NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 P 4.4758 0.0000 0.0000 62.2178 32.8199 175.5001 16 K 4.5233 8.2346 119.5924 53.0923 35.5019 173.9752 17 P 4.7275 0.0000 0.0000 62.4813 32.6621 176.0761 18 F 4.4351 9.0414 125.6737 61.2045 39.8887 176.5563 19 L 3.5997 8.6286 120.1212 58.5982 42.0143 179.7173 20 K 4.3440 7.4629 117.2580 58.7737 33.6800 176.3080 21 G 3.7426 12.0000 106.9789 47.1485 0.0000 173.6892 22 L 4.4917 7.4823 118.4324 54.2177 42.3869 176.5473 23 V 3.8272 7.7780 119.6129 63.9743 31.8693 176.5007 24 N 4.3061 9.4013 122.8369 54.1667 37.1886 174.0542 25 H 4.7196 7.6278 115.8988 54.7025 31.2328 174.2310 26 R 4.6878 8.3740 120.8525 56.1675 31.5047 175.6290 27 V 4.9826 9.5481 119.4076 59.8049 37.1336 174.1437 28 G 4.2917 9.8716 109.4586 44.5547 0.0000 172.4018 29 V 4.8589 8.8692 126.5420 61.1101 33.8044 173.9845 30 K 4.6895 8.4403 130.1701 54.6000 33.9718 175.7745 31 L 4.5485 7.9648 127.3711 53.8574 42.5535 177.4137 32 K 4.1460 8.1151 120.5340 59.2198 32.1964 178.0477 33 F 4.7569 7.0879 112.8241 56.2743 40.0853 177.1488 34 N 4.3414 8.7922 118.7111 53.5037 36.8753 173.9328 35 S 4.7664 8.1239 107.9530 59.0785 63.1367 173.9883 36 T 4.8489 7.6094 116.1875 63.3093 70.9940 174.7890 37 E 4.8269 8.7007 125.7043 54.7325 33.4083 173.3542 38 Y 5.2491 8.9601 124.9104 56.7247 40.2462 174.7621 39 R 5.5325 8.1233 122.6795 53.7954 33.6622 175.6777 40 G 4.0293 7.9416 107.4919 46.6748 0.0000 171.6422 41 T 4.7826 7.9116 116.4367 62.6740 70.3695 174.7667 42 L 4.6400 8.8543 128.8200 54.2228 42.0895 177.3384 43 V 3.9282 8.4183 127.2823 65.4766 31.9681 175.8557 44 S 4.7281 7.7084 112.5787 58.0692 66.8919 172.3499 45 T 5.0401 7.6821 113.8415 65.8682 71.3472 171.4645 46 D 4.4427 7.9397 120.2123 54.3940 41.9173 176.1519 47 N 4.5228 8.3475 115.1330 56.1371 37.6784 176.1096 48 Y 4.3283 11.3700 115.5496 57.6441 38.0452 176.2108 49 F 3.1796 8.1330 117.9355 58.1520 37.1464 173.4831 50 N 5.4175 7.6749 116.1392 51.7219 40.4841 174.1612 51 L 5.0977 8.8501 122.6883 54.0826 44.6555 174.8118 52 Q 4.4395 8.7366 122.6086 54.4850 30.9860 173.8776 53 L 5.1094 8.4090 128.1749 53.2591 45.3785 174.5860 54 N 5.4171 9.0885 124.5768 51.4336 41.4387 174.0392 55 E 3.6742 7.9594 121.0731 57.2346 27.5531 175.8198 56 A 4.4997 7.8148 120.2660 51.8326 20.1457 177.4443 57 E 4.9140 9.6368 124.8001 54.4251 32.1968 174.5466 58 E 4.8541 9.0942 128.6885 55.9806 31.4281 175.0388 59 F 5.0296 9.4511 125.4066 55.6150 42.6445 173.9750 60 V 4.5914 8.8463 124.0808 61.2959 33.7278 175.4993 61 A 3.8220 9.3852 131.6194 53.3454 16.5974 177.5159 62 G 4.0098 8.5449 104.2853 47.2284 0.0000 174.0097 63 V 4.3756 7.9699 120.0001 60.3200 33.5259 174.9311 64 S 3.7561 8.4091 121.9298 58.5438 62.6655 173.1981 65 H 4.6615 8.6877 124.7592 55.6834 29.0403 175.0147 66 G 3.9488 8.2377 106.7376 45.2946 0.0000 173.4490 67 T 4.7233 7.9836 115.3640 62.4887 69.6426 174.6134 68 L 4.7620 9.3004 125.5953 51.8377 44.6026 178.5913 69 G 4.3747 8.4092 115.6170 46.3253 0.0000 174.9677 70 E 4.6803 8.9486 125.6648 55.9110 30.6482 174.9808 71 I 4.9097 8.9292 116.5735 59.0612 41.5813 174.2233 72 F 5.0730 8.8781 121.6995 56.0274 41.3990 174.4638 73 I 4.5515 8.8374 125.4875 59.5415 39.7980 175.0084 74 R 4.8109 8.7816 127.8524 56.1018 31.5843 177.8685 75 S 4.2446 10.0825 119.3240 61.6752 63.0720 173.6331 76 N 4.2181 8.1830 119.6180 56.4557 38.8443 175.7905 77 N 4.7145 8.6771 113.5899 53.3696 39.0028 174.3006 78 V 4.4261 8.1581 119.6713 61.2666 32.9543 174.8561 79 L 4.3826 8.8702 131.0591 57.0031 42.2011 175.8037 80 Y 5.1002 7.1257 114.4503 56.2156 