NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8801 8.3549 109.7341 44.5927 0.0000 173.6425 2 S 4.3382 7.6206 118.9075 54.5427 65.1208 172.5029 3 S 4.1028 8.9068 121.6711 58.8524 63.9038 174.5674 4 G 3.5893 8.9487 117.7733 45.9596 0.0000 169.9680 5 S 3.5589 8.9531 125.3855 58.6869 61.3638 171.6163 6 S 4.3041 8.1959 117.2454 57.3505 64.6723 175.4502 7 G 3.8564 8.4610 118.7255 44.2195 0.0000 170.4954 8 P 4.3591 0.0000 0.0000 62.3326 32.1996 175.4122 9 S 4.4630 8.1176 113.3027 56.8980 62.3272 173.4180 10 H 4.4087 8.7002 125.8372 56.6185 28.8899 175.9956 11 S 4.4606 7.9877 108.5028 58.8444 64.6003 174.7560 12 L 3.4674 8.8031 127.4146 54.5918 37.6726 173.1225 13 Q 4.5915 7.8388 121.6793 53.0021 32.3351 174.8817 14 A 4.1506 8.3278 123.9194 51.8292 18.8611 176.4575 15 P 4.2502 0.0000 0.0000 65.4789 31.6849 178.4103 16 E 4.1392 8.2927 117.9404 58.9960 28.9427 179.4082 17 V 3.5814 7.6355 117.6099 65.6439 31.7208 177.6295 18 R 3.8122 7.9702 117.8525 58.6548 30.2055 178.3736 19 F 5.6605 7.4746 118.0052 56.7269 40.4354 178.5916 20 S 4.3812 8.0371 115.9671 61.1201 62.9582 174.9353 21 K 3.8160 8.1937 123.9039 58.8895 31.7263 178.1483 22 E 4.0555 8.0737 118.1257 59.7516 29.7843 178.5025 23 M 4.0738 8.2033 118.7018 58.8519 31.9851 178.9355 24 E 4.0447 8.5778 118.7216 59.4384 29.5041 178.7794 25 C 4.1682 7.5896 117.6164 62.2898 31.9245 175.2111 26 L 4.2851 8.7755 121.3129 57.9812 41.3146 178.9002 27 Q 3.9912 8.1230 119.0758 59.5007 28.6882 178.4273 28 A 4.0043 7.7060 119.9504 55.9706 18.4412 179.3004 29 M 4.1767 7.8333 115.3773 58.1486 32.1086 176.6020 30 G 3.4546 8.0114 107.1883 45.4688 0.0000 175.2221 31 F 4.6537 7.6649 120.0975 57.5893 36.3531 175.2397 32 V 3.7535 7.8426 116.7802 63.8586 32.1889 174.7105 33 N 4.3070 8.3777 118.1860 53.8144 37.8787 174.6758 34 Y 4.1381 8.4467 123.4840 60.2589 39.0725 176.4025 35 N 3.7889 8.5824 116.8568 56.6671 38.5505 176.5894 36 A 4.1531 7.9648 121.7568 54.3525 18.6557 178.6775 37 N 4.1235 8.4728 114.0950 56.8367 38.7648 176.7277 38 L 4.0060 8.2342 121.3668 58.7852 41.9123 178.8098 39 Q 3.8998 7.8231 115.3969 59.0987 28.6769 179.0223 40 A 3.8892 8.3136 120.6027 55.3252 18.5945 179.2424 41 L 3.8543 8.4734 119.3366 57.4958 41.4204 179.9332 42 I 3.5050 7.7869 119.3513 64.2313 36.7646 178.2146 43 A 4.0846 8.0899 121.2816 53.7878 18.3767 178.0945 44 T 4.2394 7.9860 106.4538 60.4620 69.4900 174.1269 45 D 4.1342 8.2331 120.2519 55.7107 39.0006 173.5359 46 G 3.3654 7.6160 106.5534 45.2197 0.0000 171.1208 47 D 4.3540 7.2889 120.7270 52.5363 43.1698 175.7850 48 T 3.7777 8.6089 118.3092 65.3573 68.9489 175.4512 49 N 4.4189 8.2720 118.7653 56.0813 38.4774 176.5959 50 A 3.8523 7.8816 120.4339 55.4173 18.6408 179.0148 51 A 3.8504 8.0571 119.4341 55.6751 18.2539 179.8651 52 I 3.1914 8.6043 118.7708 64.6459 37.2312 177.9542 53 Y 3.9135 8.7629 117.7721 61.5343 37.6702 179.2424 54 K 3.9715 9.0320 119.7212 59.3575 31.9958 178.9089 55 L 3.8702 8.0761 118.8329 58.2435 41.7247 179.4518 56 K 4.0751 8.5940 117.8617 59.9765 32.2282 178.4344 57 S 4.2240 7.7185 111.8107 60.5290 62.5175 174.7480 58 S 4.0953 7.6584 114.4034 59.2489 62.4509 174.5697 59 Q 4.6476 8.5215 126.6379 53.6644 28.6418 175.4350 60 G 4.1200 7.8381 109.0572 45.1168 0.0000 167.6976 61 F 3.3246 8.4070 118.0649 58.7088 36.5027 174.4846 62 S 4.6074 8.2024 116.5885 57.3518 67.2836 175.0213 63 G 4.7103 7.3677 124.4441 44.7669 0.0000 169.7487 64 P 4.2773 0.0000 0.0000 61.9894 31.0139 176.9048 65 S 4.4027 8.3334 119.5137 56.7553 65.3701 173.4145 66 S 4.6926 8.7915 118.6263 55.6967 65.7920 173.8651 67 G 3.7539 8.4365 110.5165 46.5069 0.0000 172.7015 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 G 8.35 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 2 S 7.62 4.34 0.00 3.90 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 3 S 8.91 4.10 0.00 3.83 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 4 G 8.95 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 0.00 0.00 0.00 5 S 8.95 3.56 0.00 4.03 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 6 S 8.20 4.30 0.00 3.76 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 8.46 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 8 P 0.00 4.36 0.00 2.15 2.06 0.00 3.69 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 9 S 8.12 4.46 0.00 3.88 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 10 H 8.70 4.41 0.00 3.19 3.30 0.00 5.81 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 S 7.99 4.46 0.00 3.92 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 12 L 8.80 3.47 0.00 1.83 1.78 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 7.84 4.59 0.00 1.91 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.91 0.00 0.00 0.00 0.00 0.00 2.16 2.27 0.00 14 A 8.33 4.15 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 15 P 0.00 4.25 0.00 2.41 