NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 46 N 4.8256 8.4249 119.2050 53.5141 40.0026 174.0726 47 I 4.1925 7.0167 130.3898 57.5477 38.7537 175.6809 48 D 4.3019 8.8855 119.4669 56.6239 38.3490 172.4256 49 T 4.2137 8.1113 115.3185 63.9534 68.3750 175.4567 50 M 4.6450 7.7509 117.0870 54.6619 34.1930 176.7409 51 A 4.3259 7.9045 120.1786 53.0826 18.7626 179.0526 52 K 3.9874 7.9229 117.8341 59.5372 32.9709 178.9333 53 A 4.1034 7.8986 121.5138 54.4210 18.3984 179.3585 54 L 3.9615 7.7367 119.0944 58.3157 42.2766 179.0969 55 T 3.8863 8.0704 109.9342 65.1451 68.8266 176.5640 56 T 4.5954 7.7092 117.0950 64.6042 67.3375 176.0610 57 M 4.1137 8.1103 120.8062 58.2726 31.9688 178.4787 58 Q 4.0540 8.2911 119.8466 59.1366 29.2588 178.1521 59 E 3.9930 8.2722 119.6372 59.5519 29.5129 179.3652 60 Q 3.9937 8.0998 117.9853 58.9232 28.7667 178.9681 61 I 3.6686 8.3557 121.0267 64.5996 37.3601 178.1481 62 D 4.5043 8.5837 120.0983 57.5358 40.7052 179.0354 63 S 4.0524 8.2082 113.5481 61.1513 62.4268 175.8996 64 L 3.8130 8.3009 123.2885 58.0665 41.8362 178.6091 65 A 3.3287 8.2658 120.7419 54.9255 18.0517 179.3685 66 A 3.8079 7.5549 118.7134 55.3104 18.4453 180.1199 67 V 3.4427 7.4770 116.5207 66.0179 31.5382 178.4170 68 V 3.4884 8.1335 118.3139 66.0137 31.3408 178.0574 69 L 3.8552 8.2645 119.0417 57.7042 41.3780 179.2903 70 Q 4.0205 8.0421 119.6523 59.1300 28.9086 177.9550 71 N 4.3636 8.5168 118.1219 56.0719 38.5235 177.4117 72 R 3.8314 8.1693 120.6212 59.4959 30.1161 178.8177 73 R 4.0961 8.5076 118.4613 59.0355 29.8977 179.3051 74 G 3.5673 8.3955 106.0506 47.8443 0.0000 175.8334 75 L 4.0019 8.2079 122.1003 57.5889 41.4038 179.3974 76 D 4.3381 8.4128 118.3919 57.2007 40.7812 178.2984 77 M 4.1589 8.2912 119.1334 58.7487 32.1176 178.2899 78 L 4.0641 8.0644 118.2481 57.0531 41.9216 178.6765 79 T 4.5705 8.0565 108.8474 61.4886 69.9069 176.4967 80 A 3.9443 7.7052 126.4420 56.2105 18.1465 180.0652 81 A 4.1959 8.0581 118.5445 54.6755 18.6298 177.9952 82 Q 4.4208 8.2272 113.5271 55.5991 28.9592 176.2633 83 G 3.7389 8.3436 106.1396 46.0935 0.0000 174.1995 84 G 3.9540 8.0255 105.2529 44.2871 0.0000 175.1645 85 I 3.7194 9.5397 119.0047 63.9334 37.7810 177.5147 86 C 4.3215 8.1177 117.0434 60.1277 41.3236 175.9052 87 L 3.9312 7.9378 119.8140 57.7196 41.0395 179.2231 88 A 4.0128 8.2442 120.3099 54.7455 18.4035 178.7491 89 L 4.2716 7.7790 114.5576 53.9280 42.1823 176.1729 90 D 4.4328 8.1178 117.4657 55.3207 40.1452 172.6875 91 E 4.8095 7.9947 114.3055 53.2256 33.2791 175.9548 92 K 4.0341 8.4322 121.3194 56.7021 32.8139 176.7566 93 C 4.6056 8.6274 124.9309 56.2127 44.3935 172.4167 94 C 4.7881 8.6991 124.7154 58.6063 28.9897 172.9855 95 F 4.8720 8.6917 122.2101 55.0754 41.8864 174.7250 96 W 5.1168 8.5543 131.6030 57.5561 31.2189 176.2733 97 V 4.0673 6.5933 113.4151 59.5540 32.8798 175.4480 98 N 3.5491 5.7700 123.5137 53.6458 39.7461 173.4505 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 46 N 8.42 4.83 0.00 2.68 2.83 0.00 0.00 6.77 7.06 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 47 I 7.02 4.19 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 1.41 0.65 0.91 0.00 0.00 48 D 8.89 4.30 0.00 2.80 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 T 8.11 4.21 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 50 M 7.75 4.65 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.49 0.00 51 A 7.90 4.33 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 52 K 7.92 3.99 0.00 2.04 2.08 0.00 1.39 0.00 0.00 1.82 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.56 7.81 53 A 7.90 4.10 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 54 L 7.74 3.96 0.00 1.70 1.84 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 55 T 8.07 3.89 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 1.27 