NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.3299 8.1744 110.9432 62.0291 70.5011 173.5983 6 N 4.7771 7.9460 116.2712 53.7039 39.1559 171.9589 7 S 4.4782 8.6897 115.1689 58.1883 65.2523 173.4712 8 D 4.8820 8.5094 121.1051 54.5549 41.9215 175.5379 9 F 5.3237 7.8759 113.9000 55.4341 41.4749 174.1050 10 V 4.5827 8.7867 112.6839 59.6036 35.1039 174.8037 11 V 4.7430 8.7232 124.3186 61.4384 33.6278 174.4155 12 I 4.8609 9.2072 128.9493 59.4278 40.1562 174.2570 13 K 5.0207 8.9903 129.2480 54.1806 34.3302 175.1718 14 A 4.3439 8.5839 130.1963 52.5120 18.9659 177.4672 15 L 4.6436 9.0475 122.7247 54.8908 42.5746 175.9993 16 E 4.6794 7.6990 115.5431 54.6912 32.5702 174.3281 17 D 4.4698 8.3613 119.0080 55.5616 41.3377 176.9518 18 G 3.8709 8.4382 108.6574 45.8420 0.0000 173.9772 19 V 3.9019 7.4472 120.3412 62.8616 32.8573 174.5511 20 N 5.3350 9.0611 124.6122 51.4426 41.6973 173.5565 21 V 4.5051 8.6861 124.3848 61.5088 33.3400 174.1992 22 I 4.6797 8.7397 130.2368 59.4010 39.5707 175.1596 23 G 4.1631 8.7348 114.8874 45.1955 0.0000 172.4091 24 L 5.4892 8.9069 125.7047 53.0711 43.8081 176.3253 25 T 4.4795 8.8472 114.8964 61.9841 69.1365 174.1741 26 R 4.3721 7.7654 126.0481 56.8321 31.1555 175.1827 27 G 3.7450 8.7501 109.4764 44.0359 0.0000 173.9174 28 A 3.9621 8.5755 121.4671 54.3330 18.6827 177.8182 29 D 4.8120 7.2554 112.7809 53.2055 42.3211 176.0824 30 T 4.7604 8.3372 119.6232 61.9829 70.7768 173.3061 31 R 4.6064 8.8353 122.1786 54.6428 33.7569 174.0279 32 F 5.2816 8.5318 119.0774 57.8140 38.9282 175.3208 33 H 4.9560 9.0135 119.0970 56.3678 30.4543 174.3907 34 H 4.9043 7.7352 117.8881 54.6774 33.5151 171.8015 35 S 4.8412 8.2674 119.0525 56.4054 64.7193 172.4408 36 E 4.5184 9.1430 129.8515 54.5799 30.7781 174.9663 37 K 4.6285 8.6378 127.4460 56.6418 33.7892 176.1198 38 L 4.8835 9.1619 125.1995 52.9659 44.3657 176.1533 39 D 4.7516 9.2081 124.0026 52.6560 43.0404 175.9586 40 K 4.1164 9.0103 122.0310 58.6780 32.2257 177.1830 41 G 3.9926 9.2157 115.6313 45.0927 0.0000 173.3009 42 E 4.2934 8.0845 119.7350 56.1556 30.9337 175.9528 43 V 4.8720 8.2565 121.8076 61.0277 34.4425 174.1392 44 L 4.7071 9.1094 130.0703 53.2857 44.5614 174.8457 45 I 4.9378 8.4802 126.5166 59.6602 39.1474 174.6149 46 A 4.7312 9.0139 129.5180 50.0837 21.7685 175.2719 47 Q 4.8525 8.6011 120.8319 54.7841 30.6575 175.6323 48 F 4.7441 8.4344 120.7516 57.8220 39.7215 175.1600 49 T 4.7631 9.0869 112.0849 59.5890 72.1199 174.0030 50 E 3.9039 8.9279 121.4981 59.3529 29.5171 177.1796 51 H 4.6604 7.8901 113.7504 55.9682 29.9829 174.0908 52 T 5.0909 8.1041 116.7479 61.9519 71.3257 174.3147 53 S 5.0229 8.9824 119.9216 58.0294 64.7708 173.4209 54 A 5.1562 7.8775 121.2497 51.2551 22.5946 175.2736 55 I 5.0082 8.4792 120.1859 59.3983 41.0642 174.6423 56 K 4.5696 9.0787 128.2537 54.4430 34.8900 174.6062 57 V 4.8227 8.3991 126.5559 61.1312 33.8005 174.5486 58 R 4.5256 9.0273 126.7685 55.4584 33.0630 175.8373 59 G 4.0926 9.0321 108.9969 44.0406 0.0000 172.4436 60 K 4.5524 9.2348 120.5257 55.9308 33.1295 175.5461 61 A 5.1467 8.7950 128.3339 50.8010 23.3596 173.7959 62 Y 4.7999 9.0449 122.4035 56.4461 40.6095 174.4562 63 I 5.0399 8.4340 127.3830 59.5493 40.9313 174.3891 64 Q 5.0860 9.0920 125.2978 54.3858 32.0089 174.8481 65 T 4.8488 8.5309 112.5256 59.5426 72.4513 174.5280 66 R 3.7164 8.5530 120.5445 59.3883 29.8678 176.5536 67 H 4.6173 7.9944 112.8914 55.2175 29.6537 173.6445 68 G 3.7673 7.3581 105.6047 44.0957 0.0000 173.0528 69 V 4.5427 8.0493 112.7035 60.4401 33.1535 175.6478 70 I 4.6163 8.3735 122.8242 59.4627 42.0693 173.2760 71 E 5.1794 8.5753 126.0501 54.4536 31.9336 175.9991 72 S 4.5457 8.6582 119.2811 57.9868 64.9724 172.8947 73 E 4.9232 8.7802 120.6898 54.4809 32.3631 176.3513 74 G 3.7115 8.5912 111.1940 45.7264 0.0000 172.7068 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 5 T 8.17 4.33 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 1.23 0.00 0.00 6 N 7.95 4.78 0.00 2.79 2.83 0.00 0.00 7.27 6.75 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 7 S 8.69 4.48 0.00 4.10 3.97 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 0.00 0.00 0.00 8 D 8.51 4.88 0.00 2.81 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 9 F 7.88 5.32 0.00 3.01 2.96 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.79 4.58 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 0.58 0.00 0.00 0.88 0.00 0.00 11 V 8.72 4.74 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 1.17 0.00 0.00 1.17 0.00 0.00 12 I 9.21 4.86 1.87 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 1.09 0.43 0.92 0.00 0.00 13 K 8.99 5.02 0.00 1.86 1.77 0.00 1.61 0.00 0.00 1.59 0.00 0.00 2.83 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.37 7.81 14 A 8.58 4.34 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 15 L 9.05 4.64 0.00 1.65 1.73 1.02 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 16 E 7.70 4.68 0.00 2.02 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 0.00 2.34 2.33 0.00 17 D 8.36 4.47 0.00 2.69 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.44 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 19 V 7.45 3.90 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 