NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 E 4.0557 8.2876 121.4513 55.5358 31.4664 176.8401 20 I 4.3168 7.5598 107.9531 58.7259 39.0834 173.0675 21 D 4.9507 7.6852 120.0434 52.4159 45.0231 175.8456 22 Y 4.4012 8.1545 122.2373 59.1750 38.8835 177.8939 23 K 3.7281 6.9355 119.1393 58.7510 33.0461 177.3364 24 D 4.6597 7.5280 120.5242 53.0590 39.4029 176.8378 25 I 3.7404 7.6736 114.9850 65.1022 37.8749 176.7865 26 A 3.9932 8.1222 122.0008 54.6408 18.1363 179.0153 27 T 3.9488 8.8879 112.2688 66.8293 69.0068 176.8645 28 L 4.3974 7.9893 120.0012 57.5832 41.4021 179.1722 29 K 4.2433 8.0459 118.5186 58.5997 32.1392 177.6027 30 N 4.4882 7.9193 114.9962 54.4007 39.1280 174.8863 31 Y 4.8238 8.2491 119.2951 57.0746 38.7672 175.2974 32 I 4.9548 7.4533 118.9872 60.0408 41.5500 175.5099 33 T 4.3823 8.4190 115.1727 60.7488 69.8696 175.2338 34 E 4.5069 8.4940 118.3533 57.0615 28.5711 177.9042 35 S 4.5834 8.8924 112.8252 57.8264 65.2201 174.8275 36 G 4.3443 8.9381 112.3253 46.6365 0.0000 174.7016 37 K 3.9426 7.9007 119.5666 56.5078 32.8399 176.2296 38 I 4.3972 8.0917 115.1802 61.0936 38.5986 175.5135 39 V 4.1183 8.0177 116.9918 60.0395 32.0438 174.8090 40 P 4.4193 0.0000 0.0000 62.8529 32.3145 177.3423 41 S 4.4241 8.9926 114.8852 60.3676 62.7106 176.5256 42 R 4.0151 8.0216 115.9380 58.6160 29.4150 176.9486 43 I 4.4272 7.1704 118.1617 61.0913 37.1580 176.3914 44 T 4.5926 7.5644 108.5662 60.3155 71.5106 176.3615 45 G 4.0689 8.0172 111.3348 46.6288 0.0000 174.1070 46 T 3.8177 8.0484 112.9073 61.9095 68.0426 174.0192 47 R 3.9372 8.6116 126.7706 56.0902 31.9109 177.5137 48 A 3.9475 8.5798 124.6428 55.2777 18.3561 179.6918 49 K 3.7226 7.9813 117.4578 60.2628 32.0818 178.2852 50 Y 4.4329 7.6110 115.9922 61.0854 37.9791 177.4093 51 Q 3.9467 8.6494 120.9058 59.5143 29.1274 179.1834 52 R 3.8643 8.1291 118.5927 59.4818 29.9608 178.8386 53 Q 3.9835 7.7239 117.7795 58.9560 29.0214 178.2851 54 L 4.1063 8.6637 122.9386 57.6031 42.1611 178.5149 55 A 3.9603 7.9718 120.6357 55.3127 18.1802 179.6432 56 R 3.7398 7.8284 115.6746 59.5819 30.2332 179.0090 57 A 4.0401 7.6246 120.0048 55.2490 18.2189 179.6525 58 I 3.5904 7.4759 117.6927 64.4983 37.0089 178.3904 59 K 3.5061 7.7527 118.2759 59.5598 32.3678 178.9364 60 R 3.3889 7.5230 115.6446 59.4250 29.0449 178.6288 61 A 4.0326 7.9635 121.1620 54.8005 18.1636 179.7552 62 R 4.2221 7.8089 117.3297 58.4275 30.1064 177.9084 63 Y 4.8052 7.5509 114.3189 58.7911 37.0271 176.5048 64 L 4.5270 7.9110 119.5126 53.5750 41.7983 176.7033 65 S 4.0350 7.9706 111.6627 59.4345 60.5740 171.7667 66 L 4.5696 7.3914 115.9205 54.4734 41.9017 176.6632 67 L 4.6843 7.3537 118.2005 52.6118 45.6864 172.6578 68 P 4.8399 0.0000 0.0000 62.1082 32.2632 175.5325 69 Y 4.1713 9.3001 120.8777 60.8951 37.9266 176.1703 70 T 4.8928 7.3437 104.0407 59.5071 72.0364 173.1350 71 D 4.6236 8.5572 119.4509 55.3216 41.2704 177.8746 72 R 4.0819 7.6425 119.7399 58.5864 30.6128 175.5436 73 H 4.3506 7.9989 121.7680 56.9559 30.0050 173.3400 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 19 E 8.29 4.06 0.00 1.89 1.86 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 2.00 1.94 0.00 20 I 7.56 4.32 1.79 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.88 0.73 0.00 0.00 21 D 7.69 4.95 0.00 2.51 2.42 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 0.00 22 Y 8.15 4.40 0.00 3.28 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 23 K 6.94 3.73 0.00 1.54 1.73 0.00 1.69 0.00 0.00 1.33 0.00 0.00 2.70 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.06 0.21 7.81 24 D 7.53 4.66 0.00 2.72 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 25 I 7.67 3.74 1.89 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 1.57 0.71 1.04 0.00 0.00 26 A 8.12 3.99 1.30 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 0.00 0.00 27 T 8.89 3.95 4.33 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 1.40 0.00 0.00 28 L 7.99 4.40 0.00 1.79 1.81 1.03 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 29 K 8.05 4.24 0.00 2.05 1.87 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.45 