NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3031 8.1631 117.3743 63.1906 69.1914 173.4912 2 G 3.5870 8.4314 115.9188 44.7166 0.0000 171.2116 3 A 4.4053 8.0130 122.0426 52.2123 21.1621 177.6214 4 G 4.2062 7.7829 112.7457 46.3950 0.0000 176.6773 5 T 3.8613 8.3205 118.0826 66.0238 68.6638 173.8490 6 P 4.1964 0.0000 0.0000 65.4501 31.0605 177.0248 7 S 4.5596 8.6764 114.1490 58.8317 63.6988 176.0072 8 Q 4.1285 8.3604 121.0599 58.4525 28.6395 178.4764 9 G 3.7355 8.0692 105.5769 47.5861 0.0000 174.0001 10 K 4.3394 7.8353 117.3124 56.5718 32.6773 177.8765 11 K 4.3991 7.5904 120.2124 55.3156 30.0864 176.1352 12 N 5.0814 7.9651 119.8386 52.5155 38.3757 175.0378 13 T 4.5249 7.9847 114.5708 63.1542 70.3337 174.2523 14 T 4.4659 8.3079 122.3611 62.6156 69.4097 172.9586 15 T 4.3702 7.5755 114.2463 63.0473 70.8656 172.5837 16 H 4.9645 7.9684 119.9638 54.7695 30.0313 174.3775 17 T 4.8296 9.3804 112.7879 59.0653 72.9827 172.8954 18 K 4.1522 8.8222 122.4318 57.6829 32.7464 175.0360 19 C 4.3194 9.2461 128.2415 58.1557 32.2063 174.3509 20 R 3.6969 8.3876 126.7529 59.0352 30.0171 177.3020 21 R 3.8001 7.3323 116.7958 57.9044 30.2174 176.4025 22 C 4.4878 7.7704 109.6099 57.1171 30.6059 174.9208 23 G 3.8141 8.1234 108.3792 46.0634 0.0000 173.3332 24 E 4.4865 7.3670 119.5623 54.0797 31.6985 176.1924 25 K 4.5330 8.0663 124.1811 55.9482 30.0573 176.6459 26 S 4.8181 7.6986 113.0627 58.3030 66.6184 174.5022 27 Y 4.7521 8.7435 123.9052 57.0959 38.9352 174.4281 28 H 4.6320 8.9404 129.1208 55.6486 29.4298 175.4345 29 T 4.2574 8.8569 122.3201 64.4578 67.0872 175.1349 30 K 4.2153 8.2888 119.3143 57.8830 32.7167 177.6332 31 K 4.0693 7.6850 116.1649 55.6080 33.1925 176.2089 32 K 3.2610 8.9042 117.2850 56.3637 29.8026 176.0325 33 V 4.5554 6.4954 116.5459 61.7067 35.2094 172.0570 34 C 5.0637 9.2867 128.4053 58.6040 32.0273 174.2357 35 S 4.4713 8.9112 121.7778 59.9505 63.2722 174.9086 36 S 4.5352 8.2209 115.2266 60.1710 63.0966 174.3698 37 C 4.3798 8.1270 112.9820 57.6986 30.5489 175.0430 38 G 3.9405 8.3406 108.9722 45.1976 0.0000 173.1283 39 F 4.3913 8.0631 122.4192 59.9628 39.6337 175.8282 40 G 3.5811 8.4892 116.0727 44.7950 0.0000 173.4722 41 K 4.3524 8.2552 119.2207 57.1747 33.7801 176.0612 42 S 4.7311 7.5942 109.5460 56.1946 66.1400 173.6399 43 A 4.1838 8.5925 124.4776 54.9602 18.5915 178.9296 44 K 4.2420 7.7135 113.4852 56.2438 32.8797 176.7808 45 R 4.4401 8.1780 120.6796 55.5397 31.0804 176.5153 46 R 3.8025 8.6910 124.6554 56.9518 30.5912 175.4032 47 D 4.3675 7.3292 121.7193 53.8674 44.1252 174.3092 48 Y 4.5081 8.2369 122.4249 55.7392 41.2699 176.5765 49 E 3.9707 8.5453 121.8305 59.0039 29.8025 178.7018 50 W 4.6585 7.6014 113.0949 57.2949 28.1332 176.4291 51 Q 4.5254 7.6017 117.1532 56.4961 28.2480 175.4592 52 S 4.6600 7.5865 110.5312 56.7280 66.0624 174.6787 53 K 3.9461 8.6123 120.4809 56.7295 32.5221 177.7635 54 A 4.0158 8.9534 125.5528 55.4853 18.3129 179.6554 55 G 4.0645 7.7603 102.4483 45.1332 0.0000 173.2753 56 E 4.2675 7.9155 125.7117 56.4425 30.0120 174.3743 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 T 8.16 4.30 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 2 G 8.43 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 3 A 8.01 4.41 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 4 G 7.78 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 0.00 0.00 0.00 0.00 5 T 8.32 3.86 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 6 P 0.00 4.20 0.00 2.17 2.20 0.00 3.71 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 2.09 2.00 0.00 7 S 8.68 4.56 0.00 4.12 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 8 Q 8.36 4.13 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 9 G 8.07 3.74 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 0.00 0.00 0.00 10 K 7.84 4.34 0.00 1.75 1.85 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.39 1.45 7.81 11 K 7.59 4.40 0.00 1.89 1.78 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.47 1.45 7.81 12 N 7.97 5.08 0.00 2.77 2.82 0.00 0.00 6.27 7.71 