NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.4023 8.0333 117.3852 63.7003 70.9002 175.7227 3 D 4.2738 8.1344 120.8678 56.6313 40.6755 178.0448 4 F 4.0221 9.0982 122.2450 61.3116 39.7848 176.2273 5 N 4.3142 8.2385 115.9872 56.6378 38.3243 176.9502 6 Q 4.2861 8.0546 119.8536 58.5690 28.7895 179.1918 7 K 3.8207 8.1896 119.0641 59.5945 32.1082 179.5280 8 I 3.5275 7.5774 119.7989 64.3355 37.0683 178.1292 9 E 3.9543 8.2842 119.5636 59.6039 29.3205 179.5905 10 Q 4.7327 8.2335 119.3925 58.7281 28.8909 178.9043 11 L 4.1912 8.0921 119.9081 57.6007 41.6035 179.9116 12 K 4.0096 7.9196 118.1709 59.4113 32.1141 179.0385 13 E 3.9352 7.9533 118.2813 59.3603 29.4803 178.7960 14 F 3.8946 8.6573 120.8797 61.8083 39.4272 177.0970 15 I 3.9056 8.1463 119.0281 64.7111 36.8908 178.0000 16 E 3.9366 8.0590 119.4317 59.2320 29.6177 178.3552 17 E 3.8701 8.1634 119.3891 59.4806 29.5536 178.6821 18 C 4.1034 7.9843 116.6743 62.7535 27.9790 175.9115 19 R 4.0513 7.6552 118.5735 59.6007 30.0032 178.6807 20 R 4.0869 7.8820 117.4429 59.3712 30.1122 179.0532 21 V 3.6099 7.5379 117.2961 65.8477 31.3713 177.5770 22 W 4.2461 8.4602 123.4382 58.5988 30.3081 175.8252 23 L 4.3556 7.7412 117.6810 55.8854 42.9674 176.6796 24 V 4.0313 7.4272 117.4759 63.0509 31.7017 175.8450 25 L 4.1953 7.4942 117.0310 53.3269 42.6019 176.5918 26 K 4.3163 8.1290 122.5078 54.3241 32.6554 176.0883 27 K 4.1114 8.3472 127.0052 55.2055 32.6760 175.6817 28 P 4.5284 0.0000 0.0000 63.0203 32.1285 175.6450 29 T 4.4292 8.8234 117.5114 63.4143 69.7470 176.8195 30 K 4.6447 8.2112 126.6106 59.0972 32.4384 177.8822 31 D 4.3618 8.2110 118.8537 57.4297 40.9549 178.2957 32 E 3.9288 8.4522 119.9081 59.5755 29.6386 178.0412 33 Y 4.2675 8.0687 118.7032 61.0620 38.9666 177.8522 34 L 3.6194 8.3567 119.8440 57.8611 41.6497 179.1214 35 A 3.9014 7.9884 120.7052 55.2393 18.3165 179.3882 36 V 3.4426 7.9704 114.9832 66.1052 31.5792 178.1470 37 A 3.8337 7.8485 120.0939 56.0556 18.1547 178.8894 38 K 3.7782 8.5480 117.0146 59.0605 31.8970 179.2748 39 V 3.5653 8.1289 119.2278 65.8620 31.4468 178.7072 40 T 3.7732 8.4623 116.0334 66.3690 68.3068 176.1965 41 A 3.9655 8.2405 122.6689 55.1242 18.3140 179.1828 42 L 3.9499 8.2328 119.1484 58.4420 42.1286 179.3685 43 G 3.5675 8.0828 105.3165 47.9831 0.0000 175.3531 44 I 3.7136 7.8786 123.0100 64.0967 37.0807 178.6949 45 S 4.0132 8.2680 115.6612 61.9725 62.7583 175.7264 46 L 3.9087 8.1430 122.7336 58.4274 41.6609 178.6429 47 L 4.0682 8.3700 118.1824 58.0245 41.8867 179.8609 48 G 3.7171 8.3856 105.4521 48.0619 0.0000 175.2060 49 I 3.7059 8.3466 123.2881 64.1779 37.2513 178.2004 50 I 3.8583 7.9415 120.2720 64.7290 37.0794 178.8059 51 G 3.7602 8.2762 105.6876 47.2746 0.0000 175.1198 52 Y 4.2070 7.9231 122.1001 60.9427 38.8154 177.3357 53 I 3.6372 8.4579 119.8482 64.2424 37.1820 178.1417 54 I 4.0234 7.4574 119.6112 64.5961 37.8094 176.9797 55 H 3.9372 9.0096 118.9250 58.1562 29.3621 178.2859 56 V 3.1080 7.0146 117.8471 64.4917 32.7414 175.8668 57 P 4.1817 0.0000 0.0000 66.1556 31.2837 178.1382 58 A 4.0170 7.7838 120.5259 54.6781 18.0305 179.4526 59 T 3.9982 7.6766 113.9686 66.2541 68.8124 176.5280 60 Y 4.1588 8.0526 121.5610 60.7120 38.5434 177.9734 61 I 3.5971 7.6788 120.6334 63.7898 37.0667 177.8307 62 K 3.8875 8.2241 119.3236 59.8610 31.7419 179.5627 63 G 3.4043 8.0671 105.1290 47.3366 0.0000 174.9519 64 I 4.0546 7.1925 117.5741 61.2247 38.0836 175.7586 65 L 4.6858 7.2552 116.2181 54.7593 43.5127 176.3759 66 K 4.0953 7.5967 125.7694 56.6133 32.0518 176.3602 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 T 8.03 4.40 4.27 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 1.23 0.00 0.00 3 D 8.13 4.27 0.00 2.83 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 4 F 9.10 4.02 0.00 3.10 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 5 N 8.24 4.31 0.00 3.03 3.09 0.00 0.00 7.07 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 6 Q 8.05 4.29 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.85 0.00 0.00 0.00 0.00 0.00 2.47 2.28 0.00 7 K 8.19 3.82 0.00 1.56 1.73 0.00 1.62 0.00 0.00 1.58 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.69 7.81 8 I 7.58 3.53 1.97 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.72 0.85 0.00 0.00 9 E 8.28 3.95 0.00 2.15 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 2.45 0.00 10 Q 8.23 4.73 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.77 0.00 0.00 0.00 0.00 0.00 2.53 2.38 0.00 11 L 8.09 4.19 0.00 1.62 1.67 0.80 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 12 K 7.92 4.01 0.00 2.08 1.86 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.77 7.81 13 E 7.95 3.94 0.00 2.25 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 2.63 0.00 14 F 8.66 3.89 0.00 3.06 3.01 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 