1.50 7.81 30 N 7.92 4.49 0.00 2.05 2.41 0.00 0.00 6.83 6.88 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 31 Y 8.25 4.82 0.00 3.10 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 32 I 7.45 4.95 1.90 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.70 1.00 0.00 0.00 33 T 8.42 4.38 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 1.27 0.00 0.00 34 E 8.49 4.51 0.00 1.97 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 2.31 2.39 0.00 35 S 8.89 4.58 0.00 3.79 3.82 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 36 G 8.94 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 0.00 0.00 0.00 0.00 37 K 7.90 3.94 0.00 1.97 2.00 0.00 1.53 0.00 0.00 1.89 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.52 1.47 7.81 38 I 8.09 4.40 1.99 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 1.37 0.87 0.91 0.00 0.00 39 V 8.02 4.12 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 1.03 0.00 0.00 40 P 0.00 4.42 0.00 2.09 2.00 0.00 3.61 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 41 S 8.99 4.42 0.00 3.95 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 42 R 8.02 4.02 0.00 1.97 2.06 0.00 3.08 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 43 I 7.17 4.43 1.89 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 1.37 0.60 0.92 0.00 0.00 44 T 7.56 4.59 4.38 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 1.29 0.00 0.00 45 G 8.02 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 T 8.05 3.82 4.39 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 1.31 0.00 0.00 47 R 8.61 3.94 0.00 1.35 1.53 0.00 3.04 0.00 0.00 2.88 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 48 A 8.58 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 49 K 7.98 3.72 0.00 1.68 1.47 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.60 1.57 7.81 50 Y 7.61 4.43 0.00 3.13 2.81 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 51 Q 8.65 3.95 0.00 2.20 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 52 R 8.13 3.86 0.00 2.05 1.95 0.00 3.18 0.00 0.00 3.08 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 53 Q 7.72 3.98 0.00 2.19 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 54 L 8.66 4.11 0.00 1.58 1.74 -0.62 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 55 A 7.97 3.96 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 56 R 7.83 3.74 0.00 2.13 1.95 0.00 3.11 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 57 A 7.62 4.04 1.40 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 58 I 7.48 3.59 2.00 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 1.53 0.78 0.86 0.00 0.00 59 K 7.75 3.51 0.00 1.40 1.45 0.00 1.63 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.57 7.81 60 R 7.52 3.39 0.00 1.66 1.90 0.00 2.79 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 1.63 1.50 0.00 61 A 7.96 4.03 1.54 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 0.00 0.00 0.00 0.00 0.00 0.00 62 R 7.81 4.22 0.00 1.60 1.51 0.00 2.61 0.00 0.00 2.63 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.50 0.00 63 Y 7.55 4.81 0.00 3.02 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 64 L 7.91 4.53 0.00 1.91 1.75 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 65 S 7.97 4.03 0.00 4.06 3.99 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 66 L 7.39 4.57 0.00 1.78 1.75 1.07 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.35 4.68 0.00 1.67 1.52 0.94 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 68 P 0.00 4.84 0.00 2.53 2.12 0.00 3.83 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 2.02 2.03 0.00 69 Y 9.30 4.17 0.00 3.06 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 70 T 7.34 4.89 4.30 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 1.32 0.00 0.00 71 D 8.56 4.62 0.00 2.72 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 72 R 7.64 4.08 0.00 1.75 1.97 0.00 3.32 0.00 0.00 3.14 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.55 0.00 73 H 8.00 4.35 0.00 3.14 3.00 0.00 5.77 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00