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 13 T 7.98 4.52 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 14 T 8.31 4.47 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 15 T 7.58 4.37 3.67 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 16 H 7.97 4.96 0.00 3.07 3.49 0.00 5.64 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 9.38 4.83 4.34 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 0.00 0.00 1.27 0.00 0.00 18 K 8.82 4.15 0.00 1.79 1.81 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.52 7.81 19 C 9.25 4.32 0.00 3.15 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 20 R 8.39 3.70 0.00 1.50 1.42 0.00 3.01 0.00 0.00 3.05 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.48 0.00 21 R 7.33 3.80 0.00 0.67 1.47 0.00 3.34 0.00 0.00 3.30 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.39 0.00 22 C 7.77 4.49 0.00 3.10 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 23 G 8.12 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 24 E 7.37 4.49 0.00 2.05 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.41 0.00 25 K 8.07 4.53 0.00 1.80 1.77 0.00 1.74 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.52 7.81 26 S 7.70 4.82 0.00 3.87 3.85 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 27 Y 8.74 4.75 0.00 3.10 3.09 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 0.00 0.00 0.00 0.00 28 H 8.94 4.63 0.00 3.11 3.00 0.00 5.67 0.00 0.00 0.00 0.00 6.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 T 8.86 4.26 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 1.23 0.00 0.00 30 K 8.29 4.22 0.00 1.78 1.81 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.48 7.81 31 K 7.69 4.07 0.00 1.51 1.70 0.00 1.76 0.00 0.00 1.58 0.00 0.00 2.82 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.14 0.75 7.81 32 K 8.90 3.26 0.00 1.83 1.90 0.00 1.86 0.00 0.00 1.54 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.50 7.81 33 V 6.50 4.56 2.01 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 1.03 0.00 0.00 0.98 0.00 0.00 34 C 9.29 5.06 0.00 3.43 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 35 S 8.91 4.47 0.00 4.12 4.10 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 36 S 8.22 4.54 0.00 3.91 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 37 C 8.13 4.38 0.00 3.18 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 38 G 8.34 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 39 F 8.06 4.39 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 40 G 8.49 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.26 4.35 0.00 1.66 1.98 0.00 1.80 0.00 0.00 1.81 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.34 7.81 42 S 7.59 4.73 0.00 3.95 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 43 A 8.59 4.18 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 44 K 7.71 4.24 0.00 1.73 1.71 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.45 7.81 45 R 8.18 4.44 0.00 1.66 1.82 0.00 3.20 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 46 R 8.69 3.80 0.00 1.89 1.99 0.00 3.46 0.00 0.00 3.40 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.68 0.00 47 D 7.33 4.37 0.00 2.49 2.22 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 48 Y 8.24 4.51 0.00 1.43 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 0.00 0.00 0.00 49 E 8.55 3.97 0.00 2.04 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 2.37 2.25 0.00 50 W 7.60 4.66 0.00 3.45 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 51 Q 7.60 4.53 0.00 1.99 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.66 0.00 0.00 0.00 0.00 0.00 2.09 1.67 0.00 52 S 7.59 4.66 0.00 3.98 3.80 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 53 K 8.61 3.95 0.00 1.83 1.82 0.00 1.73 0.00 0.00 1.86 0.00 0.00 2.96 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.57 1.43 7.81 54 A 8.95 4.02 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 55 G 7.76 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 56 E 7.92 4.27 0.00 1.88 1.89 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 2.22 2.23 0.00