NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 587 S 4.3345 8.2929 115.2910 57.7739 63.3649 174.0473 588 K 3.6801 8.6106 133.1604 59.9794 31.3268 173.8491 589 S 4.2620 8.1006 113.4872 60.9705 63.1003 175.5900 590 L 3.9493 7.9579 122.6268 58.4799 41.9158 179.1429 591 V 3.9053 8.7418 120.8252 66.4123 31.3326 178.2585 592 D 4.4178 8.2971 121.5416 58.7316 39.7519 181.4371 593 T 4.0207 8.1084 111.4093 64.6509 68.4310 176.5319 594 V 3.5340 7.5137 119.4610 66.2446 31.6947 177.7907 595 Y 3.8232 8.2511 115.8234 60.6480 37.6285 177.9801 596 A 4.0779 8.9064 122.4752 55.1495 18.3093 179.5606 597 L 4.1146 8.0803 119.8464 58.0590 41.7537 180.1961 598 K 3.8952 8.2221 124.1944 60.0464 31.5537 180.9289 599 D 4.5596 8.2063 119.9019 57.4547 40.2817 178.5240 600 E 3.9464 8.2098 118.0421 59.8734 29.6873 180.0778 601 V 3.5750 8.1159 118.2226 65.8380 31.6553 177.6793 602 Q 3.9523 8.2559 119.5509 59.5028 28.5746 178.4620 603 E 4.0829 8.2461 118.9028 58.8021 29.3441 179.4521 604 L 4.0622 7.4947 119.0233 57.7204 41.7672 179.1535 605 R 3.8990 7.9704 118.0189 59.4320 29.9592 178.5562 606 Q 3.9521 7.9756 118.9479 59.6361 28.7498 178.5776 607 D 4.3830 7.4552 117.0511 57.0767 40.9590 177.9910 608 N 4.4056 7.9392 116.3161 56.5595 39.0443 176.6622 609 K 4.0414 8.1594 120.7146 59.6229 32.4180 179.5135 610 K 4.5324 7.9296 118.3208 57.1548 33.3713 178.8081 *612 K 4.1746 8.0708 122.5520 57.5146 34.4680 177.3528 613 K 3.9470 7.9911 119.1652 59.3129 32.0301 178.5139 614 S 4.4775 7.9724 113.0940 59.4353 63.4665 176.0234 615 L 3.9248 7.7934 124.3768 58.4105 41.4420 178.5164 616 E 4.0190 8.0875 118.0489 59.4129 29.3033 179.2245 617 E 4.0275 8.1099 118.4913 59.0509 29.4247 179.0679 618 E 3.9079 7.9025 119.6346 59.2025 29.7260 178.4710 619 Q 3.9828 7.9743 118.2233 59.2214 28.8355 179.3693 620 R 3.8492 7.7000 118.2741 59.4218 29.9485 178.2770 621 A 4.0217 7.9791 119.6863 54.9899 18.6311 179.2074 622 R 4.1627 8.0738 114.1783 58.6365 29.8904 178.9688 623 K 3.9269 8.4419 119.6940 59.6196 32.1532 178.9036 624 D 4.3802 8.1904 118.9157 57.0175 40.6397 178.6772 625 L 3.9859 7.8789 121.2195 57.9631 41.9734 178.5194 626 E 3.9551 8.2040 118.1149 59.6737 29.4304 178.8633 627 K 4.1484 7.7896 118.1376 59.6793 32.1512 178.7456 628 L 3.9091 7.8424 118.1035 58.2681 41.7574 180.0274 629 V 3.5931 8.2519 117.9131 66.1977 31.4543 178.2649 630 R 4.0022 9.1080 121.3888 59.7569 29.6587 179.6619 631 K 3.9378 8.3702 122.9467 59.7529 31.8476 180.8718 632 V 3.9284 7.7379 119.2381 66.1409 31.2768 178.1837 633 L 4.1386 7.8932 119.6214 57.7957 41.4954 178.9839 634 K 4.6906 8.1209 124.5374 57.6680 32.8875 179.7825 635 N 5.0533 8.1270 117.9282 53.8198 38.6786 178.5052 *637 N 4.6491 7.9019 116.6428 52.9023 38.2195 177.6122 638 D 4.6267 8.1108 122.7207 52.9797 39.6623 177.2332 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 587 S 8.29 4.33 0.00 3.88 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 588 K 8.61 3.68 0.00 1.88 1.80 0.00 1.85 0.00 0.00 1.78 0.00 0.00 2.88 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.46 1.12 7.81 589 S 8.10 4.26 0.00 3.88 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 0.00 590 L 7.96 3.95 0.00 1.81 1.87 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 591 V 8.74 3.91 2.27 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 0.88 0.00 0.00 1.02 0.00 0.00 592 D 8.30 4.42 0.00 2.72 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 593 T 8.11 4.02 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 1.23 0.00 0.00 594 V 7.51 3.53 2.31 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 1.00 0.00 0.00 1.08 0.00 0.00 595 Y 8.25 3.82 0.00 3.15 3.06 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 0.00 596 A 8.91 4.08 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 0.00 597 L 8.08 4.11 0.00 1.88 1.67 0.90 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 