NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 744 S 4.4500 8.3344 115.4141 58.2929 64.0458 173.0845 745 E 3.8751 8.1746 124.4435 58.6277 30.3582 175.0076 746 D 5.0256 8.0114 116.4096 52.2621 44.8649 174.2945 747 D 4.9379 8.2273 120.7390 51.5067 44.2164 174.8569 748 P 4.3684 0.0000 0.0000 65.5148 31.5691 176.9351 749 L 4.3988 8.8849 118.6222 55.0954 41.8802 177.7077 750 Y 4.0642 8.2401 121.9876 61.1760 38.5618 178.1552 751 D 4.2119 8.2039 119.0795 57.2320 40.9843 178.4077 752 E 3.9196 8.1842 118.4573 59.4361 29.4636 179.0981 753 A 4.0447 8.2058 121.0028 55.0921 18.3130 179.8889 754 V 3.3531 7.7092 116.9570 66.0719 31.5639 178.3321 755 R 3.8697 8.1085 118.0375 59.2818 29.8996 178.8623 756 F 4.1292 8.2814 120.2199 61.3511 39.4311 177.4271 757 V 3.4121 8.3460 119.8796 65.4117 31.0812 177.8748 758 T 3.9666 7.9010 108.5697 63.8156 68.8720 176.5440 759 E 4.0849 7.7646 121.4475 59.2516 29.8842 178.7618 760 S 4.0837 7.8790 112.7762 58.9468 63.1383 174.8069 761 R 3.8480 7.6037 119.2963 56.8282 28.2141 175.6148 762 R 4.5471 7.5872 116.7095 54.5439 32.3059 176.2508 763 A 4.7118 8.4424 124.6410 51.4317 20.0258 176.6758 764 S 4.4600 7.9393 113.9720 59.2854 65.3873 174.7785 765 I 3.6011 8.1780 124.1330 64.6321 36.9163 178.8545 766 S 4.3069 8.0675 114.3529 61.4053 62.8158 176.2230 767 A 4.0253 8.1173 124.4212 54.9261 18.1720 179.8110 768 V 3.3125 7.9421 116.7716 66.0802 31.6156 178.1512 769 Q 3.9383 8.4145 118.2489 59.2321 28.3500 179.2658 770 R 3.9469 7.7781 117.7735 58.6458 30.1399 178.7809 771 K 3.8170 7.5114 118.9756 58.8594 32.2701 178.1444 772 L 4.2668 7.5908 115.5494 53.1679 43.1456 176.2367 773 K 3.8149 7.9288 117.9923 57.7023 29.6995 173.2534 774 I 4.6057 7.1843 109.9356 58.2272 41.4401 175.8806 775 G 3.9766 8.1862 107.0596 43.6871 0.0000 174.0771 776 Y 3.9056 8.4752 120.4318 60.9309 38.7569 178.1061 777 N 4.4550 8.3376 116.8375 56.1785 38.6729 177.2246 778 R 3.8817 8.0443 119.5407 59.4501 30.2218 178.3242 779 A 3.9564 8.0523 120.3440 54.9857 18.3477 179.4967 780 A 3.8244 8.1293 119.6975 55.3338 18.4462 180.1244 781 R 3.9237 8.4283 117.0480 59.5815 30.0707 179.1967 782 M 4.2330 7.9533 118.2839 58.5146 31.8860 178.8623 783 I 3.7656 7.9714 119.9940 64.3227 37.2500 178.2126 784 E 3.9546 8.4058 119.3110 59.4450 29.2887 179.3168 785 A 4.0220 8.1408 120.6977 55.4887 18.3747 179.6472 786 M 4.2946 8.4202 117.3353 58.3541 31.5835 178.6132 787 E 4.1876 8.3459 121.1142 59.0836 29.6492 178.5838 788 M 4.1103 7.9944 116.6676 58.3079 32.3716 177.1370 789 A 4.3855 7.8965 118.2534 51.7137 18.8996 177.6862 790 G 3.8506 7.8355 105.3313 46.2879 0.0000 175.2207 791 V 3.9592 8.0909 122.6116 64.2579 32.4588 176.1053 792 V 5.0631 7.6063 112.0065 59.2661 36.0205 175.4405 793 T 4.2771 8.6257 113.6338 60.2363 70.0189 172.6725 794 P 4.7534 0.0000 0.0000 61.9015 31.9151 176.2424 795 M 4.3139 8.3575 120.1723 55.5818 32.8989 175.8874 796 N 4.8638 8.6254 123.2605 51.5082 39.9094 175.5499 797 T 3.8096 8.4962 113.7999 67.1109 68.3948 175.0134 798 N 4.5794 8.1152 115.4480 53.2995 38.6693 175.9270 799 G 3.9789 8.4511 108.0038 45.0868 0.0000 174.0347 800 S 4.6532 7.6239 114.2261 57.1524 64.6687 173.3410 801 R 4.8957 8.1878 119.7244 54.5437 33.5909 174.6787 802 E 4.7089 8.5825 119.3229 54.7780 32.5642 175.2020 803 V 4.1684 8.1438 122.1527 62.6728 31.9341 175.4876 804 I 4.1654 8.7721 129.4575 63.6557 37.7085 176.9542 805 A 4.1408 7.9078 122.9717 51.1066 18.8663 175.3150 806 P 4.3717 0.0000 0.0000 62.1153 32.1164 176.1484 807 A 4.2753 8.1233 122.2887 51.0827 19.0493 175.7931 808 P 4.3955 0.0000 0.0000 62.4167 31.9345 177.5515 809 V 3.8136 8.1300 114.5702 61.9515 32.0123 176.4441 810 R 4.4934 8.4323 120.0178 55.9224 30.5304 176.4165 811 D 4.5417 7.8445 123.4014 53.4036 39.5234 175.7023 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 744 S 8.33 4.45 0.00 4.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 745 E 8.17 3.88 0.00 2.02 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 2.25 2.37 0.00 746 D 8.01 5.03 0.00 2.61 2.47 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 0.00 747 D 8.23 4.94 0.00 2.69 2.53 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 0.00 748 P 0.00 4.37 0.00 2.24 2.19 0.00 3.83 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 749 L 8.88 4.40 0.00 1.80 1.72 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 750 Y 8.24 4.06 0.00 3.10 2.99 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 0.00 751 D 8.20 4.21 0.00 2.80 2.71 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 0.00 752 E 8.18 3.92 0.00 2.12 1.99 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 2.40 2.33 0.00 753 A 8.21 4.04 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 0.00 754 V 7.71 3.35 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.14 0.00 0.00 755 R 8.11 3.87 0.00 2.06 1.98 0.00 3.18 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.82 0.00 756 F 8.28 4.13 0.00 3.07 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 0.00 757 V 8.35 3.41 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 0.92 0.00 0.00 1.05 0.00 0.00 758 T 7.90 3.97 