NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 P 4.3694 0.0000 0.0000 62.4687 32.4761 176.1586 9 T 3.8465 7.5906 113.2767 61.5868 68.7935 173.0225 10 A 4.3877 9.5046 131.8088 52.4010 20.2362 176.2768 11 C 5.0116 8.5651 116.5648 55.4392 44.8893 174.0960 12 C 4.7750 8.2686 117.6998 55.3815 41.6967 174.1388 13 F 4.4467 8.4798 121.8873 57.3133 40.1072 174.8606 14 S 4.2069 7.3809 113.4052 57.1278 65.8239 172.3283 15 Y 5.0985 7.7933 117.0759 55.7683 40.9163 175.7874 16 T 4.0302 8.9233 117.2501 62.9859 67.7719 174.3722 17 S 4.5285 8.6774 121.3542 59.2883 63.9052 173.7227 18 R 4.5150 7.4335 116.0794 54.0494 32.3188 174.0900 19 Q 2.5200 7.7744 119.3761 53.7252 29.4796 175.4447 20 I 3.8007 7.3639 126.4511 60.3982 38.0229 174.1839 21 P 4.1565 0.0000 0.0000 62.5788 31.9018 176.9626 22 Q 3.2421 8.8487 124.9844 58.9545 28.8992 178.4136 23 N 4.3055 7.6923 113.5149 55.3320 37.5155 175.2938 24 F 5.0181 8.1538 117.6423 57.4858 38.8811 174.3989 25 I 4.5047 7.5482 121.8130 59.6823 38.7713 174.8648 26 A 4.7187 8.8441 126.7401 53.2164 20.6437 176.3428 27 A 5.0704 7.9295 114.8137 50.9229 23.3104 174.3331 28 Y 5.5310 8.5697 116.2553 55.8802 41.7201 173.8932 29 F 4.3611 8.6908 114.1790 55.7635 41.9195 172.2847 30 E 5.0354 8.6192 120.4463 54.4280 30.9959 175.6526 31 T 4.2821 8.6074 117.2709 61.3887 69.9762 174.1503 32 S 4.2702 8.0367 116.2738 58.6311 62.9328 175.6584 33 S 4.2519 8.5712 121.2930 60.8714 62.8568 175.1101 34 Q 4.4468 7.6205 116.9686 55.9648 28.6790 175.2612 35 C 4.5685 7.9159 117.1097 56.6928 40.7691 174.9794 36 S 4.1112 8.7660 117.5171 60.5310 62.7362 174.4507 37 K 4.7187 7.2749 117.6021 53.5476 35.7265 174.3913 38 P 4.4485 0.0000 0.0000 63.1539 32.1645 176.1903 39 G 4.1648 8.0992 104.6157 45.4741 0.0000 172.0723 40 V 4.5725 8.1996 124.1859 60.9043 33.9086 174.3092 41 I 4.5924 8.1356 129.0111 59.5436 39.0299 174.7826 42 F 5.2042 8.9949 126.7791 56.5481 41.1215 174.6387 43 L 5.1165 9.2330 125.6381 54.0416 43.4989 175.9413 44 T 5.0712 8.4891 117.0770 59.3536 71.0540 174.9621 45 K 4.1383 8.5474 120.0054 58.8278 33.2956 179.0735 46 R 3.9998 7.8051 117.4889 56.7124 30.4841 176.5323 47 S 3.7340 7.8178 109.9506 59.9726 60.7873 172.7088 48 R 4.6848 7.7355 118.7679 54.6329 33.8633 174.7416 49 Q 4.9939 8.8694 125.1021 54.8280 30.0064 174.9430 50 V 4.5009 8.7628 125.1334 61.1456 34.3518 173.9598 51 C 5.0623 8.8814 125.0876 56.7512 40.1194 172.3958 52 A 5.1611 9.2261 125.0023 49.8947 22.7793 174.8763 53 D 3.3700 8.1784 120.1051 52.5288 41.0593 175.2550 54 P 3.9268 0.0000 0.0000 65.2314 31.3632 177.4319 55 S 4.6420 7.4490 109.2070 57.7307 63.8219 174.7597 56 E 4.2091 7.6869 122.0798 55.8106 31.3968 177.0708 57 E 3.8746 8.4074 121.7371 59.0630 30.0356 178.8380 58 W 4.1812 8.0853 116.3249 59.7386 27.9012 178.5501 59 V 2.7035 6.0657 112.4132 63.8707 30.8236 178.3167 60 Q 3.8314 7.4880 117.2509 58.7630 28.4616 179.0475 61 K 4.0011 8.3633 121.1094 59.6644 32.2896 178.5679 62 Y 4.1925 8.1913 117.1552 61.1066 37.6927 178.6395 63 V 3.1732 8.0635 119.3280 65.7782 31.5313 178.0281 64 S 4.0106 7.9023 112.5460 61.4476 62.0591 175.5943 65 D 4.3629 7.9663 119.3598 57.3046 41.0880 177.9520 66 L 4.1935 8.0164 119.4224 57.7830 41.4470 179.2972 67 E 4.0759 8.1636 117.3087 59.5085 29.6644 179.1446 68 L 4.2769 8.1837 115.7468 56.1707 41.6398 177.4955 69 S 4.2417 7.6843 120.9489 58.7284 63.9318 173.6572 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 8 P 0.00 4.37 0.00 2.06 2.11 0.00 3.64 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 1.92 2.08 0.00 9 T 7.59 3.85 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 1.23 0.00 0.00 10 A 9.50 4.39 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.57 5.01 0.00 2.49 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 0.00 0.00 0.00 0.00 12 C 8.27 4.77 0.00 2.79 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 F 8.48 4.45 0.00 2.98 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 14 S 7.38 4.21 0.00 3.85 3.73 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 15 Y 7.79 5.10 0.00 3.03 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 16 T 8.92 4.03 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 17 S 8.68 4.53 0.00 4.06 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 18 R 7.43 4.52 0.00 1.75 1.85 0.00 3.01 0.00 0.00 3.06 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.39 0.00 19 Q 7.77 2.52 0.00 0.93 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.98 0.00 0.00 0.00 0.00 0.00 1.76 1.16 0.00 20 I 7.36 3.80 2.02 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.59 1.05 0.00 0.00 21 P 0.00 4.16 0.00 1.53 