NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 S 4.4695 8.3344 116.8060 58.4859 63.5996 172.8790 8 D 4.7058 8.3685 125.6661 51.8906 42.9208 173.9019 9 F 5.2527 7.9540 116.0670 55.4236 41.7434 173.0209 10 V 4.4862 9.0083 119.8716 61.1347 34.5031 174.2673 11 V 4.5072 8.9268 127.8663 61.6832 33.3805 174.4408 12 I 4.8896 8.9416 128.9594 59.4720 40.3585 174.2790 13 K 5.0110 9.2555 129.6743 54.2048 34.2624 175.1892 14 A 4.3592 8.8300 130.7064 52.5229 18.7873 177.5191 15 L 4.7318 8.6382 122.4287 55.0715 42.9279 175.8385 16 E 4.8116 7.7788 115.2762 54.4733 33.2281 174.6835 17 D 4.5688 8.6742 119.3079 55.2104 41.5407 176.6961 18 G 3.8344 8.7335 109.2121 46.2910 0.0000 173.7171 19 V 3.9262 8.0154 120.4244 62.6421 32.8526 174.4468 20 N 5.3912 9.3109 125.2341 51.4331 41.6084 173.7146 21 V 4.6522 8.6960 123.8234 61.4477 33.7034 174.0964 22 I 4.6015 8.9860 130.1267 59.4612 39.6341 175.0131 23 G 4.3927 9.4062 115.2713 44.8301 0.0000 172.6694 24 L 5.7418 9.6675 126.3336 52.9256 43.8282 176.0980 25 T 4.7321 8.3765 112.5301 61.2619 70.4740 173.7534 26 R 4.5344 7.9775 126.6084 55.2641 29.3966 176.1300 27 G 4.2252 8.9994 111.5466 42.7708 0.0000 173.6108 28 A 4.2434 8.3479 122.7734 54.3404 18.3808 177.6601 29 D 5.0398 7.3212 112.5191 52.7074 43.6978 175.6159 30 T 4.7900 8.5308 117.6004 60.6872 71.3913 173.4529 31 R 4.4757 8.3696 121.6760 53.9414 33.7990 174.7374 32 F 5.1093 8.3469 119.0631 57.8142 38.2876 175.0496 33 H 4.6933 9.0410 120.6788 57.0719 29.5285 175.3174 34 H 4.8915 7.6685 119.0782 54.9144 33.2632 171.9039 35 S 4.9244 8.6981 119.8153 56.4555 64.6204 172.4443 36 E 4.7283 9.3988 128.8251 54.4975 31.8419 174.2876 37 K 4.9856 8.4991 124.1034 55.1228 35.0198 175.3307 38 L 4.8676 9.0747 123.6344 53.1332 44.7662 175.3965 39 D 4.9225 10.6100 124.9182 52.8756 42.8669 176.0927 40 K 4.3056 8.7596 122.3567 57.7374 32.1185 176.5444 41 G 3.9643 9.3311 115.8292 45.0042 0.0000 172.7187 42 E 4.3980 8.0549 120.1591 55.5813 31.0646 175.5259 43 V 4.8839 8.3156 123.2346 61.0568 33.9268 174.3699 44 L 4.7390 9.1513 129.2948 53.3180 45.0065 174.8004 45 I 4.8998 8.5027 126.8090 59.6822 38.9264 174.8234 46 A 4.7018 8.9060 129.2208 50.1162 21.7515 174.9151 47 Q 4.7951 8.6793 121.5345 54.9004 30.3969 175.8200 48 F 4.8725 8.5059 122.3362 57.8881 39.5636 174.9346 49 T 4.7900 9.2394 112.9679 59.2752 72.0212 174.0596 50 E 3.8794 9.0079 121.2847 59.5776 29.4427 177.3802 51 H 4.6474 8.1632 113.6278 56.3863 29.9603 174.2534 52 T 5.2958 7.7939 116.9024 61.7771 71.1982 174.4543 53 S 4.5895 9.0581 118.8475 57.7149 65.1352 173.4665 54 A 4.9357 7.9441 122.7295 50.9777 22.4390 174.9301 55 I 4.9115 8.9904 123.4115 59.3961 39.6820 174.9449 56 K 4.5843 9.2771 128.2349 54.5197 34.8292 174.5832 57 V 4.7479 8.4828 127.1327 61.3165 33.3686 174.5625 58 R 4.5194 9.4486 127.7348 55.5378 32.4998 177.0387 59 G 4.1438 9.0360 108.7238 44.8652 0.0000 172.9471 60 K 4.0054 8.6391 119.2803 57.1306 32.8446 175.9842 61 A 5.0353 8.4167 124.9458 51.0306 22.5695 174.2712 62 Y 4.5403 9.3854 121.9222 56.4226 40.8496 174.4664 63 I 4.9899 7.7358 126.4789 59.4988 41.0415 174.1228 64 Q 4.8930 9.0350 126.1875 54.2408 31.4896 174.9194 65 T 4.6938 8.0942 112.9218 59.3900 71.8610 174.0721 66 R 3.9044 8.4629 120.9200 59.7797 30.0975 177.3742 67 H 4.3492 7.9251 113.7450 57.7803 29.4423 174.7673 68 G 3.6777 6.7662 105.0974 44.1647 0.0000 174.0340 69 V 4.5631 7.9770 119.5141 62.2318 31.5702 176.4290 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 7 S 8.33 4.47 0.00 3.96 4.01 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 0.00 0.00 0.00 8 D 8.37 4.71 0.00 2.85 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 F 7.95 5.25 0.00 3.04 2.91 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 10 V 9.01 4.49 1.91 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 0.99 0.00 0.00 0.65 0.00 0.00 11 V 8.93 4.51 2.17 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 1.10 0.00 0.00 1.13 0.00 0.00 12 I 8.94 4.89 1.87 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.35 0.92 0.00 0.00 13 K 9.26 5.01 0.00 1.90 1.81 0.00 1.50 0.00 0.00 1.58 0.00 0.00 2.83 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.35 1.37 7.81 14 A 8.83 4.36 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 15 L 8.64 4.73 0.00 1.72 1.74 1.02 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 16 E 7.78 4.81 0.00 1.90 1.89 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 2.34 2.32 0.00 17 D 8.67 4.57 0.00 2.69 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 18 G 8.73 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 V 8.02 3.93 2.20 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 0.87 