NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5001 M 4.3683 8.1633 120.3416 55.1694 34.6208 177.2742 5002 E 3.6385 8.0445 117.9254 58.3438 30.0476 176.4851 5003 T 4.0553 8.0750 115.6211 67.0597 69.0663 175.5780 5004 I 3.6777 7.7057 119.4694 64.5845 37.5156 177.9060 5005 T 3.9718 7.2536 115.8409 66.4173 68.1697 176.4803 5006 Y 4.3893 8.0801 119.3674 61.0708 38.1165 178.1381 5007 V 3.7859 8.3429 119.3510 65.7311 31.4062 177.7194 5008 F 4.4266 8.3139 120.4611 61.3390 39.3825 176.9262 5009 I 3.3243 7.6942 118.4609 64.4583 36.9700 178.2318 5010 F 3.9574 8.3282 120.7960 61.3537 39.2433 177.0995 5011 A 3.9653 8.3197 120.2143 55.1783 17.9387 179.4683 5012 C 3.9164 7.9177 115.7207 62.7502 28.2249 176.0469 5013 I 3.3374 7.2865 121.3418 64.4539 36.4932 178.6077 5014 I 3.2359 7.0551 120.0911 63.9421 36.7692 178.3428 5015 A 4.0170 7.6635 121.6695 54.7494 18.3391 179.3774 5016 L 4.2858 8.2160 118.9405 57.9096 41.9472 179.3516 5017 F 4.5374 8.1254 118.3298 60.5816 38.8444 176.9694 5018 F 4.4107 8.1429 120.3916 61.7480 39.0915 177.0010 5019 F 4.3851 8.3510 116.7817 60.8354 38.6229 177.7144 5020 A 4.1447 8.1491 118.8135 54.7018 18.1220 178.8761 5021 I 3.8442 7.1174 117.6948 63.1062 37.6945 176.8699 5022 F 4.6556 7.5043 116.8373 57.3749 38.6634 177.1267 5023 F 4.5592 7.5519 118.1881 56.2342 40.4783 174.7451 5024 R 4.3448 7.9981 118.6994 55.0935 31.3940 174.4488 5025 E 4.4680 8.4088 116.4939 53.8431 30.2510 174.0062 5026 P 4.2439 0.0000 0.0000 62.5341 31.5607 175.4821 5027 P 4.5537 0.0000 0.0000 61.8673 29.7190 175.4724 5028 R 4.0829 7.7724 124.7002 56.5226 31.0682 176.6563 5029 I 3.8773 8.3729 125.3304 62.1621 37.6557 177.0225 5030 T 4.2245 8.4110 116.7023 60.8499 69.1716 170.3371 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 8.16 4.37 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.50 0.00 5002 E 8.04 3.64 0.00 2.17 1.68 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 2.37 2.40 0.00 5003 T 8.08 4.06 4.26 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 1.26 0.00 0.00 5004 I 7.71 3.68 1.84 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.82 0.00 0.00 5005 T 7.25 3.97 3.94 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 1.14 0.00 0.00 5006 Y 8.08 4.39 0.00 3.11 2.91 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 0.00 0.00 0.00 0.00 5007 V 8.34 3.79 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.02 0.00 0.00 5008 F 8.31 4.43 0.00 3.17 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 5009 I 7.69 3.32 1.96 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.82 0.89 0.00 0.00 5010 F 8.33 3.96 0.00 3.17 3.27 0.00 0.00 0.00 0.00 0.00 0.00 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 8.32 3.97 1.47 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 0.00 0.00 0.00 5012 C 7.92 3.92 0.00 2.84 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 5013 I 7.29 3.34 1.29 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 1.57 0.63 0.07 0.00 0.00 5014 I 7.06 3.24 1.52 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.32 0.82 0.00 0.00 5015 A 7.66 4.02 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.22 4.29 0.00 1.87 1.88 1.02 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 5017 F 8.13 4.54 0.00 3.30 3.02 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 5018 F 8.14 4.41 0.00 3.04 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 8.35 4.39 0.00 3.27 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 5020 A 8.15 4.14 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 5021 I 7.12 3.84 1.24 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.52 -0.27 0.00 0.00 5022 F 7.50 4.66 0.00 2.23 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 7.55 4.56 0.00 3.37 3.13 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 0.00 0.00 0.00 0.00 5024 R 8.00 4.34 0.00 1.90 2.15 0.00 2.97 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 5025 E 8.41 4.47 0.00 2.09 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 2.21 2.27 0.00 5026 P 0.00 4.24 0.00 2.18 2.10 0.00 3.76 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 5027 P 0.00 4.55 0.00 2.18 2.11 0.00 3.74 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 5028 R 7.77 4.08 0.00 1.82 1.90 0.00 3.36 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.59 0.00 5029 I 8.37 3.88 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 1.27 0.33 0.90 0.00 0.00 5030 T 8.41 4.22 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