NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9298 8.3393 109.7365 45.7290 0.0000 173.1122 2 S 4.5532 8.5665 118.5419 55.7107 64.7376 172.8524 3 S 4.2552 8.9481 118.9718 58.1536 64.1962 176.8619 4 G 3.5674 8.5155 108.1351 46.1814 0.0000 168.9562 5 S 3.5321 8.8283 123.2211 58.3554 62.7963 172.4983 6 S 4.7244 8.2810 116.0946 58.0384 64.1640 175.6550 7 G 3.7741 8.2770 123.8927 43.3284 0.0000 169.6310 8 S 3.7419 9.0883 129.7666 57.5948 62.8900 171.0614 9 R 4.1908 8.6244 117.6999 56.5908 30.8822 173.0571 10 Q 3.2282 8.9649 121.1549 56.3689 26.5802 172.0719 11 A 4.7003 7.8987 124.0632 48.9191 22.1880 174.8377 12 P 4.4658 0.0000 0.0000 62.3371 30.2541 175.3411 13 I 4.2644 7.9080 117.6870 60.0136 39.7156 173.1093 14 A 3.8512 8.4771 129.9962 51.6063 18.4064 177.5022 15 N 4.5635 8.4785 117.5478 52.7844 39.5468 174.5521 16 A 4.3947 8.1971 122.8996 50.8140 20.0022 177.6741 17 A 4.2555 8.3402 125.8650 52.0999 19.2425 177.5140 18 V 4.3527 7.8111 118.8924 60.1282 33.7603 174.9444 19 L 4.1171 8.4084 125.4812 53.6617 42.1160 175.2526 20 P 4.3828 0.0000 0.0000 62.2886 32.4651 175.7297 21 Q 3.0578 9.1760 119.4540 56.7646 29.7160 173.2883 22 S 3.6038 8.9399 115.8505 59.2107 61.1690 172.8129 23 Q 3.9972 8.9136 134.7682 57.8281 29.1140 176.0433 24 G 4.2723 7.8583 112.2819 44.8841 0.0000 170.1829 25 R 4.7159 7.5650 121.0606 53.7679 34.3939 175.9879 26 V 3.7231 8.2580 118.1070 62.3232 31.5346 174.4955 27 A 4.3271 8.5136 130.1949 53.0021 22.2060 176.5039 28 A 3.9800 7.9068 115.9967 52.9295 19.0299 177.5919 29 S 4.8604 9.8326 119.9536 56.1610 66.8485 175.1324 30 E 3.8938 8.6497 125.4306 59.5499 29.3945 178.5951 31 E 3.9050 8.3427 118.7629 59.8334 29.4666 178.7703 32 Q 3.9744 7.9748 117.0892 59.0199 28.7371 178.2321 33 I 3.7392 7.7992 120.6489 64.9674 37.1199 178.4073 34 Q 4.1395 8.5222 118.8304 58.9122 28.4541 178.7216 35 K 3.5031 8.1764 118.4715 58.7027 32.2384 178.6936 36 L 4.6857 8.3416 119.2436 57.1131 42.5322 178.9228 37 V 4.3102 9.1242 120.2157 65.5173 31.1150 177.8959 38 A 4.0136 8.6650 120.7452 55.4019 18.3205 179.3283 39 M 4.0977 7.7473 116.2023 56.5246 32.1108 176.6309 40 G 3.9548 7.0025 108.6170 46.2399 0.0000 173.4326 41 F 5.0917 8.1706 117.0365 55.2797 42.4248 173.8011 42 D 5.1171 8.4278 120.2705 52.5813 43.2355 176.2194 43 R 3.8673 8.6591 127.1552 60.2171 29.9539 178.1176 44 T 3.8245 8.1293 114.4660 67.0870 68.4405 176.0543 45 Q 3.8620 8.1727 119.0261 59.1236 28.4421 179.4697 46 V 3.4474 8.1941 119.2614 65.9890 31.5803 177.7954 47 E 4.3193 8.6550 118.5128 59.4342 29.4590 179.1679 48 V 3.5365 8.4919 118.5223 66.4301 31.1328 177.7585 49 A 3.9077 8.2485 120.1650 55.0829 18.2176 179.4501 50 L 3.7652 9.0694 117.7506 58.0752 41.7250 179.8756 51 A 4.1029 8.3743 120.8688 55.2042 18.2187 179.6054 52 A 3.9604 7.7646 117.4875 55.0326 18.5313 179.4359 53 A 3.9885 8.7748 119.5726 53.1352 18.5007 177.1514 54 D 4.4468 7.8907 115.2204 55.5579 39.9381 174.0058 55 D 4.6456 9.0617 114.3108 54.2803 40.4998 172.5191 56 D 4.8457 7.6513 116.6438 52.7556 42.4680 176.5519 57 L 4.0900 8.2657 125.0633 57.9926 42.3353 178.7952 58 T 3.7129 7.9039 115.1613 66.6203 68.3159 176.3686 59 V 3.5343 7.6412 119.0354 65.5110 31.8406 177.3078 60 A 3.9062 7.6165 120.3542 55.3375 18.1500 179.5738 61 V 3.3601 8.3199 117.7529 65.4200 31.0671 178.2468 62 E 3.9614 7.5506 119.1343 58.9471 28.8563 179.6165 63 I 3.6486 7.6398 119.6318 64.2758 36.9849 178.3106 64 L 3.7444 7.9739 119.2240 58.0025 41.3214 179.2909 65 M 4.4349 8.3329 117.4228 57.4758 33.2457 177.3084 66 S 4.7778 7.9753 111.0922 57.2521 62.2125 173.4398 67 Q 4.1421 7.6678 122.7861 57.7919 29.6311 177.7101 68 S 4.2659 7.9755 118.7021 58.1040 62.1997 174.0383 69 G 4.0396 8.1682 115.7222 43.0895 0.0000 170.7793 70 P 4.6078 0.0000 0.0000 61.0116 29.9144 175.7219 71 S 4.5348 7.0458 109.8562 58.0966 65.5754 174.4103 72 S 4.0507 8.7254 121.1016 61.2591 62.5895 174.3099 73 G 4.1044 8.0280 112.1017 45.8428 0.0000 172.9823 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 1 G 8.34 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 2 S 8.57 4.55 0.00 4.04 3.85 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 0.00 0.00 0.00 3 S 8.95 4.26 0.00 3.85 3.92 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 4 G 8.52 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 5 S 8.83 3.53 0.00 4.00 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 6 S 8.28 4.72 0.00 3.80 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 8.28 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 S 9.09 3.74 0.00 4.04 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 9 R 8.62 4.19 0.00 1.85 1.84 0.00 3.19 0.00 0.00 3.15 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.47 0.00 10 Q 8.96 3.23 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.77 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 11 A 7.90 4.70 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 12 P 0.00 4.47 0.00 2.19 2.12 0.00 3.74 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 13 I 7.91 4.26 1.87 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 1.35 0.68 0.94 0.00 0.00 14 A 8.48 3.85 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 15 N 8.48 4.56 0.00 2.72 2.74 0.00 0.00 6.88 7.32 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 16 A 8.20 4.39 1.22 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 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.34 4.26 1.24 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 0.00 0.00 0.00 18 V 7.81 4.35 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 0.72 0.00 0.00 0.92 0.00 0.00 19 L 8.41 4.12 0.00 1.65 1.64 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 20 P 0.00 4.38 0.00 2.17 2.08 0.00 3.91 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 21 Q 9.18 3.06 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.33 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 22 S 8.94 3.60 0.00 4.05 3.71 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 23 Q 8.91 4.00 0.00 2.