NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 P 4.4546 0.0000 0.0000 62.6931 32.5872 175.3586 4 R 4.3294 7.4905 119.0202 56.1610 33.5642 176.4465 5 P 4.1968 0.0000 0.0000 65.7718 32.1312 178.1938 6 L 3.9577 7.9797 116.8945 57.8083 41.4474 179.3412 7 D 4.3730 7.9575 119.0093 57.3164 40.5510 178.7735 8 V 3.5893 7.3429 117.2859 65.8744 31.7545 177.7578 9 L 3.9328 7.6290 118.2693 57.6953 41.4650 178.7734 10 N 4.5479 7.6928 117.0025 56.7418 38.7595 176.5600 11 R 4.2298 7.9742 116.2927 57.5104 30.2858 177.0995 12 S 4.7358 7.7955 113.6692 56.6930 64.3311 173.8753 13 L 4.1586 7.6225 121.6130 56.5987 41.5493 177.7243 14 K 4.1809 9.2426 123.6815 55.9450 30.8935 176.5549 15 S 4.9032 8.0207 114.3409 56.0056 65.7027 172.1486 16 P 4.6796 0.0000 0.0000 63.4664 32.8159 175.3296 17 V 5.0302 8.6957 113.5068 60.4909 37.2673 173.3511 18 I 5.0889 8.7917 122.1963 59.7212 40.2223 175.1261 19 V 4.8869 8.9568 127.0092 60.9785 34.6667 174.0885 20 R 4.8394 8.1460 126.1574 54.4157 32.8244 174.1151 21 L 5.1420 8.4325 125.4640 52.4393 44.7123 175.9691 22 K 3.5507 8.9021 121.5591 58.6487 32.1052 175.7730 23 G 4.3075 9.4137 118.0499 44.5346 0.0000 175.6946 24 G 5.0714 7.2437 120.7318 46.3662 0.0000 173.4416 25 R 4.0768 7.3764 119.2221 56.5247 31.3306 175.8752 26 E 5.3089 8.4888 121.3285 54.6029 33.4835 174.9279 27 F 5.2092 9.4855 121.1391 55.7914 43.3141 174.5607 28 R 4.9744 8.5150 119.9951 55.2463 33.9167 174.8383 29 G 4.3928 8.2714 109.8271 46.1040 0.0000 171.5457 30 T 4.7538 8.1061 117.2167 62.8405 69.6503 174.5644 31 L 4.2301 8.5856 129.3228 55.7199 42.6167 176.1462 32 D 4.4844 9.5912 126.8749 56.0650 42.1586 175.8389 33 G 4.2714 7.3165 101.6386 47.2572 0.0000 169.9737 34 Y 5.2453 8.1482 117.2234 57.7507 39.8310 172.2624 35 D 4.4967 8.6246 116.3392 53.2902 41.8906 178.4975 36 I 3.3382 7.6293 122.1112 64.6639 37.8427 176.5311 37 H 4.2080 7.7189 115.1520 57.6231 28.6811 176.1770 38 M 3.4718 9.9280 118.0359 55.2771 31.9837 175.4352 39 N 4.8579 8.1761 113.4380 52.8629 40.1791 173.9688 40 L 5.2679 8.6729 120.7417 52.9468 46.7614 175.6136 41 V 4.7199 8.2408 119.0003 61.3643 34.4911 173.9746 42 L 5.2799 8.9442 128.0261 53.0055 44.8286 175.5813 43 L 4.9575 8.7948 122.0874 53.8219 44.8747 175.6563 44 D 4.7159 8.1440 116.5282 55.3128 38.4175 172.5622 45 A 5.7647 8.2553 123.6938 49.2803 23.5820 175.4702 46 E 5.1230 8.2867 116.5633 53.5041 34.0048 174.8436 47 E 3.7367 8.4629 124.3311 55.7130 30.6781 175.4857 48 I 4.7821 8.5533 125.9422 60.0637 41.7466 174.3891 49 Q 4.5883 8.3400 120.6640 56.1132 32.8324 174.5722 50 N 3.9835 10.1038 116.7539 54.2100 36.4244 174.4877 51 G 4.1273 9.4543 107.0693 45.4997 0.0000 173.7512 52 E 4.6873 7.8174 116.2990 54.8365 33.9062 173.9377 53 V 3.4034 7.1892 118.5351 58.4562 33.5853 175.2646 54 V 4.4731 7.4147 121.4738 63.0144 36.4455 173.0008 55 R 4.3743 7.4793 119.1386 56.7323 33.3331 172.2906 56 K 4.9437 8.4575 118.2509 55.4896 36.6749 176.8117 57 V 4.3032 8.7949 114.8213 60.4656 36.0114 175.4038 58 G 3.9143 9.0631 115.6591 48.3265 0.0000 172.6687 59 S 5.7026 7.2810 111.1207 58.5794 64.8526 176.9693 60 V 4.5014 7.6586 112.9881 59.9836 36.3407 174.0710 61 V 4.6017 8.3016 123.5119 61.4168 33.0678 174.7075 62 I 4.2173 8.1795 129.6406 60.0377 39.2126 175.7917 63 R 4.5856 8.4604 125.3369 55.3242 30.7810 177.6134 64 G 3.5633 9.6255 113.7481 48.3878 0.0000 174.7800 65 D 4.3794 8.0613 117.8482 56.9320 41.4905 176.9054 66 T 4.2169 8.6485 115.9508 64.3669 69.1113 174.9400 67 V 4.1290 7.3517 121.6081 62.7439 32.2755 174.7363 68 V 4.3865 8.4677 126.2906 64.0102 32.8825 175.4624 69 F 5.0869 7.2759 113.1769 