NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.4895 8.1593 117.3247 62.8323 70.0459 173.3444 2 P 4.4330 0.0000 0.0000 61.8658 33.1222 173.7741 3 D 4.5104 8.7381 120.5456 54.8985 41.5199 176.5064 4 C 4.8038 8.7861 118.5041 57.2706 47.1233 174.1001 5 V 4.6309 7.1252 111.1648 59.7856 35.4427 174.6077 6 T 5.0301 8.9605 118.7054 60.9366 72.0116 174.9103 7 G 3.8638 7.4968 110.1392 46.3060 0.0000 171.3872 8 K 4.7119 8.0784 118.8014 54.5751 33.7267 176.6859 9 V 3.6183 8.1262 121.9344 62.7953 31.2476 175.4924 10 E 4.2738 9.1551 130.0670 58.9128 29.6440 176.2856 11 Y 5.1028 7.1780 115.9172 55.9168 41.3886 172.8895 12 T 4.9360 8.6441 110.5572 59.8124 71.8773 172.9666 13 K 4.4453 8.6038 125.1315 54.7858 35.7440 174.0330 14 Y 4.6386 8.5980 128.7306 56.2908 39.5397 174.8939 15 N 4.7098 8.4658 124.9107 52.1824 39.9152 175.9239 16 D 4.3852 8.7728 119.8849 57.6844 41.1421 177.2057 17 D 4.5711 7.9138 114.5369 53.4829 39.8445 175.2710 18 D 3.8799 8.1415 119.1665 56.0139 38.2600 173.6458 19 T 4.6927 7.5070 107.1684 59.7790 72.6325 172.5096 20 F 5.2859 9.3349 124.6469 56.7809 42.3508 173.8479 21 T 5.2313 8.5716 122.7181 61.8712 71.1597 173.5464 22 V 4.6354 9.3465 125.4408 60.8445 35.4878 174.3731 23 K 4.5522 8.3378 127.2228 53.6938 34.0604 174.9099 24 V 4.4277 8.3186 128.0427 61.9585 32.8152 175.2998 25 G 3.9931 9.0389 118.5028 45.9298 0.0000 172.8829 26 D 4.8049 8.6209 124.1757 52.6596 39.4914 175.9207 27 K 4.6307 7.5970 119.1395 54.8879 35.8110 174.9041 28 E 4.6701 8.7104 123.3278 54.7703 31.6355 174.6274 29 L 5.5089 8.6606 127.0608 53.0314 45.3677 175.2796 30 F 5.6483 9.0071 114.1805 56.0795 42.0605 173.2872 31 T 4.1420 8.9712 113.2082 60.0530 70.8641 173.5127 32 N 5.0131 8.4149 122.9570 52.5855 37.4357 174.3137 33 R 4.4558 7.5187 119.1676 55.2792 30.4085 177.6013 34 W 4.3098 9.0967 123.5817 58.8440 28.9360 177.6442 35 N 4.6057 8.1848 116.1270 55.6755 38.2221 176.8515 36 L 4.2240 7.7708 119.0020 56.9738 41.5984 178.5754 37 Q 2.5820 7.9665 118.0714 59.2775 28.5768 179.3040 38 S 4.2674 7.7193 113.9944 60.8513 63.5228 176.2420 39 L 3.9088 7.4094 123.2519 57.4090 41.2554 179.0359 40 L 4.4382 8.5969 119.0824 56.9453 41.4726 178.8941 41 L 4.1944 7.7808 120.3721 57.8521 41.9968 178.8199 42 S 4.2100 8.2078 115.0708 61.6654 62.7942 176.4375 43 A 4.0420 7.8604 122.9754 55.2749 18.3612 179.1263 44 Q 3.9500 8.1864 117.6081 59.6845 28.8859 179.0329 45 I 3.7897 8.7616 120.3793 64.1579 37.2632 177.5801 46 T 4.4112 8.0267 107.5007 60.5420 69.4351 174.5353 47 G 3.8407 7.8217 108.9715 47.2408 0.0000 174.0013 48 M 4.4817 7.9266 118.2095 54.9984 33.7262 176.4729 49 T 4.7867 8.1276 115.4761 62.2787 70.9046 174.5671 50 V 4.6371 8.9979 119.3973 59.7802 35.4065 174.6001 51 T 4.8411 8.2514 121.5937 62.1934 70.7064 173.6145 52 I 4.3868 8.2430 127.1994 59.4819 39.4746 174.6468 53 K 4.9437 8.2625 126.7527 55.1266 33.3963 175.6353 54 T 4.4743 8.7326 118.6273 61.6324 70.2045 172.9127 55 N 4.5264 8.8673 122.5057 54.8662 40.1889 176.2783 56 A 4.3709 7.5781 123.1476 51.2463 17.6199 178.7761 57 C 4.7566 7.5527 124.0589 53.3922 41.0619 171.6065 58 H 4.4764 7.3953 116.8571 54.1065 30.4519 173.5257 59 N 4.4605 9.0004 118.3520 57.5758 38.0565 175.1041 60 G 4.1699 9.0014 112.5832 44.9692 0.0000 173.4430 61 G 4.3121 9.3305 107.3243 46.0381 0.0000 173.0943 62 G 3.8296 8.5357 108.3343 44.0081 0.0000 172.4900 63 F 5.0828 8.3370 116.1190 55.0730 40.5589 174.9087 64 S 4.4929 8.9283 114.0554 58.5369 65.6159 174.4175 65 E 4.7955 8.1340 117.9369 54.3625 31.8823 175.4490 66 V 4.7353 8.5200 122.9625 60.9332 35.2022 174.1745 67 I 4.4496 8.6188 125.9119 59.5129 39.9091 174.8243 68 F 4.5836 8.9289 125.3270 55.8528 40.2410 175.7553 69 R 4.3467 8.8375 120.7145 56.1075 29.6325 176.2644 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 1 T 8.16 4.49 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 1.25 0.00 0.00 2 P 0.00 4.43 0.00 2.18 2.16 0.00 3.69 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.06 0.00 3 D 8.74 4.51 0.00 2.54 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 4 C 8.79 4.80 0.00 2.88 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 5 V 7.13 4.63 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 0.80 0.00 0.00 0.86 0.00 0.00 6 T 8.96 5.03 4.19 0.00 0.00 0.00 0.00 0.00 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 7 G 7.50 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 8 K 8.08 4.71 0.00 1.74 1.73 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.54 1.40 7.81 9 V 8.13 3.62 2.10 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 0.74 0.00 0.00 0.93 0.00 0.00 10 E 9.16 4.27 0.00 2.00 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 2.39 2.27 0.00 11 Y 7.18 5.10 0.00 3.09 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 12 T 8.64 4.94 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 1.50 0.00 0.00 13 K 8.60 4.45 0.00 1.85 1.59 0.00 1.83 0.00 0.00 1.54 0.00 0.00 2.92 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.30 1.32 7.81 14 Y 8.60 4.64 0.00 3.24 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 15 N 8.47 4.71 0.00 2.76 2.65 0.00 