NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9295 8.3549 109.7367 45.3465 0.0000 174.6404 3 K 3.8965 7.8529 119.0680 54.7525 32.8561 170.9940 4 V 4.4778 8.7233 123.0444 61.3473 35.4294 173.5834 5 Y 5.0576 8.8356 124.2404 56.1687 40.9561 174.6653 6 K 4.5473 8.4101 121.9504 54.4674 35.7256 174.7452 7 K 4.9157 8.4947 124.3018 54.5362 34.7233 175.5702 8 V 4.5005 8.7792 124.3156 61.0086 34.8346 173.5972 9 E 5.0655 8.7820 127.5818 54.7308 30.9028 174.7643 10 L 4.8991 9.3262 126.5330 52.8278 46.1676 175.9024 11 V 4.7110 8.3250 120.2520 61.2256 33.4668 174.9765 12 G 4.4626 8.9953 116.4395 44.9868 0.0000 171.7420 13 T 5.3949 8.0591 112.6665 60.1043 72.1724 172.9650 14 S 4.6582 8.6040 114.8813 57.9912 66.0030 175.7197 15 E 4.5550 9.1019 124.2402 57.7961 30.0778 177.7960 16 E 4.2334 8.4940 118.8353 57.0072 30.3934 176.4846 17 G 3.2686 7.0259 103.7174 44.6095 0.0000 172.8483 18 L 3.8377 7.4023 118.0070 57.7232 41.5479 179.2201 19 E 3.8994 7.9851 117.8287 59.3458 29.3732 179.1246 20 A 3.9235 7.8796 120.0776 54.9594 18.6127 179.2933 21 A 3.9158 7.8601 119.1004 55.3513 18.4497 179.9616 22 I 3.4848 7.6810 118.1616 64.6797 37.1146 178.7541 23 Q 3.8892 8.3193 118.9488 58.7233 28.5323 178.7651 24 A 3.9293 8.3314 122.0472 54.9624 18.3230 179.5150 25 A 3.8649 7.8039 118.6942 55.4331 18.5742 179.7699 26 L 3.8298 7.9519 117.2852 57.6115 41.3825 179.6136 27 A 3.9150 8.0508 120.4410 55.2401 18.5280 179.4010 28 R 3.9134 7.9106 116.8091 59.3216 30.1438 178.4367 29 A 3.9289 8.2167 121.2147 55.0800 18.2120 179.4091 30 R 4.2793 7.6923 112.0527 58.0703 29.7961 178.6262 31 K 4.0964 7.6419 119.6166 59.0073 32.0864 177.6349 32 T 4.3683 7.6957 113.4732 63.6218 70.7908 174.2703 33 L 4.3718 7.9523 120.2585 52.9014 43.3257 175.9580 34 R 4.5126 7.8006 119.8338 55.5879 33.2690 174.8888 35 H 4.1681 8.4906 113.4560 56.9135 25.9282 175.3747 36 L 4.5264 8.1096 118.7857 55.3793 42.2854 175.9059 37 D 5.2106 9.3159 122.7626 55.2548 43.0676 176.1968 38 W 5.5211 7.8602 113.2513 55.1055 32.0471 172.9643 39 F 5.3883 8.3385 113.9783 55.3062 41.0485 173.8826 40 E 4.7188 9.2773 118.8764 54.6198 33.2524 175.0933 41 V 4.2205 8.7934 125.4915 63.0619 31.5968 175.5835 42 K 4.4651 9.0460 127.8083 57.9955 33.6108 176.6474 43 E 4.7712 7.7854 117.9938 55.1203 33.1272 174.0778 44 I 5.0754 8.4652 126.5403 59.7315 40.0730 174.7220 45 R 4.6334 9.0405 123.6992 55.9581 33.4188 173.5025 46 G 4.1377 8.0855 105.1298 46.7588 0.0000 172.5980 47 T 4.7496 8.0119 109.9661 60.0643 71.5363 173.6750 48 I 4.7045 8.2558 123.0433 59.8105 39.8439 175.3434 49 G 4.3452 8.9933 115.9811 43.7776 0.0000 172.7236 50 E 3.8599 8.9037 118.4635 58.3963 29.7476 178.0428 51 A 4.7095 8.0751 120.3042 51.6378 20.6213 176.9863 52 G 3.9515 7.6026 107.5065 45.5923 0.0000 176.0682 53 V 3.6404 8.1894 124.9983 63.3648 31.6501 175.2283 54 K 4.1679 8.6955 129.6234 58.4464 32.7401 176.3099 55 E 4.7454 7.6741 118.7631 54.5596 33.1757 173.3818 56 Y 4.7058 9.2153 125.4139 57.6663 39.8282 174.5147 57 Q 4.9220 9.6208 122.7146 54.2031 32.4527 174.5593 58 V 4.7395 8.8540 125.6053 60.9912 33.7357 174.6283 59 V 4.4085 8.7685 129.9622 62.4278 32.7799 174.6238 60 L 5.2230 9.2327 129.5373 53.5405 45.9438 174.4331 61 E 4.9524 9.3654 125.8312 55.0650 31.7392 175.0497 62 V 4.4643 9.0638 124.6072 61.0246 34.1314 174.2382 63 G 2.8870 7.9617 116.1514 44.0304 0.0000 172.3241 64 F 5.6727 8.4745 118.6278 54.9787 41.9125 173.6438 65 R 4.0772 8.8712 121.9751 56.2981 30.4376 176.0361 66 L 4.4820 8.3521 126.8588 54.3303 42.5747 176.8294 67 E 4.1804 8.8781 122.0986 55.7836 30.6047 176.6703 68 E 3.4044 8.5566 114.4480 58.4015 27.6974 175.8837 *69 T 4.1354 8.0090 116.8505 61.5012 69.2274 172.9452 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 2 G 8.35 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 K 7.85 3.90 0.00 1.84 1.44 0.00 1.68 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.46 7.81 4 V 8.72 4.48 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 1.09 0.00 0.00 0.91 0.00 0.00 5 Y 8.84 5.06 0.00 3.02 3.09 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 6 K 8.41 4.55 0.00 1.44 0.74 0.00 1.57 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.15 1.26 7.81 7 K 8.49 4.92 0.00 1.64 1.64 0.00 2.06 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.13 1.38 7.81 8 V 8.78 4.50 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 0.78 0.00 0.00 1.09 0.00 0.00 9 E 8.78 5.07 0.00 2.02 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.44 0.00 10 L 9.33 4.90 0.00 1.52 1.47 0.87 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.33 4.71 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 0.80 0.00 0.00 0.93 0.00 0.00 12 G 9.00 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.06 5.39 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 1.26 0.00 0.00 14 S 8.60 4.66 0.00 3.91 3.88 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.10 4.55 0.00 2.03 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 