NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4078 0.0000 0.0000 61.8345 32.6465 176.0912 2 K 3.8931 8.5716 119.8016 56.1236 32.4640 175.6760 3 I 3.8336 9.3515 125.8589 61.5977 38.5008 175.4597 4 K 4.3564 8.5786 125.0157 55.8108 32.9488 176.4916 5 T 4.3807 8.2840 113.7891 60.7061 70.1187 176.5792 6 V 3.8903 8.6454 125.1270 62.2836 29.1693 176.6455 7 R 3.9888 8.3200 123.8093 58.9753 29.8175 177.7817 8 G 3.7651 8.2857 104.5271 48.0856 0.0000 175.3212 9 A 4.3402 8.5186 123.1747 54.5892 18.2433 178.9786 10 A 4.2471 7.6109 116.3365 53.2855 18.1243 177.7928 11 K 4.6172 7.6899 113.2936 56.4794 32.9242 176.9319 12 R 4.3756 8.1248 115.5092 55.1231 32.3306 174.5770 13 F 5.0861 7.5557 114.8421 55.7790 43.5165 174.8699 14 K 4.3811 8.8693 119.2991 55.6309 34.9601 174.3110 15 K 3.8586 9.3184 129.3102 57.6485 32.6568 176.5788 16 T 4.5838 8.4292 119.1496 60.5478 70.2389 175.5324 17 G 4.0082 7.7715 107.6396 48.6703 0.0000 173.3267 18 K 4.2009 7.3643 119.5975 55.3070 33.9371 176.8626 19 G 3.6563 9.0492 104.7411 48.6578 0.0000 173.5107 20 G 3.9057 7.7781 107.8822 45.7841 0.0000 173.3500 21 F 4.6638 8.2080 113.4257 56.3702 41.8414 171.7379 22 K 4.2712 8.5686 128.8028 56.1436 33.0765 173.5721 23 H 5.1635 9.3748 125.5526 54.0990 30.4270 171.7603 24 K 4.5574 8.3693 119.6332 54.8958 34.0137 176.6892 25 H 4.3138 8.7242 123.1147 55.9381 29.2409 175.0314 26 A 4.4387 8.3524 125.8398 52.0439 20.2345 176.0069 27 N 4.3318 8.9599 113.0343 54.5538 35.6532 175.2511 28 L 4.7673 7.4571 114.4660 52.7109 42.1393 175.0719 29 R 4.4643 7.2244 114.0689 56.5458 32.8122 174.1521 30 H 4.7891 8.0364 117.4561 55.4382 33.0905 173.9192 31 I 3.2228 7.4539 116.8557 62.5353 35.1267 173.1441 32 L 4.5654 7.5933 127.9014 54.8007 43.6337 178.8777 33 T 3.8298 8.0386 112.9315 64.5749 67.3527 174.5125 34 K 4.3995 7.9762 117.5625 56.5011 32.9793 175.9758 35 K 4.4883 7.4451 118.6815 54.6738 33.9540 176.6664 36 A 4.1183 8.3628 125.0256 52.0990 19.5261 178.8260 37 T 3.7660 8.6447 115.8744 64.9445 68.4441 176.4760 38 K 3.8013 7.9139 121.0294 59.0972 32.6082 178.4165 39 R 3.9594 7.6848 118.4728 59.5324 30.2726 178.5678 40 K 4.0099 8.2769 118.4109 59.3709 31.7681 179.3858 41 R 4.0049 8.4289 118.8208 59.1348 29.9579 176.9890 42 H 4.9054 7.7036 114.1003 55.8141 29.5193 175.8505 43 L 4.6814 7.7796 120.4591 54.4913 43.9191 178.4647 44 R 4.0211 8.2544 117.3680 58.4524 30.1001 175.1058 45 P 4.4999 0.0000 0.0000 62.6485 32.0859 174.7279 46 K 4.7420 8.1654 117.1464 55.2120 34.5623 175.8674 47 A 4.6746 8.0064 121.5663 50.7249 22.6997 176.2139 48 M 4.4307 8.6248 120.5292 55.1309 33.2948 176.8217 49 V 3.9077 8.5250 114.8709 61.3136 32.3773 177.6399 50 S 4.1878 8.9538 118.5957 59.1191 62.8742 176.7424 51 K 3.9459 9.3342 125.7225 57.9228 31.6841 178.4513 52 G 3.3841 8.7775 107.3369 47.6307 0.0000 173.9608 53 D 4.7778 7.5264 117.9210 53.7463 42.2805 177.7319 54 L 4.0221 7.4733 121.9276 58.2402 41.6453 178.8652 55 G 3.7252 8.0749 104.0804 47.8683 0.0000 175.1226 56 L 4.0433 7.4731 120.1213 57.5004 41.6051 179.1127 57 V 3.1590 7.5457 117.5620 65.6857 32.1772 176.3858 58 I 4.3410 7.4033 118.8605 59.0981 33.6738 173.8614 59 A 4.5681 7.0291 123.6503 53.3601 26.2678 177.7477 60 C 4.3276 7.6355 111.3721 60.9347 29.3409 173.4321 61 L 4.8593 7.2707 118.8469 52.4775 41.4167 175.5265 62 P 4.1442 0.0000 0.0000 65.1453 31.9367 177.5759 63 Y 4.5285 7.8798 113.1005 57.3515 38.4172 175.3985 64 A 4.3129 8.2170 129.6142 52.9118 18.4429 178.2085 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 P 0.00 4.41 0.00 2.21 2.13 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.01 0.00 2 K 8.57 3.89 0.00 1.86 1.88 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.49 1.53 7.81 3 I 9.35 3.83 2.01 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.51 0.96 0.00 0.00 4 K 8.58 4.36 0.00 1.77 1.76 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.38 7.81 5 T 8.28 4.38 4.31 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 6 V 8.65 3.89 2.20 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 1.15 0.00 0.00 0.93 0.00 0.00 7 R 8.32 3.99 0.00 1.94 2.00 0.00 3.34 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.82 0.00 8 G 8.29 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 0.00 0.00 0.00 9 A 8.52 4.34 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 10 A 7.61 4.25 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.69 4.62 0.00 1.89 1.77 0.00 1.65 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 1.35 1.60 7.81 12 R 8.12 4.38 0.00 0.88 1.24 0.00 2.95 0.00 0.00 3.07 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.60 0.00 13 F 7.56 5.09 0.00 2.76 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 14 K 8.87 4.38 