NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3454 8.2649 123.5817 51.9932 18.8590 176.1922 2 V 3.6709 8.1318 115.0257 63.0685 32.1595 176.1453 3 C 5.1378 7.6613 115.6938 54.0247 43.2815 171.4993 4 P 4.6031 0.0000 0.0000 62.2532 31.8849 176.1698 5 T 4.0017 8.2421 111.5426 62.8671 70.1818 173.7251 6 G 4.0895 8.5905 106.9163 44.0560 0.0000 175.2736 7 L 3.8300 9.1004 122.8648 57.7443 42.5626 177.4834 8 F 4.9230 7.9588 116.3771 56.4051 37.7446 175.5338 9 S 4.9214 7.6772 111.2150 57.3019 64.6965 175.1960 10 N 5.0310 8.2087 119.4874 51.0210 40.6095 172.0631 11 P 5.1053 0.0000 0.0000 62.6583 32.2106 175.8222 12 L 5.1169 9.7591 123.6259 53.2200 46.7355 174.5990 13 C 5.2500 9.4333 120.0829 56.1043 38.3983 172.3516 14 C 5.7400 9.3331 120.5178 53.6580 43.8289 175.0688 15 A 3.9634 8.6595 123.2307 55.3346 18.6000 177.5491 16 T 3.9972 7.2840 107.0054 61.9222 71.2028 171.7035 17 N 5.3269 8.1587 123.5126 51.1947 40.3137 173.2927 18 V 3.7186 8.9095 126.4817 64.3755 32.0708 175.9662 19 L 3.7214 9.5323 124.2362 55.3929 39.3248 174.1277 20 D 4.6355 8.2763 114.9319 55.3224 38.8950 174.5781 21 L 4.6867 8.6799 119.3453 55.5040 45.9209 176.5177 22 I 4.7750 7.7600 120.0080 59.4267 39.2286 175.3468 23 G 4.1608 8.6246 115.4843 45.7125 0.0000 172.9623 24 V 4.4487 8.5992 124.4838 61.3248 34.5555 175.0234 25 D 4.3566 8.4138 124.2320 55.6061 38.4445 174.1417 26 C 4.9246 7.8660 114.0302 56.9394 39.2152 174.8746 27 K 4.9522 9.0648 120.5111 54.8701 36.6252 175.8835 28 T 4.4097 8.5202 113.7448 60.8949 69.5489 172.7590 29 P 4.5710 0.0000 0.0000 63.3336 31.9770 176.1682 30 T 4.5564 8.5722 110.0643 61.0937 68.9441 173.5578 31 I 4.4378 7.0526 113.6190 59.6113 40.4887 173.8336 32 A 4.0096 8.3447 124.0682 52.2678 19.0777 178.8108 33 V 4.2448 7.7982 124.3940 61.6419 30.5332 175.2941 34 D 4.4658 7.8927 122.0371 56.5613 41.7006 177.5714 35 T 4.8781 7.5730 107.9697 58.9861 73.1312 175.0738 36 G 3.6678 8.5685 107.6771 47.9517 0.0000 175.8204 37 A 4.0598 8.0152 122.8313 54.9974 18.3813 179.7041 38 I 3.7230 7.8133 118.0630 64.2720 37.1853 178.2605 39 F 4.4674 8.4801 121.6951 61.6378 39.2459 177.0326 40 Q 3.7659 8.5573 119.1497 59.0575 28.8966 177.9628 41 A 4.0040 8.3122 122.0658 55.3355 18.1984 179.0540 42 H 4.1510 8.6856 117.1456 59.8196 29.9161 176.9415 43 C 4.3125 8.3787 118.0573 59.8612 35.1358 175.9721 44 A 3.9472 8.1030 122.8152 54.9367 17.7523 179.5174 45 S 4.3626 7.8301 111.0301 60.2703 62.9188 175.2237 46 K 4.3833 6.9103 120.5029 55.6564 32.2448 176.2664 47 G 3.9072 8.5764 105.8253 46.5168 0.0000 173.8432 48 S 4.9085 8.1057 115.0084 56.4882 65.9103 173.3926 49 K 4.6798 8.9763 120.1916 54.0748 35.4798 173.9601 50 P 4.4483 0.0000 0.0000 61.7890 32.7308 174.7652 51 L 5.2770 9.1002 124.0113 52.9173 46.5701 174.8083 52 C 5.5919 9.7606 119.1680 55.8627 38.9623 172.7332 53 C 5.6909 9.4761 121.2208 54.9570 44.0560 175.0080 54 V 4.2461 8.5250 110.8961 61.6273 31.3338 177.0899 55 A 3.8795 7.9080 122.8795 53.8515 19.6190 176.7573 56 P 3.5342 0.0000 0.0000 61.8742 32.1070 179.0374 57 V 3.6155 10.1027 118.8290 62.0864 30.6274 170.1153 58 A 4.5877 7.9595 117.1788 51.1163 20.6709 174.9675 59 D 4.7989 7.5353 124.1056 53.5879 47.3800 175.7965 60 Q 4.5136 7.4703 119.9227 52.9005 32.7041 173.9047 61 A 3.7939 7.9965 122.2414 49.6671 19.3372 176.8272 62 L 4.5452 8.4542 123.6176 54.4495 42.8199 176.0955 63 L 4.8035 8.5190 123.2476 55.2368 42.6848 176.6942 64 C 5.7894 9.7738 120.6050 55.5646 43.1237 173.4521 65 Q 4.5773 9.1255 119.2282 53.5184 32.4005 174.9834 66 K 4.2974 8.7069 124.2148 56.3333 32.1484 176.2672 67 A 4.2462 8.4907 128.8661 51.8474 19.4051 177.1776 68 I 3.7705 8.3284 121.9702 62.1810 39.0020 175.0181 69 G 4.2872 8.9137 118.8344 45.9229 0.0000 174.1345 70 T 4.0582 6.8112 108.7540 61.1037 69.2896 173.8704 71 F 4.6403 8.3609 122.3346 59.2901 39.5390 173.0741 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 A 8.26 4.35 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 2 V 8.13 3.67 2.26 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 0.86 0.00 0.00 0.74 0.00 0.00 3 C 7.66 5.14 0.00 2.94 3.21 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.60 0.00 2.28 2.21 0.00 3.95 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.00 0.00 5 T 8.24 4.00 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 1.22 0.00 0.00 6 G 8.59 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 9.10 3.83 0.00 1.61 1.55 0.63 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 8 F 7.96 4.92 0.00 3.06 3.19 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 0.00 9 S 7.68 4.92 0.00 3.87 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 10 N 8.21 5.03 0.00 2.84 2.79 0.00 0.00 6.78 8.05 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 11 P 0.00 5.11 0.00 1.32 1.62 0.00 3.66 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.76 0.00 12 L 9.76 5.12 0.00 1.61 1.61 0.98 0.81 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 13 C 9.43 5.25 0.00 2.89 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 14 C 9.33 5.74 0.00 2.82 