NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 P 4.4278 0.0000 0.0000 61.6665 33.7157 176.9526 4 R 4.5453 7.3933 113.5406 52.5908 33.4914 173.6769 5 P 4.1467 0.0000 0.0000 66.3190 31.6051 179.8681 6 L 3.8704 7.9371 115.5157 58.0664 41.8543 179.1135 7 D 4.4815 7.9762 118.1195 57.4427 39.5275 178.5960 8 V 3.5704 7.5172 118.3496 66.1486 31.2175 178.1114 9 L 4.0295 7.4968 118.2902 57.3887 41.3238 178.6947 10 N 4.4625 7.6929 116.9175 56.9825 38.6495 176.9749 11 R 3.9883 7.1980 118.0132 59.3286 30.2561 178.3887 12 S 4.4970 7.4777 111.6565 57.7305 63.2091 174.4482 13 L 4.2043 7.2976 123.4954 55.9181 41.7681 177.0648 14 K 3.9666 9.3767 122.9860 57.3695 30.0230 176.0673 15 S 4.8539 7.7073 112.7486 55.9956 67.8280 172.2059 16 P 4.9160 0.0000 0.0000 63.2510 32.2043 175.6142 17 V 5.0319 9.2819 116.0423 59.6584 36.5298 174.1991 18 I 4.7314 9.3342 123.9371 59.6879 39.6830 174.9824 19 V 4.6810 9.1094 127.4277 61.1041 34.1690 173.9204 20 R 4.5400 8.1721 128.9797 54.8592 31.6403 175.6601 21 L 4.9029 8.1648 126.6980 52.9139 44.3978 176.1236 22 K 4.1019 8.3103 119.2186 57.4548 32.6399 178.4397 23 G 3.8126 8.7902 110.5184 45.2361 0.0000 174.9506 24 G 3.9365 8.0622 108.3582 45.1478 0.0000 174.3310 25 R 4.2409 7.1364 119.5896 57.4145 31.3600 175.2076 26 E 5.2848 8.7491 121.1916 55.2145 34.8728 174.1317 27 F 5.6731 9.3953 119.4892 54.8160 43.6284 174.4973 28 R 5.0038 8.4209 120.3128 55.3059 33.8743 174.4372 29 G 4.4768 8.4158 111.1880 46.4083 0.0000 170.6730 30 T 4.9860 8.4569 117.4487 61.8175 70.4196 174.5207 31 L 4.4599 8.5716 129.2488 55.6293 42.4206 176.4526 32 D 5.0427 9.2888 126.3191 54.7976 43.3404 175.6186 33 G 4.2548 7.6553 103.4834 46.1106 0.0000 171.5891 34 Y 5.9219 7.8485 115.7512 57.2813 40.3467 172.6445 35 D 4.9028 8.3132 119.4665 50.9242 42.9129 176.2974 36 I 3.7378 8.3407 112.1150 64.4217 37.5106 176.6932 37 H 4.3974 8.5172 116.2613 56.1404 28.6058 175.5668 38 M 3.1800 8.6210 119.2361 56.3285 31.2745 175.5189 39 N 4.9148 8.2800 114.0354 52.8595 39.9908 174.0822 40 L 5.3687 8.8666 121.9587 52.9145 46.2330 175.5486 41 V 4.8279 8.7385 120.4147 61.2445 34.3699 174.2726 42 L 5.3082 8.8828 127.5203 52.9471 45.1178 175.5431 43 L 5.0057 8.9263 122.1131 53.1069 45.0257 175.9474 44 D 4.1980 8.3142 119.9346 55.6657 38.9922 172.6359 45 A 5.2136 7.8558 121.3811 50.2503 23.3780 176.6344 46 E 4.9795 8.9992 117.9574 54.5135 33.4567 174.9020 47 E 4.0386 8.2146 124.2602 54.8749 31.3229 174.8717 48 I 4.8523 8.1122 127.3032 59.8848 40.9677 175.0201 49 Q 4.2361 8.4943 122.0475 56.2142 31.3000 173.3788 50 N 4.1191 8.9355 126.7397 54.3986 34.7248 175.9360 51 G 3.9848 8.5795 103.8909 45.5268 0.0000 173.4008 52 E 4.5278 7.4710 116.9701 53.8497 32.4804 174.7633 53 V 3.9163 8.3968 121.9196 63.6436 31.3107 175.7086 54 V 4.1452 8.3022 120.9754 61.5777 31.7615 176.0005 55 R 4.4981 7.2041 118.1292 55.6525 34.5871 173.5110 56 K 4.8785 8.5858 119.1132 55.0249 35.6890 176.4847 57 V 4.4599 8.6379 117.4323 59.3211 35.4290 177.0993 58 G 3.8258 8.9277 111.6833 49.4634 0.0000 173.2135 59 S 5.2424 7.6287 111.3145 57.5853 65.6112 174.8008 60 V 4.4700 8.8395 120.7006 61.2623 35.3845 174.0456 61 V 4.6065 8.3526 125.9047 61.3439 33.2073 174.4729 62 I 4.3829 8.4898 129.6752 59.1287 39.7654 175.7607 63 R 4.2796 8.5763 126.2278 56.0474 30.7031 177.4686 64 G 4.2842 10.0718 113.5080 47.5432 0.0000 174.9619 65 D 4.3700 8.1157 118.1786 56.7439 41.5019 176.8588 66 T 4.1967 8.0040 108.0651 62.1730 69.5104 174.6026 67 V 3.9425 7.5140 123.6440 62.9883 