NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 A 4.3530 8.1233 123.5817 51.9346 19.2840 177.0807 5 L 3.7938 7.9806 122.6322 56.8363 41.9817 176.9560 6 L 4.0283 8.1065 118.6734 58.4973 42.0681 178.4324 7 R 3.9506 8.1459 118.2207 58.6193 29.9653 177.9260 8 Q 3.9137 8.6573 117.0302 59.3009 29.0708 179.7876 9 A 3.6159 8.8080 122.5159 55.2783 18.2511 178.9800 10 Y 4.1368 7.8305 116.8177 60.6164 38.7440 178.4311 11 S 4.2998 7.6382 115.1284 61.2874 63.3942 175.9776 12 A 4.1515 7.9924 122.6500 54.5643 18.5852 177.1284 13 L 4.2487 8.3667 117.0737 56.3056 42.9988 177.6084 14 F 4.9903 7.6192 120.7455 59.1531 39.4226 176.4275 15 R 3.4596 7.1777 122.0761 57.9822 29.8239 176.8059 16 R 4.0404 8.1518 113.1463 56.2972 30.8840 177.9674 17 T 3.9100 8.6874 120.0525 65.6750 68.3223 176.2237 18 S 4.2946 7.8910 116.8876 61.4572 63.5391 176.3987 19 T 3.8720 7.8638 113.0474 64.2119 68.7251 175.0041 20 F 4.1410 8.7388 123.6859 60.8198 39.2506 176.4453 21 A 4.1140 8.4008 118.9037 55.7006 18.3017 179.2088 22 L 3.8913 8.2903 118.5566 58.8592 41.5646 179.5570 23 T 3.8058 8.2817 115.8481 66.4765 68.3246 176.5138 24 V 3.5084 7.5503 119.6640 67.0753 31.3612 177.1271 25 V 3.5427 8.0494 116.5746 65.8174 30.9911 177.1817 26 L 4.0039 8.0466 119.0269 58.4605 42.2776 179.5710 27 G 3.8006 9.1225 105.8623 48.0903 0.0000 174.9985 28 A 4.0188 8.8871 124.8522 54.7389 18.3464 179.4277 29 V 3.5408 7.8291 116.5949 66.4700 31.5080 178.0753 30 L 3.9618 7.9435 118.1185 57.8611 41.3249 178.9895 31 F 4.0457 8.2121 119.1804 62.3395 39.5859 176.0662 32 E 3.8294 9.3686 118.3154 59.0059 28.9717 178.9697 33 R 3.7961 7.8937 121.3350 58.7485 31.1383 177.2183 34 A 4.5630 8.1208 118.4582 51.9637 20.5138 177.9876 35 F 4.0670 8.4196 118.7651 60.7007 39.2937 176.9940 36 D 4.1577 8.0847 117.9876 57.7783 40.6459 178.1349 37 Q 4.0488 8.1179 117.2909 59.3701 28.6357 179.6026 38 G 3.7713 7.7445 104.3000 48.1386 0.0000 174.8554 39 A 3.8894 7.6588 123.8423 54.7164 18.2558 179.0650 40 D 4.3344 8.7452 117.2958 57.6207 41.0003 179.0362 41 A 3.9928 8.6347 121.3954 55.4193 18.3628 179.4991 42 I 3.6430 8.4368 118.6894 64.5870 37.0129 178.1211 43 F 4.1636 8.5203 119.9782 61.5444 39.4108 176.5107 44 E 3.9068 8.5868 118.2292 59.7922 29.1239 178.6458 45 H 4.1338 8.0358 116.5547 59.5879 29.9648 176.6506 46 L 4.1142 7.5932 117.4040 55.8717 42.3793 176.6125 47 N 4.9255 8.6877 118.1510 52.1134 39.4313 174.7347 48 E 3.9463 8.0902 117.6269 57.7732 30.0689 178.0812 49 G 3.7690 7.2745 110.4047 45.8447 0.0000 174.0010 50 K 4.2899 7.5501 118.7839 57.1155 33.3116 177.3361 51 L 4.4821 7.6102 118.1799 53.5077 42.5094 177.6305 52 W 4.1771 8.8045 130.8558 59.9695 30.9388 177.2684 53 K 3.9945 8.2386 118.6250 59.5034 31.6320 177.0277 54 H 4.3827 8.1685 117.0431 58.1885 29.0452 177.5455 55 I 3.9737 7.3515 108.1343 61.3781 37.3657 177.9323 56 K 2.6588 7.7701 125.6885 59.5523 31.9762 178.5941 57 H 4.1168 7.8574 112.7899 58.0655 28.0949 175.7552 58 K 4.1371 7.3888 117.7830 57.6855 32.0165 176.9010 59 Y 4.7026 8.1478 113.1962 57.4203 41.2483 175.3667 60 E 4.1826 8.1960 120.6682 55.4914 28.1912 174.9080 61 A 3.8772 9.1644 124.9778 52.1430 16.5428 179.2271 62 S 4.6626 7.3805 110.8687 56.8482 63.6278 173.4973 63 E 4.5829 7.8735 117.0203 56.7351 32.6048 175.0148 64 E 4.1090 9.0484 124.5057 56.5680 30.3283 174.0219 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 4 A 8.12 4.35 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 5 L 7.98 3.79 0.00 1.78 1.71 0.93 0.31 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 6 L 8.11 4.03 0.00 1.70 1.76 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 7 R 8.15 3.95 0.00 1.87 1.97 0.00 3.21 0.00 0.00 3.33 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.74 0.00 8 Q 8.66 3.91 0.00 2.33 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 9 A 8.81 3.62 0.89 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 10 Y 7.83 4.14 0.00 3.02 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.64 4.30 0.00 4.07 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 12 A 7.99 4.15 1.24 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 0.00 0.00 0.00 13 L 8.37 4.25 0.00 1.20 1.57 0.79 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 14 F 7.62 4.99 0.00 2.97 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 R 7.18 3.46 0.00 1.76 1.63 0.00 2.85 0.00 0.00 3.09 7.