NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 74 V 4.0160 8.0544 120.3916 62.8173 32.7621 173.9235 75 T 4.0654 8.1227 115.0169 59.9813 68.2078 173.0818 76 D 4.4033 9.4245 127.9319 55.1695 43.7296 177.2741 77 Q 4.0756 8.6666 125.1527 58.5616 28.7876 178.6064 78 L 3.9915 7.9213 121.1836 58.2296 42.3863 178.3886 79 E 3.9703 8.4824 118.5547 59.4770 29.2898 178.9789 80 D 4.3109 8.1786 117.8266 57.5838 41.4913 178.4863 81 L 4.1322 7.8759 118.8256 57.5329 41.4843 179.9278 82 R 3.9893 8.4229 118.7098 59.2514 29.8767 178.3758 83 E 3.9462 8.0017 117.6294 59.7232 29.4988 177.8811 84 H 4.1629 8.4362 118.1525 59.3736 29.8198 176.8929 85 F 4.2048 8.0080 118.1759 59.3694 38.7815 178.0215 86 K 4.2434 8.5305 117.9406 58.3673 31.7521 177.1903 87 N 4.9288 7.5542 115.5929 53.0628 39.1147 175.3553 88 T 4.4135 7.4950 109.8314 60.3703 71.9031 174.8546 89 E 3.9190 8.5300 119.9660 59.7742 29.5324 179.5755 90 E 3.9422 8.1410 118.1485 59.2282 29.5460 179.5191 91 G 3.5283 7.8653 105.5302 47.5063 0.0000 176.0528 92 K 3.9918 8.3569 120.8437 59.2301 32.0902 179.2011 93 A 3.9379 7.9839 121.0363 55.2534 18.3486 179.7374 94 L 4.0478 7.7967 117.1787 57.9499 41.7585 180.0550 95 V 3.8887 7.9585 112.4140 64.1555 31.4345 178.0712 96 H 4.1300 8.4457 118.4767 59.8366 29.6333 177.0911 97 H 4.2162 8.0128 117.8186 58.9256 28.4612 177.2871 98 Y 4.0747 8.0790 121.3236 60.4487 38.5691 177.4736 99 E 3.6933 8.6493 120.7970 59.1758 29.6194 178.3769 100 E 3.8338 8.6900 119.6156 59.1432 29.5710 178.1248 101 C 4.1819 7.7335 118.7132 59.4803 37.9716 175.3180 102 A 3.7408 7.5411 122.3930 54.8406 17.7265 179.1504 103 E 3.7719 8.2087 117.9214 59.6113 29.5727 179.0141 104 R 3.8642 7.3544 117.0294 59.3166 30.2925 178.3415 105 V 3.7591 7.4845 117.8084 65.6419 31.8458 178.2497 106 K 3.9570 7.8287 117.8776 59.7397 31.9759 179.2426 107 I 3.7688 7.4974 121.3271 64.3645 36.7821 178.3080 108 Q 3.9988 7.5739 117.4566 58.7570 28.5602 178.3416 109 Q 2.8779 7.1853 117.1144 57.1202 28.7063 176.5883 110 Q 4.5982 7.2628 117.7613 55.5154 29.2856 175.1992 111 Q 4.5570 7.7436 116.2785 52.9951 32.0836 173.7438 112 P 4.2964 0.0000 0.0000 64.3565 31.7654 176.2252 113 G 3.9150 8.8871 108.0109 46.2863 0.0000 174.0896 114 Y 4.1585 8.2083 122.7596 60.2091 38.9706 176.9368 115 A 4.2283 7.9763 118.7256 53.3665 18.6836 177.6602 116 D 4.7723 7.3705 115.4938 52.8070 42.1963 174.4277 117 L 4.5637 7.5634 121.3579 53.2748 44.5759 176.2446 118 E 4.3817 8.3543 114.3709 56.7091 28.5427 175.0741 119 H 4.5491 7.3005 115.3404 55.6974 30.6513 173.3995 120 K 4.2295 8.1058 118.2288 55.5870 32.5863 176.6168 121 E 4.2693 8.7777 125.3324 55.4054 30.4255 174.7684 122 D 5.1342 8.4205 123.8548 51.9602 42.5258 175.8922 123 C 5.5118 8.2590 112.9077 55.6330 39.7028 177.0083 124 V 3.5922 8.0786 121.2617 66.0497 31.0111 176.8054 125 E 3.9358 8.1153 118.4302 59.6199 29.4069 178.5871 126 E 4.1244 8.3132 117.9870 59.2820 29.5291 178.9362 127 F 4.0260 9.0238 121.2443 61.4533 39.5059 177.2188 128 F 4.2702 9.4613 118.0336 60.9446 38.6945 177.3883 129 H 4.2685 8.6356 115.9811 58.6667 28.4929 177.4859 130 L 3.9195 7.8303 121.6468 58.3387 41.9694 178.7487 131 Q 3.7287 8.0050 119.7722 59.2685 28.7812 177.9739 132 H 3.9728 8.6134 119.6249 59.2679 29.8052 176.4859 133 Y 3.9404 7.8920 121.2305 60.7770 38.5467 178.2317 134 L 3.6223 7.9391 119.6705 57.6682 41.6649 179.1599 135 D 4.1863 8.2002 119.1779 57.8129 40.5706 179.1549 136 T 3.6234 7.5780 114.4989 65.9218 68.3544 175.8057 137 A 3.8148 6.7512 121.7135 53.7463 19.4959 178.9105 138 T 4.0247 7.8210 108.2432 64.1515 69.2794 177.1169 139 A 3.8951 7.9290 124.0302 54.2621 18.2276 177.1604 140 P 4.3378 0.0000 0.0000 64.2020 31.4983 176.8837 141 R 4.5249 7.4674 116.5753 