NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.1951 8.2549 121.1072 56.1832 31.3026 174.5467 2 L 4.3929 8.2060 125.9322 52.6346 44.4108 173.9057 3 K 5.0442 7.9755 119.3617 55.0932 36.3024 175.1092 4 G 4.2368 8.1647 107.6800 46.3632 0.0000 172.0047 5 K 5.2212 8.5199 118.7679 53.9738 35.9030 176.1905 6 V 3.7068 8.6772 124.6620 63.4898 31.8187 176.3937 7 K 4.2034 8.7342 130.5698 58.6054 32.4391 176.7811 8 W 5.0498 7.5915 114.1058 55.8154 31.0165 172.5893 9 F 4.9193 9.0273 122.9683 56.7992 42.3365 173.3301 10 N 4.7022 8.6595 125.6626 52.3712 38.8423 175.6727 11 S 4.6622 8.8460 122.7861 60.4631 63.6230 175.8032 12 E 4.2800 8.1239 119.5132 58.7656 29.8965 177.9041 13 K 4.1612 7.8485 116.5460 59.6242 32.6851 177.7404 14 G 4.2464 7.8111 105.2822 44.9761 0.0000 172.6163 15 F 5.2766 7.2145 114.2500 53.4799 41.9488 174.0224 16 G 2.5667 6.6617 102.3553 46.3455 0.0000 171.2816 17 F 4.9724 7.0305 116.8530 55.5299 43.5901 174.2576 18 I 4.8133 8.9044 122.6542 59.5055 39.4934 174.4636 19 E 5.2804 9.4842 125.5690 54.7242 31.0073 175.3181 20 V 4.7893 8.1117 120.7091 59.9403 35.1568 174.3844 21 E 4.2983 8.8834 124.2749 57.7616 29.6651 174.8942 22 G 3.8882 8.7714 116.2840 45.9317 0.0000 173.7670 23 Q 4.5110 7.0745 115.7141 53.3631 30.7750 174.8792 24 D 4.7442 8.2519 119.3874 53.7750 41.7304 176.0069 25 D 4.8336 8.5075 120.2051 54.7437 41.6114 176.2896 26 V 4.4413 8.7947 122.8984 61.0208 34.0302 174.5360 27 F 3.8328 8.5890 130.1812 57.5882 40.9964 174.1258 28 V 4.2023 7.1737 124.6891 59.9843 34.1497 173.9745 29 H 4.9768 8.2099 124.5166 53.9483 31.8717 175.2467 30 F 4.2141 8.9185 119.9442 60.0520 37.6027 177.8769 31 S 3.9648 6.5235 114.0459 60.5936 62.8656 174.9989 32 A 4.0510 8.0537 123.5723 53.4202 18.4325 176.7915 33 I 4.3809 7.7027 118.3111 60.5457 37.3370 176.1578 34 Q 4.2612 8.6630 125.5913 55.3239 29.8839 174.1608 35 G 3.7439 8.2242 103.5032 44.5211 0.0000 173.0404 36 E 4.4973 8.6061 118.0179 55.6268 31.8297 176.9586 37 G 3.7877 8.4718 109.0411 44.4116 0.0000 172.3670 38 F 4.0590 8.6125 121.1759 57.6480 39.2788 175.3316 39 K 3.8672 7.9651 128.3957 57.1366 31.6509 176.0249 40 T 4.2505 7.6934 117.0236 61.0934 70.3248 171.8806 41 L 4.7281 6.5725 121.8922 52.7555 45.4844 175.8336 42 E 4.8658 9.6103 120.2205 54.0303 32.8823 175.7965 43 E 4.3469 8.5813 119.2929 57.7075 30.5029 175.3756 44 G 4.2434 9.1691 110.2194 45.6523 0.0000 174.1853 45 Q 3.9241 7.3500 115.7807 55.8232 29.9632 176.8596 46 A 4.9247 8.6543 124.9620 51.1573 20.8701 176.4491 47 V 5.0715 8.7718 114.4538 59.5101 36.5689 174.7058 48 S 5.3581 8.4264 116.0641 57.0708 66.4103 173.0327 49 F 5.0393 8.1172 115.5174 56.8576 41.7265 171.7854 50 E 4.9667 9.2450 117.7650 54.6979 33.9577 175.0938 51 I 4.9699 8.3200 121.1647 59.8610 39.2730 175.4684 52 V 4.4220 8.6602 127.4530 61.0073 33.9172 173.9067 53 E 5.0756 8.3017 127.6084 53.1441 31.4413 174.7898 54 G 4.2291 8.6413 117.3292 45.8073 0.0000 173.7542 55 N 4.7219 8.7956 122.6866 52.9813 37.7013 175.6068 56 R 4.2681 8.0404 117.0022 55.9017 30.4954 175.7107 57 G 3.9295 7.7750 103.7896 44.0934 0.0000 171.0746 58 P 4.9366 0.0000 0.0000 62.8109 32.2398 175.5284 59 Q 4.7769 8.1502 118.3922 55.2901 32.1918 172.9604 60 A 4.8607 9.2213 126.7345 52.0390 19.4029 176.8879 61 A 4.5357 8.6065 120.6427 50.5152 23.1729 175.7361 62 N 4.1322 8.7803 116.5955 54.5665 37.3179 175.0074 63 V 4.1522 8.3531 118.8858 63.0769 32.8399 174.6898 64 T 4.8359 8.6800 119.2121 60.1300 71.1612 173.6452 65 I 4.4681 9.1557 125.1904 59.5671 38.5215 173.4503 66 E 5.0927 8.3614 124.8766 53.4408 32.5494 176.4770 67 A 4.1101 8.1683 128.1228 53.1398 19.1436 176.3635 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 R 8.25 4.20 0.00 1.77 1.82 0.00 3.13 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.73 0.00 2 L 8.21 4.39 0.00 0.27 1.08 0.66 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 3 K 7.98 5.04 0.00 1.60 1.70 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.26 1.36 7.81 4 G 8.16 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 0.00 0.00 0.00 0.00 5 K 8.52 5.22 0.00 1.70 1.70 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.38 7.81 6 V 8.68 3.71 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 0.89 0.00 0.00 0.85 0.00 0.00 7 K 8.73 4.20 0.00 1.94 2.03 0.00 2.09 0.00 0.00 1.99 0.00 0.00 3.12 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.78 1.55 7.81 8 W 7.59 5.05 0.00 3.45 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 9 F 9.03 4.92 0.00 2.88 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 10 N 8.66 4.70 0.00 2.61 2.06 0.00 0.00 6.97 8.27 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 11 S 8.85 4.66 0.00 4.03 4.08 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 0.00 0.00 0.00 0.00 12 E 8.12 4.28 0.00 1.94 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 2.30 2.41 0.00 13 K 7.85 4.16 0.00 1.53 2.12 0.00 1.93 0.00 0.00 1.81 0.00 0.00 3.08 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.46 1.56 7.81 14 G 7.81 