NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 V 4.0319 8.0544 120.3931 62.5046 32.5847 174.9311 10 N 4.4005 8.4604 126.0803 52.7418 39.5208 170.6202 11 V 3.7935 9.1842 117.8306 63.3229 32.5823 176.2674 12 Q 4.6454 7.9265 116.9143 55.6037 30.0234 176.2567 13 R 4.5996 8.1077 118.4350 52.4440 30.9403 173.6814 14 P 4.2822 0.0000 0.0000 65.4498 31.6978 177.4419 15 L 4.1294 7.8716 116.2664 56.7698 41.5381 178.6161 16 D 4.4993 8.1635 119.1146 56.7136 40.4332 178.2419 17 A 3.9519 7.7375 121.0920 54.8451 18.5485 179.4168 18 L 3.8596 7.7540 117.8212 57.6834 41.6489 179.5869 19 G 3.9822 8.0290 105.1867 48.3025 0.0000 175.2138 20 N 4.5103 8.3281 117.5121 55.1309 38.8466 176.6039 21 S 4.6463 7.7883 115.0507 57.0016 63.4617 173.8436 22 L 4.2021 7.1783 122.3028 56.4308 41.8010 176.9519 23 N 4.4489 9.5071 118.9892 53.8416 36.7659 174.0432 24 S 4.8996 7.6991 113.1953 55.7513 67.3968 171.8096 25 P 4.9030 0.0000 0.0000 63.1087 31.9358 176.1754 26 V 4.7502 9.2064 116.1775 59.7997 36.7816 174.1814 27 I 4.9291 8.6768 122.9909 59.7732 39.7756 174.8198 28 I 4.7348 9.2312 128.4803 59.4439 39.6355 174.4126 29 K 4.3839 8.5965 129.7529 54.9186 33.7214 175.7944 30 L 5.0117 8.4811 127.4556 52.7887 44.3594 176.4568 31 K 4.1199 8.3853 120.3059 57.9704 31.0983 177.9531 32 G 3.8088 8.7918 109.2931 45.7355 0.0000 173.8082 33 D 4.6358 7.5298 115.4441 54.9299 38.7562 173.8131 34 R 4.4599 7.1738 118.9123 55.5334 31.9668 174.7399 35 E 5.1174 8.2563 124.1267 54.6121 33.6107 173.9667 36 F 5.2605 9.7124 123.9901 55.7605 43.2006 174.2477 37 R 5.0680 8.8891 120.1587 54.2910 34.2827 175.2547 38 G 4.3543 8.0913 108.1591 46.5791 0.0000 171.1187 39 V 4.7246 7.9321 120.3843 61.2540 33.1952 175.2656 40 L 4.5617 8.6545 131.0489 55.3110 42.3006 177.0444 41 K 4.6956 9.0151 125.5194 57.1235 34.8255 176.2361 42 S 4.7761 7.9585 111.8289 57.7444 65.5281 173.8150 43 F 5.4407 8.1241 118.1175 56.2747 40.6063 172.6467 44 D 5.0085 8.5889 120.1185 51.1105 41.8642 176.4773 45 L 4.1372 8.3074 117.8428 58.4058 40.6086 177.2486 46 H 4.5122 8.5018 116.1989 55.9985 29.0242 176.2584 47 M 3.3987 8.3433 118.2240 55.6480 30.0981 176.4895 48 N 4.9299 8.0418 117.0591 53.8075 39.8656 173.8736 49 L 5.0924 8.7585 121.4498 54.6908 44.7771 174.2562 50 V 4.8710 8.5835 119.9732 61.1881 34.2148 174.2686 51 L 5.2872 8.7559 127.1398 53.1748 44.7696 175.2706 52 N 5.2179 9.1353 119.4365 51.4998 41.7802 174.1711 53 D 4.3720 8.4441 118.6247 55.4408 39.2175 174.0942 54 A 4.8080 8.3080 120.2838 51.7193 20.9339 177.7797 55 E 5.0162 9.1875 119.1689 54.5183 33.4768 174.4941 56 E 3.9403 9.0911 125.9226 54.5381 30.9261 174.7981 57 L 5.2011 8.3497 125.8703 53.1950 46.2366 175.4905 58 E 4.6800 9.3049 119.3211 56.5714 33.6213 175.5635 59 D 4.4999 9.7255 122.4395 55.3877 38.5982 173.6809 60 G 3.8620 8.3606 102.0803 46.5427 0.0000 173.8311 61 E 4.4422 8.3606 120.3388 53.2206 32.0999 174.7212 62 V 3.8973 8.6060 126.3141 64.0301 31.6161 175.1736 63 T 4.5168 8.8318 117.9896 61.8026 70.3419 174.4002 64 R 4.5603 7.4153 120.4438 55.5005 33.5925 173.1955 65 R 5.1246 8.6861 123.7531 54.3821 33.0027 174.9044 66 L 4.6913 9.0437 124.1671 52.6736 44.4695 177.8576 67 G 3.7949 8.9405 111.5727 49.5336 0.0000 172.9996 68 T 5.3415 7.6247 112.5437 60.7642 70.5890 173.5062 69 V 4.4764 8.8281 126.6858 60.0811 35.2927 173.2724 70 L 4.9164 8.4815 125.7010 53.6431 43.5630 175.1109 71 I 4.3553 8.4830 127.9899 59.3834 39.6238 175.5219 72 R 4.5023 8.5343 126.5862 55.5725 30.8632 177.6834 73 G 3.9583 9.4471 112.5708 47.9487 0.0000 175.0042 74 D 4.3294 8.1182 118.0257 56.6987 41.5051 176.2961 75 N 4.7386 7.9927 114.5685 