NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 21 K 4.3523 8.3149 120.1373 56.4410 33.4701 174.4158 22 R 4.6598 8.2087 118.6993 54.3697 34.2291 172.9720 23 N 5.1519 9.2425 116.6288 51.7800 43.3975 174.4528 24 F 4.5010 8.7517 119.9026 55.4867 39.9971 175.6645 25 S 4.4810 8.3153 120.1784 57.8723 63.8570 173.9844 26 V 4.5287 7.9341 119.8080 61.5318 34.2830 174.7325 27 T 4.3449 8.5173 120.5179 60.9389 70.0035 172.3137 28 F 4.9455 7.5508 122.3343 56.5625 40.5303 172.2290 29 Y 4.8331 8.6627 116.9763 56.4962 41.0336 174.7045 30 L 4.9297 8.3116 120.3837 52.5073 46.2958 176.6831 31 S 4.5445 8.4011 115.5460 57.7472 64.9019 175.6685 32 K 3.9232 8.5695 122.7654 60.1580 31.7835 179.5486 33 E 3.9963 8.1315 118.0493 59.1337 29.4609 178.8661 34 E 3.9269 8.1474 118.9586 59.6977 29.8271 178.2289 35 H 4.1431 8.4822 118.3202 59.4222 29.8247 176.9609 36 D 4.4252 8.4257 120.8687 57.0531 40.5679 178.8883 37 V 3.5395 8.0977 119.1556 66.0351 31.5046 178.0569 38 L 3.9554 7.9712 118.6759 57.6876 41.3537 179.4209 39 R 3.7011 8.2367 119.0044 59.3382 30.0275 178.5395 40 R 3.7528 8.0038 118.3726 59.5449 29.9364 178.4778 41 L 3.8625 7.5676 117.0413 57.5457 41.8083 179.1884 42 A 3.2522 7.1142 120.9906 54.9144 18.0818 179.1188 43 D 4.4349 8.1918 116.4237 57.3268 40.9800 178.1492 44 E 3.9814 7.9477 118.8483 58.6652 29.5217 176.9636 45 E 4.5936 7.6146 114.2940 57.6299 34.2668 176.1496 46 V 4.3777 8.2574 113.2643 59.8037 33.5584 176.0731 47 E 4.2498 8.3332 130.3658 55.4621 28.5119 180.1013 48 S 4.4184 7.5758 113.4355 56.5025 64.0233 172.2866 49 V 3.6464 8.2555 128.2904 65.6011 31.4253 176.9748 50 N 4.3014 8.1091 116.2467 56.1309 37.1162 177.0274 51 S 4.0860 8.0362 115.3485 60.7458 62.5661 175.4899 52 F 4.0745 8.6099 123.7868 61.4031 39.0477 177.2742 53 V 3.4503 8.2856 118.0723 65.7704 31.3600 177.7263 54 K 3.8675 8.1347 119.3842 59.5438 31.9270 178.5749 55 R 3.8173 8.0896 118.9561 59.6192 30.0137 177.7315 56 H 3.8349 8.1313 118.2977 59.3146 29.7594 177.1644 57 I 3.6229 7.8565 121.4447 64.2389 36.9455 177.9125 58 L 3.8696 7.8840 121.0325 58.3382 41.6960 179.0078 59 K 4.2241 8.3089 119.8980 59.1887 32.2078 178.6089 60 T 3.9717 7.7253 109.1294 64.3595 68.7648 176.7111 61 I 3.8938 7.5090 122.2420 63.0109 37.5194 175.8130 62 I 4.5020 7.3120 117.4734 60.2744 41.1601 172.3478 63 Y 4.8744 8.0689 124.3641 57.1994 41.8171 174.6045 64 K 3.5065 8.0040 123.8062 56.7278 29.8522 175.2715 65 K 4.1292 7.9748 115.5954 57.2171 33.1616 176.7064 66 G 4.0485 8.2529 106.4870 45.4317 0.0000 174.5895 67 T 3.9919 7.9775 110.5820 64.3362 69.0446 173.9218 68 N 4.7704 7.6002 116.0337 51.9940 39.6424 172.6168 69 Q 4.5204 8.1066 115.7815 55.4294 31.4548 172.3503 70 D 4.7149 8.0969 117.0524 53.6189 44.2545 174.7419 71 S 4.5987 8.3561 110.6159 57.9739 64.6193 172.7614 72 S 4.6567 8.3986 115.0348 57.2104 65.5549 172.0336 73 I 4.7543 7.8215 114.2325 58.4260 40.4902 174.8155 74 N 4.4807 8.7424 117.0472 53.3560 36.9659 174.8109 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 21 K 8.31 4.35 0.00 1.78 1.84 0.00 1.67 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.48 7.81 22 R 8.21 4.66 0.00 1.95 1.85 0.00 3.23 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.75 0.00 23 N 9.24 5.15 0.00 2.67 2.71 0.00 0.00 6.75 7.47 0.00 0.00 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 F 8.75 4.50 0.00 2.92 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 25 S 8.32 4.48 0.00 3.98 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 V 7.93 4.53 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 1.06 0.00 0.00 1.03 0.00 0.00 27 T 8.52 4.34 4.19 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 1.24 0.00 0.00 28 F 7.55 4.95 0.00 3.17 3.04 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 29 Y 8.66 4.83 0.00 3.05 2.88 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 30 L 8.31 4.93 0.00 1.73 1.66 1.12 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 31 S 8.40 4.54 0.00 3.91 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 32 K 8.57 3.92 0.00 1.81 1.89 0.00 1.68 0.00 0.00 1.83 