NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 71 K 4.1414 8.3149 120.1322 57.8536 33.8924 175.4455 72 T 3.3769 8.3525 118.7615 63.7869 66.5753 169.3501 73 P 4.9434 0.0000 0.0000 62.2563 34.5265 173.6176 74 P 4.8176 0.0000 0.0000 64.1256 30.2378 178.8906 75 M 4.2504 9.2082 121.2765 56.7884 31.5807 176.9428 76 S 4.4595 7.9420 115.9629 60.8015 63.5893 174.8822 77 Y 4.6784 7.9223 121.0884 57.5404 39.3200 175.8155 78 L 4.1283 7.7614 120.0667 55.9639 42.3546 177.3297 79 I 4.0738 7.2763 118.0716 63.4013 37.9561 177.5442 80 R 4.0609 7.9609 118.2056 57.9383 30.2514 176.6398 81 K 4.5396 7.6372 113.6280 55.0314 32.8084 176.9059 82 A 4.2894 7.8981 121.4669 53.3376 18.1672 177.6493 83 A 4.6181 7.9620 118.6387 50.3190 21.0605 175.1771 84 G 4.2807 8.3123 110.7120 43.4289 0.0000 174.7819 85 I 3.9749 8.7386 124.1961 61.1229 35.7407 177.6947 86 G 3.8787 10.4898 112.7455 47.2559 0.0000 173.3987 87 K 4.2085 8.5757 113.6951 57.0887 30.7870 175.9427 88 G 3.9980 7.0505 111.7425 45.6569 0.0000 176.7398 89 S 4.1057 8.8711 128.9392 58.2661 61.6379 173.2225 90 S 4.7340 8.4927 122.0251 57.2908 62.6286 174.5065 91 T 3.3887 8.1547 120.3742 63.6130 67.0772 169.5663 92 P 4.0096 0.0000 0.0000 63.0988 33.4611 175.7165 93 N 4.6344 10.2460 114.2375 53.5009 35.3750 175.8759 94 K 4.5064 7.2457 113.5835 56.1440 34.7157 176.0202 95 A 4.9922 8.2315 122.8283 57.0987 20.5715 178.0046 96 K 4.6047 6.9261 118.9417 55.0612 32.4981 176.4757 97 V 4.1903 8.5624 121.6798 63.1088 33.9039 175.4337 98 G 4.2287 7.5736 104.3609 44.2028 0.0000 173.1058 99 K 4.7051 8.6829 124.0755 54.9566 35.5122 175.4965 100 L 4.9702 9.1901 126.6755 52.7937 45.2245 175.0297 101 N 4.7291 8.5222 117.3367 52.6841 39.6992 176.2372 102 W 4.5539 8.9707 134.8848 59.6462 31.0147 175.7274 103 D 4.5061 7.6276 118.1600 54.2344 41.2912 178.3771 104 Q 4.1246 7.7854 119.3452 58.5441 29.0124 177.3636 105 V 3.5016 7.7497 118.7601 67.2274 31.1154 177.6237 106 L 3.6164 7.5421 116.2080 58.4629 41.4732 179.3243 107 E 3.9992 7.9470 117.8080 59.4801 29.4463 179.4741 108 I 3.5159 7.6339 119.0546 64.1672 37.3319 178.1542 109 A 4.0787 9.7954 121.3575 55.5178 18.1146 179.2077 110 K 3.7166 9.4814 114.8184 60.5684 32.5867 178.6884 111 T 3.9685 9.0479 110.5871 66.1361 68.7711 173.4726 112 K 4.6973 8.3041 122.7071 57.8078 34.5560 176.6915 113 M 3.4632 8.8863 121.9979 55.5181 30.0149 175.8230 114 P 4.3344 0.0000 0.0000 65.7303 31.1208 177.1088 115 D 4.2731 7.4942 118.3914 55.8823 41.2885 175.3161 116 L 3.8591 7.7427 126.4992 56.0231 42.2418 177.2966 117 N 4.7857 8.5346 126.8192 53.9508 38.9339 175.1586 118 A 4.7675 7.5544 115.8584 51.1584 20.0565 176.2444 119 G 4.0750 7.7873 111.4232 44.3471 0.0000 172.7972 120 S 4.6567 7.5156 113.4497 57.9570 65.5454 179.1303 121 V 3.7508 8.1478 124.2195 66.2471 31.2803 177.4190 122 E 4.2163 8.2329 115.7434 57.8419 29.4028 176.7846 123 A 4.4379 7.9260 120.3240 53.6565 21.4351 176.7589 124 A 4.5266 8.9750 119.0820 50.7493 16.6004 175.4919 125 A 4.7702 7.5853 125.7458 51.8861 26.3000 178.7459 126 N 4.5155 8.1326 112.4980 55.8087 38.7304 177.7797 127 T 3.9523 7.2926 116.5410 66.1245 68.6360 176.7648 128 V 3.7231 7.8233 119.7043 66.8736 31.7487 177.1288 129 A 3.8557 9.3600 118.8195 55.4674 18.2010 179.7700 130 G 3.9056 8.2514 100.5233 48.2316 0.0000 175.1402 131 T 3.8067 8.0249 117.3620 66.7684 68.9210 175.6465 132 A 4.0529 8.7018 121.9989 56.0641 18.4403 179.3379 133 R 4.0962 8.6196 114.8180 60.1660 30.0779 179.3779 134 S 4.8286 8.1470 111.1207 59.1726 62.8704 174.5878 135 M 4.4016 9.5997 121.8719 55.6392 32.2935 175.0088 136 G 3.8770 7.4325 110.7983 46.2006 0.0000 172.2086 137 V 4.5156 6.9184 119.9632 61.1943 33.6261 175.7288 138 T 4.5220 8.5107 115.5803 60.1197 69.6374 173.0354 139 V 4.6672 8.3677 126.3437 61.2288 34.9013 175.1925 140 E 4.0599 9.0657 121.6880 56.3332 29.8740 176.2363 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 71 K 8.31 4.14 0.00 1.73 1.85 0.00 1.84 0.00 0.00 1.79 0.00 0.00 3.03 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.44 1.45 7.81 72 T 8.35 3.38 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 1.26 0.00 0.00 73 P 0.00 4.94 0.00 2.07 1.89 0.00 3.73 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 2.02 2.19 0.00 74 P 0.00 4.82 0.00 2.26 1.48 0.00 3.72 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.05 0.00 75 M 9.21 4.25 0.00 2.03 2.14 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 2.67 2.52 0.00 76 S 7.94 4.46 0.00 4.05 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 77 Y 7.92 4.68 0.00 2.99 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 78 L 7.76 4.13 0.00 1.82 1.62 0.78 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 79 I 7.28 4.07 1.91 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 1.65 1.14 0.90 0.00 0.00 80 R 7.96 4.06 0.00 1.85 2.24 0.00 3.29 0.00 0.00 3.36 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 81 K 7.64 4.54 0.00 1.44 1.50 0.00 1.68 0.00 0.00 1.54 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.82 0.62 7.81 82 A 7.90 4.29 1.28 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 83 A 7.96 4.62 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 84 G 8.31 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 