NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 A 4.0719 8.2644 123.5596 51.8569 19.9018 176.0268 11 R 3.8665 7.9813 122.4852 54.6568 31.2430 174.5025 12 F 4.9003 8.9925 123.6922 54.6731 42.4622 173.5146 13 P 4.2834 0.0000 0.0000 62.4494 31.7462 175.3852 14 P 4.2497 0.0000 0.0000 65.4929 31.3639 178.2052 15 A 3.9791 8.0794 118.9292 55.4000 18.1777 179.5220 16 R 3.8503 7.9580 116.4400 59.6517 30.1629 178.5496 17 I 3.6973 8.0651 120.0346 64.2458 37.0921 178.3935 18 K 3.9490 8.6854 120.8257 59.3407 31.8251 179.0336 19 K 3.9747 7.9607 117.8315 59.5032 32.2522 179.0910 20 I 3.8416 8.1211 120.3550 64.6624 36.7820 178.1777 21 M 4.0593 8.2670 119.8242 58.5628 31.5375 177.9800 22 Q 4.4481 7.7210 114.9750 56.5201 29.0113 177.5439 23 T 4.2915 7.7800 116.9753 63.5874 68.7885 173.7466 24 D 4.7471 7.3368 122.1586 52.2630 41.8163 176.8089 25 E 4.0547 8.7970 127.0592 59.3738 29.7719 178.4806 26 E 4.0541 7.9506 117.8727 58.9005 29.6869 177.5119 27 I 3.9190 7.4443 120.4307 61.2319 38.1281 175.4422 28 G 4.2585 8.1398 122.8462 45.2850 0.0000 174.7857 29 K 4.2675 8.5470 124.7664 55.8195 32.7015 176.4889 30 V 4.3583 7.9633 120.3286 59.2257 34.1959 175.3261 31 A 3.9386 8.7986 126.3399 52.5135 18.7800 177.8009 32 A 3.8985 8.9029 126.3811 55.4437 18.6568 178.8530 33 A 4.1065 7.9973 117.8636 54.8218 19.0039 179.4459 34 V 3.5789 8.3631 116.2732 66.1535 31.4579 176.2441 35 P 4.2191 0.0000 0.0000 65.9614 31.2127 178.9735 36 V 3.7688 7.7124 111.4016 64.0230 31.4596 178.6396 37 I 3.8309 7.6856 112.6650 64.0407 37.6326 178.1652 38 I 3.8408 8.0651 121.8094 63.9504 36.7710 178.3197 39 S 4.2209 8.0839 114.1518 61.5007 62.2677 176.2141 40 R 3.9322 7.9137 120.6918 59.3041 29.7563 178.3310 41 A 4.0204 8.5798 121.0141 55.1877 18.4329 179.3129 42 L 3.9155 8.6808 119.5830 58.2467 42.1798 178.8755 43 E 4.2668 8.6336 119.5084 59.4673 29.7949 178.8784 44 L 4.1205 8.2914 119.0850 57.5910 41.5915 179.2711 45 F 4.2654 8.5899 121.0360 61.1360 39.2933 177.3641 46 L 3.7911 8.1623 118.8646 57.4143 41.4588 179.0021 47 E 3.8756 8.0939 118.9752 59.3324 29.3463 178.8769 48 S 4.0237 7.8704 112.8176 61.0935 62.3841 175.8874 49 L 3.7516 7.6989 123.0182 58.1719 41.7741 178.9284 50 L 3.9293 8.3424 119.2280 57.8013 41.4477 179.7661 51 K 3.9770 8.0271 118.1885 58.8165 31.8978 179.6919 52 K 4.0317 7.6273 118.6720 59.3010 32.2428 179.1796 53 A 4.0233 8.0959 121.0040 55.1990 18.2021 179.2552 54 C 4.1868 8.2374 119.0001 61.9716 31.3561 175.7881 55 Q 3.9392 7.3400 117.5094 59.1099 28.2203 178.6241 56 V 3.7084 7.8440 119.3372 66.1163 31.0761 178.1972 57 T 3.4823 7.8458 109.6709 64.6380 68.5767 176.2067 58 Q 4.2752 7.9988 118.2037 56.4187 28.7847 177.1168 59 S 4.8645 7.3282 114.8295 58.7764 64.4524 174.7935 60 R 4.2816 7.7760 118.2729 58.2641 32.9591 175.3540 *64 T 4.0685 7.7721 114.5940 63.6691 70.2297 173.7034 65 M 4.2775 8.6517 126.5424 55.4227 33.0827 175.6465 66 T 4.6639 8.3128 115.3432 59.6159 73.2229 174.7788 67 T 3.9295 8.3374 114.3623 65.2073 67.1464 175.8981 68 S 4.0292 7.6296 114.7608 61.9468 62.9859 176.1653 69 H 4.2369 7.9841 118.3675 58.0035 28.6086 177.3172 70 L 4.1932 7.5381 119.3395 57.4869 41.7301 179.0064 71 K 3.8615 7.9192 118.2647 59.9909 32.1757 179.0879 72 Q 4.4934 7.8831 113.1279 56.5989 27.8006 176.4708 73 C 4.8217 8.1466 115.1957 59.3240 30.1699 174.9202 74 I 4.5146 7.8743 120.0927 60.7762 37.2622 175.4131 75 E 4.1746 8.1612 124.3691 56.6309 29.7131 176.2676 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 10 A 8.26 4.07 1.03 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 0.00 0.00 0.00 0.00 0.00 11 R 7.98 3.87 0.00 1.72 1.67 0.00 3.24 0.00 0.00 3.19 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.69 0.00 12 F 8.99 4.90 0.00 3.08 2.92 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 0.00 0.00 0.00 0.00 13 P 0.00 4.28 0.00 2.21 2.09 0.00 3.81 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.25 0.00 14 P 0.00 4.25 0.00 2.17 2.13 0.00 3.64 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 15 A 8.08 3.98 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 R 7.96 3.85 0.00 1.96 2.16 0.00 3.24 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.79 0.00 17 I 8.07 3.70 2.05 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.68 0.96 0.00 0.00 18 K 8.69 3.95 0.00 1.77 1.94 0.00 1.64 0.00 0.00 1.65 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.47 7.81 19 K 7.96 3.97 0.00 2.00 1.86 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.53 7.81 20 I 8.12 3.84 1.98 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.80 0.88 0.00 0.00 21 M 8.27 4.06 0.00 2.02 2.26 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.57 0.00 22 Q 7.72 4.45 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.95 