NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3510 8.2649 123.5890 51.8989 20.5526 177.1035 3 R 4.1157 7.8462 118.3243 56.6370 31.3345 176.5591 4 K 3.9161 9.1611 121.4398 59.9130 32.8288 179.0627 5 A 4.0361 8.1016 118.8380 54.7768 18.1324 177.9788 6 L 4.7456 7.4998 115.6286 55.0586 43.1967 176.8817 7 I 4.5889 7.9814 118.7749 61.2624 38.0911 176.4680 8 E 4.4809 8.1936 116.2251 56.3025 29.6698 177.5170 9 K 3.7974 7.7225 121.5259 58.5802 32.4671 177.7078 10 A 3.9460 7.3804 120.9474 54.1501 18.5885 177.6967 11 K 4.1466 7.4909 115.9272 55.6874 30.8103 177.6971 12 R 4.0630 8.4600 123.2018 57.8377 30.0347 177.3562 13 T 4.4387 7.2872 114.8927 62.1031 67.4329 172.2662 14 P 4.2829 0.0000 0.0000 63.4707 31.9866 178.4689 15 K 3.8662 9.2894 117.4560 55.4821 30.8350 175.5884 16 F 4.7016 7.6794 111.4584 57.5063 42.7127 173.9526 17 K 3.9148 9.5601 128.0962 59.8654 32.2511 177.8264 18 V 3.8087 8.1287 111.2970 64.7908 31.5043 178.9884 19 R 4.1307 7.6782 112.7501 56.9560 29.5608 175.9891 20 A 4.4515 8.6160 122.8315 51.2477 19.4633 177.6283 21 Y 4.5569 8.2736 120.8220 56.6749 39.4032 178.1664 22 T 2.6975 7.8943 111.4869 57.3171 72.7863 170.4195 23 R 4.0641 8.1491 125.9610 54.6002 30.7327 175.9176 24 C 4.5928 7.8492 120.9476 59.4126 32.2141 173.9796 25 V 4.3531 8.0801 124.3333 61.4026 31.3719 176.4043 26 R 4.6334 7.9386 119.1566 57.6559 34.5527 175.2089 27 C 4.6086 8.4537 109.8764 57.5191 31.5889 174.8532 28 G 3.8891 8.6339 106.5338 44.4073 0.0000 172.2826 29 R 3.8078 8.1141 120.0048 56.4258 29.8869 176.4846 30 A 3.9282 8.7398 129.2491 55.0865 18.3845 177.7878 31 R 4.3210 7.9381 114.4410 55.4203 31.4423 175.9621 32 S 3.6281 8.5818 109.2127 59.3311 61.9542 172.6355 33 V 4.4133 7.2671 115.2819 61.4636 29.8112 175.9629 34 Y 4.2537 8.6786 122.0215 58.3285 38.6614 177.3446 35 R 4.2972 8.5914 120.3822 59.0397 30.8651 181.5240 36 F 4.6807 8.0426 120.5109 57.2018 38.4081 174.5890 37 F 4.9770 8.5353 120.3171 56.5745 45.4796 176.5529 38 G 4.0863 8.1811 107.3763 45.6835 0.0000 173.3120 39 L 4.7618 7.6385 120.2300 53.6813 43.3504 175.7650 40 C 4.8754 8.1891 115.9884 57.1501 32.1701 174.6081 41 R 3.8127 8.3042 118.9984 59.7863 28.5642 179.2400 42 I 3.6057 7.6192 119.5947 64.3419 37.4316 177.7010 43 C 4.0056 7.9880 116.9705 62.7576 27.9475 175.4692 44 L 3.5357 7.9300 122.1618 58.2888 41.4041 179.1810 45 R 3.6900 7.2900 117.7413 59.8256 30.0671 177.5682 46 E 3.9358 8.2762 118.0991 59.9755 29.4390 179.2524 47 L 3.9369 8.2835 118.0331 58.0101 41.6568 179.6169 48 A 3.9019 7.9504 120.0325 55.5239 18.2871 179.1642 49 H 4.3039 8.1774 114.2095 58.8235 28.8587 177.7321 50 K 4.1190 7.7434 119.5073 60.2674 31.9715 177.6533 51 G 3.9435 8.0659 104.5869 45.5491 0.0000 175.2598 52 Q 3.8373 8.0696 118.2674 57.3302 28.8604 176.2626 53 L 4.4712 7.1009 118.7731 51.9290 41.1641 174.2346 54 P 4.1600 0.0000 0.0000 64.2462 31.4306 178.4419 55 G 4.2165 9.0214 112.5475 46.5306 0.0000 174.3485 56 V 3.7135 8.2067 120.0792 62.9225 31.7497 175.1221 57 R 4.5943 8.1992 125.9603 53.8972 33.2148 173.9909 58 K 3.6662 8.8276 121.7674 56.9319 32.0731 176.8123 59 A 4.4499 8.4432 126.6225 51.5528 19.4474 176.1127 60 S 4.3161 8.2670 113.2066 58.0664 64.8275 177.0524 61 W 4.2656 7.8249 121.6266 57.3577 27.2065 174.1555 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 A 8.26 4.35 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 3 R 7.85 4.12 0.00 2.04 1.87 0.00 3.20 0.00 0.00 3.36 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.79 0.00 4 K 9.16 3.92 0.00 1.77 1.87 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.46 7.81 5 A 8.10 4.04 1.32 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 0.00 0.00 6 L 7.50 4.75 0.00 1.86 1.80 0.96 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 7 I 7.98 4.59 1.90 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 1.34 1.09 0.90 0.00 0.00 8 E 8.19 4.48 0.00 2.16 2.31 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 2.39 2.34 0.00 9 K 7.72 3.80 0.00 0.84 1.49 0.00 1.59 0.00 0.00 1.53 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 0.90 0.69 7.81 10 A 7.38 3.95 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 11 K 7.49 4.15 0.00 2.02 1.79 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.36 7.81 12 R 8.46 4.06 0.00 1.75 1.93 0.00 3.20 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 13 T 7.29 4.44 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 1.18 0.00 0.00 14 P 0.00 4.28 0.00 2.43 