0.00 0.00 0.00 15 I 8.15 3.91 2.16 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 1.50 0.63 0.94 0.00 0.00 16 E 8.06 3.94 0.00 2.21 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 0.00 2.31 2.35 0.00 17 E 8.16 3.87 0.00 1.96 1.57 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 2.12 2.25 0.00 18 C 7.98 4.10 0.00 3.28 3.01 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 0.00 0.00 0.00 19 R 7.66 4.05 0.00 2.09 2.08 0.00 3.48 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.00 0.00 20 R 7.88 4.09 0.00 2.12 1.97 0.00 3.18 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 1.63 1.69 0.00 21 V 7.54 3.61 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 1.02 0.00 0.00 1.01 0.00 0.00 22 W 8.46 4.25 0.00 3.25 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 23 L 7.74 4.36 0.00 1.80 1.62 0.97 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 24 V 7.43 4.03 2.04 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 0.73 0.00 0.00 0.93 0.00 0.00 25 L 7.49 4.20 0.00 1.35 1.38 0.50 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.13 4.32 0.00 1.63 1.68 0.00 1.62 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.30 1.45 7.81 27 K 8.35 4.11 0.00 1.72 1.65 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.33 1.31 7.81 28 P 0.00 4.53 0.00 2.21 2.06 0.00 3.65 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.84 0.00 29 T 8.82 4.43 4.25 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 1.22 0.00 0.00 30 K 8.21 4.64 0.00 1.89 1.84 0.00 1.65 0.00 0.00 1.95 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.73 7.81 31 D 8.21 4.36 0.00 2.70 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.45 3.93 0.00 2.04 2.25 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 2.36 2.36 0.00 33 Y 8.07 4.27 0.00 3.02 3.14 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 34 L 8.36 3.62 0.00 1.81 1.63 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 35 A 7.99 3.90 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 36 V 7.97 3.44 2.11 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 0.87 0.00 0.00 1.01 0.00 0.00 37 A 7.85 3.83 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.55 3.78 0.00 2.01 1.71 0.00 1.67 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.58 7.81 39 V 8.13 3.57 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 0.89 0.00 0.00 0.92 0.00 0.00 40 T 8.46 3.77 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 1.21 0.00 0.00 41 A 8.24 3.97 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.23 3.95 0.00 1.89 1.67 0.91 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 43 G 8.08 3.57 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 0.00 0.00 0.00 44 I 7.88 3.71 1.85 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 1.52 0.72 0.90 0.00 0.00 45 S 8.27 4.01 0.00 4.07 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 46 L 8.14 3.91 0.00 1.73 1.82 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 47 L 8.37 4.07 0.00 1.88 1.74 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.39 3.72 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 0.00 0.00 0.00 49 I 8.35 3.71 2.14 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 1.49 0.88 0.97 0.00 0.00 50 I 7.94 3.86 2.06 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.11 0.94 0.00 0.00 51 G 8.28 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.92 4.21 0.00 3.18 3.17 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 0.00 53 I 8.46 3.64 2.02 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 1.62 1.00 0.92 0.00 0.00 54 I 7.46 4.02 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.68 0.93 0.00 0.00 55 H 9.01 3.94 0.00 3.41 3.15 0.00 5.81 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 V 7.01 3.11 1.66 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 0.73 0.00 0.00 0.20 0.00 0.00 57 P 0.00 4.18 0.00 2.29 2.23 0.00 3.76 0.00 0.00 3.56 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 58 A 7.78 4.02 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 59 T 7.68 4.00 4.34 0.00 0.00 0.00 0.00 0.00 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 60 Y 8.05 4.16 0.00 2.97 3.20 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 61 I 7.68 3.60 2.03 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 1.60 0.98 0.86 0.00 0.00 62 K 8.22 3.89 0.00 1.78 1.87 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.81 7.81 63 G 8.07 3.40 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 0.00 64 I 7.19 4.05 1.50 0.00 0.00 0.76 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 0.58 0.63 0.00 0.00 65 L 7.26 4.69 0.00 1.50 1.54 0.86 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 66 K 7.60 4.10 0.00 1.90 1.65 0.00 1.82 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.36 7.81