NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5001 M 4.4032 8.1476 120.3454 55.3341 34.8506 177.0932 5002 E 3.8278 7.8482 117.8068 57.6740 29.8199 177.2711 5003 T 4.6194 8.2774 110.6108 63.2930 69.2574 177.6370 5004 I 3.8913 8.0321 117.3373 64.1859 37.9802 177.8602 5005 T 3.6423 7.6875 117.0755 66.5774 68.1481 175.9656 5006 Y 4.2649 7.4752 118.2524 61.3091 38.0865 178.5213 5007 V 3.7477 7.8317 118.4937 65.5366 31.4695 177.9466 5008 F 4.2439 9.3354 122.0391 61.7564 39.2548 176.6165 5009 I 3.3686 7.9880 119.4610 63.9695 36.6042 178.4102 5010 F 3.6423 8.3595 122.1132 61.4199 39.9749 177.5975 5011 A 4.1917 8.2612 120.6364 55.0478 18.0066 179.2171 5012 C 3.4908 8.0573 116.8850 62.5270 31.5938 176.5183 5013 I 3.2170 7.6271 121.5343 63.8098 36.5338 178.0625 5014 I 3.2370 7.9028 119.6125 63.5191 37.7650 177.3215 5015 A 4.0858 7.2325 120.3950 53.4164 18.0598 178.3453 5016 L 4.0064 7.2820 118.1093 56.3057 42.0090 178.3208 5017 F 4.7276 7.6006 117.1390 61.3935 39.2939 176.3473 5018 F 4.0386 8.0729 119.5585 61.4677 38.8664 176.8205 5019 F 3.8868 8.8396 115.7006 60.9165 39.1050 177.8500 5020 A 4.3292 7.7308 117.3166 54.3277 18.1386 178.6343 5021 I 4.2810 7.3142 116.8878 62.8606 38.5082 176.8292 5022 F 4.8633 8.2744 116.2734 58.3281 39.5375 176.5001 5023 F 5.0370 8.5944 119.4609 56.8882 39.5470 175.6555 5024 R 4.1950 8.0531 116.3333 55.5027 30.1508 175.5980 5025 E 4.0532 8.6201 121.2067 55.1715 29.8271 175.0202 5026 P 4.3589 0.0000 0.0000 61.9080 31.9723 174.2977 5027 P 4.3212 0.0000 0.0000 62.3966 31.1354 176.3607 5028 R 4.2664 8.2848 123.9225 54.3029 29.6661 177.0346 5029 I 3.9540 8.0885 124.7282 61.6110 35.6704 176.7991 5030 T 4.2074 7.9996 120.7153 63.5278 69.2645 174.2599 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 5001 M 8.15 4.40 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.46 0.00 5002 E 7.85 3.83 0.00 2.16 2.01 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 2.37 2.45 0.00 5003 T 8.28 4.62 4.39 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 1.37 0.00 0.00 5004 I 8.03 3.89 1.86 0.00 0.00 0.75 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 1.01 0.96 0.00 0.00 5005 T 7.69 3.64 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 1.09 0.00 0.00 5006 Y 7.48 4.26 0.00 3.24 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 5007 V 7.83 3.75 2.32 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 0.98 0.00 0.00 0.88 0.00 0.00 5008 F 9.34 4.24 0.00 2.94 3.22 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 5009 I 7.99 3.37 2.10 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.71 0.85 0.00 0.00 5010 F 8.36 3.64 0.00 3.25 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 5011 A 8.26 4.19 1.32 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 0.00 0.00 5012 C 8.06 3.49 0.00 2.32 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5013 I 7.63 3.22 1.63 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.11 0.13 0.00 0.00 5014 I 7.90 3.24 1.85 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.49 0.89 0.00 0.00 5015 A 7.23 4.09 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5016 L 7.28 4.01 0.00 1.52 1.44 0.77 0.91 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 5017 F 7.60 4.73 0.00 3.37 2.88 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 0.00 0.00 0.00 5018 F 8.07 4.04 0.00 2.86 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 5019 F 8.84 3.89 0.00 3.00 3.03 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 0.00 0.00 0.00 5020 A 7.73 4.33 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5021 I 7.31 4.28 1.78 0.00 0.00 0.75 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 0.93 1.21 0.00 0.00 5022 F 8.27 4.86 0.00 2.48 3.08 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 5023 F 8.59 5.04 0.00 2.65 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5024 R 8.05 4.19 0.00 1.96 2.18 0.00 3.12 0.00 0.00 3.19 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.89 0.00 5025 E 8.62 4.05 0.00 1.97 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 0.00 2.30 2.30 0.00 5026 P 0.00 4.36 0.00 2.20 2.02 0.00 3.81 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.93 0.00 5027 P 0.00 4.32 0.00 2.20 2.13 0.00 3.74 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 1.97 1.98 0.00 5028 R 8.28 4.27 0.00 1.81 1.94 0.00 3.36 0.00 0.00 3.21 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 5029 I 8.09 3.95 1.86 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 1.41 0.46 0.91 0.00 0.00 5030 T 8.00 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