NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.4585 0.0000 0.0000 62.6893 33.3361 174.7414 3 F 5.1911 8.8909 125.5509 56.2675 41.4496 171.8820 4 I 4.1956 8.9728 128.5089 59.3868 39.6601 174.0794 5 E 4.8429 8.3415 127.2693 54.4473 32.0480 174.3924 6 C 4.7251 8.8071 124.6966 58.3332 30.8637 172.5224 7 H 5.3267 8.8652 121.8737 54.3459 29.6508 174.4016 8 I 4.8476 8.5217 116.3091 58.4601 41.3803 174.8093 9 A 4.6529 8.5402 124.4538 52.2564 18.9409 177.4342 10 T 4.6333 7.9699 115.6985 61.3525 67.7349 174.0018 11 G 3.8613 8.7104 122.7619 45.7608 0.0000 173.5268 12 L 4.3280 7.3556 121.2520 53.7211 42.9323 177.4459 13 S 4.3671 8.3864 117.4992 58.2454 65.0449 175.9079 14 V 3.6439 8.3135 122.6608 64.8715 31.2540 178.3766 15 A 3.9777 7.9207 121.0656 55.0623 18.2683 179.4385 16 R 3.9022 7.8737 116.9828 59.3874 30.0890 178.9123 17 K 4.0244 8.0429 118.1558 59.2029 31.9306 179.4005 18 Q 3.9813 8.0448 118.6944 58.8474 28.6215 178.4510 19 Q 3.9186 7.9514 120.1488 59.0720 29.0825 177.8984 20 L 3.9360 8.0704 121.4288 58.2972 42.0949 179.0271 21 I 3.7518 8.0753 122.1012 65.0513 36.9756 179.1798 22 R 3.9739 8.1510 121.4867 61.7250 29.2360 180.3978 23 D 4.5522 8.7351 120.1688 57.1982 40.7354 179.4281 24 V 3.7099 8.0811 113.1836 64.2550 31.5330 178.3921 25 I 3.6424 7.8472 119.5971 64.5549 36.9836 177.6942 26 D 4.3626 8.4064 119.0103 57.5993 41.0863 178.9462 27 V 3.6934 8.3643 119.4518 64.6665 31.4374 178.3922 28 T 4.0107 7.9436 116.8996 66.0549 68.3170 176.4432 29 N 4.5743 8.3564 122.9165 56.7762 38.8297 177.7807 30 K 4.0141 7.9668 124.0168 59.7604 31.8760 180.7244 31 S 4.5712 7.9627 114.9825 60.2581 63.3035 175.0634 32 I 4.3307 7.6841 113.0146 59.5263 37.9829 177.0210 33 G 3.8586 8.5054 108.9100 45.7916 0.0000 174.5985 34 S 4.1682 7.3718 116.7817 58.3821 63.5050 173.4459 35 D 4.5665 8.5950 124.6409 53.2080 41.8372 175.1554 36 P 4.2642 0.0000 0.0000 65.7297 31.1609 178.2179 37 K 4.0945 8.3791 117.5811 58.1459 31.9433 177.4175 38 I 4.4418 8.0315 111.2207 60.2599 37.8974 174.7502 39 I 4.6974 7.6968 122.1838 60.1966 38.5546 174.9026 40 N 5.2207 9.2656 123.7434 51.4710 42.3442 173.6584 41 V 5.0412 8.4632 121.1078 61.1529 35.2186 174.1613 42 L 4.8591 9.0930 128.4926 53.3185 45.3061 174.6922 43 L 5.1093 8.7184 126.1695 52.9050 43.8259 176.1208 44 V 4.4179 8.4421 123.3877 59.9332 34.3933 174.7917 45 E 5.0408 8.6618 123.9547 55.7232 31.8023 174.6736 46 H 5.2591 8.9076 117.7237 54.0524 33.9734 173.0532 47 A 4.4754 8.5409 122.6936 51.6651 19.5670 178.6036 48 E 3.8895 8.9476 119.9683 59.6461 29.6278 179.3564 49 A 4.2005 7.9672 118.8453 53.9164 18.5573 177.2682 50 N 4.8699 8.1081 112.4638 52.8561 38.9229 174.6616 51 M 4.7242 7.8127 117.3528 53.4620 35.4739 175.0365 52 S 4.4538 8.4986 116.3611 56.7484 65.0790 172.8573 53 I 4.3896 8.2667 128.4338 60.9357 39.0475 175.8557 54 S 3.8042 9.5715 118.5297 59.7045 60.2931 173.8401 55 G 3.9402 8.2491 105.2104 45.9742 0.0000 174.6447 56 R 4.1288 7.8233 119.2236 55.9873 30.8062 176.7445 57 I 4.0326 8.2167 121.4131 61.5288 37.3176 175.6625 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 4.46 0.00 2.16 2.28 0.00 3.72 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 3 F 8.89 5.19 0.00 2.98 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 4 I 8.97 4.20 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 1.05 0.50 0.83 0.00 0.00 5 E 8.34 4.84 0.00 1.40 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.17 0.00 6 C 8.81 4.73 0.00 2.86 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 7 H 8.87 5.33 0.00 3.04 3.28 0.00 5.64 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.52 4.85 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.95 0.92 0.00 0.00 9 A 8.54 4.65 1.27 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 0.00 0.00 0.00 10 T 7.97 4.63 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 1.29 0.00 0.00 11 G 8.71 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 12 L 7.36 4.33 0.00 1.65 1.60 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 13 S 8.39 4.37 0.00 4.04 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 14 V 8.31 3.64 