NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5522 8.3049 120.3270 54.6205 33.9790 175.4230 2 K 3.8620 8.9414 126.7963 57.3471 31.1288 177.5412 3 A 4.0556 9.3499 135.0000 54.4604 20.6759 180.3634 4 K 3.8228 8.2787 116.6972 59.7072 32.2669 177.5593 5 E 4.0216 7.6939 116.6380 59.1357 29.6681 177.1208 6 L 4.0492 7.7522 120.1539 55.7213 42.6446 177.8775 7 R 4.1232 8.6616 118.7850 57.0585 29.8990 177.6387 8 E 3.8675 8.0272 115.9649 57.0140 29.8694 174.2033 9 K 3.8722 7.2361 126.7056 55.4428 33.9587 176.4093 10 S 4.0320 8.4657 119.8354 61.6626 61.4687 176.6974 11 V 3.5558 7.9655 121.6704 65.9470 30.9102 177.5125 12 E 3.9424 8.2122 117.5848 59.6742 29.2764 178.7777 13 E 4.2587 8.2666 117.7000 59.8616 29.3569 179.4263 14 L 3.9803 8.0567 118.4472 57.1119 42.0803 178.1472 15 N 4.8079 7.4822 114.3663 53.8084 39.0817 176.4356 16 T 3.9075 8.5152 117.6313 66.5525 68.4092 175.8832 17 E 3.9766 8.2882 119.6142 59.4253 29.4246 178.8291 18 L 3.8658 7.4059 119.8817 58.4017 41.6203 178.8613 19 L 3.9697 7.7426 117.9833 58.2471 41.3768 178.8508 20 N 5.0051 8.0980 116.7342 56.2331 38.4640 176.8610 21 L 4.2641 8.1097 119.6549 56.7601 41.7159 176.6719 22 L 3.7329 8.1643 124.8503 56.3547 43.1410 176.1654 23 R 4.4623 8.8823 129.6195 57.5719 28.8224 178.5343 24 E 4.2180 7.5699 117.4250 58.3643 29.7791 178.1206 25 Q 4.4119 7.7290 116.8119 56.1526 31.3230 176.9135 26 F 4.2813 8.4176 119.7943 61.2225 39.4100 176.7493 27 N 4.2205 8.8109 116.4042 56.4772 38.1979 176.9801 28 L 3.9702 7.8988 118.1898 58.1337 41.9220 179.2126 29 R 4.0065 7.4535 117.3277 59.7610 30.0348 178.9192 30 M 4.0048 7.5523 117.2536 58.4295 31.9727 178.3205 31 Q 4.1319 8.4430 118.0450 57.9369 29.4597 176.5707 32 A 4.9392 8.0358 120.3446 53.3854 20.9745 177.6591 33 A 4.5654 8.4422 117.5096 52.4625 18.0773 178.8754 34 S 4.5466 8.3700 111.5395 61.1716 66.9559 175.1149 35 G 3.9864 7.7717 109.2684 42.7055 0.0000 175.1137 36 Q 2.8757 9.2845 123.2270 57.4575 27.7865 175.1740 37 L 3.5377 8.1822 106.1637 57.6838 38.3268 174.7203 38 Q 4.3088 8.0437 117.1900 56.3097 29.2955 175.8476 39 Q 4.7216 7.5934 118.1438 54.3345 30.7839 175.3569 40 S 4.6002 8.7799 117.0553 60.4601 64.5159 175.9953 41 H 4.0913 8.5209 118.6450 58.2672 27.4811 177.0753 42 L 4.0002 7.6341 120.4924 57.6878 40.2376 178.8540 43 L 4.1054 8.1080 119.1706 57.6481 41.2892 179.1204 44 K 3.7323 8.0852 118.9495 60.8849 32.2080 177.6194 45 Q 4.2910 8.9204 117.5634 56.3713 31.3164 175.3012 46 V 3.6576 8.6194 123.8739 65.4213 31.2860 174.9470 47 R 3.9223 7.1180 116.6039 59.5693 29.8148 179.2683 48 R 4.0313 7.6353 117.4570 59.3309 30.0580 178.8692 49 D 4.3624 8.0092 118.3286 57.4968 40.5177 178.9117 50 V 3.5855 7.9914 118.5146 65.6899 31.4214 177.5924 51 A 4.0466 8.2846 121.0385 55.8125 18.1383 179.2743 52 R 3.9570 8.7361 116.9488 59.5525 29.9192 179.0744 53 V 3.6208 7.7928 117.8094 66.4445 32.2650 178.0845 54 K 4.0391 9.1397 118.6369 59.8234 31.9258 179.3920 55 T 3.8382 8.5330 116.5840 67.2254 68.5220 175.1267 56 L 4.4199 8.2208 118.9729 54.9841 43.6864 176.0598 57 L 4.0016 8.2138 124.7093 56.8740 42.2271 176.2492 58 N 4.2798 7.0528 116.1080 55.7030 39.3571 176.2856 59 E 3.4675 7.8725 117.0603 59.3740 29.7531 178.7515 60 K 3.9189 7.4939 118.4762 58.9714 32.2707 177.5630 61 A 3.8671 8.4252 121.9540 53.9496 18.4812 177.5690 62 G 4.1968 8.8808 113.1574 46.0725 0.0000 173.6146 63 A 4.2589 8.0550 127.3400 51.9069 19.0870 177.9749 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 8.30 4.55 0.00 2.01 2.40 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.63 0.00 2 K 8.94 3.86 0.00 1.90 1.57 0.00 1.66 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 9.35 4.06 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 8.28 3.82 0.00 1.72 1.88 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.44 7.81 5 E 7.69 4.02 0.00 2.13 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.37 0.00 6 L 7.75 4.05 0.00 1.68 1.70 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 7 R 8.66 4.12 0.00 2.10 2.03 0.00 3.28 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.70 0.00 8 E 8.03 3.87 0.00 2.34 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.39 0.00 9 K 7.24 3.87 0.00 1.98 1.74 0.00 1.56 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.40 7.81 10 S 8.47 4.03 0.00 4.09 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 0.00 11 V 7.97 3.56 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 8.21 3.94 0.00 2.40 1.98 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 2.66 2.40 0.00 13 E 8.27 4.26 0.00 2.07 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 2.56 2.39 0.00 14 L 8.06 3.98 0.00 1.60 1.77 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 15 N 7.48 4.81 0.00 3.01 3.02 0.00 0.00 6.83 7.10 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 16 T 8.52 3.91 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 17 E 8.29 3.98 0.00 2.18 2.23 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 2.30 2.68 0.00 18 L 7.41 3.87 0.00 1.74 1.90 0.90 0.57 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 7.74 3.97 0.00 2.02 1.72 0.92 0.50 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 20 N 8.10 5.01 0.00 3.01 2.86 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 8.11 4.26 0.00 1.72 1.73 1.