NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3386 8.2649 123.5832 51.9308 19.8694 176.4855 2 V 3.7826 8.1827 111.3606 62.9727 31.8660 176.0832 3 C 5.1862 7.6237 115.9014 53.9873 41.6242 171.6407 4 P 4.6320 0.0000 0.0000 62.4238 31.9009 176.0788 5 T 4.3186 8.1712 110.8102 62.8337 70.5156 173.7801 6 G 4.1447 8.3960 107.8091 44.2710 0.0000 175.0776 7 L 3.8414 9.1529 125.2162 57.5712 42.3528 177.9637 8 F 5.1245 7.9244 115.7766 56.7240 38.4269 176.1305 9 S 5.1441 7.7512 111.8792 57.9531 64.1293 173.6505 10 N 5.0080 8.1592 120.8094 51.0748 40.2515 172.1981 11 P 5.1678 0.0000 0.0000 62.4987 32.5650 175.6889 12 L 5.0733 9.7404 122.8370 53.3443 46.8517 174.5325 13 C 5.2848 9.4707 120.1695 56.0893 38.0987 172.3033 14 C 5.5914 9.1014 120.9962 54.8430 43.6297 175.0503 15 A 3.9640 8.5895 123.9349 55.3005 18.4773 177.5222 16 T 4.2001 7.5305 106.9415 61.7469 71.2892 171.7334 17 N 5.2089 8.4112 123.7157 51.1561 39.9786 172.8138 18 V 3.6624 8.6673 125.6366 63.9080 32.7099 175.5940 19 L 3.8152 9.5278 125.6112 55.3254 39.4049 173.8033 20 D 4.5994 8.1549 114.6221 55.1828 39.0316 174.6303 21 L 4.8587 8.7596 116.9069 55.3170 48.8140 176.1263 22 I 4.8100 7.8176 120.3918 59.2310 39.2981 175.5629 23 G 4.0293 9.3644 116.7987 46.1218 0.0000 171.7931 24 V 4.6057 8.5275 125.3271 61.2999 34.8578 174.6690 25 D 4.3841 8.7294 122.8894 55.4096 39.5504 173.9647 26 C 4.9327 8.0795 113.4288 57.0394 38.8919 173.7740 27 K 4.5755 8.6452 116.1863 55.7936 36.7191 175.6880 28 T 4.3631 8.6662 121.9262 62.7083 69.0261 172.8762 29 P 4.5108 0.0000 0.0000 63.4685 31.9190 176.1912 30 T 4.5719 8.7556 109.8832 61.2159 69.1205 173.4411 31 I 4.5369 7.0617 113.6255 59.2872 40.6693 174.0630 32 A 4.1130 8.3344 124.0391 52.1018 18.7165 178.3683 33 V 4.2659 7.8859 116.4748 59.7124 31.6087 175.0985 34 D 4.4835 8.4437 124.1509 56.0084 41.7175 177.6704 35 T 4.8163 7.5247 108.3469 59.5137 72.6078 175.3031 36 G 3.7788 8.6544 108.5880 47.9572 0.0000 175.8221 37 A 4.0467 8.0048 122.4679 55.2759 18.5007 179.7083 38 I 3.7613 7.7208 117.9209 64.1702 37.1175 178.4030 39 F 4.4676 8.4305 121.6507 61.5489 39.2082 176.9469 40 Q 3.7486 8.5250 119.2081 59.0813 28.8656 178.0635 41 A 3.9799 8.2022 121.8028 55.4011 18.2178 178.9908 42 H 4.1717 8.5395 115.9404 59.7299 30.2449 176.5889 43 C 4.3869 8.3268 118.0024 60.0132 39.3827 175.7458 44 A 4.0052 8.1944 122.5565 55.4415 17.6283 179.5129 45 S 4.0285 7.9620 110.6483 60.8928 62.4802 175.6152 46 K 4.4076 8.2629 118.9048 55.6479 32.3581 177.3259 47 G 3.8287 8.1447 107.9939 45.5097 0.0000 173.1777 48 S 4.7866 7.6261 114.7711 56.6667 65.8610 173.0828 49 K 4.6895 8.9057 120.0108 53.9415 35.0499 174.3830 50 P 4.1623 0.0000 0.0000 62.4229 32.3182 175.0892 51 L 5.1629 9.3751 124.3510 52.8932 46.4694 174.8173 52 C 5.5594 9.1346 118.4184 55.7847 40.8596 172.7556 53 C 5.6972 9.6776 121.4081 54.9633 43.7344 175.3728 54 V 4.2820 8.6104 111.9823 62.8613 31.4646 177.0492 55 A 4.6898 7.6920 121.9479 49.7140 21.9355 173.8929 56 P 4.4651 0.0000 0.0000 63.2266 31.8181 176.4302 57 V 4.1054 7.4235 113.0237 59.7930 32.3307 177.3851 58 A 4.3810 8.3690 133.3757 51.7688 16.7765 176.9922 59 D 4.6562 7.6934 121.2840 52.9965 42.5289 176.9753 60 Q 3.4773 8.5407 122.9036 57.4260 29.2183 172.6664 61 A 3.6939 9.6951 134.7463 51.7915 16.6222 176.2355 62 L 4.6959 7.8825 121.5746 54.1800 46.6098 174.4834 63 L 4.8284 8.5396 127.0213 55.3231 43.2105 176.2924 64 C 6.0122 9.4505 123.3407 56.0699 46.2678 172.8258 65 Q 4.6160 8.8169 116.4923 54.3214 31.8584 174.1124 66 K 4.2303 8.5552 121.8268 56.7242 32.7518 176.2625 67 A 4.3063 8.1945 129.2704 51.3937 19.2893 177.4419 68 I 3.4395 8.4003 122.1328 63.6195 37.8625 177.1787 69 G 3.9870 8.7644 114.8642 46.0364 0.0000 172.1612 70 T 3.7297 7.0330 113.2285 64.1990 68.0227 173.6125 71 F 4.4789 7.4706 120.6198 57.2714 37.6301 174.6835 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 4.34 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.18 3.78 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 0.62 0.00 0.00 3 C 7.62 5.19 0.00 2.92 3.20 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 0.00 0.00 0.00 0.00 4 P 0.00 4.63 0.00 2.28 2.21 0.00 3.96 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 2.32 2.02 0.00 5 T 8.17 4.32 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 8.40 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 0.00 0.00 0.00 7 L 9.15 3.84 0.00 1.62 1.56 0.66 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 8 F 7.92 5.12 0.00 3.05 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 9 S 7.75 5.14 0.00 3.98 4.18 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 10 N 8.16 5.01 0.00 2.87 2.79 0.00 0.00 6.72 8.19 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 11 P 0.00 5.17 0.00 1.33 1.61 0.00 3.65 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.74 0.00 12 L 9.74 5.07 0.00 1.62 1.61 1.02 0.79 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 13 C 9.47 5.28 0.00 2.98 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 9.10 5.59 0.00 2.83 