NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 L 4.3308 8.1844 120.6290 54.6087 42.8129 175.7409 14 V 4.1051 8.1152 122.9462 59.7389 34.5106 172.5430 15 D 4.3795 8.6402 127.0391 53.6660 41.9627 174.2447 16 P 4.3222 0.0000 0.0000 65.5245 30.7828 177.8753 17 L 3.9446 8.2791 120.8934 58.5656 42.1402 178.8338 18 T 3.9389 7.9311 109.7482 65.0131 68.5476 176.4823 19 T 3.8275 7.8074 117.9993 66.6301 68.5666 176.7425 20 V 3.6955 8.1574 120.2926 65.8231 31.4811 178.2696 21 R 4.0126 8.6360 121.0253 59.8746 29.6101 178.7236 22 E 4.0276 8.0659 117.9317 60.4778 30.0086 181.5674 23 Q 4.2932 8.1572 119.1724 59.8222 29.3759 179.1688 24 C 4.3921 8.6677 119.6734 60.5657 40.0140 176.0079 25 E 4.4104 8.2875 119.3316 59.7639 29.3487 180.8804 26 Q 4.7990 7.8995 117.9692 56.0592 30.5235 181.8816 27 L 4.1476 8.0607 119.4660 56.0335 41.3076 184.1233 28 E 3.8530 8.2504 116.8263 58.4135 30.8179 178.7837 29 K 3.9315 8.3612 118.2113 59.8784 31.4539 178.6322 30 C 4.1701 7.8195 116.4657 63.1565 28.0839 176.2342 31 V 4.0903 8.1387 121.3975 66.8566 31.0052 178.5571 32 K 3.9482 8.1612 122.8816 59.7545 31.4696 180.7722 33 A 4.1777 8.2769 122.2136 55.0154 18.4552 179.3535 34 R 3.4357 9.6385 120.0049 60.4926 30.0001 178.6725 35 E 4.0292 8.5662 120.2177 61.8862 29.6640 181.4823 36 R 4.1590 7.9873 121.5815 61.1577 29.2141 180.6344 37 L 4.2048 8.3277 121.8253 58.9717 42.3348 178.9868 38 E 3.8939 8.6495 118.6140 61.4657 29.2509 181.4708 39 L 4.1318 7.7130 118.4167 57.7627 41.9589 178.4067 40 C 4.3548 7.5779 117.9329 59.8107 38.9293 174.6439 41 D 4.3534 8.4851 122.3238 58.3810 40.6072 178.4649 42 E 4.2984 8.1507 118.4742 60.0882 29.8128 180.7806 43 R 4.5180 7.8728 119.6748 60.5060 30.2663 183.5753 44 V 4.1559 7.4829 116.6214 65.6186 31.9645 177.7557 45 S 4.2946 7.7001 111.1312 60.0938 62.7644 175.0279 46 S 4.2772 7.8882 116.9503 59.8933 63.6093 174.1694 47 R 4.6132 7.7590 120.1657 54.5693 31.6927 175.8478 48 S 4.3286 8.4673 118.0021 59.9924 63.4476 174.1558 49 Q 4.3586 7.7200 119.2685 54.6689 29.7817 173.5753 50 T 4.6963 7.9268 119.5391 62.2886 72.5812 174.2397 51 E 4.1952 8.6606 123.8714 57.9387 30.2497 176.9172 52 E 4.0078 8.1108 118.5254 56.7354 30.0178 175.4474 53 D 5.0088 8.2913 122.2297 53.0594 44.8492 176.0092 54 C 5.6676 8.5516 116.0066 56.6375 39.4880 176.8744 55 T 3.4070 7.9307 112.1340 65.3661 68.2902 174.4787 56 E 4.0234 8.2761 121.7705 59.1756 29.3774 178.1777 57 E 3.9635 8.1492 117.1484 59.6372 29.6788 179.2502 58 L 3.9864 7.9505 119.8607 58.2410 42.0595 178.9604 59 F 4.6046 8.6761 118.2474 61.0523 38.9911 177.0988 60 D 4.4302 8.5795 118.7084 57.9505 40.6328 178.7386 61 F 4.2486 8.4536 120.8699 60.9788 39.3445 176.7102 62 L 3.5520 8.5441 118.5997 58.2843 41.6619 178.8593 63 H 3.9008 8.9189 117.7484 59.6822 29.4892 176.8147 64 A 4.0142 7.6983 120.6646 55.8549 18.5421 178.6890 65 R 3.5919 8.3083 117.6177 58.8298 29.8262 177.8033 66 D 4.3087 8.4604 119.6200 57.7768 41.0347 178.5602 67 H 3.9954 7.8333 118.2775 59.4478 30.0050 174.2219 68 C 4.3215 8.3069 115.4076 57.6314 40.2186 175.6361 69 V 3.4135 7.7800 120.1896 66.2710 30.5088 177.7591 70 A 3.7163 8.5507 122.9092 55.6085 17.9880 179.0735 *71 H 4.5913 7.7784 114.5629 57.4693 28.1981 178.5088 72 K 4.7972 7.8290 116.8277 57.4630 38.0519 178.0349 73 L 3.9784 8.8535 121.2970 58.5336 41.6874 179.0187 74 F 4.6004 8.1920 114.1520 59.5294 38.8569 176.6798 75 N 4.5759 8.2380 116.9005 56.0525 38.5758 176.0885 76 S 4.4561 7.7451 113.3089 58.9175 63.4437 174.0961 77 L 4.5356 7.4819 120.2542 53.0677 43.2164 176.3731 78 K 4.0735 8.3245 120.7171 56.7136 32.1568 176.5333 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 13 L 8.18 4.33 0.00 1.65 1.70 0.92 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 14 V 8.12 4.11 2.09 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 0.78 0.00 0.00 0.94 0.00 0.00 15 D 8.64 4.38 0.00 2.73 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.32 0.00 2.32 2.34 0.00 3.76 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.06 0.00 17 L 8.28 3.94 0.00 1.83 1.98 0.94 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 18 T 7.93 3.94 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 19 T 7.81 3.83 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 20 V 8.16 3.70 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 1.12 0.00 0.00 1.04 0.00 0.00 21 R 8.64 4.01 0.00 2.07 1.99 0.00 3.21 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.91 0.00 22 E 8.07 4.03 0.00 2.08 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.19 0.00 23 Q 8.16 4.29 0.00 2.11 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 24 C 8.67 4.39 0.00 3.15 3.10 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 0.00 0.00 0.00 0.00 25 E 8.29 4.41 0.00 2.07 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.19 0.00 26 Q 7.90 4.80 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.80 0.00 0.00 0.00 0.00 0.00 2.20 2.13 0.00 27 