NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4821 8.1633 120.3268 54.6309 34.2268 176.8447 2 K 3.7749 8.0692 118.7686 58.8671 31.6978 176.5953 3 A 4.0131 8.8016 131.0567 54.5843 20.6591 180.0728 4 K 3.8546 7.4773 117.3030 59.6460 32.2546 177.9691 5 E 4.0858 7.7061 115.8728 59.0633 29.6286 177.7683 6 L 4.0148 7.6836 118.3013 55.5127 42.1307 177.2663 7 R 3.8957 8.5052 117.7297 57.3644 28.6638 176.3385 8 E 4.1962 7.9445 113.6195 55.9960 30.1181 173.1850 9 K 3.7672 7.8288 126.3553 55.6262 32.6618 175.8907 10 S 4.0726 8.7154 118.7990 62.3684 62.8320 176.5298 11 V 3.4692 8.0181 121.3396 66.0559 30.8007 177.2669 12 E 4.0564 8.1499 118.3708 59.6819 29.6664 179.2199 13 E 4.4978 7.9706 119.3598 58.7909 29.5737 178.7043 14 L 3.9249 7.9797 120.7096 58.5147 41.8522 178.8715 15 N 4.5558 7.6068 113.6712 56.2567 37.7481 176.4508 16 T 3.8835 8.0979 119.3680 66.1278 68.3408 175.7143 17 E 4.4807 8.1031 120.5094 58.9376 29.3945 178.7381 18 L 3.8867 7.5052 119.5727 58.2819 41.8363 178.8233 19 L 3.9668 7.5166 116.7693 58.3887 41.8039 178.7440 20 N 5.0609 8.2558 116.3725 56.4042 38.4295 176.9722 21 L 4.2616 8.4115 119.5722 56.7768 41.7844 176.6811 22 L 4.0327 8.1675 124.4911 56.5674 43.0473 175.4823 23 R 4.4535 8.8537 128.3008 57.2744 28.9755 178.2446 24 E 3.9968 7.9594 117.5769 58.9165 29.8549 178.4429 25 Q 4.3378 7.7128 117.4767 57.6337 30.6850 176.8048 26 F 4.2226 8.4153 121.8242 60.8190 39.4216 176.4865 27 N 4.1289 8.9627 116.2826 56.6220 38.5036 177.0056 28 L 3.9176 8.0411 119.4095 58.1068 41.4610 179.6655 29 R 3.8713 7.5575 116.0235 59.6160 30.2453 178.5516 30 M 3.9596 7.5615 117.5965 58.4686 31.9422 178.1484 31 Q 4.5315 8.9258 120.8527 58.7878 29.0452 178.8235 32 A 4.0992 8.4389 119.8359 54.4910 18.3943 178.6526 33 A 4.2908 7.9700 118.4307 53.2741 19.0601 178.1200 34 S 4.6732 7.8020 112.5485 58.3437 64.3086 175.3135 35 G 3.9382 7.6627 113.8159 44.4006 0.0000 177.9340 36 Q 2.9417 9.1697 123.5888 55.7210 28.1068 172.4477 37 L 3.7681 5.6200 128.9146 55.9492 42.2449 176.0298 38 Q 4.6870 8.5733 124.5936 56.0656 29.2822 176.6113 39 Q 4.6922 7.6550 118.3910 54.7712 28.6163 176.1777 40 S 4.1045 8.2829 117.9084 61.7892 63.4749 176.0442 41 H 4.1387 8.5415 119.0732 58.4026 27.4982 176.8340 42 L 4.1189 7.2620 120.2718 57.8094 41.6108 179.0861 43 L 4.0960 7.8452 116.9119 57.5483 41.3966 179.1071 44 K 4.0409 8.3726 119.9620 61.3800 32.4444 177.1777 45 Q 4.4541 8.9341 121.7389 55.6219 30.5148 174.3201 46 V 3.3463 8.9212 118.4379 64.5777 32.1384 175.1643 47 R 4.0422 8.1338 116.2669 59.7152 30.4260 178.5876 48 R 4.1506 7.4330 117.0655 59.6592 30.1174 178.5720 49 D 4.3171 8.0222 117.6286 57.3931 40.7548 178.5562 50 V 3.5333 8.5660 119.4190 66.7237 31.1264 177.2664 51 A 4.2310 8.9917 120.7343 55.5738 17.7502 179.3245 52 R 3.8160 8.5466 114.7682 59.5952 30.1770 178.9901 53 V 3.6283 8.1012 117.3823 66.5338 31.6622 178.3480 54 K 4.1069 8.8450 117.3795 59.3985 30.5355 179.4140 55 T 4.0415 8.8949 117.3395 67.4474 68.5400 175.2757 56 L 4.8164 8.5552 120.8957 54.6849 44.1828 175.4513 57 L 4.0915 8.5531 122.1843 56.2452 39.5522 176.0810 58 N 4.2947 6.9763 113.3202 55.2632 39.0173 176.1909 59 E 4.0175 8.6459 117.5220 59.9062 30.3337 179.7807 60 K 3.6586 8.2979 118.9261 58.8110 32.1857 176.3952 61 A 3.9376 8.3347 120.7063 52.0901 18.4876 176.2788 62 G 3.4837 7.7390 118.3508 45.1058 0.0000 172.9306 63 A 4.1916 7.5616 129.3794 52.0723 19.3165 176.8375 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 M 8.16 4.48 0.00 2.43 2.14 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.57 0.00 2 K 8.07 3.77 0.00 1.90 1.64 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.50 7.81 3 A 8.80 4.01 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 4 K 7.48 3.85 0.00 1.71 2.01 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.43 7.81 5 E 7.71 4.09 0.00 2.03 2.15 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 2.71 2.43 0.00 6 L 7.68 4.01 0.00 1.90 1.60 0.92 0.87 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 7 R 8.51 3.90 0.00 1.90 1.98 0.00 3.28 0.00 0.00 3.22 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.69 0.00 8 E 7.94 4.20 0.00 2.33 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.45 0.00 9 K 7.83 3.77 0.00 2.21 1.78 0.00 1.67 0.00 0.00 1.90 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.47 7.81 10 S 8.72 4.07 0.00 4.04 4.16 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 0.00 0.00 0.00 0.00 11 V 8.02 3.47 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 1.06 0.00 0.00 0.93 0.00 0.00 12 E 8.15 4.06 0.00 2.35 2.02 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 2.32 2.48 0.00 13 E 7.97 4.50 0.00 2.26 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 2.51 2.32 0.00 14 L 7.98 3.92 0.00 1.83 1.68 