NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 662 G 3.9789 8.3549 109.7353 45.2195 0.0000 172.6326 663 K 4.5337 7.6396 121.3296 54.3108 36.4890 175.4994 664 I 3.8150 9.2573 124.2265 64.9281 38.1095 177.5244 665 C 4.4449 7.8622 120.9059 58.5311 26.1615 173.1572 666 K 4.0244 8.4939 123.6523 59.4399 32.2064 177.9912 667 K 4.4713 7.6860 117.6246 54.8241 33.4575 177.2938 668 T 4.1353 8.6311 113.5958 60.7618 70.8892 173.9122 669 P 4.1717 0.0000 0.0000 66.1436 31.4495 178.8304 670 E 3.9574 8.0149 116.5466 59.3577 29.5715 179.2277 671 Q 3.8752 8.0394 118.0769 58.7928 28.8061 178.6482 672 L 3.5712 8.2277 121.5813 58.3757 42.1780 178.4602 673 H 3.9101 8.5296 118.4510 59.2162 29.5480 176.9774 674 M 3.9000 7.6477 119.6962 58.4990 32.1072 178.1480 675 L 3.7058 7.3084 118.7473 57.5720 41.5282 179.7283 676 K 4.0343 7.6341 118.3427 59.5964 31.6124 179.6818 677 S 4.1099 7.7600 114.7280 61.2687 62.7699 176.6484 678 A 4.1621 8.4069 124.1533 55.0526 17.9507 179.3230 679 F 4.2617 8.5336 120.0136 61.0786 39.4982 177.5741 680 V 3.9844 7.7132 110.5126 64.0539 31.3412 178.6515 681 R 4.1585 7.3315 117.5614 57.9384 30.7925 176.9436 682 T 4.5783 7.5164 112.2190 60.5190 70.4609 173.8684 683 Q 3.7702 8.3861 124.9808 56.0678 29.5110 175.9604 684 W 4.8217 7.4956 118.4655 53.6794 29.2740 172.9168 685 P 4.2571 0.0000 0.0000 61.9509 31.8381 177.4276 686 S 4.3149 8.7277 117.0492 57.3914 64.6014 173.5564 687 P 4.3424 0.0000 0.0000 66.2519 31.0623 178.5341 688 E 3.9983 8.0976 117.2416 59.2191 29.6753 178.4840 689 E 3.9694 8.1065 118.7151 59.4101 29.3684 178.9468 690 Y 4.2856 7.8395 117.0066 61.0374 37.8332 178.0201 691 D 4.3889 7.8990 119.2890 57.3150 40.8933 178.8235 692 K 3.9133 8.0922 119.9098 59.5555 32.1944 178.7570 693 L 3.9610 8.0917 118.9911 57.6168 41.4353 179.2659 694 A 4.0652 8.2097 120.7552 55.1762 18.1492 179.4687 695 K 3.8124 7.9752 116.6581 59.8257 32.3531 178.3473 696 E 4.2132 8.3402 117.4125 58.1960 29.6403 178.3504 697 S 4.4028 8.1950 113.6547 58.3996 63.8148 175.5572 698 G 3.9211 8.4218 109.6003 44.9589 0.0000 173.4364 699 L 4.2725 7.4770 118.9610 53.5691 42.8963 176.6169 700 A 4.1844 8.1990 123.6035 51.8231 19.2948 178.8380 701 R 3.8955 8.7226 121.7744 59.8334 30.2771 179.2765 702 T 3.8163 7.8457 108.8309 64.6277 68.6369 176.0526 703 D 4.4399 7.9952 121.5620 56.9711 40.9336 178.6753 704 I 3.8533 7.6549 119.9037 64.4628 37.1078 178.3362 705 V 3.1426 7.7838 119.3075 66.1238 31.1802 178.2614 706 S 4.1962 8.0379 114.4832 61.3291 62.5793 176.5022 707 W 4.0724 8.8257 131.5770 60.4966 30.4022 178.1490 708 F 4.0193 9.1024 118.0965 60.0949 38.2576 178.0541 709 G 3.6246 8.0332 105.6322 47.9122 0.0000 175.4291 710 D 4.3497 8.1826 122.0771 57.3090 40.8274 179.2699 711 T 3.2904 7.4025 115.9678 66.5322 68.0584 176.9324 712 R 4.2340 7.6914 118.5588 59.4677 29.9358 178.2160 713 Y 4.1375 8.3292 119.1149 60.6700 38.8577 177.9947 714 A 3.7974 8.1435 121.6830 54.8204 18.2380 179.1739 715 W 4.3062 8.2849 126.5085 60.4570 30.8635 177.6023 716 K 4.0458 7.9227 114.8908 57.5776 32.5635 176.7200 717 N 4.6535 7.0060 116.5896 52.9342 38.9431 175.2426 718 G 4.2309 8.3819 104.6689 46.2945 0.0000 174.0906 719 N 4.8518 8.2693 114.7233 52.6440 39.2877 175.5948 720 L 4.4210 7.1803 118.5502 53.1498 41.9973 177.0404 721 K 3.7216 7.6581 122.6800 59.1586 32.4658 178.9702 722 W 4.4276 8.0585 116.5407 59.7155 27.7960 177.7387 723 Y 3.8122 6.3904 120.2317 60.5628 38.2115 176.8651 724 Y 4.5554 7.0441 118.4257 60.9369 38.1604 178.4067 725 Y 4.4726 8.2018 117.5622 61.2866 37.9529 178.0214 726 Y 4.2310 