L 8.06 4.15 0.00 1.59 1.59 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 28 E 8.25 3.85 0.00 1.89 1.92 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 2.32 1.96 0.00 29 K 8.36 3.93 0.00 1.80 1.94 0.00 1.66 0.00 0.00 1.81 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.55 1.58 7.81 30 C 7.82 4.17 0.00 3.13 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 31 V 8.14 4.09 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 1.12 0.00 0.00 1.07 0.00 0.00 32 K 8.16 3.95 0.00 1.82 1.81 0.00 1.86 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.38 1.34 7.81 33 A 8.28 4.18 1.60 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 34 R 9.64 3.44 0.00 1.68 2.17 0.00 2.95 0.00 0.00 2.81 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 35 E 8.57 4.03 0.00 2.01 1.93 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 2.24 2.20 0.00 36 R 7.99 4.16 0.00 1.84 2.01 0.00 3.23 0.00 0.00 3.09 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 37 L 8.33 4.20 0.00 1.70 1.77 0.78 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.65 3.89 0.00 1.97 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 2.26 2.26 0.00 39 L 7.71 4.13 0.00 1.59 1.74 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 40 C 7.58 4.35 0.00 3.09 3.21 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 0.00 0.00 0.00 0.00 41 D 8.49 4.35 0.00 2.74 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.15 4.30 0.00 2.14 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 2.26 2.19 0.00 43 R 7.87 4.52 0.00 1.89 1.86 0.00 3.22 0.00 0.00 3.15 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.49 0.00 44 V 7.48 4.16 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 1.14 0.00 0.00 1.06 0.00 0.00 45 S 7.70 4.29 0.00 4.08 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 S 7.89 4.28 0.00 3.99 4.29 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 47 R 7.76 4.61 0.00 1.73 1.83 0.00 3.35 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.67 0.00 48 S 8.47 4.33 0.00 3.89 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 49 Q 7.72 4.36 0.00 1.94 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.68 0.00 0.00 0.00 0.00 0.00 2.22 2.35 0.00 50 T 7.93 4.70 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 1.24 0.00 0.00 51 E 8.66 4.20 0.00 1.95 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 2.28 2.23 0.00 52 E 8.11 4.01 0.00 1.91 1.87 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 2.28 2.35 0.00 53 D 8.29 5.01 0.00 2.62 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 8.55 5.67 0.00 2.90 2.99 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 0.00 0.00 0.00 55 T 7.93 3.41 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 1.04 0.00 0.00 56 E 8.28 4.02 0.00 2.09 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 57 E 8.15 3.96 0.00 2.07 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 2.40 2.46 0.00 58 L 7.95 3.99 0.00 1.72 1.66 1.05 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 59 F 8.68 4.60 0.00 3.28 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 60 D 8.58 4.43 0.00 2.91 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 F 8.45 4.25 0.00 3.18 3.35 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 62 L 8.54 3.55 0.00 1.98 1.77 1.13 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.92 3.90 0.00 3.24 3.50 0.00 5.59 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 A 7.70 4.01 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 65 R 8.31 3.59 0.00 1.02 1.52 0.00 3.14 0.00 0.00 2.94 8.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.51 0.00 66 D 8.46 4.31 0.00 2.70 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 H 7.83 4.00 0.00 3.19 3.53 0.00 5.94 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 C 8.31 4.32 0.00 3.15 3.28 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 69 V 7.78 3.41 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 1.01 0.00 0.00 0.93 0.00 0.00 70 A 8.55 3.72 1.20 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 0.00 0.00 0.00 *71 H 7.78 4.59 0.00 3.03 2.97 0.00 7.19 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 K 7.83 4.80 0.00 1.78 1.79 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.82 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.34 7.81 73 L 8.85 3.98 0.00 1.87 1.68 0.96 1.04 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 74 F 8.19 4.60 0.00 2.91 3.03 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 75 N 8.24 4.58 0.00 2.78 2.90 0.00 0.00 6.96 8.29 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 76 S 7.75 4.46 0.00 3.83 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 7.48 4.54 0.00 1.46 1.45 0.97 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 78 K 8.32 4.07 0.00 1.67 1.63 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.39 7.81 * Residues marked with a * may have inaccurate shift predictions.