1.62 0.00 3.76 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 2.06 1.97 0.00 22 Q 8.85 3.24 0.00 1.60 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.90 0.00 0.00 0.00 0.00 0.00 2.02 1.26 0.00 23 N 7.69 4.31 0.00 2.75 2.77 0.00 0.00 6.03 7.43 0.00 0.00 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 F 8.15 5.02 0.00 3.24 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 25 I 7.55 4.50 1.84 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 1.25 0.55 0.98 0.00 0.00 26 A 8.84 4.72 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 27 A 7.93 5.07 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 28 Y 8.57 5.53 0.00 2.62 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 29 F 8.69 4.36 0.00 2.90 2.94 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 30 E 8.62 5.04 0.00 2.04 1.91 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 2.23 2.42 0.00 31 T 8.61 4.28 4.21 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 1.13 0.00 0.00 32 S 8.04 4.27 0.00 3.92 3.78 0.00 0.00 0.00 0.00 0.00 0.00 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 8.57 4.25 0.00 3.90 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 34 Q 7.62 4.45 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.89 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 35 C 7.92 4.57 0.00 3.19 2.89 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 36 S 8.77 4.11 0.00 4.08 4.16 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 37 K 7.27 4.72 0.00 1.80 1.73 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.41 1.44 7.81 38 P 0.00 4.45 0.00 2.02 1.95 0.00 3.79 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 39 G 8.10 4.16 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 0.00 0.00 0.00 40 V 8.20 4.57 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.70 0.00 0.00 41 I 8.14 4.59 0.56 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.16 0.76 0.00 0.00 42 F 8.99 5.20 0.00 3.13 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 43 L 9.23 5.12 0.00 1.93 1.84 1.02 1.02 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 44 T 8.49 5.07 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 1.35 0.00 0.00 45 K 8.55 4.14 0.00 1.57 1.84 0.00 1.85 0.00 0.00 1.88 0.00 0.00 3.17 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.58 1.70 7.81 46 R 7.81 4.00 0.00 1.71 1.90 0.00 3.28 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 47 S 7.82 3.73 0.00 4.01 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 48 R 7.74 4.68 0.00 1.98 1.77 0.00 3.11 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 49 Q 8.87 4.99 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.47 0.00 0.00 0.00 0.00 0.00 2.46 2.44 0.00 50 V 8.76 4.50 2.33 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 1.25 0.00 0.00 1.06 0.00 0.00 51 C 8.88 5.06 0.00 3.00 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 52 A 9.23 5.16 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 53 D 8.18 3.37 0.00 1.98 2.39 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 54 P 0.00 3.93 0.00 1.92 1.97 0.00 3.25 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.90 0.00 55 S 7.45 4.64 0.00 3.88 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 56 E 7.69 4.21 0.00 1.87 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 2.36 2.25 0.00 57 E 8.41 3.87 0.00 2.02 1.95 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 2.37 2.33 0.00 58 W 8.09 4.18 0.00 3.47 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 59 V 6.07 2.70 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 -0.84 0.00 0.00 0.55 0.00 0.00 60 Q 7.49 3.83 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.82 0.00 0.00 0.00 0.00 0.00 2.23 2.35 0.00 61 K 8.36 4.00 0.00 1.98 2.12 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.25 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.54 1.53 7.81 62 Y 8.19 4.19 0.00 3.13 2.85 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 63 V 8.06 3.17 1.98 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 0.54 0.00 0.00 0.53 0.00 0.00 64 S 7.90 4.01 0.00 4.00 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 65 D 7.97 4.36 0.00 2.69 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 66 L 8.02 4.19 0.00 1.98 1.89 1.26 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.16 4.08 0.00 2.13 2.06 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 0.00 2.57 2.56 0.00 68 L 8.18 4.28 0.00 1.69 1.72 0.92 0.88 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 69 S 7.68 4.24 0.00 3.83 3.69 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