55.7450 41.0360 172.5383 70 V 5.2646 8.5854 119.6047 61.3616 34.5768 174.8477 71 S 4.7277 9.0686 121.0506 56.0247 66.5457 171.5942 72 P 4.7596 0.0000 0.0000 62.9749 31.8422 176.0829 73 A 4.3503 8.4617 126.4566 50.7417 20.5723 174.3339 74 P 4.3655 0.0000 0.0000 65.2808 32.0078 177.3608 75 G 3.7341 7.8046 110.7934 45.6102 0.0000 172.0827 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 4.45 0.00 2.07 2.11 0.00 3.59 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 1.93 2.12 0.00 4 R 7.49 4.33 0.00 1.88 1.91 0.00 3.31 0.00 0.00 3.34 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 5 P 0.00 4.20 0.00 2.14 2.09 0.00 3.61 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 6 L 7.98 3.96 0.00 1.73 1.84 0.98 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 7 D 7.96 4.37 0.00 3.05 2.72 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 0.00 0.00 0.00 8 V 7.34 3.59 2.19 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 0.80 0.00 0.00 0.91 0.00 0.00 9 L 7.63 3.93 0.00 1.23 0.77 0.52 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 10 N 7.69 4.55 0.00 2.94 3.08 0.00 0.00 7.27 7.74 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 11 R 7.97 4.23 0.00 2.00 1.97 0.00 3.16 0.00 0.00 3.38 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 12 S 7.80 4.74 0.00 3.99 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 13 L 7.62 4.16 0.00 1.78 1.70 1.05 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 14 K 9.24 4.18 0.00 1.89 2.15 0.00 1.70 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.37 7.81 15 S 8.02 4.90 0.00 3.88 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 16 P 0.00 4.68 0.00 2.30 2.23 0.00 3.70 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 2.08 2.01 0.00 17 V 8.70 5.03 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 0.83 0.00 0.00 1.03 0.00 0.00 18 I 8.79 5.09 2.01 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.99 1.05 0.00 0.00 19 V 8.96 4.89 2.10 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 0.79 0.00 0.00 0.94 0.00 0.00 20 R 8.15 4.84 0.00 0.79 0.66 0.00 2.92 0.00 0.00 3.01 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.36 0.00 21 L 8.43 5.14 0.00 1.64 1.63 1.01 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 22 K 8.90 3.55 0.00 1.59 1.78 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.52 7.81 23 G 9.41 4.31 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 0.00 24 G 7.24 5.07 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 0.00 0.00 0.00 25 R 7.38 4.08 0.00 1.85 1.95 0.00 3.12 0.00 0.00 3.47 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.68 0.00 26 E 8.49 5.31 0.00 2.11 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 0.00 2.26 2.19 0.00 27 F 9.49 5.21 0.00 2.90 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 28 R 8.52 4.97 0.00 1.75 1.81 0.00 3.18 0.00 0.00 3.17 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 29 G 8.27 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 0.00 0.00 0.00 0.00 30 T 8.11 4.75 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 1.27 0.00 0.00 31 L 8.59 4.23 0.00 1.82 1.58 1.06 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 32 D 9.59 4.48 0.00 2.67 2.78 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 33 G 7.32 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 0.00 0.00 0.00 0.00 34 Y 8.15 5.25 0.00 3.03 2.95 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 35 D 8.62 4.50 0.00 2.86 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 7.63 3.34 1.79 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 1.38 