NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 R 4.3496 8.1127 119.0729 56.0594 31.4041 176.0953 12 V 3.6450 8.3636 122.1451 64.6387 31.6123 177.5837 13 R 4.4986 8.1394 123.0239 61.4203 29.7292 181.8769 14 N 4.4989 8.0458 119.8213 57.3641 37.7287 178.5059 15 L 4.1326 7.6338 123.1341 58.2095 41.9731 179.1341 16 Q 3.9771 8.2016 117.7533 59.0117 28.6722 178.8412 17 S 4.0858 8.0277 113.9914 61.4676 62.3944 176.0634 18 E 3.9910 8.3623 121.4124 59.3872 29.0852 179.5429 19 V 3.5861 8.0420 118.4557 65.9912 31.5906 178.0059 20 E 4.0623 8.3344 118.6587 59.2476 29.2566 179.5647 21 G 3.6022 8.1297 105.9496 47.6486 0.0000 176.0511 22 V 3.5954 7.9804 120.8301 65.6384 31.5850 178.0126 23 K 3.8993 8.3125 119.7008 59.4541 32.1138 178.3045 24 N 4.2989 8.2805 117.2909 56.6585 38.9110 176.9885 25 I 3.7019 7.8511 121.1560 64.8446 37.2385 178.4713 26 M 4.1248 8.3737 119.7998 58.6102 31.7303 179.0214 27 T 3.8917 8.1069 116.0797 66.7229 68.5787 176.7873 28 Q 4.0607 8.0539 119.5962 58.8614 28.6220 178.5101 29 N 4.3671 8.1259 117.8753 56.1794 38.4803 177.6286 30 V 3.6015 8.0292 119.8391 65.9630 31.5805 178.0027 31 E 3.9663 8.1270 118.4806 59.3825 29.1793 179.5031 32 R 3.9425 8.0994 118.3008 59.1721 30.1190 178.8764 33 I 3.7609 7.9452 118.5423 63.7283 37.8278 177.9539 34 L 4.0233 8.2763 120.2089 57.5465 41.3517 179.2573 35 A 4.0038 8.1822 120.9399 55.0764 18.3035 179.6910 36 R 3.9370 8.3753 117.7497 59.2899 30.0911 179.0219 37 G 3.6220 8.2023 105.8013 47.7058 0.0000 175.6001 38 E 3.9819 7.9674 121.0590 59.3697 29.5054 179.2859 39 N 4.3873 8.3686 116.5489 56.2339 38.5246 177.5731 40 L 4.0299 8.4276 121.0216 57.7444 41.7327 179.2084 41 D 4.3743 8.1959 118.9907 57.4450 40.8773 178.2138 42 H 4.0916 8.3591 118.7565 59.2536 29.9199 177.0348 43 L 3.9440 8.1295 122.1762 58.1734 41.9308 178.8092 44 R 4.0097 8.3812 120.3731 58.9752 29.9785 178.2423 45 N 4.3391 8.2553 116.2462 56.2707 38.5230 177.5723 46 K 4.0026 7.8589 119.8584 59.5382 31.9277 179.4716 47 T 4.0001 8.0305 109.9280 64.3871 68.7717 176.7549 48 E 3.9973 8.0443 121.9264 59.3361 29.5360 178.7799 49 D 4.3698 8.1462 119.0537 57.1541 40.8394 178.6064 50 L 3.9448 7.9649 120.9116 58.1663 42.2662 178.6850 51 E 4.0416 8.7093 120.5426 58.4838 29.6444 178.6377 52 A 4.0022 8.1134 120.8879 55.6188 18.4365 179.7557 53 T 3.9304 8.0188 114.5031 66.7897 68.5666 177.0721 54 S 4.2734 8.2347 116.2677 61.3741 62.9027 176.5275 55 E 4.0918 8.0954 121.9957 59.3953 29.2094 178.6441 56 H 4.2116 8.2092 118.0096 59.2585 29.9819 176.8652 57 F 4.2887 8.5190 122.6986 61.3349 39.1640 176.9506 58 K 3.6302 8.2813 119.1292 59.7161 31.7813 178.8098 59 T 4.0715 7.8050 116.2213 66.5879 68.1993 176.4933 60 T 3.9922 8.2871 117.9081 66.7043 66.9333 176.9986 61 S 4.0586 7.9290 117.2037 61.5236 62.8759 176.6809 62 Q 4.2159 8.0321 120.7204 58.4608 28.0871 179.1443 63 K 3.9592 7.4052 120.7524 59.8622 32.3407 178.0693 *64 V 3.9104 6.9609 119.0293 60.9539 32.3333 176.9326 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 11 R 8.11 4.35 0.00 1.75 1.89 0.00 3.21 0.00 0.00 3.33 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.20 0.00 12 V 8.36 3.64 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 0.93 0.00 0.00 0.93 0.00 0.00 13 R 8.14 4.50 0.00 1.86 1.92 0.00 3.38 0.00 0.00 3.34 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.12 0.00 14 N 8.05 4.50 0.00 2.72 2.85 0.00 0.00 6.49 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.63 4.13 0.00 1.87 1.83 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 16 Q 8.20 3.98 0.00 2.35 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.63 0.00 17 S 8.03 4.09 0.00 3.92 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 E 8.36 3.99 0.00 2.16 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 2.50 2.46 0.00 19 V 8.04 3.59 2.21 0.00 0.00 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 0.00 0.00 1.01 0.00 0.00 20 E 8.33 4.06 0.00 2.23 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 2.53 0.00 21 G 8.13 3.60 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 