41.3287 172.3276 81 I 5.2311 8.7587 121.0319 59.6080 39.5264 175.2716 82 R 4.7975 9.7807 123.4833 54.3015 33.1960 173.6679 83 E 4.6900 8.6132 121.4629 55.0779 30.7992 175.5551 84 L 3.9881 8.6534 127.6605 54.6794 41.8833 175.7594 85 P 3.9171 0.0000 0.0000 64.7681 32.1135 175.6406 86 N 4.0461 8.1323 120.2078 52.5358 36.5848 174.3282 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 15 P 0.00 4.48 0.00 2.10 2.08 0.00 3.61 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 1.97 2.14 0.00 16 K 8.23 4.52 0.00 1.80 1.69 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.49 7.81 17 P 0.00 4.73 0.00 2.07 2.07 0.00 3.76 0.00 0.00 5.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.19 0.00 18 F 9.04 4.44 0.00 2.96 3.03 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 0.00 0.00 0.00 19 L 8.63 3.60 0.00 1.64 1.54 0.53 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 20 K 7.46 4.34 0.00 1.84 2.02 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.45 1.45 7.81 21 G 12.00 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 L 7.48 4.49 0.00 1.53 1.59 0.86 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.78 3.83 2.09 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 1.00 0.00 0.00 0.94 0.00 0.00 24 N 9.40 4.31 0.00 2.79 2.85 0.00 0.00 6.96 8.04 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 25 H 7.63 4.72 0.00 3.27 3.20 0.00 5.80 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 26 R 8.37 4.69 0.00 1.89 1.79 0.00 3.11 0.00 0.00 3.33 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 27 V 9.55 4.98 2.16 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 0.63 0.00 0.00 1.00 0.00 0.00 28 G 9.87 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 0.00 0.00 0.00 0.00 29 V 8.87 4.86 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 0.92 0.00 0.00 0.98 0.00 0.00 30 K 8.44 4.69 0.00 1.40 0.74 0.00 1.34 0.00 0.00 1.43 0.00 0.00 2.83 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.70 1.07 7.81 31 L 7.96 4.55 0.00 1.14 0.95 0.71 0.88 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 32 K 8.12 4.15 0.00 1.75 1.89 0.00 1.97 0.00 0.00 1.90 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.49 7.81 33 F 7.09 4.76 0.00 3.11 3.07 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.79 4.34 0.00 3.01 2.94 0.00 0.00 6.72 7.57 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 35 S 8.12 4.77 0.00 3.81 3.96 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.61 4.85 3.96 0.00 0.00 0.00 0.00 0.00 0.00 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 37 E 8.70 4.83 0.00 1.84 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 38 Y 8.96 5.25 0.00 3.00 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.12 5.53 0.00 1.76 1.74 0.00 2.31 0.00 0.00 2.91 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.18 0.00 40 G 7.94 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 41 T 7.91 4.78 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 1.25 0.00 0.00 42 L 8.85 4.64 0.00 1.71 1.74 0.99 0.70 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 43 V 8.42 3.93 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 0.84 0.00 0.00 0.87 0.00 0.00 44 S 7.71 4.73 0.00 3.90 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 45 T 7.68 5.04 4.22 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 0.00 0.00 0.00 1.23 0.00 0.00 46 D 7.94 4.44 0.00 2.83 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.35 4.52 0.00 2.95 3.03 0.00 0.00 6.83 7.48 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 48 Y 11.37 4.33 0.00 3.50 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 49 F 8.13 3.18 0.00 3.39 3.35 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 50 N 7.67 5.42 0.00 2.98 2.85 0.00 0.00 6.52 6.62 0.00 0.00 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 L 8.85 5.10 0.00 1.68 1.67 0.96 0.33 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 52 Q 8.74 4.44 0.00 2.