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.25 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 24 G 7.86 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 0.00 0.00 0.00 0.00 25 R 7.57 4.72 0.00 1.76 1.82 0.00 3.38 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.51 0.00 26 V 8.26 3.72 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 0.65 0.00 0.00 0.93 0.00 0.00 27 A 8.51 4.33 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 28 A 7.91 3.98 1.26 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 29 S 9.83 4.86 0.00 3.88 3.74 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 30 E 8.65 3.89 0.00 2.03 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 2.38 0.00 31 E 8.34 3.90 0.00 2.04 1.97 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 0.00 2.39 2.38 0.00 32 Q 7.97 3.97 0.00 2.28 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.88 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 33 I 7.80 3.74 2.01 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 1.53 0.85 0.93 0.00 0.00 34 Q 8.52 4.14 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.80 0.00 0.00 0.00 0.00 0.00 2.61 2.55 0.00 35 K 8.18 3.50 0.00 1.98 1.92 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.71 7.81 36 L 8.34 4.69 0.00 1.74 1.93 0.83 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 37 V 9.12 4.31 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 1.28 0.00 0.00 1.04 0.00 0.00 38 A 8.66 4.01 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 39 M 7.75 4.10 0.00 1.73 2.23 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.70 0.00 40 G 7.00 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 41 F 8.17 5.09 0.00 3.17 2.82 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 0.00 42 D 8.43 5.12 0.00 2.76 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 R 8.66 3.87 0.00 1.93 1.97 0.00 3.26 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.78 0.00 44 T 8.13 3.82 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 1.21 0.00 0.00 45 Q 8.17 3.86 0.00 2.24 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.96 0.00 0.00 0.00 0.00 0.00 2.46 2.47 0.00 46 V 8.19 3.45 2.27 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 1.10 0.00 0.00 1.01 0.00 0.00 47 E 8.65 4.32 0.00 2.13 1.97 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 0.00 2.32 2.50 0.00 48 V 8.49 3.54 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 0.93 0.00 0.00 49 A 8.25 3.91 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 50 L 9.07 3.77 0.00 1.79 1.75 0.96 0.91 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 A 8.37 4.10 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.76 3.96 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 53 A 8.77 3.99 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 54 D 7.89 4.45 0.00 2.83 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 55 D 9.06 4.65 0.00 2.84 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 56 D 7.65 4.85 0.00 2.85 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.27 4.09 0.00 1.75 1.63 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 58 T 7.90 3.71 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 59 V 7.64 3.53 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 0.99 0.00 0.00 0.96 0.00 0.00 60 A 7.62 3.91 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 61 V 8.32 3.36 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 0.85 0.00 0.00 1.07 0.00 0.00 62 E 7.55 3.96 0.00 2.08 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 0.00 2.50 2.49 0.00 63 I 7.64 3.65 1.93 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.19 0.84 0.00 0.00 64 L 7.97 3.74 0.00 0.55 0.13 0.63 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 65 M 8.33 4.43 0.00 2.02 2.37 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 3.11 0.00 66 S 7.98 4.78 0.00 3.78 3.83 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 67 Q 7.67 4.14 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.34 6.86 0.00 0.00 0.00 0.00 0.00 2.25 2.25 0.00 68 S 7.98 4.27 0.00 3.88 3.85 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 0.00 0.00 0.00 69 G 8.17 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 0.00 0.00 0.00 70 P 0.00 4.61 0.00 2.19 2.12 0.00 3.81 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 71 S 7.05 4.53 0.00 3.80 3.71 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 72 S 8.73 4.05 0.00 3.87 3.87 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 73 G 8.03 4.10 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 0.00 0.00 0.00