53.0797 39.0108 174.5287 76 I 4.4833 7.5164 120.4716 60.9526 38.2007 175.5725 77 V 4.2271 8.8319 125.8143 64.7773 32.1902 175.3054 78 Y 5.0587 7.2943 116.2484 55.7700 41.6236 173.1286 79 I 5.0465 8.5070 120.3312 59.6600 40.5221 175.0408 80 S 4.6393 9.7438 122.4141 55.4678 64.9817 172.1837 81 P 4.4357 0.0000 0.0000 63.0098 31.1573 176.3112 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 9 V 8.05 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 1.02 0.00 0.00 0.91 0.00 0.00 10 N 8.46 4.40 0.00 2.93 2.67 0.00 0.00 7.19 6.83 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 11 V 9.18 3.79 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 0.76 0.00 0.00 0.93 0.00 0.00 12 Q 7.93 4.65 0.00 2.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 7.21 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 13 R 8.11 4.60 0.00 1.91 1.82 0.00 3.30 0.00 0.00 3.19 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 14 P 0.00 4.28 0.00 2.15 2.10 0.00 3.60 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 2.12 2.19 0.00 15 L 7.87 4.13 0.00 1.78 1.82 0.93 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 16 D 8.16 4.50 0.00 2.86 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.74 3.95 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 18 L 7.75 3.86 0.00 0.79 0.13 0.49 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 19 G 8.03 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 20 N 8.33 4.51 0.00 2.85 2.90 0.00 0.00 7.00 8.11 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 21 S 7.79 4.65 0.00 3.90 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 22 L 7.18 4.20 0.00 1.74 1.68 1.03 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 23 N 9.51 4.45 0.00 2.86 2.98 0.00 0.00 6.77 7.59 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 24 S 7.70 4.90 0.00 3.91 3.70 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.90 0.00 1.95 2.00 0.00 3.63 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 2.13 0.00 26 V 9.21 4.75 2.10 0.00 0.00 0.00 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 0.99 0.00 0.00 27 I 8.68 4.93 1.99 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.08 0.99 0.00 0.00 28 I 9.23 4.73 1.94 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 1.16 0.88 0.00 0.00 29 K 8.60 4.38 0.00 0.79 0.74 0.00 1.51 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.88 1.14 7.81 30 L 8.48 5.01 0.00 1.75 1.58 1.10 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 31 K 8.39 4.12 0.00 1.76 1.74 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.47 1.62 7.81 32 G 8.79 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 33 D 7.53 4.64 0.00 2.94 2.81 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 0.00 0.00 0.00 34 R 7.17 4.46 0.00 1.97 1.80 0.00 3.16 0.00 0.00 3.37 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.51 0.00 35 E 8.26 5.12 0.00 1.79 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.38 0.00 36 F 9.71 5.26 0.00 2.87 2.86 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 37 R 8.89 5.07 0.00 1.76 1.80 0.00 3.22 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 38 G 8.09 4.35 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 0.00 39 V 7.93 4.72 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.95 0.00 0.00 40 L 8.65 4.56 0.00 1.85 1.71 1.