32.1056 175.1416 68 V 4.2099 8.7065 128.4099 64.6053 32.1655 175.5988 69 F 5.0878 7.2857 113.0303 55.9067 41.1164 172.5785 70 V 5.2750 8.5236 119.0619 61.4636 34.4414 174.5896 71 S 4.7861 9.2339 120.8212 56.1385 66.5960 171.8240 72 P 4.7134 0.0000 0.0000 62.7538 32.0781 176.3243 73 A 4.2979 8.7566 125.2659 52.4341 19.1563 176.0496 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 3 P 0.00 4.43 0.00 2.06 2.17 0.00 3.58 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 2.07 0.00 4 R 7.39 4.55 0.00 1.98 1.99 0.00 2.82 0.00 0.00 3.19 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.77 0.00 5 P 0.00 4.15 0.00 2.16 2.15 0.00 3.61 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 6 L 7.94 3.87 0.00 1.64 1.85 1.12 1.05 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 7 D 7.98 4.48 0.00 2.83 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 8 V 7.52 3.57 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 0.98 0.00 0.00 0.95 0.00 0.00 9 L 7.50 4.03 0.00 1.06 0.66 0.66 0.16 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 10 N 7.69 4.46 0.00 2.91 2.96 0.00 0.00 7.21 7.58 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 11 R 7.20 3.99 0.00 2.09 1.98 0.00 3.19 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 12 S 7.48 4.50 0.00 3.87 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 13 L 7.30 4.20 0.00 1.82 1.68 1.09 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 14 K 9.38 3.97 0.00 1.89 1.97 0.00 1.69 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.42 7.81 15 S 7.71 4.85 0.00 3.90 3.69 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 0.00 16 P 0.00 4.92 0.00 2.13 2.21 0.00 3.65 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 2.09 2.02 0.00 17 V 9.28 5.03 2.20 0.00 0.00 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 1.01 0.00 0.00 18 I 9.33 4.73 2.03 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.75 1.04 0.00 0.00 19 V 9.11 4.68 2.15 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 0.92 0.00 0.00 0.95 0.00 0.00 20 R 8.17 4.54 0.00 1.31 0.66 0.00 2.94 0.00 0.00 3.09 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.33 0.00 21 L 8.16 4.90 0.00 1.59 1.72 1.12 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 22 K 8.31 4.10 0.00 1.66 1.73 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.54 7.81 23 G 8.79 3.81 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 0.00 0.00 0.00 24 G 8.06 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 25 R 7.14 4.24 0.00 1.88 1.85 0.00 3.21 0.00 0.00 3.35 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 26 E 8.75 5.28 0.00 1.86 1.72 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 2.13 2.40 0.00 27 F 9.40 5.67 0.00 2.90 2.89 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 28 R 8.42 5.00 0.00 1.72 1.82 0.00 3.16 0.00 0.00 3.36 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 29 G 8.42 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.46 4.99 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 8.57 4.46 0.00 1.84 1.77 1.08 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 32 D 9.29 5.04 0.00 2.65 2.65 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 0.00 0.00 0.00 0.00 33 G 7.66 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 0.00 0.00 0.00 0.00 34 Y 7.85 5.92 0.00 2.92 2.89 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 35 D 8.31 4.90 0.00 2.82 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 8.34 3.74 1.83 