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 15 A 8.59 3.96 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.53 4.20 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 1.21 0.00 0.00 17 N 8.41 5.21 0.00 2.87 2.68 0.00 0.00 6.48 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 8.67 3.66 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.94 0.00 0.00 19 L 9.53 3.82 0.00 1.79 1.69 0.93 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.15 4.60 0.00 2.80 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 21 L 8.76 4.86 0.00 1.53 1.66 0.95 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.82 4.81 1.89 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 1.31 0.76 0.93 0.00 0.00 23 G 9.36 4.03 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 0.00 0.00 0.00 24 V 8.53 4.61 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 0.94 0.00 0.00 0.94 0.00 0.00 25 D 8.73 4.38 0.00 2.78 2.67 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 26 C 8.08 4.93 0.00 2.93 3.07 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 0.00 0.00 0.00 0.00 27 K 8.65 4.58 0.00 1.79 1.67 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.34 1.39 7.81 28 T 8.67 4.36 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 1.22 0.00 0.00 29 P 0.00 4.51 0.00 2.02 2.08 0.00 3.64 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 1.95 2.22 0.00 30 T 8.76 4.57 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 1.31 0.00 0.00 31 I 7.06 4.54 1.80 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.43 0.85 0.00 0.00 32 A 8.33 4.11 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 33 V 7.89 4.27 1.89 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 0.79 0.00 0.00 0.51 0.00 0.00 34 D 8.44 4.48 0.00 2.66 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 7.52 4.82 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 8.65 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 37 A 8.00 4.05 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.72 3.76 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 0.56 0.94 0.00 0.00 39 F 8.43 4.47 0.00 3.18 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 8.53 3.75 0.00 2.24 2.08 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 8.20 3.98 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 8.54 4.17 0.00 3.23 3.71 0.00 5.96 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 C 8.33 4.39 0.00 3.07 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 8.19 4.01 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.96 4.03 0.00 3.98 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 46 K 8.26 4.41 0.00 1.81 1.80 0.00 1.71 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.37 1.48 7.81 47 G 8.14 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 48 S 7.63 4.79 0.00 3.73 3.95 0.00 0.00 0.00 0.00 0.00 0.00 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 8.91 4.69 0.00 1.58 1.62 0.00 1.64 0.00 0.00 1.69 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.31 1.31 7.81 50 P 0.00 4.16 0.00 0.62 1.02 0.00 3.48 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 1.76 1.66 0.00 51 L 9.38 5.16 0.00 1.60 1.62 0.95 0.72 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 52 C 9.13 5.56 0.00 2.95 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 53 C 9.68 5.70 0.00 2.86 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 54 V 8.61 4.28 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 0.16 0.00 0.00 0.87 0.00 0.00 55 A 7.69 4.69 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 P 0.00 4.47 0.00 2.19 2.34 0.00 3.74 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 1.98 1.97 0.00 57 V 7.42 4.11 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 0.73 0.00 0.00 0.98 0.00 0.00 58 A 8.37 4.38 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 59 D 7.69 4.66 0.00 2.68 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 8.54 3.48 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.88 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 61 A 9.70 3.69 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 62 L 7.88 4.70 0.00 1.86 1.48 0.92 0.48 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 63 L 8.54 4.83 0.00 1.84 1.52 1.05 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 64 C 9.45 6.01 0.00 3.07 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 65 Q 8.82 4.62 0.00 1.75 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.98 0.00 0.00 0.00 0.00 0.00 1.69 2.02 0.00 66 K 8.56 4.23 0.00 1.75 1.71 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.67 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.43 7.81 67 A 8.19 4.31 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 68 I 8.40 3.44 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.43 0.93 0.00 0.00 69 G 8.76 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 0.00 0.00 0.00 70 T 7.03 3.73 4.15 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 0.77 0.00 0.00 71 F 7.47 4.48 0.00 3.07 2.91 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