NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 25 A 4.1404 8.2649 123.5831 52.6236 18.8808 177.2350 26 T 3.2930 8.4865 120.4757 62.0955 67.9563 170.2405 27 L 4.2748 8.4794 119.1657 58.3944 42.8309 181.4560 28 K 3.6586 6.5821 115.3998 54.8562 35.0113 174.1092 29 Y 4.8519 7.2893 116.4091 56.4425 42.7163 173.6711 30 I 4.5976 8.0755 118.4976 60.4168 42.0331 173.9375 31 C 4.6398 8.2254 124.7780 58.6419 31.9739 173.4136 32 A 3.6746 9.0416 129.6860 55.9664 17.2669 178.4188 33 E 3.9199 8.4842 114.2507 58.6056 30.0573 177.3114 34 C 4.3435 7.8497 115.6371 58.4360 30.6327 173.9041 35 S 4.0804 8.4773 112.7859 58.7524 61.2296 168.7062 36 S 4.5143 7.8196 112.7305 55.8376 65.7553 172.6097 37 K 4.1961 8.9267 124.6635 56.6217 32.1770 175.8428 38 L 4.7025 9.0171 131.2170 55.5378 44.9501 174.9685 39 S 5.7290 8.1044 125.2305 59.1740 64.5847 176.0678 40 L 4.4911 7.5679 129.8747 55.3426 46.6343 172.7853 41 S 4.4985 8.7341 120.6273 59.1424 69.4365 176.1468 42 R 4.4473 9.1091 110.5291 55.4289 31.7033 176.5227 43 T 3.4617 8.5447 115.6816 64.5686 66.2632 172.2186 44 D 4.5840 7.9777 120.5473 53.8591 42.6367 175.6537 45 A 3.8827 9.0276 117.1523 51.3646 17.4844 178.6863 46 V 4.4448 7.7933 112.3070 62.4267 32.5996 175.7079 47 R 4.6124 7.6287 122.0469 55.9528 30.1943 175.0186 48 C 4.6909 8.3182 115.9625 58.6111 34.0615 173.5688 49 K 4.5274 8.4677 114.9507 52.7723 32.7076 174.4339 50 D 4.5769 7.9681 117.7277 53.5987 40.4520 175.2853 51 C 4.8527 7.8906 113.2386 57.1273 32.0766 174.0941 52 G 3.9575 8.4324 113.3725 45.8936 0.0000 173.2061 53 H 4.7955 7.9517 117.0212 54.3599 29.9471 176.2223 54 R 4.2697 8.6564 124.3847 56.7306 29.9229 175.3265 55 I 4.6230 7.9161 117.4141 58.9185 40.1204 174.5231 56 L 5.1954 8.6139 126.4053 52.8787 45.0875 176.3108 57 L 4.4486 9.1271 124.2643 53.4435 41.9048 177.7068 58 K 3.4190 8.6627 126.4283 57.3802 32.5650 174.4980 59 A 3.9374 7.4997 123.0998 52.0641 19.1397 177.4105 60 R 4.2741 8.2113 122.1379 55.2619 31.1915 176.3546 61 T 4.1210 8.1357 113.8379 61.6177 69.4268 174.5268 62 K 4.1600 8.4122 121.6290 58.1287 32.6564 178.1544 63 R 3.8603 7.9661 114.8702 56.5975 29.4154 175.5568 64 L 4.5503 8.2550 122.8375 53.6803 43.5796 175.7524 65 V 4.3108 8.1337 116.9556 59.4290 34.5221 174.8935 66 Q 4.6848 8.0484 124.0500 54.2900 31.7536 174.4746 67 F 4.8217 8.1850 119.5498 56.2338 42.9578 174.7199 68 E 4.1761 9.0394 122.8559 56.4278 30.0314 176.0618 69 A 3.7200 8.1788 119.9497 53.6827 15.6814 177.6080 70 R 4.2394 8.0133 123.9499 57.6578 30.9011 176.0482 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 25 A 8.26 4.14 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.49 3.29 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 1.24 0.00 0.00 27 L 8.48 4.27 0.00 1.68 1.71 0.91 0.44 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 28 K 6.58 3.66 0.00 1.88 2.29 0.00 1.96 0.00 0.00 1.91 0.00 0.00 2.89 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.31 1.46 7.81 29 Y 7.29 4.85 0.00 2.87 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 30 I 8.08 4.60 1.90 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 1.25 0.46 0.93 0.00 0.00 31 C 8.23 4.64 0.00 3.06 2.92 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 0.00 0.00 0.00 32 A 9.04 3.67 1.37 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 0.00 0.00 0.00 33 E 8.48 3.92 0.00 1.97 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 2.29 2.13 0.00 34 C 7.85 4.34 0.00 3.09 3.06 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 0.00 