NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.3459 8.1744 110.9439 61.2944 70.5794 173.4959 6 N 4.7498 7.8880 120.1165 53.3916 39.2470 173.3394 7 S 4.6113 8.0997 112.3862 57.5980 65.4681 173.6431 8 D 4.7691 8.6954 121.4023 54.9328 42.4364 174.4119 9 F 5.3552 7.7710 115.2901 55.7467 41.3342 173.6980 10 V 4.5966 9.0008 112.1432 59.5523 35.5978 174.8861 11 V 4.8392 8.8126 124.3383 61.3289 33.7850 174.4048 12 I 5.0313 8.6884 128.1694 59.4171 40.6715 174.1053 13 K 5.0209 9.4293 129.0547 54.2930 34.5045 175.0018 14 A 4.4294 8.7013 130.3413 52.1638 19.1415 177.4200 15 L 4.6665 8.8286 122.4954 54.4933 42.4575 176.1584 16 E 4.6750 7.6221 115.1396 55.1599 31.8868 174.7125 17 D 4.5355 8.5111 119.8208 55.2531 41.4662 175.9171 18 G 3.8558 7.7362 104.3285 46.7701 0.0000 174.4065 19 V 4.0359 7.8310 119.0888 62.3335 33.3285 174.3640 20 N 5.3305 8.9761 124.2043 51.5586 41.2390 173.6107 21 V 4.4704 8.5990 124.9980 61.4263 33.3618 174.3960 22 I 4.6071 9.0465 129.9853 59.3312 40.0679 174.8871 23 G 4.1548 8.6372 114.5066 44.7166 0.0000 172.7787 24 L 5.2638 9.0035 127.4324 53.7856 43.5916 176.6327 25 T 4.4820 8.8401 114.0443 61.5218 69.5055 174.3962 26 R 3.9675 8.7881 126.9724 56.5319 30.4431 176.5739 27 G 3.9058 8.7832 111.0901 43.7182 0.0000 173.4736 28 A 4.1350 8.3570 122.3250 54.2963 18.5469 177.4077 29 D 4.7803 7.3912 116.2339 53.3022 42.2117 177.0025 30 T 4.4497 8.3081 124.6276 61.6014 67.6325 173.0288 31 R 4.7701 8.9781 123.1772 53.8190 33.5673 174.8741 32 F 5.4773 8.6208 117.5844 57.5258 39.4041 175.8087 33 H 5.0662 8.9774 116.4460 55.6626 30.3839 173.1282 34 H 4.8422 7.6344 117.5911 55.0462 33.2492 172.1081 35 S 4.8837 8.2521 119.4651 56.4316 65.2595 172.5891 36 E 4.4474 8.7013 126.2186 54.6775 31.2079 174.5163 37 K 4.9637 8.5928 126.2839 54.9456 33.8823 175.5515 38 L 4.8962 8.9398 125.5999 53.0883 44.5049 176.3407 39 D 5.0160 8.9417 123.3697 52.6188 43.1439 175.8643 40 K 3.9397 9.4765 122.4760 58.4098 32.1936 177.1623 41 G 3.9838 9.2306 115.0635 45.2395 0.0000 173.2558 42 E 4.2434 8.0036 119.9574 56.1471 30.9182 175.8888 43 V 4.8091 8.3069 122.4867 61.0689 33.9494 174.1736 44 L 4.6834 8.9781 130.4048 53.3055 44.4363 174.8179 45 I 4.9734 8.4440 126.6721 59.6493 39.0074 174.7015 46 A 4.7352 8.7167 129.0500 50.1044 22.0200 175.3666 47 Q 4.9196 8.5756 120.3392 54.8446 30.6134 175.6357 48 F 4.6707 8.4851 119.9551 58.0604 39.9921 175.2425 49 T 4.5958 8.6415 110.6200 60.6802 71.6889 173.0162 50 E 4.0470 8.9593 121.4982 59.5608 29.7075 177.4524 51 H 4.4696 8.2398 114.4993 56.7403 29.8433 174.3643 52 T 5.5106 8.3752 116.7436 60.9642 70.5703 174.7574 53 S 5.1189 8.9307 119.6311 57.9392 64.4287 173.6695 54 A 4.9990 7.8681 120.7563 51.3909 22.3923 175.3654 55 I 5.0283 8.5912 121.2661 59.2985 40.6334 174.7386 56 K 4.5580 8.9962 127.9113 54.4918 34.8614 174.6450 57 V 4.7092 8.4123 126.8100 61.3186 33.3871 174.5147 58 R 4.5083 9.0644 127.6647 55.6412 32.3543 177.2204 59 G 4.1423 8.9153 108.7202 44.3161 0.0000 172.5461 60 K 4.8944 8.8097 119.1950 56.2196 32.9551 175.3867 61 A 5.1654 8.9655 128.5906 50.8675 23.6515 173.5399 62 Y 4.9980 9.2379 120.7429 55.9219 41.3526 174.5661 63 I 4.9400 8.0351 126.8557 59.5533 40.8168 174.2852 64 Q 5.0793 9.0459 126.4635 54.3678 31.4908 174.9162 65 T 4.7637 8.7915 112.7820 59.7725 72.5312 174.6264 66 R 3.7308 8.5668 121.2549 59.3469 29.8599 176.4597 67 H 4.7303 9.3744 112.9246 55.4507 29.6426 175.8617 68 G 3.6942 6.6705 107.9291 44.6542 0.0000 172.4249 69 V 4.8248 7.6678 113.7912 59.8676 35.0376 175.1249 70 I 4.4809 8.1313 121.8994 60.1152 41.8732 172.7936 71 E 5.3738 8.7086 126.3302 54.5674 32.0906 175.8692 72 S 4.7100 8.8230 118.5531 57.7850 65.2270 172.9187 73 E 4.9917 8.6623 119.5520 54.6310 33.5508 175.9942 74 G 3.7077 8.4793 109.9808 45.8740 0.0000 172.4896 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 5 T 8.17 4.35 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 1.22 0.00 0.00 6 N 7.89 4.75 0.00 2.80 2.86 0.00 0.00 7.15 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 7 S 8.10 4.61 0.00 4.03 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 8 D 8.70 4.77 0.00 2.80 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 9 F 7.77 5.36 0.00 3.03 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 10 V 9.00 4.60 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.84 0.00 0.00 11 V 8.81 4.84 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.19 0.00 0.00 12 I 8.69 5.03 1.86 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 1.08 0.68 0.91 0.00 0.00 13 K 9.43 5.02 0.00 1.90 1.84 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.40 7.81 14 A 8.70 4.43 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 8.83 4.67 0.00 1.69 1.72 0.98 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 16 E 7.62 4.67 0.00 2.03 1.88 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 2.17 2.30 0.00 17 D 8.51 4.54 0.00 2.69 2.64 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 18 G 7.74 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 0.00 0.00 0.00 19 V 7.83 4.04 