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 0.82 0.00 0.00 0.93 0.00 0.00 15 A 7.92 3.98 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.87 3.90 0.00 1.90 2.05 0.00 3.14 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 17 K 8.04 4.02 0.00 2.03 1.84 0.00 1.72 0.00 0.00 1.64 0.00 0.00 3.13 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.67 7.81 18 Q 8.04 3.98 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.81 0.00 0.00 0.00 0.00 0.00 2.66 2.51 0.00 19 Q 7.95 3.92 0.00 2.20 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.56 0.00 20 L 8.07 3.94 0.00 1.86 1.84 0.92 0.93 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 21 I 8.08 3.75 2.05 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.92 0.92 0.00 0.00 22 R 8.15 3.97 0.00 1.81 1.94 0.00 3.27 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 23 D 8.74 4.55 0.00 2.77 2.75 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 0.00 0.00 0.00 0.00 24 V 8.08 3.71 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 0.82 0.00 0.00 1.01 0.00 0.00 25 I 7.85 3.64 2.04 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 1.73 1.00 0.92 0.00 0.00 26 D 8.41 4.36 0.00 2.69 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 27 V 8.36 3.69 2.28 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 0.79 0.00 0.00 0.93 0.00 0.00 28 T 7.94 4.01 4.39 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 1.22 0.00 0.00 29 N 8.36 4.57 0.00 2.84 2.99 0.00 0.00 7.05 6.58 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 30 K 7.97 4.01 0.00 1.90 1.71 0.00 1.86 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.39 1.32 7.81 31 S 7.96 4.57 0.00 4.04 4.05 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 32 I 7.68 4.33 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.94 0.91 0.00 0.00 33 G 8.51 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 34 S 7.37 4.17 0.00 4.01 3.82 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 35 D 8.59 4.57 0.00 2.75 2.53 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 0.00 0.00 0.00 0.00 36 P 0.00 4.26 0.00 2.26 2.32 0.00 3.76 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 2.08 2.01 0.00 37 K 8.38 4.09 0.00 1.88 1.92 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.48 1.48 7.81 38 I 8.03 4.44 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.68 0.92 0.00 0.00 39 I 7.70 4.70 2.03 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.84 0.94 0.00 0.00 40 N 9.27 5.22 0.00 2.74 2.70 0.00 0.00 6.03 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 41 V 8.46 5.04 2.12 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 0.79 0.00 0.00 0.96 0.00 0.00 42 L 9.09 4.86 0.00 2.01 1.58 0.95 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.72 5.11 0.00 1.52 1.55 0.91 0.89 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 44 V 8.44 4.42 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 0.72 0.00 0.00 0.88 0.00 0.00 45 E 8.66 5.04 0.00 1.90 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 2.30 0.00 46 H 8.91 5.26 0.00 3.04 3.12 0.00 5.61 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 47 A 8.54 4.48 1.27 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 0.00 0.00 0.00 48 E 8.95 3.89 0.00 2.01 2.03 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 2.41 2.28 0.00 49 A 7.97 4.20 1.28 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 50 N 8.11 4.87 0.00 2.86 2.83 0.00 0.00 6.71 7.44 0.00 0.00 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 M 7.81 4.72 0.00 1.95 1.90 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.34 0.00 52 S 8.50 4.45 0.00 3.74 3.68 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 53 I 8.27 4.39 1.86 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 1.41 0.71 0.90 0.00 0.00 54 S 9.57 3.80 0.00 3.95 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 55 G 8.25 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 0.00 0.00 0.00 56 R 7.82 4.13 0.00 1.83 1.87 0.00 3.15 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.85 0.00 57 I 8.22 4.03 1.87 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 1.27 0.79 0.91 0.00 0.00