0.92 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 15 N 7.61 4.56 0.00 2.98 2.93 0.00 0.00 7.10 7.59 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 16 T 8.10 3.88 4.38 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 1.21 0.00 0.00 17 E 8.10 4.48 0.00 2.23 2.24 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 2.37 2.59 0.00 18 L 7.51 3.89 0.00 1.96 1.89 0.90 0.58 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 19 L 7.52 3.97 0.00 1.86 1.74 0.96 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 20 N 8.26 5.06 0.00 2.97 2.87 0.00 0.00 7.62 6.74 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 21 L 8.41 4.26 0.00 1.69 1.74 1.03 0.71 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 22 L 8.17 4.03 0.00 1.62 1.86 0.82 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 23 R 8.85 4.45 0.00 2.10 2.27 0.00 3.69 0.00 0.00 3.21 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 24 E 7.96 4.00 0.00 2.08 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 2.40 2.35 0.00 25 Q 7.71 4.34 0.00 2.21 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.76 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 26 F 8.42 4.22 0.00 3.13 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 27 N 8.96 4.13 0.00 3.00 2.92 0.00 0.00 7.14 6.34 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 28 L 8.04 3.92 0.00 1.84 1.72 0.90 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.56 3.87 0.00 1.79 1.79 0.00 3.16 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 30 M 7.56 3.96 0.00 1.85 2.01 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.06 0.00 31 Q 8.93 4.53 0.00 2.09 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 32 A 8.44 4.10 1.34 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 0.00 0.00 0.00 33 A 7.97 4.29 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 34 S 7.80 4.67 0.00 4.15 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 35 G 7.66 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 36 Q 9.17 2.94 0.00 2.22 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.67 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 37 L 5.62 3.77 0.00 1.58 1.64 0.93 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 8.57 4.69 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 7.05 0.00 0.00 0.00 0.00 0.00 2.22 2.34 0.00 39 Q 7.65 4.69 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.94 0.00 0.00 0.00 0.00 0.00 2.36 2.26 0.00 40 S 8.28 4.10 0.00 4.06 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 41 H 8.54 4.14 0.00 3.39 3.62 0.00 5.48 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 42 L 7.26 4.12 0.00 1.87 1.73 0.62 1.39 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 43 L 7.85 4.10 0.00 1.77 1.73 0.91 0.83 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 44 K 8.37 4.04 0.00 1.95 2.00 0.00 1.53 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.54 7.81 45 Q 8.93 4.45 0.00 2.09 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 5.94 0.00 0.00 0.00 0.00 0.00 2.39 2.52 0.00 46 V 8.92 3.35 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 0.97 0.00 0.00 0.96 0.00 0.00 47 R 8.13 4.04 0.00 1.89 2.00 0.00 3.21 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.03 0.00 48 R 7.43 4.15 0.00 1.71 2.00 0.00 3.31 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.74 0.00 49 D 8.02 4.32 0.00 2.99 2.71 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 50 V 8.57 3.53 2.27 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 1.01 0.00 0.00 0.97 0.00 0.00 51 A 8.99 4.23 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.55 3.82 0.00 2.03 2.01 0.00 3.28 0.00 0.00 3.09 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 53 V 8.10 3.63 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 0.90 0.00 0.00 1.00 0.00 0.00 54 K 8.85 4.11 0.00 1.87 1.87 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.60 7.81 55 T 8.89 4.04 4.40 0.00 0.00 0.00 0.00 0.00 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 56 L 8.56 4.82 0.00 1.68 1.66 1.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 57 L 8.55 4.09 0.00 2.00 1.84 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 58 N 6.98 4.29 0.00 2.94 2.70 0.00 0.00 7.13 7.54 0.00 0.00 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 E 8.65 4.02 0.00 2.18 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 2.38 2.41 0.00 60 K 8.30 3.66 0.00 1.73 2.07 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.17 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.41 7.81 61 A 8.33 3.94 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 62 G 7.74 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.56 4.19 1.18 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 0.00 0.00