NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.4013 8.0433 122.7555 54.9673 43.6249 175.3679 2 K 4.9793 8.8587 124.0981 55.2719 36.7775 173.6612 3 C 4.8091 9.6413 119.2607 56.7656 45.3046 172.5273 4 N 5.3506 7.8509 117.4953 52.7759 40.1793 174.4543 5 K 4.6986 8.3136 120.6420 54.9453 35.2533 176.1785 6 L 4.0854 8.6019 123.7111 57.8740 40.9771 177.7226 7 V 3.5878 7.7592 118.0541 62.3091 31.7742 174.8528 8 P 4.7401 0.0000 0.0000 61.7856 30.4341 175.2122 9 L 4.2086 8.0834 135.0000 56.1519 45.1213 174.8472 10 F 5.1204 8.0748 123.0166 57.7087 47.3509 171.3980 11 Y 5.1971 6.7808 118.1693 55.3556 42.0344 173.8684 12 K 4.8598 8.9440 121.2292 55.1190 36.4180 174.2229 13 T 5.0927 8.4960 114.5016 60.7349 69.7962 174.6130 14 C 5.0558 8.7208 123.0569 55.4986 41.3258 173.6335 15 P 4.2023 0.0000 0.0000 65.7259 32.0159 178.1760 16 A 4.2298 7.9426 121.1693 53.5033 19.0425 178.7623 17 G 3.7731 7.9974 104.2063 48.0047 0.0000 173.8855 18 K 4.5462 7.6163 118.6703 54.8784 35.6067 176.1545 19 N 5.1283 8.6842 116.0888 53.3320 39.9177 173.4785 20 L 5.1450 8.1793 119.0598 53.6643 47.3675 174.5951 21 C 5.5571 9.1621 116.7380 55.7161 44.2532 173.2744 22 Y 5.8922 8.9496 121.4485 54.3044 41.5106 174.4887 23 K 4.8223 8.4366 117.4579 54.6582 36.9761 175.2626 24 M 5.2806 8.9801 121.4528 54.3518 34.8376 174.8430 25 F 5.1134 9.2485 125.4026 56.5020 42.4254 174.8622 26 M 4.9850 8.8456 118.8087 53.4286 35.4792 176.4781 27 V 4.3527 7.9596 123.8820 62.6125 31.6288 176.7057 28 A 4.1315 8.3094 124.3897 53.6521 18.3835 180.4048 29 T 4.8582 7.4763 121.1065 64.8524 68.3734 172.2946 30 P 4.2832 0.0000 0.0000 62.7581 31.9275 172.6030 31 K 4.5115 8.3785 125.7924 55.4137 32.2457 175.1156 32 V 4.0466 7.5426 118.8778 60.1165 33.4122 170.5600 33 P 3.9221 0.0000 0.0000 62.6676 31.9126 175.5815 34 V 4.3656 7.9486 115.9471 62.1081 37.5378 173.8777 35 K 4.3643 7.9102 119.1348 54.2628 33.2845 173.8886 36 R 4.5857 8.1241 121.9067 54.3293 32.5286 175.4111 37 G 3.9848 8.0551 111.6972 46.1469 0.0000 170.3585 38 C 5.7133 8.9744 118.5958 55.5004 37.6017 173.4967 39 I 4.7734 8.7476 122.0727 59.6461 41.0098 174.8782 40 D 5.4790 8.4107 120.4600 52.6255 39.9042 175.6163 41 V 4.3333 7.0341 117.9654 63.2247 34.7110 173.8021 42 C 5.0008 8.1670 115.4670 55.4002 41.0343 172.4451 43 P 4.5911 0.0000 0.0000 62.7050 31.8431 176.4041 44 K 4.3834 7.9399 117.3431 54.8672 35.5794 174.5759 45 S 5.2893 7.4597 127.8294 58.1897 65.2032 175.6331 46 S 4.2881 7.8520 125.1098 57.6992 63.8842 174.6032 47 L 4.6664 8.6553 119.3250 55.4447 41.1742 176.3214 48 L 4.8130 7.7561 120.7775 54.2480 44.0147 175.6097 49 V 4.6798 7.3428 105.4108 61.0955 35.9092 171.9731 50 K 4.8128 8.1227 126.4539 55.7388 35.2720 174.5620 51 Y 5.9386 8.3761 115.9251 57.5890 40.5841 174.4243 52 V 4.0033 8.3163 121.2251 61.5136 34.2550 174.7732 53 C 5.3457 8.3009 125.1776 56.1619 42.4622 173.7273 54 C 4.9025 8.8102 119.8282 55.5325 47.2466 173.6622 55 N 4.9341 8.3776 120.3706 53.9444 39.5120 175.2051 56 T 4.0706 8.0618 113.2987 62.8473 69.1158 171.2621 57 D 4.5399 8.2076 128.3291 54.9191 41.9909 174.3366 58 R 4.0323 8.6815 124.4786 56.7475 28.8419 174.9418 59 C 4.5279 7.6560 108.6108 56.2860 41.0282 173.2437 60 N 4.4734 7.8768 124.7043 53.7526 38.6548 173.9401 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 L 8.04 4.40 0.00 1.75 1.62 0.94 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 2 K 8.86 4.98 0.00 1.54 1.77 0.00 1.70 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.47 7.81 3 C 9.64 4.81 0.00 2.85 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 4 N 7.85 5.35 0.00 2.80 2.65 0.00 0.00 6.41 6.52 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 5 K 8.31 4.70 0.00 1.73 1.60 0.00 1.81 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.33 1.54 7.81 6 L 8.60 4.09 0.00 1.76 1.74 0.90 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 7 V 7.76 3.59 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 0.91 0.00 0.00 0.93 0.00 0.00 8 P 0.00 4.74 0.00 2.21 2.08 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 1.94 0.00 9 L 8.08 4.21 0.00 1.63 1.11 0.93 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 10 F 8.07 5.12 0.00 2.72 2.12 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 11 Y 6.78 5.20 0.00 3.03 2.84 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 K 8.94 4.86 0.00 1.87 1.73 0.00 1.60 0.00 0.00 1.60 0.00 0.00 2.83 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.36 1.37 7.81 13 T 8.50 5.09 4.30 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 1.24 0.00 0.00 14 C 8.72 5.06 0.00 3.00 2.98 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 15 P 0.00 4.20 0.00 2.19 2.18 0.00 3.78 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 2.00 1.97 0.00 16 A 7.94 4.23 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 17 G 8.