56.7159 33.0129 177.5874 142 L 4.0712 8.0798 119.5460 58.2365 41.8852 178.7776 143 F 4.3789 8.3590 116.4505 59.6232 38.9198 177.2006 144 D 4.5234 7.8871 117.0861 56.2900 40.6599 177.6456 145 K 4.3454 7.6934 116.8194 55.8334 32.8635 176.4978 146 L 4.4279 6.7945 118.7316 53.2239 43.3023 176.5421 147 K 4.0902 8.2303 119.9860 56.6401 32.1571 176.1048 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 74 V 8.05 4.02 2.07 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 0.95 0.00 0.00 0.92 0.00 0.00 75 T 8.12 4.07 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 76 D 9.42 4.40 0.00 2.83 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.67 4.08 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.71 0.00 0.00 0.00 0.00 0.00 2.44 2.47 0.00 78 L 7.92 3.99 0.00 1.79 1.89 0.94 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 79 E 8.48 3.97 0.00 2.24 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 2.36 2.44 0.00 80 D 8.18 4.31 0.00 2.92 2.87 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 0.00 0.00 0.00 81 L 7.88 4.13 0.00 1.97 1.88 1.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 82 R 8.42 3.99 0.00 2.00 2.01 0.00 3.16 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 83 E 8.00 3.95 0.00 2.17 2.14 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 0.00 2.35 2.39 0.00 84 H 8.44 4.16 0.00 3.19 3.37 0.00 5.82 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.01 4.20 0.00 3.35 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 K 8.53 4.24 0.00 1.93 1.94 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.68 7.81 87 N 7.55 4.93 0.00 2.65 2.76 0.00 0.00 6.95 7.20 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 88 T 7.49 4.41 4.47 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 1.18 0.00 0.00 89 E 8.53 3.92 0.00 2.00 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 0.00 2.40 2.35 0.00 90 E 8.14 3.94 0.00 1.51 1.58 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 2.40 2.40 0.00 91 G 7.87 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 0.00 0.00 0.00 92 K 8.36 3.99 0.00 2.05 1.84 0.00 1.66 0.00 0.00 1.64 0.00 0.00 3.08 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.45 7.81 93 A 7.98 3.94 1.33 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 0.00 0.00 94 L 7.80 4.05 0.00 1.94 1.73 0.94 0.60 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 95 V 7.96 3.89 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 0.83 0.00 0.00 1.03 0.00 0.00 96 H 8.45 4.13 0.00 3.25 3.39 0.00 5.61 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 H 8.01 4.22 0.00 3.26 3.32 0.00 5.67 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Y 8.08 4.07 0.00 3.26 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 99 E 8.65 3.69 0.00 2.37 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 2.33 2.34 0.00 100 E 8.69 3.83 0.00 1.98 1.85 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 2.26 2.27 0.00 101 C 7.73 4.18 0.00 3.03 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 0.00 102 A 7.54 3.74 1.09 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 0.00 0.00 0.00 0.00 0.00 0.00 103 E 8.21 3.77 0.00 2.08 2.04 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 2.27 2.28 0.00 104 R 7.35 3.86 0.00 1.92 2.10 0.00 3.30 0.00 0.00 3.13 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 105 V 7.48 3.76 2.16 0.00 0.00 0.00 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 0.00 106 K 7.83 3.96 0.00 1.98 1.99 0.00 1.32 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.42 7.81 107 I 7.50 3.77 1.98 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 1.48 0.87 0.88 0.00 0.00 108 Q 7.57 4.00 0.00 2.18 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.03 