2.44 2.34 0.00 16 E 8.49 4.23 0.00 1.96 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 2.40 0.00 17 G 7.03 3.27 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 7.40 3.84 0.00 1.56 1.63 0.87 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 19 E 7.99 3.90 0.00 1.99 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 2.38 2.42 0.00 20 A 7.88 3.92 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 A 7.86 3.92 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 22 I 7.68 3.48 1.83 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 1.34 0.68 0.23 0.00 0.00 23 Q 8.32 3.89 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 24 A 8.33 3.93 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.80 3.86 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 L 7.95 3.83 0.00 1.61 1.66 0.73 0.74 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 27 A 8.05 3.91 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 R 7.91 3.91 0.00 1.93 2.02 0.00 3.12 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 29 A 8.22 3.93 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 30 R 7.69 4.28 0.00 1.96 2.02 0.00 3.05 0.00 0.00 3.20 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.62 0.00 31 K 7.64 4.10 0.00 1.80 1.87 0.00 1.62 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.65 7.81 32 T 7.70 4.37 4.17 0.00 0.00 0.00 0.00 0.00 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 33 L 7.95 4.37 0.00 1.25 0.68 0.47 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 34 R 7.80 4.51 0.00 1.68 1.52 0.00 3.25 0.00 0.00 3.17 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.52 0.00 35 H 8.49 4.17 0.00 3.66 3.49 0.00 5.62 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 L 8.11 4.53 0.00 1.67 1.67 0.86 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 37 D 9.32 5.21 0.00 3.15 3.09 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 38 W 7.86 5.52 0.00 3.24 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 F 8.34 5.39 0.00 3.02 2.94 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 40 E 9.28 4.72 0.00 1.99 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 2.41 2.55 0.00 41 V 8.79 4.22 2.19 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 0.83 0.00 0.00 1.12 0.00 0.00 42 K 9.05 4.47 0.00 1.68 1.87 0.00 1.85 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.61 1.55 7.81 43 E 7.79 4.77 0.00 2.03 1.75 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 2.29 2.34 0.00 44 I 8.47 5.08 1.92 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 1.44 0.83 0.99 0.00 0.00 45 R 9.04 4.63 0.00 1.78 2.02 0.00 3.01 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 46 G 8.09 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 47 T 8.01 4.75 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 1.18 0.00 0.00 48 I 8.26 4.70 1.84 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 1.22 0.62 0.93 0.00 0.00 49 G 8.99 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.90 3.86 0.00 1.93 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 2.28 2.30 0.00 51 A 8.08 4.71 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 G 7.60 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 53 V 8.19 3.64 1.79 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 -0.20 0.00 0.00 0.66 0.00 0.00 54 K 8.70 4.17 0.00 1.83 1.86 0.00 1.76 0.00 0.00 1.60 0.00 0.00 2.85 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.38 1.35 7.81 55 E 7.67 4.75 0.00 2.03 1.67 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 0.00 2.20 2.27 0.00 56 Y 9.22 4.71 0.00 3.10 2.83 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 0.00 0.00 0.00 0.00 57 Q 9.62 4.92 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.75 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 58 V 8.85 4.74 2.06 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 0.94 0.00 0.00 0.94 0.00 0.00 59 V 8.77 4.41 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 0.94 0.00 0.00 0.99 0.00 0.00 60 L 9.23 5.22 0.00 1.68 1.39 1.08 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 61 E 9.37 4.95 0.00 1.97 1.82 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 2.28 2.27 0.00 62 V 9.06 4.46 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 1.01 0.00 0.00 0.90 0.00 0.00 63 G 7.96 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 0.00 0.00 0.00 64 F 8.47 5.67 0.00 3.37 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 R 8.87 4.08 0.00 1.91 1.90 0.00 3.04 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.05 0.00 66 L 8.35 4.48 0.00 1.61 1.55 0.87 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.88 4.18 0.00 1.99 1.89 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 2.34 2.39 0.00 68 E 8.56 3.40 0.00 2.14 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 2.21 2.29 0.00 *69 T 8.01 4.14 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 1.21 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.