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.79 0.00 0.00 0.00 0.00 0.00 1.58 1.16 0.00 53 L 8.41 5.11 0.00 1.63 1.33 0.91 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 54 N 9.09 5.42 0.00 2.71 2.59 0.00 0.00 7.28 7.24 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 55 E 7.96 3.67 0.00 2.07 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 56 A 7.81 4.50 1.21 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 0.00 0.00 0.00 57 E 9.64 4.91 0.00 2.13 2.18 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 2.05 2.22 0.00 58 E 9.09 4.85 0.00 2.41 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 2.30 2.31 0.00 59 F 9.45 5.03 0.00 3.05 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 V 8.85 4.59 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.70 0.00 0.00 61 A 9.39 3.82 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 62 G 8.54 4.01 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 0.00 0.00 0.00 63 V 7.97 4.38 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 0.96 0.00 0.00 1.01 0.00 0.00 64 S 8.41 3.76 0.00 3.35 3.50 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 65 H 8.69 4.66 0.00 3.05 3.25 0.00 5.69 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 66 G 8.24 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 T 7.98 4.72 4.25 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 1.28 0.00 0.00 68 L 9.30 4.76 0.00 1.58 1.53 0.89 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.41 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.95 4.68 0.00 1.94 1.72 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 2.37 2.27 0.00 71 I 8.93 4.91 1.74 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.85 0.81 0.00 0.00 72 F 8.88 5.07 0.00 2.79 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 73 I 8.84 4.55 2.00 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 1.11 0.95 1.00 0.00 0.00 74 R 8.78 4.81 0.00 1.82 1.94 0.00 3.66 0.00 0.00 3.45 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.64 0.00 75 S 10.08 4.24 0.00 3.61 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 76 N 8.18 4.22 0.00 2.77 3.01 0.00 0.00 6.90 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 N 8.68 4.71 0.00 2.95 2.89 0.00 0.00 6.45 8.35 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 78 V 8.16 4.43 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 0.90 0.00 0.00 1.10 0.00 0.00 79 L 8.87 4.38 0.00 1.50 1.50 0.95 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 80 Y 7.13 5.10 0.00 3.10 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 8.76 5.23 1.95 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.87 0.95 0.00 0.00 82 R 9.78 4.80 0.00 1.76 2.10 0.00 2.81 0.00 0.00 3.29 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.67 0.00 83 E 8.61 4.69 0.00 1.95 1.85 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 2.23 2.33 0.00 84 L 8.65 3.99 0.00 1.58 1.55 0.88 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 85 P 0.00 3.92 0.00 2.05 2.01 0.00 3.92 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 2.00 1.99 0.00 86 N 8.13 4.05 0.00 2.92 2.97 0.00 0.00 5.85 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00