NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 17 L 4.4795 8.0433 120.5827 54.3549 44.7379 179.4908 18 L 4.0538 9.1305 122.5570 53.9600 42.8091 174.6797 19 C 4.1161 9.4577 121.6267 59.9909 32.7142 174.4175 20 K 3.8163 8.6946 128.5273 59.6455 31.7055 177.5085 21 K 4.2415 8.3083 115.6281 57.1890 32.4334 177.6658 22 G 3.9678 8.3369 107.3834 45.6795 0.0000 174.2728 23 C 4.2686 7.9789 113.8809 59.0285 30.0983 174.5590 24 G 3.8137 8.3659 108.6973 45.1528 0.0000 173.1526 25 Y 4.4294 7.6146 116.9681 57.3553 39.8338 174.3328 26 Y 4.4801 8.9353 118.9005 58.0955 38.7304 175.8804 27 G 4.1629 8.6837 110.6226 45.5285 0.0000 172.4030 28 N 4.7707 8.7963 120.9556 50.8857 39.9560 174.1761 29 P 4.0578 0.0000 0.0000 65.4268 31.6209 177.5307 30 A 3.9030 7.7795 119.8491 53.5312 18.8521 177.6148 31 W 3.7144 7.4768 117.2609 56.7548 29.1620 176.1671 32 Q 3.3761 8.9473 110.4997 56.8550 26.4367 175.5332 33 G 3.8018 8.1209 103.6105 45.6251 0.0000 173.9977 34 F 5.1192 8.2270 119.2776 56.3286 40.4916 175.4925 35 C 5.3597 8.7029 118.9113 57.4505 32.1297 174.6587 36 S 3.2890 8.8798 114.9994 61.6783 62.2601 176.7403 37 K 3.9068 7.8815 121.9382 59.0421 31.9170 179.1181 38 C 4.1356 8.0340 116.5810 62.1955 28.1160 175.7921 39 W 3.9655 8.2677 130.2890 60.3786 30.3385 178.1216 40 R 3.3936 7.7222 118.7369 58.8811 29.4268 178.0387 41 E 3.8006 7.8992 119.2193 59.3296 29.6801 178.5508 42 E 3.7008 7.7463 118.5022 59.4628 29.4294 178.8678 43 Y 3.6238 7.2952 119.2318 60.7467 38.7154 177.6685 44 H 3.9662 7.9107 116.9815 58.8351 28.8668 177.7844 45 K 3.7861 8.3033 120.3019 59.5240 31.8803 179.2696 46 A 3.9023 7.8094 120.8242 55.0927 18.2113 179.7096 47 R 3.7040 7.7148 117.2558 59.3958 30.0903 178.6785 48 Q 3.8785 8.1796 118.2509 58.7385 28.6409 178.8024 49 K 3.8583 7.9448 120.4347 59.5863 32.3217 178.3973 50 Q 3.9344 7.9519 119.7872 59.4983 28.8829 178.6581 51 I 3.7839 7.9716 120.7826 64.3189 37.1066 178.4313 52 Q 3.9966 8.1671 118.9273 59.1490 28.5727 178.7910 53 E 4.0542 8.4573 119.7169 59.5517 29.3871 179.2138 54 D 4.4325 8.3598 119.0229 56.7348 40.7752 178.6305 55 W 4.0723 8.3021 129.1498 60.5129 30.7362 177.7610 56 E 4.0201 8.4228 118.6183 59.4784 28.8409 179.2071 57 L 3.9090 7.9884 119.9844 58.0465 42.0878 178.7735 58 A 3.8351 8.1072 120.9262 55.1647 18.2600 179.2402 59 E 3.6065 8.0023 117.8716 59.1540 29.6554 178.9474 60 R 3.8508 8.0318 118.8418 59.4377 30.0446 178.5353 61 L 3.9528 8.1278 119.0321 57.6090 41.5876 179.0879 62 Q 3.8703 8.2585 119.9049 59.3726 28.9870 178.7529 63 R 3.8989 7.9878 118.8593 59.2259 30.0939 178.5350 64 E 3.9343 8.2327 118.9808 59.4377 29.5099 178.7974 65 E 3.9738 8.4003 118.7709 59.5257 29.5423 179.1138 66 E 4.0363 8.6792 118.9763 59.5499 29.2595 179.4123 67 E 3.9887 8.1609 117.5296 59.3525 29.6265 178.9333 68 A 4.1572 7.8495 119.8972 54.8265 18.8058 179.2991 69 F 4.4566 8.6183 119.3084 60.3476 39.4366 175.0192 70 A 4.1434 7.9268 124.1983 54.2657 17.7187 175.2339 71 S 4.8288 8.1796 123.7853 59.1893 60.1715 175.3876 72 S 4.3131 7.1377 117.1539 57.6888 64.3033 174.7235 *73 Q 4.1254 8.3689 117.7986 55.3249 28.5562 174.4956 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 17 L 8.04 4.48 0.00 1.64 1.24 0.91 0.33 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 18 L 9.13 4.05 0.00 1.58 1.49 0.10 0.34 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 19 C 9.46 4.12 0.00 3.22 2.97 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 0.00 0.00 0.00 20 K 8.69 3.82 0.00 1.62 1.75 0.00 1.58 0.00 0.00 0.72 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.30 7.81 21 K 8.31 4.24 0.00 1.99 1.96 0.00 1.95 0.00 0.00 1.96 0.00 0.00 3.04 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.90 1.46 7.81 22 G 8.34 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 23 C 7.98 4.27 0.00 3.26 3.19 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 0.00 24 G 8.37 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 25 Y 7.61 4.43 0.00 3.07 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 26 Y 8.94 4.48 0.00 2.94 2.93 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 27 G 8.68 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 0.00 0.00 0.00 28 N 8.80 4.77 0.00 2.37 2.20 0.00 0.00 7.38 8.23 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 