0.00 1.70 1.75 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.56 7.81 15 K 9.32 3.86 0.00 1.90 1.72 0.00 1.82 0.00 0.00 1.71 0.00 0.00 2.72 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.34 0.89 7.81 16 T 8.43 4.58 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 17 G 7.77 4.01 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 0.00 0.00 0.00 18 K 7.36 4.20 0.00 1.80 1.60 0.00 1.48 0.00 0.00 1.66 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.28 1.36 7.81 19 G 9.05 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 20 G 7.78 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 21 F 8.21 4.66 0.00 3.25 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.57 4.27 0.00 1.93 1.88 0.00 1.72 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.52 7.81 23 H 9.37 5.16 0.00 3.07 3.40 0.00 5.46 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.37 4.56 0.00 1.64 1.66 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.29 1.33 7.81 25 H 8.72 4.31 0.00 3.43 3.22 0.00 5.74 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.35 4.44 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 27 N 8.96 4.33 0.00 2.92 3.00 0.00 0.00 6.56 7.85 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 28 L 7.46 4.77 0.00 1.53 1.53 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.22 4.46 0.00 1.86 1.93 0.00 3.00 0.00 0.00 3.10 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.46 0.00 30 H 8.04 4.79 0.00 3.05 3.13 0.00 5.75 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 31 I 7.45 3.22 1.83 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 1.40 0.73 0.89 0.00 0.00 32 L 7.59 4.57 0.00 1.73 1.67 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 33 T 8.04 3.83 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 34 K 7.98 4.40 0.00 1.89 1.88 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.36 1.44 7.81 35 K 7.45 4.49 0.00 1.99 1.75 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.39 1.42 7.81 36 A 8.36 4.12 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 37 T 8.64 3.77 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 1.20 0.00 0.00 38 K 7.91 3.80 0.00 1.72 1.83 0.00 1.74 0.00 0.00 1.58 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.26 1.34 7.81 39 R 7.68 3.96 0.00 1.89 2.15 0.00 3.23 0.00 0.00 3.33 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 40 K 8.28 4.01 0.00 1.83 1.85 0.00 1.72 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.65 7.81 41 R 8.43 4.00 0.00 1.95 2.09 0.00 3.27 0.00 0.00 3.23 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 42 H 7.70 4.91 0.00 3.29 3.24 0.00 5.67 0.00 0.00 0.00 0.00 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 7.78 4.68 0.00 1.79 1.65 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 44 R 8.25 4.02 0.00 1.81 2.00 0.00 3.22 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 45 P 0.00 4.50 0.00 2.19 2.11 0.00 3.72 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 2.03 1.99 0.00 46 K 8.17 4.74 0.00 1.63 1.90 0.00 1.90 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.36 7.81 47 A 8.01 4.67 1.05 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 0.00 0.00 0.00 0.00 0.00 48 M 8.62 4.43 0.00 1.96 2.05 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.53 0.00 49 V 8.53 3.91 2.16 0.00 0.00 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 1.16 0.00 0.00 50 S 8.95 4.19 0.00 4.03 4.18 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.33 3.95 0.00 2.03 2.02 0.00 1.57 0.00 0.00 1.67 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.43 7.81 52 G 8.78 3.38 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 0.00 53 D 7.53 4.78 0.00 2.86 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 54 L 7.47 4.02 0.00 1.73 1.83 1.18 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 55 G 8.07 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.47 4.04 0.00 1.75 1.63 0.89 0.93 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 57 V 7.55 3.16 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.69 0.00 0.00 0.47 0.00 0.00 58 I 7.40 4.34 1.89 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.07 0.98 0.00 0.00 59 A 7.03 4.57 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 60 C 7.64 4.33 0.00 2.95 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 61 L 7.27 4.86 0.00 1.61 1.60 0.69 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.14 0.00 1.93 1.96 0.00 3.72 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.26 0.00 63 Y 7.88 4.53 0.00 2.98 2.96 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 64 A 8.22 4.31 1.57 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 0.00 0.00 0.00 0.00 0.00 0.00