0.00 0.00 0.00 22 V 7.98 3.60 2.21 0.00 0.00 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 23 K 8.31 3.90 0.00 1.85 1.94 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.45 7.81 24 N 8.28 4.30 0.00 2.94 2.95 0.00 0.00 7.22 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 I 7.85 3.70 1.98 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 1.52 0.61 0.91 0.00 0.00 26 M 8.37 4.12 0.00 2.00 2.17 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.86 0.00 27 T 8.11 3.89 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 1.21 0.00 0.00 28 Q 8.05 4.06 0.00 2.34 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 29 N 8.13 4.37 0.00 2.93 2.86 0.00 0.00 6.55 7.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 8.03 3.60 2.23 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 1.11 0.00 0.00 0.99 0.00 0.00 31 E 8.13 3.97 0.00 2.25 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 2.53 2.49 0.00 32 R 8.10 3.94 0.00 2.04 1.98 0.00 3.28 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.91 0.00 33 I 7.95 3.76 1.99 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 1.52 1.22 0.96 0.00 0.00 34 L 8.28 4.02 0.00 1.87 1.70 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 35 A 8.18 4.00 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 36 R 8.38 3.94 0.00 2.01 2.05 0.00 3.10 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 1.63 1.65 0.00 37 G 8.20 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 E 7.97 3.98 0.00 2.13 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 2.33 2.56 0.00 39 N 8.37 4.39 0.00 2.73 2.87 0.00 0.00 7.10 6.49 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 40 L 8.43 4.03 0.00 1.85 1.72 0.92 0.95 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 41 D 8.20 4.37 0.00 2.90 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 42 H 8.36 4.09 0.00 3.26 3.47 0.00 5.59 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.13 3.94 0.00 1.90 1.87 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 44 R 8.38 4.01 0.00 1.91 2.06 0.00 3.19 0.00 0.00 3.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.53 0.00 45 N 8.26 4.34 0.00 2.88 2.82 0.00 0.00 7.03 6.47 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 46 K 7.86 4.00 0.00 1.93 1.82 0.00 1.59 0.00 0.00 1.59 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.50 7.81 47 T 8.03 4.00 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 1.28 0.00 0.00 48 E 8.04 4.00 0.00 2.19 2.03 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 2.32 2.61 0.00 49 D 8.15 4.37 0.00 2.91 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 L 7.96 3.94 0.00 1.84 1.84 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 51 E 8.71 4.04 0.00 2.20 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 2.32 2.34 0.00 52 A 8.11 4.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 T 8.02 3.93 4.37 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 1.22 0.00 0.00 54 S 8.23 4.27 0.00 4.16 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 0.00 55 E 8.10 4.09 0.00 2.31 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.59 0.00 56 H 8.21 4.21 0.00 3.26 3.56 0.00 5.62 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 F 8.52 4.29 0.00 3.11 3.26 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 0.00 58 K 8.28 3.63 0.00 1.88 1.95 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.40 7.81 59 T 7.80 4.07 4.42 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 60 T 8.29 3.99 4.19 0.00 0.00 0.00 0.00 0.00 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 61 S 7.93 4.06 0.00 3.72 3.66 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 62 Q 8.03 4.22 0.00 2.22 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.83 0.00 0.00 0.00 0.00 0.00 2.32 2.66 0.00 63 K 7.41 3.96 0.00 1.88 1.85 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.74 1.59 7.81 *64 V 6.96 3.91 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.92 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.