NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3825 8.3044 120.3479 55.2651 33.7065 174.3812 2 L 4.5290 8.2176 126.7485 52.5824 45.3096 172.9503 3 L 5.2688 9.4287 128.9761 53.2661 45.7695 174.7452 4 L 4.9092 8.9722 125.1539 52.8630 45.1682 175.3214 5 R 4.9772 8.5894 122.4629 54.7104 32.6334 174.2456 6 I 4.5056 8.7973 127.8194 60.1637 39.2876 174.7280 7 T 5.3709 8.4649 122.8997 61.3153 70.9441 173.3042 8 M 4.6107 8.3495 124.0496 53.8074 35.9852 173.6626 9 L 4.5421 8.0127 124.8643 54.5221 42.4182 176.8945 10 E 3.9809 8.8116 123.2168 57.8016 29.8961 177.0663 11 G 3.8643 8.9140 108.2911 45.6712 0.0000 174.5926 12 R 4.2889 7.6414 118.8555 55.1635 31.4934 176.7513 13 S 4.4882 8.9198 116.4124 58.2048 65.3951 175.5254 14 T 3.9852 8.2480 112.4690 64.6101 68.7579 176.5428 15 E 3.9434 8.1738 120.9706 59.4658 29.6554 179.1002 16 Q 3.9977 8.2137 117.8793 59.0688 28.8157 179.3119 17 K 3.9925 8.0391 119.0540 59.3561 32.0137 179.3750 18 A 4.0150 8.0951 121.1530 55.1015 18.2925 179.3321 19 E 3.8873 8.3699 117.9442 59.1074 29.6350 178.9013 20 L 3.9333 7.8695 119.9797 57.9394 42.2830 178.7478 21 A 3.9774 8.0204 120.7765 55.0951 18.3547 179.6407 22 R 3.7916 8.3574 117.3317 59.6291 30.1762 178.6748 23 A 4.0191 8.4628 121.0006 55.1183 18.2835 179.6298 24 L 4.0061 8.1690 117.6123 57.6966 41.7304 179.7696 25 S 4.1067 7.9801 114.5365 61.6764 62.8198 176.6619 26 A 4.0020 8.1147 123.1346 55.0308 17.9968 179.5394 27 A 3.8714 8.4349 119.5806 55.0893 18.3413 179.8395 28 A 3.7216 8.3202 119.2730 55.1216 18.6907 179.3562 29 A 4.0472 8.0133 119.2207 55.5889 17.9977 179.8594 30 A 3.8724 7.9531 118.6096 55.2604 18.3095 179.7607 31 A 3.7644 7.8531 118.3562 54.5641 18.3876 178.9285 32 F 4.9125 7.8030 113.3793 56.0839 40.1775 175.7658 33 D 4.4353 7.6280 117.0907 55.9036 38.7825 174.0617 34 V 4.5466 7.5054 109.3099 58.4586 35.4559 174.8712 35 P 4.2785 0.0000 0.0000 62.6852 32.0658 176.8573 36 L 3.8417 8.9727 124.9242 58.3713 41.9248 179.0038 37 A 4.1465 7.9858 118.7391 54.4259 18.3759 177.7283 38 E 4.2627 8.0370 114.0509 57.2559 30.1709 176.6241 39 V 4.1101 7.6606 120.1281 62.7367 31.9468 175.6851 40 R 4.7604 8.5562 126.5358 54.8900 32.8187 175.1309 41 L 5.1643 8.2104 122.0841 53.8881 45.4118 174.9505 42 I 4.7081 8.9873 126.1233 59.5348 40.9459 174.2620 43 I 4.8917 8.4356 126.1542 59.6109 39.7790 174.8469 44 Q 4.6990 9.5366 125.8375 54.1832 31.5663 174.5147 45 E 5.1591 8.8582 123.0498 55.1262 31.7910 175.7545 46 V 4.7563 8.4727 114.9375 58.8556 36.5278 173.5423 47 P 4.8263 0.0000 0.0000 61.8862 32.5520 175.4270 48 P 4.3000 0.0000 0.0000 65.7984 31.3351 178.3458 49 T 4.2164 7.8725 105.9176 63.1726 69.1472 174.5987 50 H 4.9019 8.4877 118.0814 55.0348 29.9834 172.9993 51 W 4.6782 8.1453 130.2550 55.6989 32.5841 174.0436 52 T 5.1623 8.0484 122.0394 61.5356 71.3239 173.6963 53 V 4.3419 8.6003 124.9784 60.8980 33.8633 175.9787 54 G 3.7068 9.9116 111.8047 46.5005 0.0000 174.4708 55 G 3.9689 8.6167 108.0658 44.6393 0.0000 174.1640 56 I 4.4966 7.4221 121.2832 58.9598 39.3547 175.6245 57 S 4.8309 8.5153 119.5428 58.2004 63.6898 174.0340 58 M 4.0037 8.7097 121.9928 58.5134 31.8217 176.5622 59 A 3.9524 7.2952 120.6225 56.2256 17.9099 177.1417 60 E 4.3641 8.8877 120.3132 57.5392 29.0222 175.9787 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 4.38 0.00 1.98 2.03 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 2.47 2.52 0.00 2 L 8.22 4.53 0.00 1.86 1.48 0.94 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 3 L 9.43 5.27 0.00 1.64 1.46 0.93 0.99 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 4 L 8.97 4.91 0.00 1.62 1.54 0.97 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 5 R 8.59 4.98 0.00 1.79 1.80 0.00 3.24 0.00 0.00 3.24 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 6 I 8.80 4.51 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.76 0.92 0.00 0.00 7 T 8.46 5.37 4.47 0.00 0.00 0.00 0.00 0.00 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 8 M 8.35 4.61 0.00 2.01 1.80 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 2.48 2.47 0.00 9 L 8.01 4.54 0.00 1.31 1.44 0.62 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 10 E 8.81 3.98 0.00 1.80 1.88 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 2.34 2.28 0.00 11 G 8.91 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 