2.22 0.00 3.76 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.98 0.00 15 K 9.29 3.87 0.00 1.78 2.06 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.69 1.14 7.81 16 F 7.68 4.70 0.00 3.16 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.56 3.91 0.00 1.75 1.95 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.60 7.81 18 V 8.13 3.81 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 0.77 0.00 0.00 0.90 0.00 0.00 19 R 7.68 4.13 0.00 1.95 2.10 0.00 3.35 0.00 0.00 3.35 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.78 0.00 20 A 8.62 4.45 1.32 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 0.00 0.00 21 Y 8.27 4.56 0.00 3.01 2.89 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 22 T 7.89 2.70 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 1.27 0.00 0.00 23 R 8.15 4.06 0.00 1.90 1.98 0.00 3.48 0.00 0.00 3.41 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.23 0.00 24 C 7.85 4.59 0.00 3.05 3.02 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 0.00 0.00 0.00 25 V 8.08 4.35 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 0.81 0.00 0.00 0.95 0.00 0.00 26 R 7.94 4.63 0.00 1.74 1.91 0.00 3.17 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 27 C 8.45 4.61 0.00 3.08 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 28 G 8.63 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 0.00 0.00 0.00 29 R 8.11 3.81 0.00 1.93 1.94 0.00 3.27 0.00 0.00 3.37 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.90 0.00 30 A 8.74 3.93 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 31 R 7.94 4.32 0.00 1.92 1.91 0.00 3.28 0.00 0.00 3.40 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.63 0.00 32 S 8.58 3.63 0.00 4.23 4.18 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 0.00 0.00 0.00 33 V 7.27 4.41 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 0.89 0.00 0.00 1.09 0.00 0.00 34 Y 8.68 4.25 0.00 3.06 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.59 4.30 0.00 1.95 2.01 0.00 3.15 0.00 0.00 3.29 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.64 0.00 36 F 8.04 4.68 0.00 2.88 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 37 F 8.54 4.98 0.00 3.28 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 38 G 8.18 4.09 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 0.00 0.00 0.00 39 L 7.64 4.76 0.00 1.69 1.54 0.78 1.05 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 40 C 8.19 4.88 0.00 3.20 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 41 R 8.30 3.81 0.00 2.17 2.59 0.00 2.84 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 1.69 1.78 0.00 42 I 7.62 3.61 1.87 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 1.65 0.56 0.90 0.00 0.00 43 C 7.99 4.01 0.00 3.06 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 44 L 7.93 3.54 0.00 1.31 1.53 0.43 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.29 3.69 0.00 1.66 1.98 0.00 3.18 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.56 0.00 46 E 8.28 3.94 0.00 2.13 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 2.33 2.59 0.00 47 L 8.28 3.94 0.00 1.57 1.66 0.87 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.95 3.90 1.18 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 0.00 0.00 0.00 0.00 0.00 49 H 8.18 4.30 0.00 3.39 3.33 0.00 5.67 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.74 4.12 0.00 1.90 1.87 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.60 7.81 51 G 8.07 3.94 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 0.00 52 Q 8.07 3.84 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.98 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 53 L 7.10 4.47 0.00 1.63 1.71 0.15 0.89 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 54 P 0.00 4.16 0.00 2.27 2.26 0.00 3.91 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.06 0.00 55 G 9.02 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 0.00 0.00 0.00 0.00 56 V 8.21 3.71 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 0.78 0.00 0.00 1.31 0.00 0.00 57 R 8.20 4.59 0.00 1.76 1.74 0.00 3.35 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 58 K 8.83 3.67 0.00 1.79 1.81 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.43 7.81 59 A 8.44 4.45 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.27 4.32 0.00 3.72 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 61 W 7.82 4.27 0.00 3.39 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00