8.0104 120.7076 60.8925 38.8966 178.2774 727 Q 3.8951 8.1978 119.0262 58.7395 28.6599 178.0000 728 S 4.4907 8.2280 113.2988 59.5897 63.0225 175.0071 729 A 4.5479 7.2813 121.8262 53.3622 20.4304 177.5950 730 N 4.2216 7.8413 115.6660 55.8563 39.1067 175.0354 731 S 4.3042 7.7976 119.4850 58.4525 63.3982 173.9499 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 662 G 8.35 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 663 K 7.64 4.53 0.00 1.75 1.66 0.00 1.63 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.58 7.81 664 I 9.26 3.82 1.87 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 1.42 0.47 0.92 0.00 0.00 665 C 7.86 4.44 0.00 2.95 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 0.00 666 K 8.49 4.02 0.00 1.85 2.00 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.53 7.81 667 K 7.69 4.47 0.00 1.69 1.66 0.00 1.62 0.00 0.00 1.51 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.40 7.81 668 T 8.63 4.14 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 1.23 0.00 0.00 669 P 0.00 4.17 0.00 2.12 2.10 0.00 3.55 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.16 0.00 670 E 8.01 3.96 0.00 2.00 1.95 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 2.35 2.40 0.00 671 Q 8.04 3.88 0.00 2.24 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.30 0.00 672 L 8.23 3.57 0.00 1.74 1.62 0.86 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 673 H 8.53 3.91 0.00 3.19 3.37 0.00 5.83 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 674 M 7.65 3.90 0.00 2.17 1.96 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 2.54 2.51 0.00 675 L 7.31 3.71 0.00 0.59 0.13 -0.43 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 676 K 7.63 4.03 0.00 1.46 0.98 0.00 0.94 0.00 0.00 0.61 0.00 0.00 2.51 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.42 1.15 7.81 677 S 7.76 4.11 0.00 3.90 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 0.00 678 A 8.41 4.16 1.57 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 0.00 0.00 0.00 0.00 0.00 0.00 679 F 8.53 4.26 0.00 3.10 3.46 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 0.00 0.00 0.00 0.00 680 V 7.71 3.98 2.10 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 0.93 0.00 0.00 1.00 0.00 0.00 681 R 7.33 4.16 0.00 1.93 2.00 0.00 3.15 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.86 0.00 682 T 7.52 4.58 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 0.00 683 Q 8.39 3.77 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 7.03 0.00 0.00 0.00 0.00 0.00 1.95 1.65 0.00 684 W 7.50 4.82 0.00 3.36 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 0.00 685 P 0.00 4.26 0.00 0.49 1.29 0.00 3.19 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.41 0.00 686 S 8.73 4.31 0.00 4.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 687 P 0.00 4.34 0.00 2.20 2.22 0.00 3.59 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 2.15 2.23 0.00 688 E 8.10 4.00 0.00 2.03 1.92 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 2.37 2.40 0.00 689 E 8.11 3.97 0.00 2.06 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 2.26 2.28 0.00 690 Y 7.84 4.29 0.00 3.16 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 691 D 7.90 4.39 0.00 2.95 2.74 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 0.00 692 K 8.09 3.91 0.00 1.83 1.95 0.00 1.63 0.00 0.00 1.64 0.00 0.00 3.10 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.48 7.81 693 L 8.09 3.96 0.00 1.98 1.77 1.01 0.52 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 0.00 694 A 8.21 4.07 1.46 