0.00 0.00 0.00 35 S 8.48 4.08 0.00 4.08 4.11 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 0.00 0.00 0.00 0.00 36 S 7.82 4.51 0.00 3.88 3.92 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 0.00 0.00 0.00 37 K 8.93 4.20 0.00 1.68 1.88 0.00 1.80 0.00 0.00 1.64 0.00 0.00 2.68 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.32 7.81 38 L 9.02 4.70 0.00 1.65 1.61 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 39 S 8.10 5.73 0.00 4.04 3.91 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.57 4.49 0.00 1.53 1.47 0.89 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 41 S 8.73 4.50 0.00 3.96 3.58 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 42 R 9.11 4.45 0.00 1.89 1.94 0.00 3.23 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.67 0.00 43 T 8.54 3.46 4.23 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 1.20 0.00 0.00 44 D 7.98 4.58 0.00 2.52 2.65 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 0.00 0.00 0.00 0.00 45 A 9.03 3.88 1.38 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 0.00 0.00 46 V 7.79 4.44 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 0.68 0.00 0.00 0.91 0.00 0.00 47 R 7.63 4.61 0.00 1.75 1.21 0.00 3.26 0.00 0.00 3.27 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.59 0.00 48 C 8.32 4.69 0.00 2.92 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 K 8.47 4.53 0.00 1.73 1.67 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.73 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.42 7.81 50 D 7.97 4.58 0.00 2.69 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 51 C 7.89 4.85 0.00 3.07 2.86 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 52 G 8.43 3.96 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 0.00 0.00 0.00 53 H 7.95 4.80 0.00 3.20 3.23 0.00 5.62 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 R 8.66 4.27 0.00 1.80 1.92 0.00 3.18 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.77 0.00 55 I 7.92 4.62 1.87 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 1.22 0.94 0.92 0.00 0.00 56 L 8.61 5.20 0.00 1.54 1.66 0.88 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 57 L 9.13 4.45 0.00 1.57 1.63 0.93 0.72 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 58 K 8.66 3.42 0.00 1.61 1.74 0.00 1.72 0.00 0.00 1.56 0.00 0.00 2.96 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.84 1.18 7.81 59 A 7.50 3.94 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 60 R 8.21 4.27 0.00 1.77 1.82 0.00 3.26 0.00 0.00 3.30 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 61 T 8.14 4.12 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 1.19 0.00 0.00 62 K 8.41 4.16 0.00 1.76 1.90 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.41 7.81 63 R 7.97 3.86 0.00 1.89 1.96 0.00 3.00 0.00 0.00 3.13 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 64 L 8.25 4.55 0.00 1.61 1.58 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 65 V 8.13 4.31 1.81 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 0.63 0.00 0.00 0.99 0.00 0.00 66 Q 8.05 4.68 0.00 1.89 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.69 0.00 0.00 0.00 0.00 0.00 2.15 2.31 0.00 67 F 8.18 4.82 0.00 3.04 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 68 E 9.04 4.18 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 2.30 2.37 0.00 69 A 8.18 3.72 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 70 R 8.01 4.24 0.00 1.79 1.80 0.00 3.26 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.77 0.00