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 22 L 8.16 3.73 0.00 1.54 1.77 0.84 1.09 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 23 R 8.88 4.46 0.00 2.09 2.31 0.00 3.37 0.00 0.00 3.19 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.55 0.00 24 E 7.57 4.22 0.00 1.91 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 2.32 2.28 0.00 25 Q 7.73 4.41 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.75 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 26 F 8.42 4.28 0.00 3.15 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 27 N 8.81 4.22 0.00 2.94 2.89 0.00 0.00 7.08 6.65 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 28 L 7.90 3.97 0.00 1.75 1.74 0.90 0.94 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 29 R 7.45 4.01 0.00 1.67 1.85 0.00 3.00 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.80 0.00 30 M 7.55 4.00 0.00 1.89 2.01 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 31 Q 8.44 4.13 0.00 2.05 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.73 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 32 A 8.04 4.94 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 33 A 8.44 4.57 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 34 S 8.37 4.55 0.00 4.02 3.79 0.00 0.00 0.00 0.00 0.00 0.00 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 7.77 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 36 Q 9.28 2.88 0.00 2.41 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.41 0.00 0.00 0.00 0.00 0.00 2.28 2.41 0.00 37 L 8.18 3.54 0.00 1.97 1.73 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 8.04 4.31 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.70 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 39 Q 7.59 4.72 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.73 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 40 S 8.78 4.60 0.00 4.03 4.09 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 41 H 8.52 4.09 0.00 3.40 3.61 0.00 5.48 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 7.63 4.00 0.00 1.55 1.72 0.60 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.11 4.11 0.00 1.79 1.70 0.90 0.72 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 44 K 8.09 3.73 0.00 1.87 2.05 0.00 1.61 0.00 0.00 1.82 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.62 7.81 45 Q 8.92 4.29 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 5.78 0.00 0.00 0.00 0.00 0.00 2.41 2.54 0.00 46 V 8.62 3.66 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 1.09 0.00 0.00 0.97 0.00 0.00 47 R 7.12 3.92 0.00 2.10 1.96 0.00 3.19 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.98 0.00 48 R 7.64 4.03 0.00 1.76 1.99 0.00 3.14 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 49 D 8.01 4.36 0.00 2.92 2.92 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 50 V 7.99 3.59 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 1.02 0.00 0.00 0.99 0.00 0.00 51 A 8.28 4.05 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.74 3.96 0.00 2.00 1.97 0.00 3.16 0.00 0.00 3.10 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 53 V 7.79 3.62 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 0.88 0.00 0.00 1.04 0.00 0.00 54 K 9.14 4.04 0.00 1.90 1.86 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.64 7.81 55 T 8.53 3.84 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 8.22 4.42 0.00 1.78 1.65 0.92 1.12 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 L 8.21 4.00 0.00 1.90 1.76 0.96 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 58 N 7.05 4.28 0.00 2.80 2.94 0.00 0.00 6.96 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 59 E 7.87 3.47 0.00 2.22 2.11 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 2.32 2.59 0.00 60 K 7.49 3.92 0.00 2.15 1.93 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.55 7.81 61 A 8.43 3.87 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 62 G 8.88 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 0.00 0.00 0.00 63 A 8.05 4.26 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