NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8380 8.3501 109.7336 45.4493 0.0000 174.4296 2 A 4.0693 8.7966 122.8666 50.3031 19.4119 175.5845 3 M 4.3815 8.2128 118.9643 53.3493 34.2142 173.6175 4 G 3.5497 8.5149 115.0143 46.0870 0.0000 170.8105 5 A 4.5006 8.1886 128.5906 51.4827 19.6554 175.8954 6 K 3.4634 7.8462 118.3061 58.0277 28.0691 175.2937 7 E 4.6856 7.2892 120.3567 55.0541 32.5488 174.8101 8 Y 5.4545 9.0804 119.3145 56.6657 42.8545 174.0555 9 C 5.4485 9.2927 115.8891 56.7069 34.1054 172.5315 10 R 5.7566 9.4285 120.3046 53.7763 32.9932 174.7473 11 T 4.4554 8.2906 116.0893 61.8113 69.7117 174.9088 12 L 4.3573 9.2241 124.7486 55.4457 42.8500 176.6436 13 F 5.1968 8.0306 115.7753 55.0138 43.0784 172.7481 14 P 5.0408 0.0000 0.0000 63.2959 32.7324 174.8691 15 Y 4.5104 8.5095 121.5006 56.5627 42.4771 173.4466 16 T 4.2258 7.4804 123.3359 61.7682 69.8588 174.6770 17 G 3.6436 8.3913 117.2536 45.2587 0.0000 173.4223 18 T 4.0799 9.6059 116.2890 63.4254 69.5805 175.2753 19 N 4.7600 7.9100 118.5970 51.8079 40.0310 175.3858 20 E 4.1093 8.5357 120.0899 59.1174 30.1027 177.0582 21 D 4.6441 8.1088 116.1324 54.7591 41.1175 174.4036 22 E 5.2610 7.5122 120.1877 54.2730 31.4345 174.8966 23 L 4.4767 8.7534 129.5402 54.8690 43.0975 175.8787 24 T 4.4814 8.5425 123.7388 62.5755 69.3070 174.0668 25 F 5.0703 8.4372 121.2933 55.3594 42.0706 174.4757 26 R 4.7992 8.5931 118.8628 54.9051 32.6260 174.8452 27 E 4.2775 8.7328 120.7072 56.5684 30.5808 176.4097 28 G 3.9258 8.7835 114.4400 45.2391 0.0000 172.3719 29 E 4.4865 8.1969 119.8690 54.7848 31.2590 175.3522 30 I 4.6468 8.3373 125.8193 60.7326 38.1043 175.1979 31 I 4.4145 9.0467 128.7067 59.8161 40.1156 175.0177 32 H 5.1044 8.9732 123.8310 54.6633 29.5832 174.4619 33 L 4.3019 8.4492 127.3813 55.5046 41.9059 176.2446 34 I 4.2269 8.8962 127.8221 63.1030 38.3970 176.5505 35 S 4.4774 7.5544 116.4354 57.3786 66.6706 175.3338 36 K 3.2693 8.5323 123.1387 57.3959 32.4939 176.5495 37 E 4.4112 7.9166 118.1816 55.4526 28.8431 175.3282 38 T 4.3822 8.5479 112.9900 61.1466 69.3234 175.2137 39 G 4.0555 8.5228 111.2097 45.1564 0.0000 173.4952 40 E 4.5980 7.3601 117.8970 54.0139 32.1051 175.1619 41 A 4.4567 9.1582 127.9294 53.6981 18.9497 175.8111 42 G 3.4325 8.4416 114.8192 45.3428 0.0000 172.3170 43 W 5.0652 8.1364 120.6615 54.7598 30.8491 175.6834 44 W 5.0457 8.9888 124.7397 54.8007 31.9125 174.6175 45 K 5.1467 9.3440 124.5171 54.9208 33.9410 175.3481 46 G 4.8168 9.6426 113.4672 44.7543 0.0000 170.5107 47 E 5.4743 9.5461 121.7803 54.1286 32.2740 174.5915 48 L 4.7092 8.9482 128.6746 54.1784 45.8615 175.7799 49 N 4.2508 9.7790 122.5079 54.4173 37.2624 174.5921 50 G 4.0212 8.9260 103.6591 44.6648 0.0000 173.7256 51 K 4.5314 8.4060 120.5099 54.1547 34.1522 174.8452 52 E 5.2519 8.9248 122.1964 54.6842 30.9179 174.8875 53 G 4.2752 8.9609 111.7689 45.3779 0.0000 170.7345 54 V 5.4948 9.1595 112.6832 59.9690 35.1096 175.2280 55 F 5.3885 9.0731 117.1385 55.0736 41.9320 171.9854 56 P 4.1432 0.0000 0.0000 62.2615 31.6016 177.2807 57 D 3.9779 8.4285 122.8798 54.9220 39.2587 177.9560 58 N 4.2104 7.7137 116.8031 55.5035 38.8479 175.5176 59 F 4.6186 8.2612 115.4748 57.7840 39.5787 174.6545 60 A 5.3286 7.8225 121.4617 50.0116 22.6973 175.6833 61 V 4.5083 8.9073 118.2623 59.9039 34.6463 174.8429 62 Q 4.6807 8.8796 124.1292 56.0775 29.6370 175.0745 63 I 4.2900 9.0121 126.1303 62.5594 38.8459 175.9597 64 S 4.2518 7.8342 118.7481 58.4443 62.6449 173.1107 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 G 8.35 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 2 A 8.80 4.07 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 3 M 8.21 4.38 0.00 1.87 1.90 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 4 G 8.51 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 0.00 0.00 0.00 5 A 8.19 4.50 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 6 K 7.85 3.46 0.00 1.92 1.86 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.23 1.38 7.81 7 E 7.29 4.69 0.00 1.67 1.78 0.00 0.00 0.00 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 2.16 0.00 8 Y 9.08 5.45 0.00 2.82 2.79 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 9 C 9.29 5.45 0.00 3.29 3.31 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 10 R 9.43 5.76 0.00 1.82 1.77 0.00 3.11 0.00 0.00 3.29 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.33 0.00 11 T 8.29 4.46 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.27 0.00 0.00 12 L 9.22 4.36 0.00 1.36 1.22 0.89 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 13 F 8.03 5.20 0.00 3.21 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 14 P 0.00 5.04 0.00 2.14 2.16 0.00 