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 1.20 0.00 0.00 759 E 7.76 4.08 0.00 1.98 1.99 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 2.28 2.51 0.00 760 S 7.88 4.08 0.00 3.70 3.41 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 0.00 761 R 7.60 3.85 0.00 1.92 2.01 0.00 3.25 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.67 0.00 762 R 7.59 4.55 0.00 1.69 1.81 0.00 3.11 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.63 0.00 763 A 8.44 4.71 1.20 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 0.00 0.00 0.00 764 S 7.94 4.46 0.00 4.08 4.02 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 0.00 765 I 8.18 3.60 1.67 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 1.45 0.42 0.22 0.00 0.00 766 S 8.07 4.31 0.00 4.08 4.17 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 0.00 767 A 8.12 4.03 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 0.00 768 V 7.94 3.31 2.06 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 0.98 0.00 0.00 1.16 0.00 0.00 769 Q 8.41 3.94 0.00 2.24 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.62 2.50 0.00 770 R 7.78 3.95 0.00 1.72 1.93 0.00 3.16 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 771 K 7.51 3.82 0.00 0.79 1.05 0.00 1.47 0.00 0.00 1.42 0.00 0.00 3.19 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.62 1.17 7.81 772 L 7.59 4.27 0.00 1.56 1.62 0.87 0.75 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 0.00 773 K 7.93 3.81 0.00 1.86 1.82 0.00 1.61 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.30 7.81 774 I 7.18 4.61 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.63 0.94 0.00 0.00 775 G 8.19 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 0.00 776 Y 8.48 3.91 0.00 3.12 2.99 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 0.00 777 N 8.34 4.45 0.00 2.89 2.92 0.00 0.00 6.68 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 778 R 8.04 3.88 0.00 1.89 1.93 0.00 3.19 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 779 A 8.05 3.96 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 0.00 780 A 8.13 3.82 1.22 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 0.00 0.00 0.00 781 R 8.43 3.92 0.00 1.82 2.10 0.00 3.31 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.83 0.00 782 M 7.95 4.23 0.00 2.11 2.27 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.74 0.00 783 I 7.97 3.77 1.98 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.70 0.91 0.00 0.00 784 E 8.41 3.95 0.00 2.21 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 2.34 2.52 0.00 785 A 8.14 4.02 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 786 M 8.42 4.29 0.00 2.12 2.37 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 2.97 2.52 0.00 787 E 8.35 4.19 0.00 2.05 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 2.32 2.19 0.00 788 M 7.99 4.11 0.00 2.17 2.08 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.58 0.00 789 A 7.90 4.39 1.44 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 0.00 0.00 0.00 0.00 0.00 0.00 790 G 7.84 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 0.00 791 V 8.09 3.96 2.25 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 0.98 0.00 0.00 1.00 0.00 0.00 792 V 7.61 5.06 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 0.90 0.00 0.00 0.94 0.00 0.00 793 T 8.63 4.28 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 0.00 794 P 0.00 4.75 0.00 2.07 2.10 0.00 3.73 0.00 0.00 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.19 0.00 795 M 8.36 4.31 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.54 0.00 796 N 8.63 4.86 0.00 2.93 2.97 0.00 0.00 6.85 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 0.00 797 T 8.50 3.81 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 1.22 0.00 0.00 798 N 8.12 4.58 0.00 2.71 2.85 0.00 0.00 7.07 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 799 G 8.45 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 0.00 800 S 7.62 4.65 0.00 4.01 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 0.00 801 R 8.19 4.90 0.00 1.76 1.82 0.00 3.18 0.00 0.00 3.34 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.61 0.00 802 E 8.58 4.71 0.00 1.87 1.82 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 2.23 2.36 0.00 803 V 8.14 4.17 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 0.72 0.00 0.00 0.86 0.00 0.00 804 I 8.77 4.17 2.11 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 1.15 0.68 0.91 0.00 0.00 805 A 7.91 4.14 1.22 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 0.00 0.00 0.00 806 P 0.00 4.37 0.00 2.17 2.05 0.00 3.76 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 807 A 8.12 4.28 1.28 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 0.00 0.00 0.00 0.00 0.00 0.00 808 P 0.00 4.40 0.00 2.04 1.99 0.00 3.83 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 809 V 8.13 3.81 2.20 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 0.70 0.00 0.00 0.98 0.00 0.00 810 R 8.43 4.49 0.00 1.78 1.94 0.00 3.14 0.00 0.00 3.27 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 811 D 7.84 4.54 0.00 2.73 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00