85 I 8.74 3.97 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.86 0.97 0.00 0.00 86 G 10.49 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 0.00 0.00 0.00 87 K 8.58 4.21 0.00 1.77 2.21 0.00 1.62 0.00 0.00 1.71 0.00 0.00 3.13 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.26 1.43 7.81 88 G 7.05 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.87 4.11 0.00 3.92 3.95 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 0.00 0.00 0.00 90 S 8.49 4.73 0.00 3.97 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 91 T 8.15 3.39 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 92 P 0.00 4.01 0.00 2.22 2.22 0.00 3.79 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.17 0.00 93 N 10.25 4.63 0.00 2.86 3.17 0.00 0.00 6.71 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 94 K 7.25 4.51 0.00 1.69 1.74 0.00 1.84 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.35 1.44 7.81 95 A 8.23 4.99 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 96 K 6.93 4.60 0.00 1.79 1.72 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.49 7.81 97 V 8.56 4.19 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 1.03 0.00 0.00 98 G 7.57 4.23 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 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.68 4.71 0.00 1.60 1.71 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.45 7.81 100 L 9.19 4.97 0.00 1.49 1.62 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 101 N 8.52 4.73 0.00 2.73 2.85 0.00 0.00 6.56 7.95 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 0.00 102 W 8.97 4.55 0.00 3.38 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 0.00 103 D 7.63 4.51 0.00 2.53 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 Q 7.79 4.12 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.67 0.00 0.00 0.00 0.00 0.00 2.57 2.45 0.00 105 V 7.75 3.50 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 1.01 0.00 0.00 0.81 0.00 0.00 106 L 7.54 3.62 0.00 1.61 1.53 0.81 0.70 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 0.00 107 E 7.95 4.00 0.00 1.96 1.96 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 2.37 2.35 0.00 108 I 7.63 3.52 1.98 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 1.46 0.54 0.96 0.00 0.00 109 A 9.80 4.08 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 K 9.48 3.72 0.00 1.83 1.85 0.00 1.70 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.65 7.81 111 T 9.05 3.97 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 1.26 0.00 0.00 112 K 8.30 4.70 0.00 1.98 1.69 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.17 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.44 1.62 7.81 113 M 8.89 3.46 0.00 2.07 2.50 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 2.69 2.45 0.00 114 P 0.00 4.33 0.00 2.16 2.17 0.00 3.69 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 1.97 2.03 0.00 115 D 7.49 4.27 0.00 2.66 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 0.00 116 L 7.74 3.86 0.00 1.58 1.63 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 117 N 8.53 4.79 0.00 2.74 2.80 0.00 0.00 6.89 7.35 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 0.00 118 A 7.55 4.77 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 0.00 119 G 7.79 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 0.00 120 S 7.52 4.66 0.00 3.97 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 0.00 121 V 8.15 3.75 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 0.93 0.00 0.00 0.90 0.00 0.00 122 E 8.23 4.22 0.00 2.00 2.00 0.00 0.00 0.00 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 2.26 0.00 123 A 7.93 4.44 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 A 8.98 4.53 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 A 7.59 4.77 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 0.00 126 N 8.13 4.52 0.00 2.77 2.90 0.00 0.00 7.08 7.05 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 0.00 127 T 7.29 3.95 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 0.00 128 V 7.82 3.72 2.27 0.00 0.00 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 0.97 0.00 0.00 129 A 9.36 3.86 1.32 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 0.00 0.00 0.00 130 G 8.25 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 0.00 0.00 0.00 131 T 8.02 3.81 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 132 A 8.70 4.05 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 R 8.62 4.10 0.00 1.87 1.99 0.00 3.17 0.00 0.00 3.13 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.81 0.00 134 S 8.15 4.83 0.00 3.91 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 0.00 135 M 9.60 4.40 0.00 2.02 2.36 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.62 0.00 136 G 7.43 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 0.00 0.00 0.00 137 V 6.92 4.52 2.24 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 0.85 0.00 0.00 0.97 0.00 0.00 138 T 8.51 4.52 4.27 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 139 V 8.37 4.67 2.25 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 1.33 0.00 0.00 1.03 0.00 0.00 140 E 9.07 4.06 0.00 1.30 1.28 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 2.13 2.31 0.00