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 16 R 8.15 4.04 0.00 1.93 1.85 0.00 3.20 0.00 0.00 3.33 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.63 0.00 17 T 8.69 3.91 4.21 0.00 0.00 0.00 0.00 0.00 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 18 S 7.89 4.29 0.00 4.07 4.12 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 0.00 0.00 0.00 0.00 19 T 7.86 3.87 4.33 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 1.22 0.00 0.00 20 F 8.74 4.14 0.00 3.19 3.14 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 0.00 0.00 0.00 0.00 21 A 8.40 4.11 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.29 3.89 0.00 1.79 1.95 0.93 1.00 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 23 T 8.28 3.81 4.27 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 1.17 0.00 0.00 24 V 7.55 3.51 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 0.95 0.00 0.00 0.68 0.00 0.00 25 V 8.05 3.54 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 0.94 0.00 0.00 1.00 0.00 0.00 26 L 8.05 4.00 0.00 1.74 1.67 0.93 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 27 G 9.12 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 28 A 8.89 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 29 V 7.83 3.54 2.29 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 1.05 0.00 0.00 0.99 0.00 0.00 30 L 7.94 3.96 0.00 1.97 1.75 0.95 1.07 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 31 F 8.21 4.05 0.00 2.99 3.33 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 32 E 9.37 3.83 0.00 2.13 2.05 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 2.55 2.42 0.00 33 R 7.89 3.80 0.00 1.93 2.18 0.00 3.28 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 34 A 8.12 4.56 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 35 F 8.42 4.07 0.00 1.77 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.08 4.16 0.00 2.71 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.12 4.05 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.44 2.62 0.00 38 G 7.74 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 39 A 7.66 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 D 8.75 4.33 0.00 2.83 2.77 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 41 A 8.63 3.99 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 42 I 8.44 3.64 2.03 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 1.41 0.80 0.95 0.00 0.00 43 F 8.52 4.16 0.00 2.89 3.33 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 44 E 8.59 3.91 0.00 2.17 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 2.47 2.66 0.00 45 H 8.04 4.13 0.00 3.19 3.49 0.00 5.78 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 7.59 4.11 0.00 1.69 1.59 0.94 0.96 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 47 N 8.69 4.93 0.00 2.34 2.53 0.00 0.00 6.91 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 48 E 8.09 3.95 0.00 1.88 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.29 0.00 49 G 7.27 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 50 K 7.55 4.29 0.00 1.73 1.85 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.49 7.81 51 L 7.61 4.48 0.00 1.87 1.70 1.01 0.95 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 52 W 8.80 4.18 0.00 3.35 3.11 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 53 K 8.24 3.99 0.00 1.79 1.74 0.00 1.81 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.45 7.81 54 H 8.17 4.38 0.00 3.32 3.21 0.00 5.87 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 I 7.35 3.97 1.88 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.47 0.91 0.00 0.00 56 K 7.77 2.66 0.00 1.20 1.45 0.00 2.01 0.00 0.00 1.79 0.00 0.00 2.87 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.25 0.89 7.81 57 H 7.86 4.12 0.00 3.18 3.41 0.00 5.77 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 K 7.39 4.14 0.00 1.37 1.23 0.00 1.70 0.00 0.00 1.59 0.00 0.00 3.01 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.42 1.48 7.81 59 Y 8.15 4.70 0.00 2.90 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 60 E 8.20 4.18 0.00 1.95 1.91 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 2.30 2.41 0.00 61 A 9.16 3.88 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 62 S 7.38 4.66 0.00 3.76 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 63 E 7.87 4.58 0.00 1.85 1.79 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 2.10 2.17 0.00 64 E 9.05 4.11 0.00 2.16 2.05 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 2.16 2.29 0.00