0.00 0.00 0.00 0.00 0.00 2.41 2.58 0.00 109 Q 7.19 2.88 0.00 1.93 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 7.43 0.00 0.00 0.00 0.00 0.00 1.19 2.26 0.00 110 Q 7.26 4.60 0.00 1.96 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.59 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 111 Q 7.74 4.56 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.95 0.00 0.00 0.00 0.00 0.00 2.23 2.50 0.00 112 P 0.00 4.30 0.00 2.19 2.07 0.00 3.77 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 113 G 8.89 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 0.00 114 Y 8.21 4.16 0.00 2.96 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 0.00 115 A 7.98 4.23 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 0.00 116 D 7.37 4.77 0.00 2.60 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 L 7.56 4.56 0.00 1.66 1.49 1.01 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 118 E 8.35 4.38 0.00 2.16 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 2.19 2.28 0.00 119 H 7.30 4.55 0.00 3.32 3.22 0.00 5.75 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 K 8.11 4.23 0.00 1.73 1.76 0.00 1.56 0.00 0.00 0.81 0.00 0.00 2.55 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.96 1.21 7.81 121 E 8.78 4.27 0.00 1.97 1.88 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 2.29 2.30 0.00 122 D 8.42 5.13 0.00 2.79 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 C 8.26 5.51 0.00 3.14 3.23 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 0.00 124 V 8.08 3.59 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 0.33 0.00 0.00 0.92 0.00 0.00 125 E 8.12 3.94 0.00 2.05 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 2.48 2.52 0.00 126 E 8.31 4.12 0.00 2.52 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 0.00 2.61 2.46 0.00 127 F 9.02 4.03 0.00 3.20 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 F 9.46 4.27 0.00 3.26 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 H 8.64 4.27 0.00 3.50 3.44 0.00 5.82 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 L 7.83 3.92 0.00 1.84 1.48 0.77 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 8.01 3.73 0.00 1.60 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.59 0.00 0.00 0.00 0.00 0.00 2.11 2.20 0.00 132 H 8.61 3.97 0.00 3.27 3.45 0.00 5.85 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 Y 7.89 3.94 0.00 3.15 3.15 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 0.00 134 L 7.94 3.62 0.00 1.77 1.61 0.89 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 135 D 8.20 4.19 0.00 2.67 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 T 7.58 3.62 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 1.05 0.00 0.00 137 A 6.75 3.81 -0.19 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 0.00 0.00 138 T 7.82 4.02 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 1.23 0.00 0.00 139 A 7.93 3.90 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 P 0.00 4.34 0.00 2.17 2.09 0.00 3.46 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.92 0.00 141 R 7.47 4.52 0.00 2.13 2.01 0.00 3.27 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.53 0.00 142 L 8.08 4.07 0.00 1.97 1.86 1.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 143 F 8.36 4.38 0.00 3.05 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 0.00 144 D 7.89 4.52 0.00 2.88 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 K 7.69 4.35 0.00 1.94 1.85 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.62 7.81 146 L 6.79 4.43 0.00 1.28 1.33 0.35 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 147 K 8.23 4.09 0.00 1.64 1.61 0.00 1.67 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.31 1.43 7.81