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 0.00 0.00 0.00 0.00 0.00 0.00 695 K 7.98 3.81 0.00 1.88 2.04 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.49 7.81 696 E 8.34 4.21 0.00 2.06 1.97 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 2.32 2.30 0.00 697 S 8.19 4.40 0.00 3.94 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 0.00 698 G 8.42 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 0.00 0.00 0.00 699 L 7.48 4.27 0.00 1.63 1.58 0.80 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 700 A 8.20 4.18 1.29 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 0.00 701 R 8.72 3.90 0.00 1.88 1.91 0.00 3.26 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 702 T 7.85 3.82 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 1.18 0.00 0.00 703 D 8.00 4.44 0.00 2.90 2.78 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 0.00 0.00 0.00 704 I 7.65 3.85 1.98 0.00 0.00 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 1.75 1.02 1.22 0.00 0.00 705 V 7.78 3.14 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 0.91 0.00 0.00 0.00 0.00 0.00 706 S 8.04 4.20 0.00 4.20 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 0.00 707 W 8.83 4.07 0.00 3.49 3.46 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 0.00 0.00 0.00 0.00 708 F 9.10 4.02 0.00 3.57 3.29 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 0.00 709 G 8.03 3.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 710 D 8.18 4.35 0.00 2.58 2.58 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 0.00 711 T 7.40 3.29 3.18 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 -0.41 0.00 0.00 712 R 7.69 4.23 0.00 2.05 2.17 0.00 2.74 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.80 0.00 713 Y 8.33 4.14 0.00 3.09 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 0.00 714 A 8.14 3.80 1.29 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 0.00 715 W 8.28 4.31 0.00 3.06 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 0.00 716 K 7.92 4.05 0.00 1.77 1.73 0.00 1.55 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.31 7.81 717 N 7.01 4.65 0.00 2.30 2.65 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 0.00 718 G 8.38 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 0.00 0.00 0.00 0.00 719 N 8.27 4.85 0.00 2.70 2.82 0.00 0.00 6.58 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 720 L 7.18 4.42 0.00 1.42 0.93 0.45 -0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 721 K 7.66 3.72 0.00 1.91 1.88 0.00 1.77 0.00 0.00 2.00 0.00 0.00 3.11 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.56 1.54 7.81 722 W 8.06 4.43 0.00 3.59 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 723 Y 6.39 3.81 0.00 1.43 2.30 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 0.00 724 Y 7.04 4.56 0.00 2.77 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 0.00 725 Y 8.20 4.47 0.00 3.25 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 726 Y 8.01 4.23 0.00 3.23 3.19 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 0.00 0.00 0.00 0.00 727 Q 8.20 3.90 0.00 2.27 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.67 0.00 0.00 0.00 0.00 0.00 2.25 2.03 0.00 728 S 8.23 4.49 0.00 3.97 3.98 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 0.00 0.00 0.00 729 A 7.28 4.55 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 0.00 730 N 7.84 4.22 0.00 1.95 2.38 0.00 0.00 7.22 6.92 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 0.00 731 S 7.80 4.30 0.00 4.02 3.82 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