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.66 3.96 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 16 T 7.28 4.00 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 1.21 0.00 0.00 17 N 8.16 5.33 0.00 2.86 2.67 0.00 0.00 6.49 7.71 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 18 V 8.91 3.72 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 0.91 0.00 0.00 0.93 0.00 0.00 19 L 9.53 3.72 0.00 1.81 1.71 0.93 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.28 4.64 0.00 2.81 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 21 L 8.68 4.69 0.00 1.56 1.67 0.98 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.76 4.77 1.89 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 1.30 0.96 0.93 0.00 0.00 23 G 8.62 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 0.00 0.00 0.00 0.00 24 V 8.60 4.45 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 0.97 0.00 0.00 0.94 0.00 0.00 25 D 8.41 4.36 0.00 2.86 2.66 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 0.00 0.00 0.00 0.00 26 C 7.87 4.92 0.00 2.89 3.05 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 27 K 9.06 4.95 0.00 1.66 1.66 0.00 1.67 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.40 7.81 28 T 8.52 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 1.23 0.00 0.00 29 P 0.00 4.57 0.00 2.03 2.11 0.00 3.64 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.23 0.00 30 T 8.57 4.56 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 1.26 0.00 0.00 31 I 7.05 4.44 1.80 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.38 0.83 0.00 0.00 32 A 8.34 4.01 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 33 V 7.80 4.24 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 0.42 0.00 0.00 0.82 0.00 0.00 34 D 7.89 4.47 0.00 2.70 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 35 T 7.57 4.88 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 1.23 0.00 0.00 36 G 8.57 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.02 4.06 1.36 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 0.00 0.00 0.00 0.00 0.00 0.00 38 I 7.81 3.72 1.93 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.72 0.99 0.00 0.00 39 F 8.48 4.47 0.00 3.19 3.21 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.56 3.77 0.00 2.12 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 41 A 8.31 4.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.69 4.15 0.00 3.36 3.67 0.00 5.79 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 43 C 8.38 4.31 0.00 3.08 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 44 A 8.10 3.95 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 45 S 7.83 4.36 0.00 4.04 4.02 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 46 K 6.91 4.38 0.00 1.85 1.80 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.26 7.81 47 G 8.58 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 48 S 8.11 4.91 0.00 3.85 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 49 K 8.98 4.68 0.00 1.57 1.59 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.29 1.30 7.81 50 P 0.00 4.45 0.00 0.49 1.00 0.00 3.46 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.63 0.00 51 L 9.10 5.28 0.00 1.62 1.71 0.94 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 52 C 9.76 5.59 0.00 2.88 3.36 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 0.00 0.00 0.00 0.00 53 C 9.48 5.69 0.00 2.86 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 54 V 8.53 4.25 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.88 0.00 0.00 55 A 7.91 3.88 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 56 P 0.00 3.53 0.00 2.13 1.79 0.00 3.67 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.10 0.00 57 V 10.10 3.62 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 0.70 0.00 0.00 0.98 0.00 0.00 58 A 7.96 4.59 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 D 7.54 4.80 0.00 2.75 2.68 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 60 Q 7.47 4.51 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.66 0.00 0.00 0.00 0.00 0.00 2.23 2.39 0.00 61 A 8.00 3.79 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 62 L 8.45 4.55 0.00 1.79 1.82 0.96 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 63 L 8.52 4.80 0.00 1.67 1.83 0.95 0.91 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 64 C 9.77 5.79 0.00 3.06 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 65 Q 9.13 4.58 0.00 1.63 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.98 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 66 K 8.71 4.30 0.00 1.76 1.70 0.00 1.90 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.43 1.48 7.81 67 A 8.49 4.25 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 68 I 8.33 3.77 1.87 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 1.33 0.70 0.93 0.00 0.00 69 G 8.91 4.29 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 0.00 70 T 6.81 4.06 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 1.20 0.00 0.00 71 F 8.36 4.64 0.00 2.77 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