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.62 4.55 0.00 1.78 1.77 0.00 1.70 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.40 1.75 7.81 19 N 8.68 5.13 0.00 2.78 2.96 0.00 0.00 5.73 6.67 0.00 0.00 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 L 8.18 5.14 0.00 1.66 1.56 0.91 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 21 C 9.16 5.56 0.00 2.85 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 22 Y 8.95 5.89 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 23 K 8.44 4.82 0.00 1.73 1.96 0.00 1.46 0.00 0.00 1.92 0.00 0.00 2.79 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.39 7.81 24 M 8.98 5.28 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.69 0.00 25 F 9.25 5.11 0.00 3.04 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 26 M 8.85 4.98 0.00 1.94 2.02 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.49 0.00 27 V 7.96 4.35 2.26 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 0.86 0.00 0.00 1.03 0.00 0.00 28 A 8.31 4.13 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 29 T 7.48 4.86 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 1.22 0.00 0.00 30 P 0.00 4.28 0.00 2.17 2.17 0.00 3.85 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 1.97 1.98 0.00 31 K 8.38 4.51 0.00 1.96 1.93 0.00 1.86 0.00 0.00 2.45 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.42 7.81 32 V 7.54 4.05 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 0.77 0.00 0.00 0.81 0.00 0.00 33 P 0.00 3.92 0.00 1.70 0.49 0.00 3.52 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.46 0.00 34 V 7.95 4.37 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 0.78 0.00 0.00 0.90 0.00 0.00 35 K 7.91 4.36 0.00 1.78 1.75 0.00 1.66 0.00 0.00 1.89 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.40 7.81 36 R 8.12 4.59 0.00 1.57 1.74 0.00 3.21 0.00 0.00 3.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 37 G 8.06 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 38 C 8.97 5.71 0.00 2.90 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.75 4.77 1.91 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.43 0.80 0.00 0.00 40 D 8.41 5.48 0.00 2.81 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 V 7.03 4.33 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 0.70 0.00 0.00 0.91 0.00 0.00 42 C 8.17 5.00 0.00 2.94 3.19 0.00 0.00 0.00 0.00 0.00 0.00 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 4.59 0.00 2.14 2.11 0.00 3.63 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.91 0.00 44 K 7.94 4.38 0.00 1.52 1.34 0.00 1.88 0.00 0.00 1.62 0.00 0.00 2.70 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.13 1.31 7.81 45 S 7.46 5.29 0.00 3.48 3.48 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.85 4.29 0.00 3.97 3.59 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.66 4.67 0.00 1.74 1.77 0.91 0.48 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 48 L 7.76 4.81 0.00 1.77 1.58 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 49 V 7.34 4.68 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 1.27 0.00 0.00 0.93 0.00 0.00 50 K 8.12 4.81 0.00 1.76 1.83 0.00 1.73 0.00 0.00 1.93 0.00 0.00 3.20 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.52 1.53 7.81 51 Y 8.38 5.94 0.00 3.33 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 52 V 8.32 4.00 1.92 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 1.02 0.00 0.00 0.54 0.00 0.00 53 C 8.30 5.35 0.00 2.81 2.97 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.81 4.90 0.00 2.92 2.83 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 55 N 8.38 4.93 0.00 2.64 2.67 0.00 0.00 7.02 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 T 8.06 4.07 4.22 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 1.19 0.00 0.00 57 D 8.21 4.54 0.00 2.92 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 R 8.68 4.03 0.00 1.94 2.02 0.00 3.23 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.54 0.00 59 C 7.66 4.53 0.00 3.13 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 60 N 7.88 4.47 0.00 2.70 2.64 0.00 0.00 7.25 7.51 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