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 15 F 7.21 5.28 0.00 2.67 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 16 G 6.66 2.57 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 0.00 0.00 0.00 0.00 0.00 0.00 17 F 7.03 4.97 0.00 2.63 2.83 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 18 I 8.90 4.81 1.43 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.48 0.50 0.00 0.00 19 E 9.48 5.28 0.00 2.04 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 0.00 2.50 2.28 0.00 20 V 8.11 4.79 2.27 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 1.05 0.00 0.00 1.01 0.00 0.00 21 E 8.88 4.30 0.00 2.01 1.98 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 2.35 2.27 0.00 22 G 8.77 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 0.00 0.00 0.00 23 Q 7.07 4.51 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.88 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 24 D 8.25 4.74 0.00 2.74 2.69 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 25 D 8.51 4.83 0.00 2.72 2.92 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 0.00 0.00 0.00 26 V 8.79 4.44 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 0.88 0.00 0.00 1.05 0.00 0.00 27 F 8.59 3.83 0.00 2.61 2.63 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 0.00 0.00 0.00 28 V 7.17 4.20 1.73 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 0.47 0.00 0.00 0.73 0.00 0.00 29 H 8.21 4.98 0.00 2.98 2.98 0.00 5.70 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 F 8.92 4.21 0.00 3.10 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 S 6.52 3.96 0.00 3.80 3.47 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.05 4.05 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 33 I 7.70 4.38 1.91 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.62 0.81 0.00 0.00 34 Q 8.66 4.26 0.00 2.06 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.03 0.00 0.00 0.00 0.00 0.00 2.26 2.44 0.00 35 G 8.22 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 36 E 8.61 4.50 0.00 1.95 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 2.22 2.22 0.00 37 G 8.47 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 38 F 8.61 4.06 0.00 2.92 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 39 K 7.97 3.87 0.00 1.57 1.72 0.00 1.96 0.00 0.00 1.95 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.35 7.81 40 T 7.69 4.25 4.32 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 1.25 0.00 0.00 41 L 6.57 4.73 0.00 0.60 1.21 0.63 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 42 E 9.61 4.87 0.00 1.92 1.82 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 2.22 2.17 0.00 43 E 8.58 4.35 0.00 2.31 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 0.00 2.34 2.36 0.00 44 G 9.17 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 0.00 0.00 0.00 0.00 45 Q 7.35 3.92 0.00 2.26 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.83 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 46 A 8.65 4.92 1.25 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 47 V 8.77 5.07 2.14 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 0.66 0.00 0.00 0.94 0.00 0.00 48 S 8.43 5.36 0.00 3.85 3.91 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 49 F 8.12 5.04 0.00 3.24 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 50 E 9.24 4.97 0.00 1.89 1.84 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 2.15 2.16 0.00 51 I 8.32 4.97 1.94 0.00 0.00 1.00 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 0.85 0.98 0.00 0.00 52 V 8.66 4.42 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 0.93 0.00 0.00 0.95 0.00 0.00 53 E 8.30 5.08 0.00 1.98 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 2.17 2.12 0.00 54 G 8.64 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 0.00 0.00 0.00 0.00 55 N 8.80 4.72 0.00 2.80 2.91 0.00 0.00 5.59 7.66 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 56 R 8.04 4.27 0.00 1.70 1.86 0.00 3.16 0.00 0.00 3.13 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.49 0.00 57 G 7.78 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 58 P 0.00 4.94 0.00 2.14 2.10 0.00 3.42 0.00 0.00 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.84 0.00 59 Q 8.15 4.78 0.00 2.15 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.10 0.00 0.00 0.00 0.00 0.00 2.53 2.64 0.00 60 A 9.22 4.86 1.01 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 0.00 0.00 61 A 8.61 4.54 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 62 N 8.78 4.13 0.00 2.87 2.92 0.00 0.00 7.00 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 63 V 8.35 4.15 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 0.63 0.00 0.00 0.86 0.00 0.00 64 T 8.68 4.84 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 65 I 9.16 4.47 1.84 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 1.15 0.52 0.92 0.00 0.00 66 E 8.36 5.09 0.00 2.03 2.01 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 2.10 2.13 0.00 67 A 8.17 4.11 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00