2.37 0.00 3.76 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.05 0.00 16 E 8.29 4.14 0.00 2.47 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.55 0.00 17 V 7.64 3.58 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 0.78 0.00 0.00 0.94 0.00 0.00 18 R 7.97 3.81 0.00 1.32 0.74 0.00 2.79 0.00 0.00 2.88 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.34 0.00 19 F 7.47 5.66 0.00 3.07 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 20 S 8.04 4.38 0.00 4.09 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 0.00 21 K 8.19 3.82 0.00 1.86 1.93 0.00 1.73 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.55 1.60 7.81 22 E 8.07 4.06 0.00 2.40 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 23 M 8.20 4.07 0.00 2.19 2.40 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 3.07 0.00 24 E 8.58 4.04 0.00 2.02 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 0.00 2.38 2.50 0.00 25 C 7.59 4.17 0.00 3.16 3.01 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 0.00 0.00 0.00 0.00 26 L 8.78 4.29 0.00 1.95 1.86 0.87 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 27 Q 8.12 3.99 0.00 2.42 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.71 0.00 0.00 0.00 0.00 0.00 2.46 2.63 0.00 28 A 7.71 4.00 1.43 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 0.00 0.00 0.00 29 M 7.83 4.18 0.00 2.08 2.55 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.62 0.00 30 G 8.01 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 7.66 4.65 0.00 3.14 3.13 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 32 V 7.84 3.75 2.14 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 0.79 0.00 0.00 0.99 0.00 0.00 33 N 8.38 4.31 0.00 2.95 2.93 0.00 0.00 6.90 7.57 0.00 0.00 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 Y 8.45 4.14 0.00 3.18 2.95 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 35 N 8.58 3.79 0.00 2.94 2.93 0.00 0.00 6.87 7.60 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 36 A 7.96 4.15 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 37 N 8.47 4.12 0.00 2.80 2.84 0.00 0.00 6.72 7.91 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 38 L 8.23 4.01 0.00 1.26 1.39 0.65 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 39 Q 7.82 3.90 0.00 2.23 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.50 0.00 0.00 0.00 0.00 0.00 2.41 2.53 0.00 40 A 8.31 3.89 1.24 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 41 L 8.47 3.85 0.00 1.58 0.92 0.99 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.79 3.50 1.95 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 1.74 0.95 0.93 0.00 0.00 43 A 8.09 4.08 1.26 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 0.00 0.00 0.00 44 T 7.99 4.24 4.11 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 0.00 0.00 0.00 1.19 0.00 0.00 45 D 8.23 4.13 0.00 2.72 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 46 G 7.62 3.37 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 0.00 47 D 7.29 4.35 0.00 2.85 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 48 T 8.61 3.78 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 1.21 0.00 0.00 49 N 8.27 4.42 0.00 2.76 2.79 0.00 0.00 6.77 7.53 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 50 A 7.88 3.85 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 51 A 8.06 3.85 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 52 I 8.60 3.19 2.07 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.61 1.01 0.00 0.00 53 Y 8.76 3.91 0.00 3.11 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 54 K 9.03 3.97 0.00 1.94 1.81 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.49 7.81 55 L 8.08 3.87 0.00 1.40 1.69 0.45 0.86 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 56 K 8.59 4.08 0.00 1.77 1.89 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.73 1.62 7.81 57 S 7.72 4.22 0.00 4.18 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 58 S 7.66 4.10 0.00 3.96 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 59 Q 8.52 4.65 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.98 0.00 0.00 0.00 0.00 0.00 2.45 2.25 0.00 60 G 7.84 4.12 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 0.00 0.00 0.00 61 F 8.41 3.32 0.00 3.11 3.10 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 0.00 0.00 0.00 0.00 62 S 8.20 4.61 0.00 3.84 3.84 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 63 G 7.37 4.71 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 0.00 0.00 0.00 64 P 0.00 4.28 0.00 2.12 2.03 0.00 3.61 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.83 0.00 65 S 8.33 4.40 0.00 3.74 3.72 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.79 4.69 0.00 3.73 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 67 G 8.44 3.75 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 0.00 0.00 0.00