NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3239 0.0000 0.0000 61.3296 31.5187 175.7525 3 P 4.1835 0.0000 0.0000 62.4086 31.6765 174.6950 4 R 4.6701 8.8984 118.6916 53.9383 34.1586 175.3303 5 P 4.1208 0.0000 0.0000 65.6198 31.4016 178.9630 6 L 3.8596 7.8550 117.3824 57.9586 41.5211 179.1870 7 D 4.4519 7.7346 118.2493 56.9758 40.4374 178.8737 8 V 3.5961 7.6764 118.9960 65.4814 31.3989 178.1321 9 L 3.9489 7.4048 119.0278 57.4209 41.3020 178.3698 10 N 4.6117 7.3735 114.6513 55.5062 38.9436 174.7871 11 R 4.5216 7.4658 115.1537 56.9638 30.2716 176.1065 12 S 4.7316 8.4613 110.6612 57.7945 64.4846 173.7545 13 L 4.2888 7.9523 120.8766 56.2033 41.6949 177.2626 14 K 3.9855 9.3124 121.0931 56.9841 30.4398 175.5986 15 S 4.9478 7.7241 115.1214 55.7593 66.3465 171.9039 16 P 4.7923 0.0000 0.0000 63.1336 32.2010 175.9085 17 V 4.9739 8.8869 116.6446 59.8648 37.0205 174.3451 18 I 4.6946 9.2596 124.0655 59.9382 39.1860 175.0731 19 V 4.3246 8.9445 128.8586 61.0883 33.3363 174.3656 20 R 4.4555 7.8605 129.3014 55.2495 31.3934 175.1192 21 L 5.3220 8.1405 124.6654 52.3933 45.5412 176.3201 22 K 4.0491 8.4986 119.8384 57.3030 32.7003 178.0696 23 G 3.7415 8.8348 109.9201 45.7037 0.0000 174.5437 24 G 3.8434 8.1076 106.1974 45.4296 0.0000 173.5314 25 R 4.5289 7.4505 119.7763 55.7620 32.0986 174.5522 26 E 5.1655 8.5649 122.6881 55.2901 33.8299 173.6906 27 F 5.3530 9.4419 122.3350 55.7653 43.6440 174.0862 28 R 5.1326 10.0048 120.6344 53.1541 33.4684 175.5220 29 G 4.5142 7.9149 115.1132 44.9944 0.0000 171.4501 30 T 4.4413 7.3442 110.2353 61.2223 70.1763 173.7360 31 L 4.5153 9.0011 128.1258 55.2267 43.1115 176.2677 32 D 4.9237 10.2721 123.8069 53.0016 42.7989 175.5409 33 G 4.2814 7.4515 110.0463 46.4931 0.0000 170.6339 34 Y 5.8516 7.1774 116.9210 56.6386 41.0172 172.7410 35 D 4.7362 8.2217 118.1285 52.5557 41.6509 174.9790 36 I 3.9690 8.3933 116.8382 65.2010 37.6741 177.2323 37 H 4.4675 8.1158 114.1664 56.5282 28.2736 176.1669 38 M 3.3104 8.0473 117.9925 55.3596 31.7620 176.2510 39 N 4.6996 8.2975 115.8174 54.4307 39.9138 174.3551 40 L 5.1612 8.5552 122.4456 53.1722 45.7545 175.4423 41 V 4.8238 8.2779 118.4616 61.7392 34.9996 173.6912 42 L 5.3382 8.8388 126.5861 52.9713 46.2895 175.3716 43 L 5.1531 8.4682 119.9454 52.9952 45.7888 176.1217 44 D 4.3835 8.3985 117.6585 55.1116 39.3577 174.0763 45 A 4.9920 7.6047 120.0412 51.3822 20.7796 177.1435 46 E 5.0212 9.4106 119.4327 54.4333 32.4975 174.6985 47 E 3.7216 8.8174 125.0940 55.2039 31.3161 174.9987 48 I 4.9345 8.4460 126.8200 59.5836 41.3967 174.3483 49 Q 4.6825 8.8371 126.0653 55.2150 32.5359 174.4006 50 N 4.1021 9.3801 124.7480 54.6422 38.0877 173.5112 51 G 3.7944 9.6230 99.1924 45.6188 0.0000 173.7223 52 E 4.5201 7.6930 118.1149 54.4698 33.1839 174.1959 53 V 4.0728 8.3348 126.5947 63.0138 32.0998 175.5067 54 V 3.9062 8.3721 128.1458 65.1906 32.2489 175.6981 55 R 4.2921 7.1117 117.3453 55.9350 33.3628 173.4586 56 K 4.9325 8.6397 122.6243 54.4512 32.2593 175.8961 57 V 3.8477 8.5584 117.6149 60.8385 32.7529 177.4739 58 G 3.7918 8.8756 111.4337 49.3596 0.0000 173.2232 59 S 5.7847 8.0810 111.9041 58.4087 65.9607 174.5430 60 V 4.3830 8.0214 118.5001 60.6904 34.4899 172.8141 61 V 4.5733 8.3337 123.4393 61.5689 32.6720 174.5239 62 I 4.3184 7.9457 129.1696 59.8076 39.4892 175.7892 63 R 4.5248 8.5036 125.3190 55.4202 30.8638 177.3795 64 G 4.4640 10.3208 113.9536 48.1154 0.0000 174.7992 65 D 4.3651 8.1393 117.8748 56.9133 41.4544 177.0993 66 T 4.2204 8.2970 115.1441 64.5259 69.0672 175.0694 67 V 4.1551 7.5209 121.6119 62.9056 32.2445 174.8145 68 V 