0.00 6.22 7.70 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 16 D 8.77 4.39 0.00 2.62 2.71 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 17 D 7.91 4.57 0.00 2.82 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.14 3.88 0.00 2.78 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 0.00 0.00 0.00 0.00 19 T 7.51 4.69 4.58 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 1.39 0.00 0.00 20 F 9.33 5.29 0.00 2.86 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 21 T 8.57 5.23 4.22 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 1.29 0.00 0.00 22 V 9.35 4.64 2.11 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 0.76 0.00 0.00 1.05 0.00 0.00 23 K 8.34 4.55 0.00 0.79 0.93 0.00 1.76 0.00 0.00 1.92 0.00 0.00 2.89 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.27 1.24 7.81 24 V 8.32 4.43 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 0.74 0.00 0.00 0.74 0.00 0.00 25 G 9.04 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 0.00 0.00 0.00 26 D 8.62 4.80 0.00 2.77 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.60 4.63 0.00 1.61 1.70 0.00 1.61 0.00 0.00 1.75 0.00 0.00 2.78 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.40 1.30 7.81 28 E 8.71 4.67 0.00 2.04 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 2.30 2.33 0.00 29 L 8.66 5.51 0.00 1.61 1.89 0.82 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 30 F 9.01 5.65 0.00 3.26 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 31 T 8.97 4.14 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 1.08 0.00 0.00 32 N 8.41 5.01 0.00 2.98 2.96 0.00 0.00 6.08 7.66 0.00 0.00 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 R 7.52 4.46 0.00 1.87 1.94 0.00 3.29 0.00 0.00 3.13 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 34 W 9.10 4.31 0.00 3.19 3.26 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 35 N 8.18 4.61 0.00 2.78 2.89 0.00 0.00 7.16 6.74 0.00 0.00 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 L 7.77 4.22 0.00 1.76 1.88 1.08 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 37 Q 7.97 2.58 0.00 1.86 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.89 0.00 0.00 0.00 0.00 0.00 1.75 2.32 0.00 38 S 7.72 4.27 0.00 4.02 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 39 L 7.41 3.91 0.00 2.09 1.50 0.91 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 40 L 8.60 4.44 0.00 2.05 2.02 1.32 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 41 L 7.78 4.19 0.00 1.89 1.72 1.09 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 42 S 8.21 4.21 0.00 4.16 3.87 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 0.00 0.00 0.00 43 A 7.86 4.04 1.63 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 0.00 0.00 44 Q 8.19 3.95 0.00 2.23 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.74 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 45 I 8.76 3.79 2.10 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 1.61 0.70 0.93 0.00 0.00 46 T 8.03 4.41 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 1.27 0.00 0.00 47 G 7.82 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 48 M 7.93 4.48 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.57 0.00 49 T 8.13 4.79 4.24 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 1.18 0.00 0.00 50 V 9.00 4.64 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.85 0.00 0.00 51 T 8.25 4.84 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 1.13 0.00 0.00 52 I 8.24 4.39 1.58 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.73 0.52 0.00 0.00 53 K 8.26 4.94 0.00 1.72 1.74 0.00 1.70 0.00 0.00 1.59 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.30 7.81 54 T 8.73 4.47 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 1.19 0.00 0.00 55 N 8.87 4.53 0.00 2.75 2.86 0.00 0.00 6.90 7.35 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 56 A 7.58 4.37 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 57 C 7.55 4.76 0.00 2.93 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 58 H 7.40 4.48 0.00 3.39 3.37 0.00 5.74 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 59 N 9.00 4.46 0.00 2.77 2.93 0.00 0.00 7.19 7.65 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 60 G 9.00 4.17 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 0.00 0.00 0.00 61 G 9.33 4.31 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 0.00 62 G 8.54 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 63 F 8.34 5.08 0.00 2.90 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 64 S 8.93 4.49 0.00 3.80 3.88 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 65 E 8.13 4.80 0.00 2.01 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 0.00 2.25 2.26 0.00 66 V 8.52 4.74 1.68 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 0.28 0.00 0.00 0.97 0.00 0.00 67 I 8.62 4.45 1.78 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 1.21 1.03 0.91 0.00 0.00 68 F 8.93 4.58 0.00 2.95 3.01 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 69 R 8.84 4.35 0.00 1.88 2.03 0.00 2.80 0.00 0.00 3.21 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00