NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 L 4.1900 8.0433 122.4765 54.8778 43.9990 178.4603 20 K 3.6873 7.9545 117.5254 58.1153 32.0469 176.6371 21 G 3.7654 8.7962 108.0878 46.9547 0.0000 173.6304 22 L 4.3612 7.9573 119.2856 53.8754 42.7760 176.5788 23 V 3.7931 7.2152 119.0403 64.6755 31.7111 175.2999 24 N 4.1815 9.5020 122.6342 54.3131 36.8576 173.5829 25 H 4.8356 8.1698 116.1911 54.0724 32.2395 173.5701 26 R 4.7202 8.3464 120.0645 55.8265 31.2724 175.5074 27 V 4.9034 9.4311 119.2494 59.5019 36.7880 174.4929 28 G 4.3860 9.3358 108.5476 44.5130 0.0000 172.1498 29 V 4.7030 8.9902 125.6554 61.1712 33.4169 174.1131 30 K 4.5823 8.1978 130.3063 54.9510 33.6804 175.8800 31 L 5.2285 7.5516 126.4340 53.0870 42.6981 177.5873 32 K 3.9737 8.3129 120.3222 59.4609 32.2694 178.1737 33 F 4.6235 7.1964 111.7561 56.9031 39.8743 176.8538 34 N 4.1490 8.9920 117.9619 54.3841 36.5312 176.4523 35 S 4.6234 8.0348 111.3570 58.2354 62.6162 174.3246 36 T 4.8340 7.6980 116.4041 63.3107 70.9229 174.7344 37 E 4.6958 8.6056 125.3002 54.6019 33.4608 173.6080 38 Y 5.0901 8.8214 124.8424 56.9483 39.9445 174.7401 39 R 5.0528 9.4120 123.5540 54.2450 33.7573 176.2392 40 G 3.8825 7.8760 108.7352 46.3431 0.0000 170.8914 41 T 4.9044 7.6655 115.8443 61.6401 70.9091 174.2460 42 L 4.4677 8.7496 129.1632 55.0753 42.3363 177.3914 43 V 4.0626 8.5790 127.6666 65.3094 31.8468 175.9446 44 S 4.7039 7.6249 112.4186 58.1436 66.9534 172.0372 45 T 5.0130 7.6713 113.6373 65.9333 71.6037 172.6132 46 D 4.4676 8.7603 117.5408 54.3859 41.3291 177.9095 47 N 3.9810 8.4993 119.9380 56.7595 38.5475 175.8232 48 Y 4.0191 8.6322 114.7483 58.8470 37.8799 177.0527 49 F 3.7393 8.9330 118.7378 58.4018 37.2205 173.6854 50 N 5.2986 7.7909 119.5468 52.1878 39.8568 174.4382 51 L 5.0000 8.7720 123.3354 54.0008 44.9134 174.8804 52 Q 4.5615 8.6929 121.5758 54.2504 31.2047 173.7915 53 L 5.1290 8.5515 128.7889 53.1989 44.9609 174.2450 54 N 5.5823 8.9915 124.8234 51.4581 41.4794 174.1408 55 E 3.9325 7.9762 122.2508 57.4305 27.6817 174.8358 56 A 4.6973 8.2935 120.7911 51.6680 20.7346 177.6409 57 E 5.0974 9.6377 122.1847 54.3673 33.2402 174.0928 58 E 4.8960 8.9978 127.8232 55.2688 31.6612 174.6111 59 F 4.9024 9.1028 125.2562 55.4798 42.6893 174.1794 60 V 4.5792 8.4931 122.9460 61.5462 34.0728 175.2377 61 A 3.8861 9.6814 130.3869 53.0545 16.6770 177.5560 62 G 4.0402 8.7061 104.9561 46.8779 0.0000 174.0531 63 V 4.4044 7.9350 120.1606 60.3257 33.4364 174.9922 64 S 3.4020 8.3849 121.6051 58.6105 62.6226 173.3776 65 H 4.7206 8.4914 124.9927 56.0215 29.2720 173.3574 66 G 3.8462 7.5597 105.8935 44.7856 0.0000 173.4353 67 T 4.9272 8.1697 115.3545 61.8377 70.0954 174.6033 68 L 4.6124 8.9868 126.5437 53.7723 44.7438 178.1502 69 G 3.7893 8.8271 111.8455 47.7410 0.0000 175.6345 70 E 5.2277 9.4670 122.5504 54.7339 32.0911 175.2029 71 I 5.0049 8.4077 116.5762 59.0811 41.5695 174.0457 72 F 5.0416 9.0038 121.5792 55.8656 41.3960 174.6995 73 I 4.5909 8.5621 124.3865 59.5413 40.4524 174.7512 74 R 5.3252 8.8524 124.5915 55.2034 31.3775 177.2409 75 C 3.7618 8.9787 118.4825 62.4407 30.8732 175.9003 76 N 4.3817 8.3678 118.9832 55.8344 38.4142 176.0665 77 N 4.6740 8.5030 112.9349 54.1437 38.7211 174.5406 78 V 4.4986 8.4228 120.8651 61.5728 32.5986 175.0246 79 L 4.3061 8.4752 130.5468 57.3586 42.5177 175.7022 80 Y 4.9408 6.9781 114.0056 56.5067 41.3159 172.3896 81 I 5.4848 8.6642 119.3719 59.7107 41.0852 175.2938 82 R 4.7894 8.9436 121.2116 54.3833 33.4337 173.4621 83 E 4.7162 8.6514 121.3847 55.4646 30.5678 175.8343 84 L 4.3272 9.0326 128.4033 53.3699 42.6505 174.9314 85 P 4.1349 0.0000 0.0000 63.5475 31.1883 175.8864 86 N 4.3320 8.6308 119.7136 52.7429 36.9935 174.4116 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 19 L 8.04 4.19 0.00 1.47 1.53 -0.17 0.27 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 20 K 7.95 3.69 0.00 1.91 1.84 0.00 1.70 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.46 7.81 21 G 8.80 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 22 L 7.96 4.36 0.00 1.76 1.64 0.90 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.22 3.79 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 0.81 0.00 0.00 0.97 0.00 0.00 24 N 9.50 4.18 0.00 2.79 2.83 0.00 0.00 6.89 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 8.17 4.84 0.00 3.31 3.23 0.00 5.80 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 R 8.35 4.72 0.00 1.89 1.80 0.00 3.11 0.00 0.00 3.33 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 27 V 9.43 4.90 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 0.69 0.00 0.00 1.00 0.00 0.00 28 G 9.34 4.39 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 0.00 29 V 8.99 4.70 2.21 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 1.03 0.00 0.00 0.99 0.00 0.00 30 K 8.20 4.58 0.00 1.36 0.74 0.00 1.33 0.00 0.00 1.46 0.00 0.00 2.85 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.69 1.04 7.81 31 L 7.55 5.23 0.00 1.00 0.69 0.76 1.35 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 32 K 8.31 3.97 0.00 1.91 1.91 0.00 1.99 0.00 0.00 