NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 503 K 4.2610 8.3144 121.7882 56.2837 33.0866 174.5737 504 R 4.5536 8.2213 125.2772 54.0266 33.4555 172.0672 505 I 4.3866 8.2691 121.7269 59.8284 41.7321 173.0731 506 A 4.5667 8.3035 129.1188 50.0338 20.1078 175.4644 507 P 4.4502 0.0000 0.0000 62.5848 32.3442 176.1736 508 T 4.1610 8.1988 118.3060 62.5537 69.2157 173.1618 509 P 4.3750 0.0000 0.0000 61.9786 32.3230 175.8361 510 V 4.0446 7.2989 118.4483 61.4069 34.3205 174.0294 511 Y 5.0991 7.8399 125.3017 55.7943 40.9741 173.8373 512 P 4.5405 0.0000 0.0000 64.0353 31.4095 176.1151 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 503 K 8.31 4.26 0.00 1.73 1.80 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.43 7.81 504 R 8.22 4.55 0.00 1.82 1.72 0.00 3.32 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 1.49 1.68 0.00 505 I 8.27 4.39 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 1.34 0.71 0.90 0.00 0.00 506 A 8.30 4.57 1.24 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 0.00 0.00 0.00 507 P 0.00 4.45 0.00 2.16 2.04 0.00 3.76 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 508 T 8.20 4.16 4.20 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 1.16 0.00 0.00 509 P 0.00 4.38 0.00 1.74 1.80 0.00 3.58 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.03 0.00 510 V 7.30 4.04 1.92 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 0.75 0.00 0.00 0.81 0.00 0.00 511 Y 7.84 5.10 0.00 2.97 2.81 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 0.00 0.00 0.00 512 P 0.00 4.54 0.00 2.08 2.02 0.00 3.75 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.14 0.00