29 P 0.00 4.06 0.00 1.94 2.01 0.00 3.52 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.00 0.00 30 A 7.78 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 W 7.48 3.71 0.00 3.35 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 0.00 0.00 0.00 32 Q 8.95 3.38 0.00 2.47 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.94 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 33 G 8.12 3.80 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 0.00 0.00 0.00 34 F 8.23 5.12 0.00 3.56 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 35 C 8.70 5.36 0.00 3.37 3.46 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 36 S 8.88 3.29 0.00 3.83 4.32 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 37 K 7.88 3.91 0.00 1.76 1.83 0.00 1.48 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.40 7.81 38 C 8.03 4.14 0.00 3.12 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 39 W 8.27 3.97 0.00 3.55 2.96 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 40 R 7.72 3.39 0.00 1.81 1.85 0.00 3.10 0.00 0.00 2.95 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.36 0.00 41 E 7.90 3.80 0.00 2.08 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 2.20 2.28 0.00 42 E 7.75 3.70 0.00 1.49 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.47 0.00 43 Y 7.30 3.62 0.00 2.14 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.91 3.97 0.00 3.34 3.22 0.00 5.70 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 45 K 8.30 3.79 0.00 1.68 1.78 0.00 1.60 0.00 0.00 1.58 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.53 7.81 46 A 7.81 3.90 1.23 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 0.00 0.00 0.00 47 R 7.71 3.70 0.00 1.50 1.81 0.00 2.85 0.00 0.00 2.84 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.50 0.00 48 Q 8.18 3.88 0.00 2.16 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.58 0.00 0.00 0.00 0.00 0.00 2.28 2.39 0.00 49 K 7.94 3.86 0.00 1.79 1.90 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.43 7.81 50 Q 7.95 3.93 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.59 0.00 0.00 0.00 0.00 0.00 2.35 2.54 0.00 51 I 7.97 3.78 1.83 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 1.66 0.69 0.91 0.00 0.00 52 Q 8.17 4.00 0.00 2.25 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 53 E 8.46 4.05 0.00 2.02 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 2.49 0.00 54 D 8.36 4.43 0.00 2.90 2.75 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 55 W 8.30 4.07 0.00 3.44 3.23 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 0.00 56 E 8.42 4.02 0.00 2.30 2.05 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 2.47 2.72 0.00 57 L 7.99 3.91 0.00 1.77 1.81 0.90 1.16 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 58 A 8.11 3.84 1.14 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 59 E 8.00 3.61 0.00 1.87 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 2.28 2.30 0.00 60 R 8.03 3.85 0.00 1.97 2.06 0.00 3.13 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 61 L 8.13 3.95 0.00 1.79 1.64 0.88 1.07 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 62 Q 8.26 3.87 0.00 2.07 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 63 R 7.99 3.90 0.00 2.04 1.95 0.00 3.18 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.83 0.00 64 E 8.23 3.93 0.00 2.03 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 0.00 2.30 2.36 0.00 65 E 8.40 3.97 0.00 2.14 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 2.47 2.45 0.00 66 E 8.68 4.04 0.00 2.12 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 2.53 2.49 0.00 67 E 8.16 3.99 0.00 2.10 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 2.35 2.45 0.00 68 A 7.85 4.16 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 69 F 8.62 4.46 0.00 3.19 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 70 A 7.93 4.14 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 71 S 8.18 4.83 0.00 4.14 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 0.00 72 S 7.14 4.31 0.00 3.91 3.79 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 *73 Q 8.37 4.13 0.00 1.84 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.68 0.00 0.00 0.00 0.00 0.00 2.18 2.42 0.00 * Residues marked with a * may have inaccurate shift predictions.