NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 448 D 4.6059 8.2233 120.1909 54.0761 42.6716 176.3098 449 I 3.6708 8.1943 125.8516 62.5541 37.3025 177.2798 450 S 4.1131 9.0007 116.0115 61.6833 63.2006 176.3061 451 T 3.8581 7.8065 118.7581 66.5411 68.3130 176.3313 452 E 3.9931 7.9632 120.3798 59.4404 29.3802 179.4919 453 L 4.0476 8.2710 119.5585 57.6118 41.5484 179.7043 454 S 4.1196 8.2399 114.4685 61.3704 62.9810 176.7340 455 K 3.9635 8.0842 122.1618 59.0175 31.7460 179.4831 456 V 3.5616 7.8595 118.6553 65.9742 31.4912 177.5590 457 N 4.2667 8.3562 116.7631 56.5684 38.7856 176.4926 458 A 3.9831 8.3091 122.4717 55.3259 18.4696 179.7125 459 S 4.0748 8.0152 113.4295 61.9691 62.9715 177.0561 460 L 4.0326 7.9700 121.3939 57.9149 41.3787 179.7484 461 Q 4.0164 8.1579 118.1638 58.9591 28.6466 178.3837 462 N 4.2382 8.2521 117.5614 56.1693 38.3933 177.6602 463 T 3.9567 7.9568 117.4403 66.6446 68.5119 176.5901 464 V 3.5616 7.5293 119.6434 65.9836 31.5121 177.6722 465 K 3.7451 7.7819 118.9135 60.0352 31.9174 178.2808 466 Y 4.4267 7.7893 116.6841 61.0029 37.7209 178.1832 467 I 3.7893 8.1105 121.1534 64.4585 37.2479 178.6074 468 K 4.0484 8.4139 119.5244 59.4411 31.8216 179.3042 469 E 4.0245 8.2033 118.9930 59.3250 29.3521 179.3021 470 S 4.0842 8.5877 113.5137 61.6675 62.6592 176.0640 471 N 4.3556 8.6053 119.4576 56.3967 37.9477 176.9950 472 H 4.1717 8.0820 119.2165 59.2149 30.1993 177.1266 473 Q 4.1200 8.1326 119.8982 58.9557 28.6058 178.1956 474 L 3.9201 8.0687 121.4038 58.4975 41.8389 178.8875 475 Q 4.1255 7.7574 115.6111 58.0605 28.6913 177.9729 476 S 4.4428 8.0750 117.6925 59.1752 63.2854 174.9756 477 V 3.9162 7.1935 120.4087 60.9889 32.2381 181.8257 478 I 3.5749 8.5551 124.7145 60.6939 36.4020 173.1709 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 448 D 8.22 4.61 0.00 2.73 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 449 I 8.19 3.67 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 1.69 0.60 0.91 0.00 0.00 450 S 9.00 4.11 0.00 4.04 4.12 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 0.00 451 T 7.81 3.86 4.41 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 1.21 0.00 0.00 452 E 7.96 3.99 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 453 L 8.27 4.05 0.00 1.82 1.71 0.92 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 454 S 8.24 4.12 0.00 4.06 4.12 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 0.00 455 K 8.08 3.96 0.00 2.04 1.90 0.00 1.81 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.65 7.81 456 V 7.86 3.56 2.29 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 1.00 0.00 0.00 0.97 0.00 0.00 457 N 8.36 4.27 0.00 2.86 2.98 0.00 0.00 7.14 8.41 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 0.00 458 A 8.31 3.98 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 0.00 459 S 8.02 4.07 0.00 4.08 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 0.00 460 L 7.97 4.03 0.00 1.83 1.73 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 461 Q 8.16 4.02 0.00 2.30 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 462 N 8.25 4.24 0.00 2.91 2.77 0.00 0.00 7.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 463 T 7.96 3.96 4.48 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 1.25 0.00 0.00 464 V 7.53 3.56 2.22 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 1.07 0.00 0.00 1.00 0.00 0.00 465 K 7.78 3.75 0.00 1.73 1.67 0.00 1.38 0.00 0.00 0.87 0.00 0.00 2.72 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.19 1.33 7.81 466 Y 7.79 4.43 0.00 3.29 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 467 I 8.11 3.79 2.07 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.91 0.94 0.00 0.00 468 K 8.41 4.05 0.00 1.97 1.87 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.65 7.81 469 E 8.20 4.02 0.00 2.34 2.11 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 2.38 2.36 0.00 470 S 8.59 4.08 0.00 3.93 4.06 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 0.00 0.00 0.00 0.00 471 N 8.61 4.36 0.00 2.90 2.87 0.00 0.00 6.73 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 472 H 8.08 4.17 0.00 3.29 3.53 0.00 5.76 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 473 Q 8.13 4.12 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.52 0.00 0.00 0.00 0.00 0.00 2.61 2.54 0.00 474 L 8.07 3.92 0.00 1.94 1.82 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 475 Q 7.76 4.13 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.69 2.53 0.00 476 S 8.08 4.44 0.00 3.86 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 477 V 7.19 3.92 2.08 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 0.72 0.00 0.00 0.93 0.00 0.00 478 I 8.56 3.57 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 1.27 0.78 0.91 0.00 0.00