NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 671 T 4.1682 8.0327 117.3683 63.7172 69.8590 171.9635 672 T 4.8762 7.6654 115.8414 59.5644 70.3453 171.3432 673 C 4.4996 10.4297 131.4661 59.7602 33.1293 173.5606 674 T 3.6818 8.6748 124.9471 66.8118 68.0969 174.8650 675 N 4.2247 7.7136 117.9038 55.6805 39.3374 175.4325 676 C 4.2723 7.6360 111.1525 58.0452 30.5706 174.4649 677 F 4.0876 7.5000 117.7165 58.5774 36.7507 174.9510 678 T 4.3076 7.2775 116.3215 62.2926 67.6842 174.5502 679 Q 5.0404 8.3808 118.2553 54.3012 31.1839 175.1739 680 T 4.5301 7.8010 115.6070 62.0190 69.3026 173.4936 681 T 4.2173 7.6750 118.5600 60.0922 70.0439 172.4028 682 P 4.3666 0.0000 0.0000 65.2569 31.6484 176.2341 683 L 4.4631 6.8738 119.9967 53.6794 45.2826 174.6241 684 W 4.7293 8.8902 126.2484 55.9827 30.5473 175.8537 685 R 4.8882 9.6601 123.2186 54.4239 32.9218 175.5297 686 R 5.1154 8.4311 118.2445 54.3029 31.1729 175.2857 687 N 4.6461 9.5278 122.6274 51.2905 38.1657 173.9691 688 P 4.1259 0.0000 0.0000 66.5491 31.4059 177.8535 689 E 3.9927 7.9970 113.1981 57.4070 29.0539 178.2544 690 G 3.9527 8.2740 107.7060 45.2280 0.0000 174.2762 691 Q 4.3293 8.7743 119.7753 55.1296 30.1659 173.5210 692 P 5.2290 0.0000 0.0000 62.1292 33.7410 174.6534 693 L 5.2213 9.3959 122.0971 52.9367 46.1848 176.2297 694 C 3.8918 8.9348 118.1746 57.7747 30.3337 174.0398 695 N 4.2025 8.6401 118.1520 57.0487 38.2595 176.4031 696 A 4.0014 7.8469 121.5405 55.2440 18.5501 178.8766 697 C 4.0750 8.1033 113.7996 63.0673 28.3617 176.8540 698 G 3.6278 8.2334 106.9869 47.5537 0.0000 175.5775 699 L 3.9431 8.2726 123.0918 57.8051 42.0902 178.6147 700 F 3.9725 8.6944 121.0319 61.3875 39.2291 176.8073 701 L 4.6971 8.1022 121.1291 57.5499 41.6554 178.7865 702 K 3.8824 7.8466 118.4981 59.6497 32.2565 178.4965 703 L 4.0196 7.9159 118.0877 57.0492 41.6733 178.0918 704 H 4.6695 8.2864 113.8125 55.0520 30.2186 175.6353 705 G 4.0077 8.6121 109.1990 44.8431 0.0000 173.5147 706 V 4.6239 7.2477 111.4994 58.9344 35.2702 175.2302 707 V 4.0036 8.2411 114.9954 60.9977 31.9346 176.4798 708 R 2.5100 8.5500 124.5413 55.4532 30.0813 174.4160 709 P 4.3471 0.0000 0.0000 62.5656 32.2145 175.5130 710 L 4.7380 8.2007 120.2765 53.1164 44.8920 176.5299 711 S 4.4304 8.6922 113.1246 59.1157 62.8727 168.9166 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 671 T 8.03 4.17 3.06 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 0.00 0.00 0.00 0.53 0.00 0.00 672 T 7.67 4.88 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 1.23 0.00 0.00 673 C 10.43 4.50 0.00 3.20 3.06 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 0.00 0.00 0.00 0.00 674 T 8.67 3.68 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 1.15 0.00 0.00 675 N 7.71 4.22 0.00 2.58 2.69 0.00 0.00 6.95 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 0.00 676 C 7.64 4.27 0.00 3.15 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 0.00 677 F 7.50 4.09 0.00 3.29 3.24 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 0.00 678 T 7.28 4.31 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 1.11 0.00 0.00 679 Q 8.38 5.04 0.00 2.13 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.50 0.00 0.00 0.00 0.00 0.00 2.60 2.46 0.00 680 T 7.80 4.53 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 1.18 0.00 0.00 681 T 7.67 4.22 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 -0.39 0.00 0.00 682 P 0.00 4.37 0.00 2.16 2.11 0.00 3.66 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.88 0.00 683 L 6.87 4.46 0.00 1.73 1.58 0.97 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 684 W 8.89 4.73 0.00 3.23 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 0.00 685 R 9.66 4.89 0.00 1.89 1.86 0.00 2.97 0.00 0.00 3.25 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.75 0.00 686 R 8.43 5.12 0.00 1.78 1.94 0.00 3.05 0.00 0.00 3.30 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 687 N 9.53 4.65 0.00 2.86 3.03 0.00 0.00 6.60 8.08 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 0.00 688 P 0.00 4.13 0.00 2.06 2.17 0.00 3.69 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 2.05 2.16 0.00 689 E 8.00 3.99 0.00 1.95 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 0.00 2.32 2.31 0.00 690 G 8.27 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 0.00 691 Q 8.77 4.33 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.84 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 692 P 0.00 5.23 0.00 1.82 1.93 0.00 3.59 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.80 0.00 693 L 9.40 5.22 0.00 1.60 1.59 0.96 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 694 C 8.93 3.89 0.00 2.76 2.79 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 0.00 695 N 8.64 4.20 0.00 2.89 2.76 0.00 0.00 7.50 8.14 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 0.00 696 A 7.85 4.00 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 0.00 697 C 8.10 4.07 0.00 2.97 3.01 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 0.00 698 G 8.23 3.63 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 0.00 0.00 0.00 0.00 0.00 0.00 699 L 8.27 3.94 0.00 2.12 1.72 0.93 1.11 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 0.00 700 F 8.69 3.97 0.00 3.19 3.21 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 0.00 701 L 8.10 4.70 0.00 2.02 1.87 1.04 0.69 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 0.00 702 K 7.85 3.88 0.00 1.89 2.08 0.00 1.85 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.47 7.81 703 L 7.92 4.02 0.00 1.18 1.39 0.83 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 704 H 8.29 4.67 0.00 2.58 3.05 0.00 5.64 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 705 G 8.61 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 0.00 706 V 7.25 4.62 2.19 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 0.98 0.00 0.00 1.18 0.00 0.00 707 V 8.24 4.00 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 0.69 0.00 0.00 0.95 0.00 0.00 708 R 8.55 2.51 0.00 1.47 1.59 0.00 3.07 0.00 0.00 3.17 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.50 0.00 709 P 0.00 4.35 0.00 2.14 1.98 0.00 2.70 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.93 0.00 710 L 8.20 4.74 0.00 1.62 1.63 1.02 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 711 S 8.69 4.43 0.00 3.93 4.08 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 0.00 0.00 0.00