R 7.64 4.29 0.00 1.75 1.83 0.00 3.20 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.83 0.00 13 S 8.92 4.49 0.00 4.02 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 14 T 8.25 3.99 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 15 E 8.17 3.94 0.00 2.02 2.04 0.00 0.00 0.00 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 2.41 0.00 16 Q 8.21 4.00 0.00 2.26 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 17 K 8.04 3.99 0.00 1.82 1.85 0.00 1.66 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.43 7.81 18 A 8.10 4.02 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 19 E 8.37 3.89 0.00 2.17 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 0.00 2.30 2.35 0.00 20 L 7.87 3.93 0.00 2.12 1.71 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.02 3.98 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.36 3.79 0.00 1.93 2.06 0.00 3.09 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 23 A 8.46 4.02 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 24 L 8.17 4.01 0.00 1.76 1.74 0.96 0.76 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 25 S 7.98 4.11 0.00 4.08 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 26 A 8.11 4.00 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 27 A 8.43 3.87 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 28 A 8.32 3.72 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.01 4.05 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 A 7.95 3.87 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 31 A 7.85 3.76 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 F 7.80 4.91 0.00 3.16 3.06 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 33 D 7.63 4.44 0.00 2.81 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.51 4.55 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.98 0.00 0.00 35 P 0.00 4.28 0.00 2.18 2.00 0.00 3.66 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 2.13 2.09 0.00 36 L 8.97 3.84 0.00 1.72 1.71 0.93 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 37 A 7.99 4.15 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 38 E 8.04 4.26 0.00 2.22 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 2.31 2.24 0.00 39 V 7.66 4.11 2.19 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 0.77 0.00 0.00 1.02 0.00 0.00 40 R 8.56 4.76 0.00 1.89 1.82 0.00 3.22 0.00 0.00 3.10 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 41 L 8.21 5.16 0.00 1.61 1.49 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 42 I 8.99 4.71 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.70 0.93 0.00 0.00 43 I 8.44 4.89 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.60 0.91 0.00 0.00 44 Q 9.54 4.70 0.00 1.97 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.77 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 45 E 8.86 5.16 0.00 1.85 1.86 0.00 0.00 0.00 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 2.32 0.00 46 V 8.47 4.76 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 0.91 0.00 0.00 1.19 0.00 0.00 47 P 0.00 4.83 0.00 2.03 2.23 0.00 3.69 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.87 0.00 48 P 0.00 4.30 0.00 2.22 2.18 0.00 3.58 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.08 0.00 49 T 7.87 4.22 4.32 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 1.24 0.00 0.00 50 H 8.49 4.90 0.00 3.31 3.38 0.00 5.79 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 W 8.15 4.68 0.00 3.44 2.90 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 0.00 0.00 0.00 52 T 8.05 5.16 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 1.13 0.00 0.00 53 V 8.60 4.34 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 0.95 0.00 0.00 0.99 0.00 0.00 54 G 9.91 3.71 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 0.00 0.00 0.00 55 G 8.62 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 56 I 7.42 4.50 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.11 0.93 0.00 0.00 57 S 8.52 4.83 0.00 4.22 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 58 M 8.71 4.00 0.00 2.07 2.39 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 3.16 0.00 59 A 7.30 3.95 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 60 E 8.89 4.36 0.00 2.17 2.31 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 2.16 2.21 0.00