0.36 0.85 0.00 0.00 37 H 7.72 4.21 0.00 3.31 3.35 0.00 5.62 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 M 9.93 3.47 0.00 2.14 2.47 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 2.44 2.44 0.00 39 N 8.18 4.86 0.00 2.90 2.81 0.00 0.00 6.78 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 8.67 5.27 0.00 1.53 1.53 0.88 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.24 4.72 2.19 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 1.07 0.00 0.00 0.93 0.00 0.00 42 L 8.94 5.28 0.00 1.59 1.56 0.91 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.79 4.96 0.00 1.57 1.55 1.01 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 44 D 8.14 4.72 0.00 2.75 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 8.26 5.76 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.29 5.12 0.00 1.81 1.81 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 2.27 2.12 0.00 47 E 8.46 3.74 0.00 1.58 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.71 0.00 48 I 8.55 4.78 1.79 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.84 0.93 0.00 0.00 49 Q 8.34 4.59 0.00 2.09 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.19 0.00 0.00 0.00 0.00 0.00 2.24 2.27 0.00 50 N 10.10 3.98 0.00 2.80 2.86 0.00 0.00 7.26 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 9.45 4.13 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 0.00 52 E 7.82 4.69 0.00 1.99 1.79 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 2.21 2.22 0.00 53 V 7.19 3.40 2.06 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 0.72 0.00 0.00 0.95 0.00 0.00 54 V 7.41 4.47 2.22 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 0.70 0.00 0.00 0.94 0.00 0.00 55 R 7.48 4.37 0.00 1.85 1.68 0.00 3.20 0.00 0.00 3.32 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.44 0.00 56 K 8.46 4.94 0.00 1.62 1.64 0.00 1.83 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.33 1.46 7.81 57 V 8.79 4.30 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 0.68 0.00 0.00 1.08 0.00 0.00 58 G 9.06 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 0.00 0.00 0.00 59 S 7.28 5.70 0.00 3.92 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 60 V 7.66 4.50 1.91 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 0.76 0.00 0.00 0.73 0.00 0.00 61 V 8.30 4.60 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 0.82 0.00 0.00 0.91 0.00 0.00 62 I 8.18 4.22 1.74 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.25 0.77 0.00 0.00 63 R 8.46 4.59 0.00 1.80 1.83 0.00 3.28 0.00 0.00 3.30 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.53 0.00 64 G 9.63 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.06 4.38 0.00 2.63 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 8.65 4.22 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 67 V 7.35 4.13 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 0.72 0.00 0.00 0.89 0.00 0.00 68 V 8.47 4.39 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 0.96 0.00 0.00 0.90 0.00 0.00 69 F 7.28 5.09 0.00 3.06 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 8.59 5.26 2.11 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 0.89 0.00 0.00 0.94 0.00 0.00 71 S 9.07 4.73 0.00 3.87 3.90 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 72 P 0.00 4.76 0.00 1.96 2.04 0.00 3.68 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 8.46 4.35 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 74 P 0.00 4.37 0.00 2.06 2.13 0.00 3.63 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 75 G 7.80 3.73 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 0.00 0.00 0.00