4.4109 8.3564 125.8282 64.0625 32.9993 175.3342 69 F 5.0224 7.2732 112.7505 56.0377 41.1484 172.5558 70 V 5.1740 8.4738 118.8762 61.4257 34.2339 174.3940 71 S 4.8212 9.0116 120.8639 56.2111 66.6419 171.9261 72 P 4.8898 0.0000 0.0000 62.9288 32.1181 176.2590 73 A 4.4358 8.3799 123.0425 52.1397 18.7748 176.4352 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 2 P 0.00 4.32 0.00 2.06 2.11 0.00 3.67 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.11 0.00 3 P 0.00 4.18 0.00 2.11 2.04 0.00 3.62 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.16 0.00 4 R 8.90 4.67 0.00 2.02 1.80 0.00 3.33 0.00 0.00 3.34 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 5 P 0.00 4.12 0.00 2.13 2.07 0.00 3.59 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 6 L 7.86 3.86 0.00 1.66 1.74 0.89 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 7 D 7.73 4.45 0.00 2.89 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.68 3.60 2.21 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 1.01 0.00 0.00 0.98 0.00 0.00 9 L 7.40 3.95 0.00 1.22 1.02 0.48 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 10 N 7.37 4.61 0.00 3.04 3.06 0.00 0.00 7.12 7.53 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 11 R 7.47 4.52 0.00 1.85 2.00 0.00 3.26 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 12 S 8.46 4.73 0.00 3.94 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.95 4.29 0.00 1.68 1.65 0.97 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 14 K 9.31 3.99 0.00 1.88 1.95 0.00 1.67 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.41 7.81 15 S 7.72 4.95 0.00 3.90 3.74 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 16 P 0.00 4.79 0.00 2.09 2.00 0.00 3.55 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.14 0.00 17 V 8.89 4.97 2.18 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 0.98 0.00 0.00 0.99 0.00 0.00 18 I 9.26 4.69 2.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.94 1.02 0.00 0.00 19 V 8.94 4.32 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 0.91 0.00 0.00 0.91 0.00 0.00 20 R 7.86 4.46 0.00 0.67 0.66 0.00 2.98 0.00 0.00 3.09 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.45 0.00 21 L 8.14 5.32 0.00 1.56 1.62 1.10 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 22 K 8.50 4.05 0.00 1.66 1.75 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.66 7.81 23 G 8.83 3.74 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 0.00 0.00 0.00 24 G 8.11 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 25 R 7.45 4.53 0.00 1.89 1.80 0.00 3.24 0.00 0.00 3.40 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 26 E 8.56 5.17 0.00 2.00 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 2.18 2.39 0.00 27 F 9.44 5.35 0.00 2.94 2.81 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 0.00 0.00 0.00 28 R 10.00 5.13 0.00 1.74 1.81 0.00 3.47 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 29 G 7.91 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.34 4.44 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 1.25 0.00 0.00 31 L 9.00 4.52 0.00 1.80 1.80 1.09 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 32 D 10.27 4.92 0.00 2.65 2.58 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 33 G 7.45 4.28 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 0.00 34 Y 7.18 5.85 0.00 3.10 2.93 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 0.00 0.00 0.00 0.00 35 D 8.22 4.74 0.00 2.73 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 36 I 8.39 3.97 1.75 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 