NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 40 R 4.1338 8.2431 119.7082 56.5303 31.4484 174.3470 41 G 3.6362 8.7085 105.5988 41.9188 0.0000 170.9793 42 P 4.2044 0.0000 0.0000 63.8240 32.7047 174.8213 43 T 3.9572 8.8545 119.6301 67.0368 68.4577 176.1548 44 R 3.8601 8.0599 119.6025 59.2220 30.1601 178.0297 45 F 3.8747 8.3116 119.9727 61.3981 39.4718 176.9938 46 V 3.8242 8.2561 117.9074 66.1217 31.2989 178.0011 47 L 4.1764 8.3274 118.4305 57.7735 41.4551 179.0729 48 A 3.5923 8.9276 121.1520 55.0551 18.1430 179.1688 49 L 3.8911 8.4484 119.0072 58.3820 42.2507 178.8614 50 L 4.0414 8.2226 119.8490 58.2032 41.9295 178.5337 51 A 3.5154 8.2820 120.9494 55.1815 18.2196 179.3680 52 F 3.7189 8.0809 119.0751 61.3681 39.3337 177.2263 53 F 4.0130 8.5506 117.1611 59.5099 38.4163 177.0549 54 R 4.1021 7.1555 117.0170 58.0376 30.3677 178.0201 55 F 4.5811 7.6575 117.2140 60.0643 39.4595 176.1397 56 T 3.8504 7.0446 114.1924 63.3293 69.2166 175.6687 57 A 4.3424 8.2597 130.0043 51.4132 17.1353 176.9476 58 I 4.4216 7.4305 122.1037 58.4774 39.9222 176.3349 59 A 4.1298 8.5250 128.2352 51.1026 18.5803 175.6916 60 P 3.1720 0.0000 0.0000 61.7947 32.2702 177.2627 61 T 3.9840 7.3826 111.3724 61.5438 70.8363 175.5514 62 R 3.8302 8.6503 121.9333 59.8435 29.7164 179.1277 63 A 4.1766 7.9440 119.7016 54.8838 18.3820 179.8210 64 V 3.4515 7.4912 116.4406 66.0013 31.9753 177.7632 65 L 3.9857 7.9891 120.2422 58.4306 41.6910 178.3732 66 D 4.5218 8.3871 117.8748 57.7510 40.9868 178.7320 67 R 4.1320 7.7306 118.4257 58.7117 29.9471 178.0594 68 W 4.3321 8.0327 127.0963 60.2880 30.6803 177.3482 69 R 3.9196 7.5503 114.7048 57.0753 29.8692 177.0270 70 S 4.5038 7.8630 113.9507 58.7217 64.7527 174.9970 71 V 3.4059 7.7168 118.6280 63.0752 31.6046 175.2987 72 N 4.2165 8.8797 124.2563 54.0234 39.5834 175.1114 73 K 3.8487 8.5348 129.2442 59.7344 32.4425 177.4617 74 Q 3.9132 8.0484 118.9389 59.8057 29.0147 178.6012 75 T 3.7991 8.0468 116.1148 66.3125 68.4556 176.5722 76 A 3.9730 8.5600 123.1463 55.3591 18.3275 179.2822 77 M 3.8694 8.1002 116.4690 58.7011 32.2515 177.9475 78 K 3.7305 7.8627 119.7481 60.1158 32.2064 178.2111 79 H 4.0574 7.8865 115.7488 58.9143 28.7177 177.5957 80 L 3.6318 7.5559 120.6349 58.0319 41.3149 179.8229 81 L 4.0521 8.0317 118.7376 57.6370 41.5425 179.3507 82 S 4.2514 7.7065 113.2673 60.7930 62.2025 176.1469 83 F 4.5380 8.2410 120.9111 60.7863 38.8011 177.4754 84 K 3.9774 8.3674 118.0007 59.6166 31.9339 179.2833 85 K 4.0188 7.9346 119.5840 59.4522 32.1819 178.8672 86 E 4.0031 8.3318 118.9465 59.4311 29.4318 179.0451 87 L 4.0836 8.3616 119.4638 57.7901 41.5872 179.8149 88 G 3.6773 7.9623 105.3307 48.3762 0.0000 175.6868 89 T 3.8836 7.8013 118.4511 66.3594 68.1920 176.6331 90 L 4.0793 7.5105 119.4779 57.7578 41.9460 179.3736 91 T 3.9910 7.9802 116.0959 66.6968 68.3877 176.9541 92 S 4.1534 8.3606 115.9450 61.3021 62.4860 176.3454 93 A 3.9725 7.8183 124.0117 55.1740 18.0184 179.1563 94 I 4.0225 7.4123 115.0646 62.6847 37.4094 177.3528 95 N 4.4790 7.6765 117.8278 55.7379 38.8784 174.6339 96 R 4.0943 7.4340 122.2613 56.5990 30.1245 176.1835 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 40 R 8.24 4.13 0.00 1.81 1.94 0.00 3.32 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 41 G 8.71 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.20 0.00 2.47 2.35 0.00 3.63 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.14 0.00 43 T 8.85 3.96 4.37 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 0.00 0.00 0.00 1.27 0.00 0.00 44 R 8.06 3.86 0.00 1.48 1.94 0.00 3.03 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.84 0.00 45 F 8.31 3.87 0.00 3.30 3.07 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 46 V 8.26 3.82 2.36 0.00 0.00 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 1.03 0.00 0.00 47 L 8.33 4.18 0.00 2.15 2.03 1.03 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 48 A 8.93 3.59 1.05 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 49 L 8.45 3.89 0.00 2.22 2.07 1.01 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 50 L 8.22 4.04 0.00 2.08 1.70 0.35 0.99 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 51 A 8.28 3.52 1.02 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 0.00 0.00 52 F 8.08 3.72 0.00 2.86 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 53 F 8.55 4.01 0.00 3.31 3.08 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 54 R 7.16 4.10 0.00 1.80 1.86 0.00 3.04 0.00 0.00 3.06 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 55 F 7.66 4.58 0.00 2.95 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 56 T 7.04 3.85 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 1.02 0.00 0.00 57 A 8.26 4.34 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 58 I 7.43 4.42 2.