4.12 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.08 0.00 15 Y 8.51 4.51 0.00 2.00 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 16 T 7.48 4.23 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 1.02 0.00 0.00 17 G 8.39 3.64 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 0.00 0.00 0.00 18 T 9.61 4.08 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 1.13 0.00 0.00 19 N 7.91 4.76 0.00 2.81 2.79 0.00 0.00 7.32 7.69 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 20 E 8.54 4.11 0.00 1.93 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 0.00 2.30 2.34 0.00 21 D 8.11 4.64 0.00 2.82 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 22 E 7.51 5.26 0.00 2.12 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 2.56 2.69 0.00 23 L 8.75 4.48 0.00 2.08 1.92 1.14 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 24 T 8.54 4.48 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 1.12 0.00 0.00 25 F 8.44 5.07 0.00 2.95 3.02 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 26 R 8.59 4.80 0.00 1.77 1.98 0.00 3.22 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 27 E 8.73 4.28 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 2.28 2.24 0.00 28 G 8.78 3.93 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 0.00 0.00 0.00 29 E 8.20 4.49 0.00 1.82 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 2.32 2.48 0.00 30 I 8.34 4.65 1.84 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 1.32 0.72 0.91 0.00 0.00 31 I 9.05 4.41 1.85 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.83 0.96 0.00 0.00 32 H 8.97 5.10 0.00 3.22 3.25 0.00 5.63 0.00 0.00 0.00 0.00 6.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.45 4.30 0.00 1.63 1.48 0.23 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 34 I 8.90 4.23 2.00 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 1.51 1.04 0.91 0.00 0.00 35 S 7.55 4.48 0.00 3.69 3.77 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 36 K 8.53 3.27 0.00 1.41 1.51 0.00 1.26 0.00 0.00 0.79 0.00 0.00 2.59 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.30 0.52 7.81 37 E 7.92 4.41 0.00 1.92 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.25 0.00 38 T 8.55 4.38 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 1.30 0.00 0.00 39 G 8.52 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 40 E 7.36 4.60 0.00 2.03 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.58 0.00 41 A 9.16 4.46 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 42 G 8.44 3.43 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 0.00 43 W 8.14 5.07 0.00 3.13 3.15 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 44 W 8.99 5.05 0.00 2.18 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 45 K 9.34 5.15 0.00 1.84 1.68 0.00 1.62 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.43 1.58 7.81 46 G 9.64 4.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 9.55 5.47 0.00 2.03 1.90 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 2.39 2.43 0.00 48 L 8.95 4.71 0.00 1.69 1.46 0.92 0.40 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 49 N 9.78 4.25 0.00 2.92 2.92 0.00 0.00 7.38 7.99 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 50 G 8.93 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 0.00 0.00 0.00 51 K 8.41 4.53 0.00 1.99 1.77 0.00 1.59 0.00 0.00 1.74 0.00 0.00 3.11 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.41 7.81 52 E 8.92 5.25 0.00 2.12 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 0.00 2.22 2.31 0.00 53 G 8.96 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 54 V 9.16 5.49 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.02 0.00 0.00 55 F 9.07 5.39 0.00 3.16 3.39 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 56 P 0.00 4.14 0.00 2.17 1.41 0.00 2.95 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.62 0.00 57 D 8.43 3.98 0.00 1.58 1.54 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 0.00 0.00 0.00 0.00 58 N 7.71 4.21 0.00 2.37 2.58 0.00 0.00 6.70 7.26 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 59 F 8.26 4.62 0.00 3.37 3.41 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 60 A 7.82 5.33 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 61 V 8.91 4.51 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 0.90 0.00 0.00 0.96 0.00 0.00 62 Q 8.88 4.68 0.00 2.45 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 7.24 0.00 0.00 0.00 0.00 0.00 2.56 2.64 0.00 63 I 9.01 4.29 2.08 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.05 0.94 0.00 0.00 64 S 7.83 4.25 0.00 3.96 3.89 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 0.00 0.00 0.00