0.00 0.00 0.00 0.00 0.00 2.37 2.58 0.00 23 T 7.78 4.29 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 1.20 0.00 0.00 24 D 7.34 4.75 0.00 2.70 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.80 4.05 0.00 1.99 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 2.31 2.28 0.00 26 E 7.95 4.05 0.00 2.02 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 2.34 2.42 0.00 27 I 7.44 3.92 2.01 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 1.22 0.33 0.90 0.00 0.00 28 G 8.14 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 0.00 0.00 0.00 29 K 8.55 4.27 0.00 1.76 1.75 0.00 1.69 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.44 1.42 7.81 30 V 7.96 4.36 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 0.74 0.00 0.00 0.93 0.00 0.00 31 A 8.80 3.94 1.29 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 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.90 3.90 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.00 4.11 1.31 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 0.00 0.00 0.00 0.00 0.00 0.00 34 V 8.36 3.58 2.26 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 1.09 0.00 0.00 0.93 0.00 0.00 35 P 0.00 4.22 0.00 2.20 2.24 0.00 3.83 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 36 V 7.71 3.77 2.10 0.00 0.00 0.00 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 0.99 0.00 0.00 37 I 7.69 3.83 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.99 0.97 0.00 0.00 38 I 8.07 3.84 2.01 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.01 0.88 0.00 0.00 39 S 8.08 4.22 0.00 4.10 4.16 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.91 3.93 0.00 2.03 2.08 0.00 3.23 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 41 A 8.58 4.02 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.68 3.92 0.00 1.78 1.91 0.82 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.63 4.27 0.00 2.45 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 0.00 2.38 2.45 0.00 44 L 8.29 4.12 0.00 1.98 1.77 0.96 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.59 4.27 0.00 3.04 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 46 L 8.16 3.79 0.00 1.86 1.73 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.09 3.88 0.00 2.09 1.95 0.00 0.00 0.00 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 2.32 0.00 48 S 7.87 4.02 0.00 4.01 3.75 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 0.00 0.00 0.00 0.00 49 L 7.70 3.75 0.00 1.07 1.36 0.78 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 50 L 8.34 3.93 0.00 1.66 1.67 0.93 1.19 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 51 K 8.03 3.98 0.00 1.87 1.83 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.64 7.81 52 K 7.63 4.03 0.00 1.86 1.81 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.53 7.81 53 A 8.10 4.02 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 C 8.24 4.19 0.00 3.09 3.07 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 0.00 0.00 0.00 55 Q 7.34 3.94 0.00 2.32 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 56 V 7.84 3.71 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 1.08 0.00 0.00 0.95 0.00 0.00 57 T 7.85 3.48 4.11 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 0.00 0.00 1.21 0.00 0.00 58 Q 8.00 4.28 0.00 2.03 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.46 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 59 S 7.33 4.86 0.00 4.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 R 7.78 4.28 0.00 1.90 1.79 0.00 3.39 0.00 0.00 3.24 7.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.83 0.00 *64 T 7.77 4.07 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 1.22 0.00 0.00 65 M 8.65 4.28 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.55 0.00 66 T 8.31 4.66 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 1.27 0.00 0.00 67 T 8.34 3.93 4.23 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 1.19 0.00 0.00 68 S 7.63 4.03 0.00 4.08 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 H 7.98 4.24 0.00 3.15 3.38 0.00 5.69 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 L 7.54 4.19 0.00 1.94 1.70 0.92 0.76 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 71 K 7.92 3.86 0.00 1.83 1.89 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.70 7.81 72 Q 7.88 4.49 0.00 2.07 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.72 0.00 0.00 0.00 0.00 0.00 2.40 2.59 0.00 73 C 8.15 4.82 0.00 2.98 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 I 7.87 4.51 1.90 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.75 0.98 0.00 0.00 75 E 8.16 4.17 0.00 2.08 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 2.28 2.31 0.00 * Residues marked with a * may have inaccurate shift predictions.