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.64 1.24 0.00 0.00 59 A 8.52 4.13 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 60 P 0.00 3.17 0.00 1.68 1.21 0.00 3.52 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.85 0.00 61 T 7.38 3.98 4.20 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 1.21 0.00 0.00 62 R 8.65 3.83 0.00 1.85 2.03 0.00 3.11 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 63 A 7.94 4.18 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 64 V 7.49 3.45 1.99 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 1.07 0.00 0.00 0.91 0.00 0.00 65 L 7.99 3.99 0.00 1.83 1.66 0.99 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 66 D 8.39 4.52 0.00 2.90 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 67 R 7.73 4.13 0.00 1.95 2.12 0.00 3.19 0.00 0.00 3.13 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 68 W 8.03 4.33 0.00 3.45 3.38 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 69 R 7.55 3.92 0.00 1.89 1.91 0.00 3.51 0.00 0.00 3.36 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.81 0.00 70 S 7.86 4.50 0.00 3.87 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 71 V 7.72 3.41 1.94 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 0.77 0.00 0.00 0.91 0.00 0.00 72 N 8.88 4.22 0.00 2.79 2.67 0.00 0.00 6.80 6.75 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 73 K 8.53 3.85 0.00 1.79 1.75 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.47 7.81 74 Q 8.05 3.91 0.00 2.16 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.69 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 75 T 8.05 3.80 4.20 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 1.13 0.00 0.00 76 A 8.56 3.97 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 77 M 8.10 3.87 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.58 0.00 78 K 7.86 3.73 0.00 1.79 1.86 0.00 1.56 0.00 0.00 1.34 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.45 7.81 79 H 7.89 4.06 0.00 3.17 2.72 0.00 5.69 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 80 L 7.56 3.63 0.00 1.69 1.78 1.14 0.81 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 81 L 8.03 4.05 0.00 1.93 1.70 0.91 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 82 S 7.71 4.25 0.00 3.86 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 83 F 8.24 4.54 0.00 3.35 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 84 K 8.37 3.98 0.00 2.04 1.94 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.54 1.57 7.81 85 K 7.93 4.02 0.00 1.99 1.85 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.51 7.81 86 E 8.33 4.00 0.00 2.26 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 2.53 2.57 0.00 87 L 8.36 4.08 0.00 1.90 1.71 0.90 1.01 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 88 G 7.96 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 T 7.80 3.88 4.40 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 1.21 0.00 0.00 90 L 7.51 4.08 0.00 1.78 1.69 0.89 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 91 T 7.98 3.99 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 1.19 0.00 0.00 92 S 8.36 4.15 0.00 4.04 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 A 7.82 3.97 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 I 7.41 4.02 1.95 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 1.39 0.70 0.89 0.00 0.00 95 N 7.68 4.48 0.00 2.64 2.91 0.00 0.00 7.16 8.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 R 7.43 4.09 0.00 1.88 1.83 0.00 3.24 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.57 0.00