NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 E 4.3975 8.4331 121.4670 56.0398 32.1564 174.9299 5 G 3.9446 8.7450 115.4280 44.8503 0.0000 175.1937 6 P 4.1148 0.0000 0.0000 64.4060 32.7821 174.4900 7 D 4.9603 7.3542 119.4374 53.8928 40.8924 176.4111 8 N 5.0109 7.6131 112.1096 52.4158 38.3888 176.9135 9 D 4.6577 8.1212 120.2855 58.5576 41.4611 179.0998 10 E 4.0578 8.1184 117.4262 58.8737 29.6411 178.1850 11 R 3.7855 7.4798 118.3044 58.3450 30.0629 176.8807 12 F 5.0500 7.6275 115.2922 57.3210 39.3818 175.3301 13 T 4.8494 7.7743 115.7549 62.0038 71.8011 172.9582 14 Y 4.4297 8.2147 124.3234 55.2179 41.9680 175.9423 15 D 4.5877 7.3682 126.6604 53.6473 39.0304 176.1440 16 Y 4.4531 8.0209 121.4419 60.0154 38.4168 176.8154 17 Y 4.0867 8.1791 120.7333 60.7847 39.1004 177.6828 18 R 3.7748 8.4419 118.9956 59.0994 30.1565 178.6377 19 L 3.9765 7.6795 120.0535 58.3897 41.9680 179.3641 20 R 3.9153 8.0077 117.8097 59.1105 30.0060 179.0952 21 V 3.4044 7.4892 117.9788 65.9835 31.4063 178.2462 22 V 3.6411 8.1833 118.3753 65.9482 31.3839 178.0762 23 G 3.6582 8.4595 105.8856 47.9941 0.0000 175.6503 24 L 4.0436 8.1933 121.5345 57.2282 41.5838 179.5076 25 I 3.6405 7.8363 119.9192 64.3863 37.0336 178.3786 26 V 3.5446 8.0308 118.8972 66.1241 31.4061 177.6773 27 A 3.9694 8.1252 120.1074 55.1879 18.0653 179.5028 28 A 3.8813 8.0215 119.0055 55.4372 18.4736 180.0903 29 V 3.5298 7.9098 116.8099 66.1426 31.6025 178.2429 30 L 4.0191 8.3511 119.2035 57.7042 41.4779 179.0864 31 C 4.1063 7.9612 118.8245 62.2460 31.5272 175.7968 32 V 3.5445 8.0834 120.1267 66.1408 31.3341 177.7412 33 I 3.7939 8.1104 120.1279 64.6104 36.9599 178.5183 34 G 3.6373 8.0331 106.0665 47.8911 0.0000 175.7247 35 I 3.7232 7.6203 121.9017 64.0881 36.8870 178.4540 36 I 3.6912 7.5879 119.4247 64.6486 37.1344 178.2942 37 I 3.8933 7.6639 120.1054 64.0464 36.4656 178.2683 38 L 4.0066 8.0501 121.2587 58.1287 41.8054 178.4706 39 L 4.3487 8.1134 114.8786 55.0595 42.5279 178.1651 40 A 4.4164 7.3942 122.9870 50.8418 15.6971 176.7734 41 G 3.2383 9.2484 113.1422 43.8295 0.0000 173.1698 42 K 4.1572 7.3621 126.6309 56.8484 33.6993 175.1598 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 4 E 8.43 4.40 0.00 1.99 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 0.00 2.19 2.26 0.00 5 G 8.75 3.94 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 0.00 0.00 0.00 6 P 0.00 4.11 0.00 2.07 2.15 0.00 3.67 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 2.12 0.00 7 D 7.35 4.96 0.00 2.67 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 8 N 7.61 5.01 0.00 2.78 3.17 0.00 0.00 6.11 8.07 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 9 D 8.12 4.66 0.00 2.82 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 10 E 8.12 4.06 0.00 1.91 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 0.00 2.30 2.30 0.00 11 R 7.48 3.79 0.00 1.39 1.33 0.00 2.31 0.00 0.00 2.80 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 1.24 0.00 12 F 7.63 5.05 0.00 3.12 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 13 T 7.77 4.85 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 1.25 0.00 0.00 14 Y 8.21 4.43 0.00 2.69 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 0.00 0.00 0.00 0.00 15 D 7.37 4.59 0.00 2.52 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 0.00 0.00 0.00 0.00 16 Y 8.02 4.45 0.00 3.30 3.08 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 17 Y 8.18 4.09 0.00 3.13 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 18 R 8.44 3.77 0.00 1.82 1.92 0.00 3.38 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.79 0.00 19 L 7.68 3.98 0.00 1.91 2.01 1.01 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 20 R 8.01 3.92 0.00 2.01 1.92 0.00 3.28 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.92 0.00 21 V 7.49 3.40 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 0.89 0.00 0.00 0.33 0.00 0.00 22 V 8.18 3.64 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 1.04 0.00 0.00 0.93 0.00 0.00 23 G 8.46 3.66 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 0.00 0.00 0.00 24 L 8.19 4.04 0.00 1.83 1.70 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 25 I 7.84 3.64 2.00 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 1.60 0.88 0.90 0.00 0.00 26 V 8.03 3.54 2.21 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 1.09 0.00 0.00 0.97 0.00 0.00 27 A 8.13 3.97 1.39 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 0.00 0.00 28 A 8.02 3.88 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.91 3.53 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 1.10 0.00 0.00 0.96 0.00 0.00 30 L 8.35 4.02 0.00 1.86 1.70 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 31 C 7.96 4.11 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 32 V 8.08 3.54 2.19 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 0.97 0.00 0.00 0.93 0.00 0.00 33 I 8.11 3.79 1.87 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 1.72 1.22 0.91 0.00 0.00 34 G 8.03 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 0.00 0.00 0.00 35 I 7.62 3.72 1.99 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 1.83 0.76 0.91 0.00 0.00 36 I 7.59 3.69 1.99 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 1.74 0.73 0.91 0.00 0.00 37 I 7.66 3.89 1.87 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 1.41 0.76 0.91 0.00 0.00 38 L 8.05 4.01 0.00 1.84 1.81 0.92 0.53 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 39 L 8.11 4.35 0.00 1.69 1.69 0.92 0.86 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 40 A 7.39 4.42 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 41 G 9.25 3.24 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 0.00 0.00 0.00 0.00 42 K 7.36 4.16 0.00 1.71 1.82 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.17 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.33 1.41 7.81