598 K 8.22 3.90 0.00 1.73 1.82 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.36 7.81 599 D 8.21 4.56 0.00 3.07 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 0.00 600 E 8.21 3.95 0.00 2.14 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 2.34 2.56 0.00 601 V 8.12 3.58 2.15 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 0.97 0.00 0.00 0.94 0.00 0.00 602 Q 8.26 3.95 0.00 2.24 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.57 0.00 0.00 0.00 0.00 0.00 2.35 2.56 0.00 603 E 8.25 4.08 0.00 2.07 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 2.33 2.35 0.00 604 L 7.49 4.06 0.00 1.97 1.70 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 605 R 7.97 3.90 0.00 2.02 1.99 0.00 3.13 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 606 Q 7.98 3.95 0.00 2.33 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 607 D 7.46 4.38 0.00 2.86 2.70 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 0.00 0.00 0.00 0.00 608 N 7.94 4.41 0.00 2.89 2.89 0.00 0.00 6.94 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 609 K 8.16 4.04 0.00 1.78 2.04 0.00 1.64 0.00 0.00 1.86 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.64 7.81 610 K 7.93 4.53 0.00 2.01 2.01 0.00 1.39 0.00 0.00 1.57 0.00 0.00 3.14 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.58 1.44 7.81 *612 K 8.07 4.17 0.00 1.91 2.11 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.40 1.43 7.81 613 K 7.99 3.95 0.00 2.12 1.95 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.44 7.81 614 S 7.97 4.48 0.00 4.11 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 615 L 7.79 3.92 0.00 1.73 1.80 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 616 E 8.09 4.02 0.00 2.35 1.98 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 2.33 2.41 0.00 617 E 8.11 4.03 0.00 2.09 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 2.33 2.36 0.00 618 E 7.90 3.91 0.00 2.21 2.14 0.00 0.00 0.00 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 2.39 0.00 619 Q 7.97 3.98 0.00 2.32 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.59 0.00 0.00 0.00 0.00 0.00 2.39 2.56 0.00 620 R 7.70 3.85 0.00 1.90 2.08 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 621 A 7.98 4.02 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 622 R 8.07 4.16 0.00 2.11 2.19 0.00 2.97 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.88 0.00 623 K 8.44 3.93 0.00 1.94 1.91 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.49 7.81 624 D 8.19 4.38 0.00 2.88 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 0.00 625 L 7.88 3.99 0.00 1.84 1.67 0.92 0.82 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 0.00 626 E 8.20 3.96 0.00 2.24 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 2.40 2.42 0.00 627 K 7.79 4.15 0.00 1.88 1.85 0.00 1.71 0.00 0.00 1.65 0.00 0.00 3.09 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.64 1.65 7.81 628 L 7.84 3.91 0.00 1.93 1.75 0.92 0.76 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 0.00 629 V 8.25 3.59 2.24 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 1.03 0.00 0.00 0.96 0.00 0.00 630 R 9.11 4.00 0.00 2.08 1.96 0.00 3.24 0.00 0.00 3.39 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 631 K 8.37 3.94 0.00 1.80 1.74 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.33 7.81 632 V 7.74 3.93 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.99 0.00 0.00 633 L 7.89 4.14 0.00 1.79 1.72 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 634 K 8.12 4.69 0.00 1.86 1.67 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.31 7.81 635 N 8.13 5.05 0.00 2.66 2.65 0.00 0.00 6.71 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *637 N 7.90 4.65 0.00 2.76 2.72 0.00 0.00 6.69 8.06 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 0.00 638 D 8.11 4.63 0.00 2.74 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.