0.00 0.00 1.00 0.00 0.00 20 N 9.31 5.39 0.00 2.62 2.57 0.00 0.00 6.21 7.54 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 21 V 8.70 4.65 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 0.93 0.00 0.00 0.90 0.00 0.00 22 I 8.99 4.60 1.55 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.09 0.34 0.00 0.00 23 G 9.41 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 0.00 0.00 0.00 0.00 24 L 9.67 5.74 0.00 1.87 1.66 1.29 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.38 4.73 4.26 0.00 0.00 0.00 0.00 0.00 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 26 R 7.98 4.53 0.00 1.85 1.97 0.00 3.26 0.00 0.00 3.05 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.40 0.00 27 G 9.00 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 0.00 0.00 0.00 0.00 28 A 8.35 4.24 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 29 D 7.32 5.04 0.00 2.64 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.53 4.79 4.16 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 0.00 0.00 0.00 1.23 0.00 0.00 31 R 8.37 4.48 0.00 1.78 1.91 0.00 2.97 0.00 0.00 3.33 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 0.00 32 F 8.35 5.11 0.00 3.01 2.95 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 0.00 0.00 0.00 33 H 9.04 4.69 0.00 3.30 3.50 0.00 5.78 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 7.67 4.89 0.00 3.17 2.96 0.00 5.80 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.70 4.92 0.00 3.74 3.62 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.40 4.73 0.00 1.96 1.70 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 2.22 2.27 0.00 37 K 8.50 4.99 0.00 1.73 1.74 0.00 1.45 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.30 1.49 7.81 38 L 9.07 4.87 0.00 1.65 1.58 1.04 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 39 D 10.61 4.92 0.00 2.72 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.76 4.31 0.00 1.60 1.83 0.00 1.95 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.44 7.81 41 G 9.33 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 42 E 8.05 4.40 0.00 2.05 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 2.29 2.28 0.00 43 V 8.32 4.88 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 0.84 0.00 0.00 0.93 0.00 0.00 44 L 9.15 4.74 0.00 1.70 1.45 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 45 I 8.50 4.90 1.77 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.61 0.70 0.00 0.00 46 A 8.91 4.70 1.13 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 0.00 0.00 47 Q 8.68 4.80 0.00 1.99 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.87 0.00 0.00 0.00 0.00 0.00 2.48 2.39 0.00 48 F 8.51 4.87 0.00 3.03 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 T 9.24 4.79 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 1.32 0.00 0.00 50 E 9.01 3.88 0.00 1.93 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 2.22 2.31 0.00 51 H 8.16 4.65 0.00 3.30 3.25 0.00 5.80 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 7.79 5.30 4.44 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 1.46 0.00 0.00 53 S 9.06 4.59 0.00 3.71 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 54 A 7.94 4.94 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 I 8.99 4.91 1.95 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.85 0.90 0.00 0.00 56 K 9.28 4.58 0.00 1.82 1.56 0.00 1.69 0.00 0.00 1.41 0.00 0.00 2.76 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.29 1.38 7.81 57 V 8.48 4.75 2.07 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 0.86 0.00 0.00 0.91 0.00 0.00 58 R 9.45 4.52 0.00 1.66 1.75 0.00 3.05 0.00 0.00 3.05 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.46 0.00 59 G 9.04 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 0.00 0.00 0.00 0.00 60 K 8.64 4.01 0.00 1.85 1.81 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.43 7.81 61 A 8.42 5.04 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 62 Y 9.39 4.54 0.00 3.05 2.95 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 0.00 0.00 0.00 63 I 7.74 4.99 1.74 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.07 0.83 0.00 0.00 64 Q 9.04 4.89 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.56 0.00 0.00 0.00 0.00 0.00 2.17 2.15 0.00 65 T 8.09 4.69 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 1.14 0.00 0.00 66 R 8.46 3.90 0.00 1.68 1.86 0.00 3.23 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 67 H 7.93 4.35 0.00 3.15 3.30 0.00 5.74 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 6.77 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 69 V 7.98 4.56 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 0.81 0.00 0.00 0.81 0.00 0.00