1.42 1.17 0.87 0.00 0.00 37 H 8.12 4.47 0.00 3.46 3.31 0.00 5.68 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 M 8.05 3.31 0.00 2.15 2.24 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 2.48 2.54 0.00 39 N 8.30 4.70 0.00 2.98 2.74 0.00 0.00 6.81 6.86 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 40 L 8.56 5.16 0.00 1.51 1.54 0.87 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.28 4.82 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 1.00 0.00 0.00 0.95 0.00 0.00 42 L 8.84 5.34 0.00 1.48 1.46 0.77 0.26 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 43 L 8.47 5.15 0.00 1.58 1.52 0.96 1.18 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 44 D 8.40 4.38 0.00 2.77 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 45 A 7.60 4.99 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 9.41 5.02 0.00 1.93 2.05 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 2.29 2.20 0.00 47 E 8.82 3.72 0.00 1.46 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.63 0.00 48 I 8.45 4.93 1.75 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.71 0.85 0.00 0.00 49 Q 8.84 4.68 0.00 2.04 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.14 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 50 N 9.38 4.10 0.00 2.82 2.77 0.00 0.00 7.32 7.86 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 51 G 9.62 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 E 7.69 4.52 0.00 1.90 1.83 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 2.18 2.20 0.00 53 V 8.33 4.07 2.05 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 0.83 0.00 0.00 0.95 0.00 0.00 54 V 8.37 3.91 1.97 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 0.72 0.00 0.00 0.86 0.00 0.00 55 R 7.11 4.29 0.00 1.86 1.66 0.00 3.19 0.00 0.00 3.35 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.53 0.00 56 K 8.64 4.93 0.00 1.64 1.72 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.75 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.33 1.42 7.81 57 V 8.56 3.85 2.31 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 0.78 0.00 0.00 1.15 0.00 0.00 58 G 8.88 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 S 8.08 5.78 0.00 3.83 3.80 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 60 V 8.02 4.38 2.05 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 0.28 0.00 0.00 0.70 0.00 0.00 61 V 8.33 4.57 2.05 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 0.80 0.00 0.00 0.90 0.00 0.00 62 I 7.95 4.32 1.73 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.05 0.85 0.00 0.00 63 R 8.50 4.52 0.00 1.83 1.85 0.00 3.31 0.00 0.00 3.32 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.56 0.00 64 G 10.32 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.14 4.37 0.00 2.64 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 T 8.30 4.22 4.37 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 1.22 0.00 0.00 67 V 7.52 4.16 2.19 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 0.69 0.00 0.00 0.90 0.00 0.00 68 V 8.36 4.41 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 1.07 0.00 0.00 0.96 0.00 0.00 69 F 7.27 5.02 0.00 3.09 3.09 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 70 V 8.47 5.17 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 0.86 0.00 0.00 0.92 0.00 0.00 71 S 9.01 4.82 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 72 P 0.00 4.89 0.00 1.97 2.04 0.00 3.65 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 73 A 8.38 4.44 1.22 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 0.00 0.00 0.00