H 5.0861 7.9946 116.5841 55.3978 29.2535 175.6340 43 R 3.4651 7.6889 117.1856 58.0451 29.7341 176.5378 44 Y 4.0928 6.9348 118.0070 56.8116 38.7957 174.9874 45 P 3.8516 0.0000 0.0000 65.4783 31.7578 178.4604 46 E 4.0095 8.0733 115.6897 58.2593 29.7193 177.3543 47 K 4.4724 7.2132 118.2566 55.5784 32.1896 175.6831 48 H 4.5372 7.9979 110.6187 54.6555 31.2882 172.1270 49 E 3.9150 9.2127 124.5295 56.4144 28.5244 175.2527 50 C 4.6751 8.1446 125.4440 57.9015 31.2454 173.2350 51 S 4.2895 8.8439 123.5923 61.1641 62.7999 175.3082 52 F 3.5516 7.9085 119.9054 58.4471 39.4813 175.1567 53 D 4.9450 7.9021 127.7073 52.6510 40.0184 176.1805 54 F 4.3357 9.1229 121.8393 60.5429 39.4725 176.3154 55 K 4.0565 8.0990 117.5641 55.5493 32.4595 175.9250 56 E 4.1425 8.7648 120.9774 55.7583 29.8061 176.7688 57 V 3.6440 8.0786 117.9710 62.8857 31.2221 174.6147 58 G 4.1692 8.1668 112.5605 46.8199 0.0000 174.3271 59 S 4.2834 8.0478 116.3008 58.0194 62.8451 172.9394 60 G 3.9247 7.5990 107.4880 46.2939 0.0000 172.3393 61 P 4.4823 0.0000 0.0000 60.9063 32.8033 176.3752 62 S 4.2032 8.2615 113.5267 58.5638 62.7778 173.1507 63 S 4.4837 8.2442 120.1558 57.6815 65.3382 173.8749 64 G 4.2812 8.7182 114.0135 46.2055 0.0000 173.3553 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 8.34 3.86 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 0.00 0.00 0.00 2 S 8.51 4.36 0.00 4.07 3.90 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 3 S 8.90 4.05 0.00 3.85 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 4 G 8.59 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.22 4.56 0.00 3.77 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 6 S 8.83 4.07 0.00 3.87 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 7 G 7.36 4.68 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 8 P 0.00 4.46 0.00 2.19 2.18 0.00 3.73 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 9 S 7.36 4.77 0.00 3.86 3.76 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.27 4.28 0.00 1.85 1.84 0.00 3.28 0.00 0.00 3.29 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 11 P 0.00 4.59 0.00 2.17 2.10 0.00 3.76 0.00 0.00 3.66 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 12 V 7.93 4.03 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 0.93 0.00 0.00 13 R 7.67 4.15 0.00 1.80 1.86 0.00 3.37 0.00 0.00 3.28 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 14 P 0.00 4.58 0.00 2.29 2.09 0.00 3.71 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.98 0.00 15 N 8.52 4.94 0.00 2.65 2.78 0.00 0.00 6.78 7.98 0.00 0.00 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 N 7.71 4.83 0.00 2.90 3.09 0.00 0.00 5.99 7.65 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 17 R 7.66 4.78 0.00 1.66 1.82 0.00 3.20 0.00 0.00 3.37 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 18 C 8.15 4.54 0.00 3.07 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 19 F 8.99 4.81 0.00 2.58 2.66 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 0.00 0.00 0.00 0.00 20 S 8.24 4.49 0.00 3.98 3.53 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 0.00 0.00 0.00 0.00 21 C 7.92 4.66 0.00 3.11 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.30 4.44 0.00 2.86 2.96 0.00 0.00 6.86 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 K 7.56 4.14 0.00 1.99 1.77 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.40 7.81 24 K 8.48 4.61 0.00 1.98 1.90 0.00 1.22 0.00 0.00 2.37 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.48 7.81 25 V 8.51 4.27 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 1.04 0.00 0.00 0.98 0.00 0.00 26 G 7.62 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.29 4.36 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 0.75 0.00 0.00 0.91 0.00 0.00 28 M 7.87 4.64 0.00 1.89 1.97 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 2.47 2.46 0.00 29 G 8.01 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.19 4.70 0.00 3.09 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 31 K 8.56 4.69 0.00 1.77 1.73 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.41 7.81 32 C 9.19 4.67 0.00 3.35 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 33 K 8.77 3.95 0.00 1.37 1.07 0.00 1.74 0.00 0.00 1.54 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.20 7.81 34 C 8.21 4.46 0.00 3.19 3.30 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 35 G 7.76 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.20 4.54 0.00 3.29 2.79 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 37 T 7.74 4.64 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 1.23 0.00 0.00 38 F 8.67 5.37 0.00 2.97 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 39 C 8.97 4.80 0.00 3.15 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 40 G 8.78 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 41 S 7.81 4.37 0.00 3.66 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 42 H 7.99 5.09 0.00 3.48 3.37 0.00 5.63 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 R 7.69 3.47 0.00 1.77 1.87 0.00 2.21 0.00 0.00 2.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.61 0.00 44 Y 6.93 4.09 0.00 3.11 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.85 0.00 2.12 2.16 0.00 3.66 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.49 0.00 46 E 8.07 4.01 0.00 2.04 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 0.00 2.22 2.23 0.00 47 K 7.21 4.47 0.00 1.90 1.91 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.51 7.81 48 H 8.00 4.54 0.00 3.74 3.43 0.00 5.60 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 49 E 9.21 3.91 0.00 2.21 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.57 0.00 50 C 8.14 4.68 0.00 3.05 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 51 S 8.84 4.29 0.00 3.94 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 52 F 7.91 3.55 0.00 2.96 2.69 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 0.00 0.00 0.00 0.00 53 D 7.90 4.95 0.00 2.66 2.63 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 54 F 9.12 4.34 0.00 3.04 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 55 K 8.10 4.06 0.00 1.82 1.82 0.00 1.82 0.00 0.00 1.80 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.53 1.59 7.81 56 E 8.76 4.14 0.00 2.10 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 2.32 2.35 0.00 57 V 8.08 3.64 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 58 G 8.17 4.17 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 0.00 59 S 8.05 4.28 0.00 3.86 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 60 G 7.60 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 61 P 0.00 4.48 0.00 2.18 2.08 0.00 3.77 0.00 0.00 3.58 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 62 S 8.26 4.20 0.00 3.84 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 S 8.24 4.48 0.00 3.80 3.64 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.72 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 0.00 0.00 0.00 0.00