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.23 0.90 0.00 0.00 37 H 8.52 4.40 0.00 3.40 3.36 0.00 5.73 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 M 8.62 3.18 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.51 0.00 39 N 8.28 4.91 0.00 2.98 2.72 0.00 0.00 6.79 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 40 L 8.87 5.37 0.00 1.49 1.51 0.90 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.74 4.83 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 0.97 0.00 0.00 0.91 0.00 0.00 42 L 8.88 5.31 0.00 1.55 1.52 0.95 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.93 5.01 0.00 1.55 1.54 0.99 1.07 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 44 D 8.31 4.20 0.00 2.69 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 45 A 7.86 5.21 1.40 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 0.00 0.00 0.00 46 E 9.00 4.98 0.00 1.84 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 0.00 2.20 2.22 0.00 47 E 8.21 4.04 0.00 1.35 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 1.93 1.54 0.00 48 I 8.11 4.85 1.77 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.40 0.86 0.00 0.00 49 Q 8.49 4.24 0.00 1.97 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.39 0.00 0.00 0.00 0.00 0.00 2.19 2.25 0.00 50 N 8.94 4.12 0.00 2.90 2.96 0.00 0.00 7.20 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 51 G 8.58 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.47 4.53 0.00 2.06 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 2.38 2.24 0.00 53 V 8.40 3.92 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 0.79 0.00 0.00 0.90 0.00 0.00 54 V 8.30 4.15 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 0.70 0.00 0.00 0.86 0.00 0.00 55 R 7.20 4.50 0.00 1.60 1.75 0.00 3.23 0.00 0.00 3.32 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.50 0.00 56 K 8.59 4.88 0.00 1.57 1.67 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.73 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.44 7.81 57 V 8.64 4.46 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 1.04 0.00 0.00 1.15 0.00 0.00 58 G 8.93 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 59 S 7.63 5.24 0.00 3.91 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 8.84 4.47 1.76 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 0.85 0.00 0.00 0.98 0.00 0.00 61 V 8.35 4.61 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 0.84 0.00 0.00 0.90 0.00 0.00 62 I 8.49 4.38 1.71 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.13 0.78 0.00 0.00 63 R 8.58 4.28 0.00 1.82 1.85 0.00 3.30 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 1.70 1.56 0.00 64 G 10.07 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 65 D 8.12 4.37 0.00 2.64 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 66 T 8.00 4.20 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 1.21 0.00 0.00 67 V 7.51 3.94 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 0.75 0.00 0.00 0.96 0.00 0.00 68 V 8.71 4.21 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.92 0.00 0.00 69 F 7.29 5.09 0.00 3.03 3.11 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 0.00 0.00 0.00 0.00 70 V 8.52 5.28 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 0.89 0.00 0.00 0.96 0.00 0.00 71 S 9.23 4.79 0.00 3.87 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 P 0.00 4.71 0.00 1.96 2.03 0.00 3.61 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 2.02 2.10 0.00 73 A 8.76 4.30 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