NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 52 S 4.4081 8.1885 115.4141 57.8822 64.9561 175.2403 53 A 3.8589 8.1937 126.1126 55.4869 17.8958 178.6709 54 R 3.9049 8.9466 117.7220 59.8683 30.5304 176.9943 55 D 4.3565 7.9217 118.0038 57.5456 40.8506 179.0899 56 I 3.7007 7.6688 119.7202 64.7679 37.1258 178.1484 57 H 4.6755 8.3303 118.3590 58.2086 28.3344 177.9850 58 Q 3.9950 8.1600 120.1659 58.8754 28.4998 178.6689 59 L 3.9891 8.1250 120.1108 57.8027 41.5130 179.3240 60 E 3.9155 8.6530 118.6842 59.4292 29.3753 179.2188 61 A 4.0239 8.2453 120.8536 55.3273 18.4023 179.9698 62 R 3.8659 7.8125 116.2626 59.4909 30.1294 179.3910 63 I 3.7354 7.9755 119.7323 64.3914 37.0315 178.2047 64 D 4.3575 8.4025 120.0975 57.3785 40.6608 178.6891 65 S 4.0844 8.2475 113.6553 61.5075 62.2880 176.3009 66 L 3.9861 7.9912 121.3838 57.7311 41.3539 179.3800 67 A 3.9726 8.5242 121.0205 55.0187 18.2226 179.5403 68 A 3.9653 8.2236 119.4433 55.3884 18.3780 180.1538 69 R 3.8546 8.0285 116.6504 59.1355 30.0951 178.5164 70 N 4.2543 8.4613 117.3235 57.0419 38.8172 177.0678 71 S 4.1054 8.1730 116.2731 61.3435 62.9103 176.4712 72 K 3.8739 8.2479 122.4687 59.5088 31.9439 178.6454 73 L 3.9678 8.2383 119.5038 58.1178 41.6172 179.2386 74 M 4.0153 8.1540 117.9991 58.6528 32.2790 177.8561 75 E 3.9506 8.4841 119.7333 59.5339 29.7983 178.8940 76 T 3.8749 8.0563 115.8028 66.6613 68.4602 176.5677 77 L 4.0080 8.4638 121.2060 57.7674 41.7369 179.7401 78 K 3.9606 8.1845 118.3847 59.5014 31.9716 179.2454 79 E 4.1400 8.1918 118.4156 59.3412 29.3395 179.2094 80 A 3.9913 7.9986 120.8621 55.0720 18.4426 179.5588 81 R 3.8306 8.2134 117.3243 59.7310 30.1586 178.7144 82 Q 4.0120 7.9525 117.3611 59.2112 28.6381 179.0093 83 Q 4.0180 8.2455 118.9849 58.8291 28.7238 178.6253 84 L 3.9810 8.3475 120.5031 57.8327 41.7633 179.6057 85 L 3.9770 8.0656 118.6316 57.7574 41.5183 179.4587 86 A 4.0131 8.1623 120.7678 54.9677 18.2770 179.4090 87 L 3.8808 8.2478 119.2623 58.3564 42.0293 179.2748 88 R 3.9487 8.2100 118.6962 59.3159 29.9707 178.3914 89 E 3.9839 8.1755 118.4604 59.1716 29.2153 178.8180 90 E 3.9392 8.1816 118.7914 59.2541 29.7753 178.7314 91 V 3.7284 7.6227 117.4581 66.0733 31.9233 177.4883 92 D 4.5356 7.9535 118.8901 57.0728 40.4699 178.2779 93 R 4.2647 7.7421 115.0943 57.1351 29.8957 176.4722 94 L 4.2167 7.5651 126.3202 55.3234 42.4612 175.3904 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 52 S 8.19 4.41 0.00 4.30 4.15 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 0.00 0.00 0.00 53 A 8.19 3.86 1.41 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 0.00 0.00 54 R 8.95 3.90 0.00 1.92 2.03 0.00 3.20 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.82 0.00 55 D 7.92 4.36 0.00 2.87 2.72 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 0.00 0.00 0.00 56 I 7.67 3.70 1.84 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 1.61 0.38 0.80 0.00 0.00 57 H 8.33 4.68 0.00 3.25 3.37 0.00 5.82 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 Q 8.16 3.99 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.57 0.00 59 L 8.13 3.99 0.00 1.81 1.71 0.92 0.86 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 60 E 8.65 3.92 0.00 2.10 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 2.30 2.48 0.00 61 A 8.25 4.02 1.38 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 0.00 0.00 62 R 7.81 3.87 0.00 2.08 1.99 0.00 3.30 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 63 I 7.98 3.74 1.87 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 1.52 0.71 0.91 0.00 0.00 64 D 8.40 4.36 0.00 2.90 2.72 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 0.00 0.00 0.00 65 S 8.25 4.08 0.00 3.98 3.97 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 0.00 0.00 0.00 66 L 7.99 3.99 0.00 1.92 1.70 0.92 1.01 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 67 A 8.52 3.97 1.35 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 0.00 0.00 68 A 8.22 3.97 1.37 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 69 R 8.03 3.85 0.00 2.01 1.99 0.00 3.15 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 1.65 1.86 0.00 70 N 8.46 4.25 0.00 2.73 2.99 0.00 0.00 7.22 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 71 S 8.17 4.11 0.00 4.04 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 K 8.25 3.87 0.00 1.88 1.97 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.49 7.81 73 L 8.24 3.97 0.00 1.86 1.71 0.92 0.67 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 74 M 8.15 4.02 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.59 0.00 75 E 8.48 3.95 0.00 2.21 1.93 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 2.30 2.39 0.00 76 T 8.06 3.87 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 1.21 0.00 0.00 77 L 8.46 4.01 0.00 1.78 1.72 0.92 1.05 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 78 K 8.18 3.96 0.00 1.95 1.86 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.65 7.81 79 E 8.19 4.14 0.00 2.17 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 2.33 2.51 0.00 80 A 8.00 3.99 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.21 3.83 0.00 1.88 2.10 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 82 Q 7.95 4.01 0.00 2.34 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.64 0.00 83 Q 8.25 4.02 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.63 0.00 84 L 8.35 3.98 0.00 1.81 1.72 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 85 L 8.07 3.98 0.00 1.85 1.71 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 86 A 8.16 4.01 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 L 8.25 3.88 0.00 1.86 1.87 0.92 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 88 R 8.21 3.95 0.00 1.92 1.90 0.00 3.14 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 89 E 8.18 3.98 0.00 2.21 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 2.33 2.49 0.00 90 E 8.18 3.94 0.00 2.17 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 91 V 7.62 3.73 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 0.89 0.00 0.00 0.93 0.00 0.00 92 D 7.95 4.54 0.00 2.83 2.69 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 0.00 0.00 0.00 0.00 93 R 7.74 4.26 0.00 1.93 1.97 0.00 3.29 0.00 0.00 3.15 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.78 0.00 94 L 7.57 4.22 0.00 1.54 1.56 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00