NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4095 0.0000 0.0000 61.9234 32.6440 176.1592 2 K 3.9733 8.6142 121.7368 55.8736 32.5291 175.4872 3 I 3.8734 9.3508 126.0012 61.4765 38.5565 175.4534 4 K 4.3648 8.5152 124.8579 55.6441 33.0608 176.5509 5 T 4.2918 8.2303 113.5441 60.8001 70.0133 176.3504 6 V 3.8349 8.7468 124.8233 62.4232 29.7828 176.7097 7 R 3.9939 8.4551 123.6077 59.3074 29.9982 177.9290 8 G 3.8879 8.2455 103.2418 48.1523 0.0000 174.7850 9 A 4.3990 8.2715 122.4488 54.6635 18.4244 179.0416 10 A 4.2439 7.6913 115.7722 53.3624 18.1047 177.8562 11 K 4.5959 8.0014 114.2360 56.5921 32.8944 176.6858 12 R 4.4574 8.3055 115.7546 55.3315 31.8909 174.4563 13 F 4.9636 7.6852 115.1323 55.8229 43.4373 174.9014 14 K 4.3801 9.1209 117.1326 55.5911 34.1141 174.0350 15 K 3.4261 8.9011 127.9755 56.9119 32.4842 176.3773 16 T 4.5640 8.4284 119.0066 60.6945 69.9453 175.1408 17 G 3.8821 8.6459 108.3954 48.3699 0.0000 173.6254 18 K 4.0671 7.4221 120.8308 55.5931 34.8283 176.7744 19 G 3.8044 9.1339 104.7573 48.7424 0.0000 173.1093 20 G 4.1307 7.5290 109.6038 44.5835 0.0000 173.6113 21 F 4.5642 8.8412 117.5573 55.8610 41.5593 172.4201 22 K 4.1745 8.5363 127.4672 56.1156 33.4271 173.4851 23 H 5.0170 9.2751 124.2051 54.2938 30.1326 171.6791 24 K 4.5831 8.3743 119.0848 54.8797 34.5824 176.5075 25 H 4.4311 8.6133 122.2315 55.7865 29.1320 175.1954 26 A 4.4442 8.3596 125.2239 51.8087 20.7226 177.1770 27 N 4.8562 8.8055 112.7659 54.4476 36.0883 174.4654 28 L 4.9317 7.1673 117.8436 54.1881 42.5501 177.0778 29 R 4.5165 7.2672 108.4996 54.6095 29.5409 173.7872 30 H 4.3157 8.7200 114.7417 58.3935 32.2982 174.1389 31 I 3.1937 8.0010 117.9939 62.3594 35.3699 172.6873 32 L 4.5744 7.6710 126.2806 54.9032 44.0643 178.5637 33 T 3.8555 8.1376 112.6791 64.5665 67.1381 174.0889 34 K 4.6276 7.7421 118.9904 56.5514 33.3048 176.2432 35 K 4.4588 7.9838 117.7871 54.5561 35.6750 176.9719 36 A 3.9546 8.7435 125.1427 52.9247 19.1729 178.2349 37 T 3.8250 8.7573 115.9012 65.0331 68.5812 176.3422 38 K 3.7429 7.9155 121.6641 59.2932 32.1478 178.1555 39 R 3.8521 7.8909 117.0533 59.8379 30.0753 178.0250 40 K 4.1288 8.0528 117.8492 59.2991 31.8661 179.2657 41 R 3.9784 8.3045 118.0525 58.5811 29.8918 177.1580 42 H 4.9878 7.6055 113.8259 55.6675 29.3575 174.7341 43 L 4.6804 8.3500 121.4931 54.9001 43.9926 178.3710 44 R 4.0757 8.2486 117.3272 58.4435 30.1772 175.6618 45 P 4.4576 0.0000 0.0000 62.4382 31.9598 175.8642 46 K 4.4528 8.2540 118.5323 56.2875 33.1954 176.2588 47 A 4.7067 8.0402 123.2272 50.2292 22.5237 175.9631 48 M 4.5268 8.6393 120.4639 55.0315 33.3606 176.7513 49 V 3.9359 8.5307 114.7067 61.2454 32.4068 177.7489 50 S 4.1032 8.9950 119.1755 59.0770 63.0443 176.5472 51 K 3.9137 8.8346 118.7954 57.5467 31.3110 176.6694 52 G 3.8393 8.3066 107.1191 47.2964 0.0000 174.7344 53 D 4.6829 7.4629 118.7671 53.8674 42.0763 178.0068 54 L 3.9426 8.1619 121.4891 58.3895 41.5241 178.6814 55 G 3.7730 8.1229 103.9635 47.9503 0.0000 175.0798 56 L 4.0464 8.0048 121.3845 57.4575 41.7006 179.4766 57 V 3.0436 7.5017 117.6023 65.7287 31.5088 177.5572 58 I 4.0398 7.3442 118.2128 60.5426 36.4586 176.0347 59 A 4.6585 7.4105 120.1820 53.1882 25.4942 177.9745 60 C 4.3188 7.9975 113.0425 60.9153 29.3190 173.3027 61 L 4.8916 7.2223 118.7979 52.0428 41.4170 174.9332 62 P 4.1481 0.0000 0.0000 65.5449 31.8938 177.4364 63 Y 4.2942 8.0121 111.9839 57.2814 38.3104 175.3167 64 A 4.3044 7.9917 129.1420 52.8552 18.4201 177.6846 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 2.14 0.00 3.75 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 8.61 3.97 0.00 1.84 1.86 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.51 1.54 7.81 3 I 9.35 3.87 2.07 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 1.46 0.54 0.97 0.00 0.00 4 K 8.52 4.36 0.00 1.76 1.74 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.43 7.81 5 T 8.23 4.29 4.29 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 6 V 8.75 3.83 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 1.12 0.00 0.00 0.95 0.00 0.00 7 R 8.46 3.99 0.00 1.94 2.02 0.00 3.33 0.00 0.00 3.40 7.54 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 8.25 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 9 A 8.27 4.40 1.31 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 0.00 0.00 0.00 10 A 7.69 4.24 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 8.00 4.60 0.00 1.87 1.83 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.79 7.81 12 R 8.31 4.46 0.00 1.37 1.49 0.00 3.23 0.00 0.00 3.21 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.62 0.00 13 F 7.69 4.96 0.00 2.86 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 14 K 9.12 4.38 0.00 1.81 1.77 0.00 