0.97 0.00 0.00 1.05 0.00 0.00 20 N 9.06 5.34 0.00 2.57 2.59 0.00 0.00 6.32 7.30 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 21 V 8.69 4.51 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 0.89 0.00 0.00 0.90 0.00 0.00 22 I 8.74 4.68 1.40 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.42 0.09 0.00 0.00 23 G 8.73 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.91 5.49 0.00 1.88 1.73 0.96 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.85 4.48 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 1.36 0.00 0.00 26 R 7.77 4.37 0.00 1.91 1.97 0.00 3.20 0.00 0.00 3.08 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.44 0.00 27 G 8.75 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 28 A 8.58 3.96 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 29 D 7.26 4.81 0.00 2.74 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 30 T 8.34 4.76 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 1.28 0.00 0.00 31 R 8.84 4.61 0.00 1.80 1.90 0.00 2.75 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 32 F 8.53 5.28 0.00 2.91 2.87 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 0.00 0.00 0.00 33 H 9.01 4.96 0.00 3.18 3.50 0.00 5.75 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 7.74 4.90 0.00 3.30 3.09 0.00 5.80 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.27 4.84 0.00 3.74 3.60 0.00 0.00 0.00 0.00 0.00 0.00 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 9.14 4.52 0.00 2.15 1.80 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 2.26 2.29 0.00 37 K 8.64 4.63 0.00 1.79 1.78 0.00 1.57 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.46 7.81 38 L 9.16 4.88 0.00 1.53 1.59 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 39 D 9.21 4.75 0.00 2.59 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 40 K 9.01 4.12 0.00 1.73 1.75 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.46 7.81 41 G 9.22 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 42 E 8.08 4.29 0.00 2.05 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 2.33 0.00 43 V 8.26 4.87 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 0.80 0.00 0.00 0.94 0.00 0.00 44 L 9.11 4.71 0.00 1.73 1.47 0.90 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 45 I 8.48 4.94 1.76 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.77 0.69 0.00 0.00 46 A 9.01 4.73 1.12 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 0.00 0.00 0.00 0.00 0.00 47 Q 8.60 4.85 0.00 1.97 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.90 0.00 0.00 0.00 0.00 0.00 2.46 2.41 0.00 48 F 8.43 4.74 0.00 3.04 2.96 0.00 0.00 0.00 0.00 0.00 0.00 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 T 9.09 4.76 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 1.31 0.00 0.00 50 E 8.93 3.90 0.00 1.93 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 0.00 2.11 2.31 0.00 51 H 7.89 4.66 0.00 3.19 3.23 0.00 5.80 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.10 5.09 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 1.31 0.00 0.00 53 S 8.98 5.02 0.00 3.85 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 54 A 7.88 5.16 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 55 I 8.48 5.01 1.84 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.66 0.82 0.00 0.00 56 K 9.08 4.57 0.00 1.67 1.38 0.00 1.57 0.00 0.00 1.38 0.00 0.00 2.82 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.25 1.32 7.81 57 V 8.40 4.82 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 0.86 0.00 0.00 0.89 0.00 0.00 58 R 9.03 4.53 0.00 1.72 1.75 0.00 3.09 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.45 0.00 59 G 9.03 4.09 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 0.00 0.00 0.00 60 K 9.23 4.55 0.00 1.85 1.72 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.42 7.81 61 A 8.79 5.15 1.23 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 62 Y 9.04 4.80 0.00 3.04 2.85 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 63 I 8.43 5.04 1.90 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 1.21 0.53 0.87 0.00 0.00 64 Q 9.09 5.09 0.00 1.99 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.54 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 65 T 8.53 4.85 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 1.17 0.00 0.00 66 R 8.55 3.72 0.00 1.61 1.80 0.00 3.20 0.00 0.00 3.17 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.58 0.00 67 H 7.99 4.62 0.00 3.16 3.27 0.00 5.69 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 7.36 3.77 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 0.00 0.00 0.00 69 V 8.05 4.54 1.75 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 0.66 0.00 0.00 0.54 0.00 0.00 70 I 8.37 4.62 1.81 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 1.19 1.48 0.85 0.00 0.00 71 E 8.58 5.18 0.00 1.84 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 2.47 2.26 0.00 72 S 8.66 4.55 0.00 4.00 3.97 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 0.00 0.00 0.00 73 E 8.78 4.92 0.00 1.83 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 2.20 2.27 0.00 74 G 8.59 3.71 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 0.00 0.00 0.00