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 41 K 9.02 4.70 0.00 1.72 1.82 0.00 1.83 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.58 1.66 7.81 42 S 7.96 4.78 0.00 3.85 3.65 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 43 F 8.12 5.44 0.00 3.14 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 44 D 8.59 5.01 0.00 2.88 2.80 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 45 L 8.31 4.14 0.00 1.76 1.82 0.88 0.45 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 46 H 8.50 4.51 0.00 3.39 3.36 0.00 5.71 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 M 8.34 3.40 0.00 2.20 2.25 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 48 N 8.04 4.93 0.00 2.93 2.75 0.00 0.00 6.56 6.74 0.00 0.00 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 L 8.76 5.09 0.00 1.92 1.80 0.88 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 50 V 8.58 4.87 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 0.92 0.00 0.00 0.92 0.00 0.00 51 L 8.76 5.29 0.00 1.59 1.53 0.94 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 52 N 9.14 5.22 0.00 2.68 2.71 0.00 0.00 7.16 7.63 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 53 D 8.44 4.37 0.00 2.77 2.71 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 0.00 0.00 0.00 0.00 54 A 8.31 4.81 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 0.00 0.00 0.00 0.00 0.00 55 E 9.19 5.02 0.00 1.88 1.77 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 2.21 2.24 0.00 56 E 9.09 3.94 0.00 1.40 1.53 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 1.88 1.47 0.00 57 L 8.35 5.20 0.00 1.49 1.52 0.89 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 58 E 9.30 4.68 0.00 1.88 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.20 0.00 59 D 9.73 4.50 0.00 2.74 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 8.36 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 61 E 8.36 4.44 0.00 1.91 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 2.17 2.22 0.00 62 V 8.61 3.90 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 0.88 0.00 0.00 0.96 0.00 0.00 63 T 8.83 4.52 4.19 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 1.22 0.00 0.00 64 R 7.42 4.56 0.00 1.83 1.78 0.00 3.26 0.00 0.00 3.40 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 65 R 8.69 5.12 0.00 1.70 1.81 0.00 3.20 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 66 L 9.04 4.69 0.00 1.66 1.59 1.11 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.94 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 68 T 7.62 5.34 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 69 V 8.83 4.48 2.03 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 0.34 0.00 0.00 0.66 0.00 0.00 70 L 8.48 4.92 0.00 1.61 1.56 0.97 0.99 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 71 I 8.48 4.36 1.74 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.11 0.82 0.00 0.00 72 R 8.53 4.50 0.00 1.85 1.84 0.00 3.13 0.00 0.00 3.33 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.60 0.00 73 G 9.45 3.96 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 0.00 0.00 0.00 74 D 8.12 4.33 0.00 2.62 2.71 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 0.00 0.00 0.00 0.00 75 N 7.99 4.74 0.00 2.77 2.81 0.00 0.00 6.84 8.52 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 76 I 7.52 4.48 1.99 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 1.16 0.47 0.92 0.00 0.00 77 V 8.83 4.23 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 0.90 0.00 0.00 0.91 0.00 0.00 78 Y 7.29 5.06 0.00 2.98 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 79 I 8.51 5.05 1.88 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 1.22 0.69 0.89 0.00 0.00 80 S 9.74 4.64 0.00 3.86 3.87 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 81 P 0.00 4.44 0.00 2.21 2.01 0.00 3.94 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 1.97 1.94 0.00