1.91 0.00 0.00 3.09 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.59 7.81 33 F 7.20 4.62 0.00 3.14 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 34 N 8.99 4.15 0.00 2.84 2.74 0.00 0.00 6.74 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 8.03 4.62 0.00 3.81 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 36 T 7.70 4.83 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 0.73 0.00 0.00 37 E 8.61 4.70 0.00 1.85 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.24 0.00 38 Y 8.82 5.09 0.00 3.05 2.86 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 39 R 9.41 5.05 0.00 1.75 1.73 0.00 2.21 0.00 0.00 2.75 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.37 0.00 40 G 7.88 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 0.00 0.00 0.00 41 T 7.67 4.90 4.23 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 1.24 0.00 0.00 42 L 8.75 4.47 0.00 1.77 1.74 1.01 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 43 V 8.58 4.06 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 0.78 0.00 0.00 0.87 0.00 0.00 44 S 7.62 4.70 0.00 3.88 3.90 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 45 T 7.67 5.01 4.18 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 1.20 0.00 0.00 46 D 8.76 4.47 0.00 2.81 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 8.50 3.98 0.00 2.91 2.93 0.00 0.00 6.99 7.46 0.00 0.00 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 8.63 4.02 0.00 3.61 3.05 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 0.00 0.00 0.00 49 F 8.93 3.74 0.00 3.28 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 50 N 7.79 5.30 0.00 3.19 2.84 0.00 0.00 6.54 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 8.77 5.00 0.00 1.71 1.70 0.94 0.53 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 52 Q 8.69 4.56 0.00 1.93 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 1.80 1.16 0.00 53 L 8.55 5.13 0.00 1.65 1.38 0.91 0.26 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 8.99 5.58 0.00 2.70 2.59 0.00 0.00 7.12 7.19 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 55 E 7.98 3.93 0.00 2.19 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 2.26 2.24 0.00 56 A 8.29 4.70 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 57 E 9.64 5.10 0.00 2.11 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 2.04 2.34 0.00 58 E 9.00 4.90 0.00 2.31 1.81 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 2.17 2.23 0.00 59 F 9.10 4.90 0.00 3.17 2.91 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 60 V 8.49 4.58 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.65 0.00 0.00 61 A 9.68 3.89 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 62 G 8.71 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 63 V 7.93 4.40 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 1.04 0.00 0.00 0.97 0.00 0.00 64 S 8.38 3.40 0.00 3.38 3.53 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 0.00 0.00 0.00 0.00 65 H 8.49 4.72 0.00 2.99 3.20 0.00 5.70 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 7.56 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 0.00 0.00 0.00 67 T 8.17 4.93 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 1.30 0.00 0.00 68 L 8.99 4.61 0.00 1.45 1.58 0.95 0.91 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 69 G 8.83 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 0.00 0.00 0.00 70 E 9.47 5.23 0.00 1.96 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 0.00 2.32 2.26 0.00 71 I 8.41 5.00 1.78 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.19 0.84 0.00 0.00 72 F 9.00 5.04 0.00 2.85 3.04 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 0.00 0.00 0.00 73 I 8.56 4.59 1.90 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 1.09 1.01 0.97 0.00 0.00 74 R 8.85 5.33 0.00 1.80 1.93 0.00 3.95 0.00 0.00 3.42 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.46 0.00 75 C 8.98 3.76 0.00 3.13 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 8.37 4.38 0.00 2.79 3.00 0.00 0.00 6.93 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 8.50 4.67 0.00 2.87 3.07 0.00 0.00 6.67 7.28 0.00 0.00 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 8.42 4.50 2.13 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 0.81 0.00 0.00 1.02 0.00 0.00 79 L 8.48 4.31 0.00 1.52 1.44 0.94 0.75 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 80 Y 6.98 4.94 0.00 3.01 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 81 I 8.66 5.48 2.03 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 1.54 0.93 0.98 0.00 0.00 82 R 8.94 4.79 0.00 1.85 2.02 0.00 2.79 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.61 0.00 83 E 8.65 4.72 0.00 1.98 1.87 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 2.26 2.48 0.00 84 L 9.03 4.33 0.00 1.60 1.54 0.89 1.12 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 85 P 0.00 4.13 0.00 2.15 2.10 0.00 3.77 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 86 N 8.63 4.33 0.00 2.86 2.86 0.00 0.00 6.14 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