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 0.91 0.00 0.00 1.02 0.00 0.00 20 N 8.98 5.33 0.00 2.60 2.59 0.00 0.00 6.52 7.36 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 21 V 8.60 4.47 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 0.88 0.00 0.00 0.89 0.00 0.00 22 I 9.05 4.61 1.50 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.41 -0.34 0.00 0.00 23 G 8.64 4.15 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 0.00 0.00 0.00 24 L 9.00 5.26 0.00 1.88 1.71 0.91 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.84 4.48 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 1.37 0.00 0.00 26 R 8.79 3.97 0.00 1.85 1.97 0.00 3.38 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 27 G 8.78 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 0.00 0.00 0.00 28 A 8.36 4.14 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 29 D 7.39 4.78 0.00 2.83 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 8.31 4.45 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 31 R 8.98 4.77 0.00 1.79 2.03 0.00 2.78 0.00 0.00 3.37 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 32 F 8.62 5.48 0.00 2.84 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 33 H 8.98 5.07 0.00 3.14 3.46 0.00 5.79 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 7.63 4.84 0.00 3.20 2.99 0.00 5.80 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.25 4.88 0.00 3.83 3.55 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 36 E 8.70 4.45 0.00 2.16 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 0.00 2.24 2.31 0.00 37 K 8.59 4.96 0.00 1.65 1.71 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.33 1.40 7.81 38 L 8.94 4.90 0.00 1.52 1.54 0.91 0.88 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 39 D 8.94 5.02 0.00 2.61 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 9.48 3.94 0.00 1.67 1.81 0.00 1.82 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.45 1.40 7.81 41 G 9.23 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.00 4.24 0.00 2.12 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.25 0.00 43 V 8.31 4.81 2.09 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 0.79 0.00 0.00 0.96 0.00 0.00 44 L 8.98 4.68 0.00 1.75 1.47 0.89 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 45 I 8.44 4.97 1.73 0.00 0.00 0.79 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 0.74 0.54 0.00 0.00 46 A 8.72 4.74 1.12 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 0.00 0.00 0.00 0.00 0.00 0.00 47 Q 8.58 4.92 0.00 1.97 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.97 0.00 0.00 0.00 0.00 0.00 2.47 2.42 0.00 48 F 8.49 4.67 0.00 3.04 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.64 4.60 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 1.29 0.00 0.00 50 E 8.96 4.05 0.00 1.96 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 0.00 2.09 2.29 0.00 51 H 8.24 4.47 0.00 3.22 3.14 0.00 5.81 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.38 5.51 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 1.36 0.00 0.00 53 S 8.93 5.12 0.00 3.85 3.98 0.00 0.00 0.00 0.00 0.00 0.00 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 7.87 5.00 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 55 I 8.59 5.03 1.80 0.00 0.00 0.41 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 0.59 0.88 0.00 0.00 56 K 9.00 4.56 0.00 1.77 1.49 0.00 1.63 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.29 1.34 7.81 57 V 8.41 4.71 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 0.89 0.00 0.00 0.89 0.00 0.00 58 R 9.06 4.51 0.00 1.75 1.80 0.00 3.17 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.53 0.00 59 G 8.92 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 8.81 4.89 0.00 1.94 1.74 0.00 1.76 0.00 0.00 1.79 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.45 7.81 61 A 8.97 5.17 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.24 5.00 0.00 2.99 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 8.04 4.94 1.88 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 1.18 0.50 0.83 0.00 0.00 64 Q 9.05 5.08 0.00 1.91 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.59 0.00 0.00 0.00 0.00 0.00 2.17 2.04 0.00 65 T 8.79 4.76 4.15 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 1.16 0.00 0.00 66 R 8.57 3.73 0.00 1.58 1.77 0.00 3.14 0.00 0.00 3.18 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.58 0.00 67 H 9.37 4.73 0.00 3.15 3.27 0.00 5.71 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 6.67 3.69 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 0.00 0.00 0.00 69 V 7.67 4.82 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.97 0.00 0.00 70 I 8.13 4.48 1.83 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 1.21 1.11 0.86 0.00 0.00 71 E 8.71 5.37 0.00 1.91 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.44 0.00 72 S 8.82 4.71 0.00 3.93 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 73 E 8.66 4.99 0.00 1.82 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.30 0.00 74 G 8.48 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00