1.90 0.00 0.00 1.65 0.00 0.00 2.78 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.35 1.51 7.81 15 K 8.90 3.43 0.00 1.63 1.61 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.69 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.22 0.75 7.81 16 T 8.43 4.56 4.20 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 1.26 0.00 0.00 17 G 8.65 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 18 K 7.42 4.07 0.00 1.79 1.56 0.00 1.56 0.00 0.00 1.68 0.00 0.00 3.07 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.39 7.81 19 G 9.13 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 0.00 0.00 0.00 20 G 7.53 4.13 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 0.00 0.00 0.00 21 F 8.84 4.56 0.00 3.33 3.32 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 22 K 8.54 4.17 0.00 1.89 1.83 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.32 1.37 7.81 23 H 9.28 5.02 0.00 2.93 2.98 0.00 5.45 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 4.58 0.00 1.62 1.64 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.27 1.32 7.81 25 H 8.61 4.43 0.00 3.42 3.20 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 8.36 4.44 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 27 N 8.81 4.86 0.00 2.86 2.91 0.00 0.00 6.50 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 7.17 4.93 0.00 1.47 1.59 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.27 4.52 0.00 1.90 1.92 0.00 3.13 0.00 0.00 3.13 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.57 0.00 30 H 8.72 4.32 0.00 3.04 3.14 0.00 5.82 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 8.00 3.19 1.77 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.82 0.82 0.00 0.00 32 L 7.67 4.57 0.00 1.72 1.66 0.93 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 33 T 8.14 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 1.20 0.00 0.00 34 K 7.74 4.63 0.00 1.88 1.86 0.00 1.56 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.32 1.42 7.81 35 K 7.98 4.46 0.00 1.89 1.70 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.35 1.34 7.81 36 A 8.74 3.95 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 37 T 8.76 3.82 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 7.92 3.74 0.00 1.78 1.78 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.33 1.31 7.81 39 R 7.89 3.85 0.00 1.82 2.20 0.00 3.28 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.74 0.00 40 K 8.05 4.13 0.00 1.85 1.84 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.66 7.81 41 R 8.30 3.98 0.00 1.92 2.07 0.00 3.23 0.00 0.00 3.21 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 42 H 7.61 4.99 0.00 3.30 3.22 0.00 5.66 0.00 0.00 0.00 0.00 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.35 4.68 0.00 1.72 1.68 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 44 R 8.25 4.08 0.00 1.82 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 1.65 1.63 0.00 45 P 0.00 4.46 0.00 2.18 2.06 0.00 3.76 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.01 0.00 46 K 8.25 4.45 0.00 1.63 1.84 0.00 1.87 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.37 7.81 47 A 8.04 4.71 0.98 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 0.00 0.00 48 M 8.64 4.53 0.00 1.97 2.05 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.52 0.00 49 V 8.53 3.94 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 1.20 0.00 0.00 1.20 0.00 0.00 50 S 8.99 4.10 0.00 4.03 4.20 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 K 8.83 3.91 0.00 1.90 2.00 0.00 1.63 0.00 0.00 1.83 0.00 0.00 3.16 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.40 1.44 7.81 52 G 8.31 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 0.00 0.00 0.00 53 D 7.46 4.68 0.00 2.89 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 8.16 3.94 0.00 1.82 1.74 1.19 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 55 G 8.12 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 56 L 8.00 4.05 0.00 1.82 1.61 0.89 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.50 3.04 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 -0.67 0.00 0.00 0.29 0.00 0.00 58 I 7.34 4.04 1.88 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.96 1.03 0.00 0.00 59 A 7.41 4.66 1.23 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 60 C 8.00 4.32 0.00 2.82 2.88 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 61 L 7.22 4.89 0.00 1.69 1.61 0.74 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.15 0.00 2.09 2.06 0.00 3.75 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.25 0.00 63 Y 8.01 4.29 0.00 2.98 3.02 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 64 A 7.99 4.30 1.58 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