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.57 7.81 33 E 8.13 4.00 0.00 2.07 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 2.41 2.44 0.00 34 E 8.15 3.93 0.00 2.12 2.18 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 2.45 2.51 0.00 35 H 8.48 4.14 0.00 3.38 3.29 0.00 5.64 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 D 8.43 4.43 0.00 2.95 2.70 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 37 V 8.10 3.54 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 1.00 0.00 0.00 0.99 0.00 0.00 38 L 7.97 3.96 0.00 1.83 1.75 1.00 0.80 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 39 R 8.24 3.70 0.00 1.87 2.09 0.00 3.25 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 1.57 1.59 0.00 40 R 8.00 3.75 0.00 1.93 1.83 0.00 3.12 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 41 L 7.57 3.86 0.00 1.30 1.70 1.02 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 42 A 7.11 3.25 0.94 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 0.00 0.00 43 D 8.19 4.43 0.00 2.75 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.95 3.98 0.00 2.09 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 0.00 2.32 2.34 0.00 45 E 7.61 4.59 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 2.26 2.30 0.00 46 V 8.26 4.38 2.16 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 0.68 0.00 0.00 1.12 0.00 0.00 47 E 8.33 4.25 0.00 2.05 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 2.27 2.29 0.00 48 S 7.58 4.42 0.00 3.86 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 49 V 8.26 3.65 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 0.98 0.00 0.00 0.86 0.00 0.00 50 N 8.11 4.30 0.00 2.94 3.03 0.00 0.00 5.89 7.65 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 51 S 8.04 4.09 0.00 3.94 4.08 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 0.00 0.00 0.00 0.00 52 F 8.61 4.07 0.00 3.18 3.30 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 53 V 8.29 3.45 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 1.12 0.00 0.00 1.13 0.00 0.00 54 K 8.13 3.87 0.00 1.97 1.94 0.00 1.72 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.62 7.81 55 R 8.09 3.82 0.00 1.96 1.93 0.00 3.17 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 56 H 8.13 3.83 0.00 2.59 3.20 0.00 5.84 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 57 I 7.86 3.62 2.01 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.62 0.91 0.00 0.00 58 L 7.88 3.87 0.00 1.76 1.88 0.93 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 59 K 8.31 4.22 0.00 1.79 1.70 0.00 1.25 0.00 0.00 1.44 0.00 0.00 2.95 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.24 1.12 7.81 60 T 7.73 3.97 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 0.99 0.00 0.00 61 I 7.51 3.89 1.99 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 1.38 0.58 0.90 0.00 0.00 62 I 7.31 4.50 1.88 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 1.20 1.13 0.92 0.00 0.00 63 Y 8.07 4.87 0.00 2.79 2.77 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 64 K 8.00 3.51 0.00 1.58 1.58 0.00 1.59 0.00 0.00 1.46 0.00 0.00 2.72 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.74 0.21 7.81 65 K 7.97 4.13 0.00 1.83 1.81 0.00 1.51 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.41 7.81 66 G 8.25 4.05 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 0.00 0.00 0.00 67 T 7.98 3.99 4.22 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 1.19 0.00 0.00 68 N 7.60 4.77 0.00 2.77 2.77 0.00 0.00 5.77 7.37 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 69 Q 8.11 4.52 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.76 0.00 0.00 0.00 0.00 0.00 2.21 2.33 0.00 70 D 8.10 4.71 0.00 2.60 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 71 S 8.36 4.60 0.00 3.95 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 72 S 8.40 4.66 0.00 3.81 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 73 I 7.82 4.75 1.88 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 1.48 0.84 0.92 0.00 0.00 74 N 8.74 4.48 0.00 2.86 2.87 0.00 0.00 5.90 7.57 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