0.00 0.00 56 T 7.71 4.60 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 1.26 0.00 0.00 57 M 8.11 4.11 0.00 2.14 2.29 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.55 0.00 58 Q 8.29 4.05 0.00 2.33 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.67 0.00 59 E 8.27 3.99 0.00 2.25 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 2.34 2.61 0.00 60 Q 8.10 3.99 0.00 2.29 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.60 0.00 61 I 8.36 3.67 2.09 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.00 1.12 0.00 0.00 62 D 8.58 4.50 0.00 2.68 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 S 8.21 4.05 0.00 3.88 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 64 L 8.30 3.81 0.00 1.84 1.67 0.85 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 65 A 8.27 3.33 0.28 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 66 A 7.55 3.81 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 67 V 7.48 3.44 2.13 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 0.86 0.00 0.00 0.91 0.00 0.00 68 V 8.13 3.49 1.91 0.00 0.00 0.00 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 0.79 0.00 0.00 69 L 8.26 3.86 0.00 1.55 1.60 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 70 Q 8.04 4.02 0.00 2.16 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 71 N 8.52 4.36 0.00 2.85 2.80 0.00 0.00 6.61 7.67 0.00 0.00 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 R 8.17 3.83 0.00 1.80 2.01 0.00 3.18 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.67 0.00 73 R 8.51 4.10 0.00 1.94 1.93 0.00 3.16 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.82 0.00 74 G 8.40 3.57 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 0.00 75 L 8.21 4.00 0.00 1.78 1.71 0.90 0.92 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 76 D 8.41 4.34 0.00 2.58 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.29 4.16 0.00 2.23 2.07 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.57 0.00 78 L 8.06 4.06 0.00 1.78 1.71 0.91 1.04 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 79 T 8.06 4.57 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 80 A 7.71 3.94 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.06 4.20 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 82 Q 8.23 4.42 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.14 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 83 G 8.34 3.74 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 0.00 0.00 0.00 84 G 8.03 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 85 I 9.54 3.72 1.86 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 1.51 1.20 0.94 0.00 0.00 86 C 8.12 4.32 0.00 3.06 3.32 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 0.00 87 L 7.94 3.93 0.00 1.79 1.81 1.01 0.73 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 88 A 8.24 4.01 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 89 L 7.78 4.27 0.00 1.80 1.88 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.12 4.43 0.00 2.80 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 91 E 7.99 4.81 0.00 1.98 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.40 0.00 92 K 8.43 4.03 0.00 1.73 1.74 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.45 7.81 93 C 8.63 4.61 0.00 3.09 3.20 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 94 C 8.70 4.79 0.00 3.07 2.94 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 0.00 0.00 0.00 0.00 95 F 8.69 4.87 0.00 2.92 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 96 W 8.55 5.12 0.00 3.16 2.98 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 97 V 6.59 4.07 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 0.73 0.00 0.00 0.48 0.00 0.00 98 N 5.77 3.55 0.00 2.47 2.47 0.00 0.00 6.92 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