NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 L 4.1818 8.0433 122.4763 55.2143 44.0651 179.0428 20 K 3.7645 7.8192 117.5957 58.5620 32.1463 176.4472 21 G 3.7923 8.8098 107.7199 46.9559 0.0000 173.5567 22 L 4.3916 7.9917 119.3609 54.3169 43.0575 176.7377 23 V 3.8980 7.1930 118.0061 64.5831 31.7357 174.7152 24 N 4.2098 8.5877 120.5202 54.4421 36.9419 173.7421 25 H 4.8519 8.2896 115.0269 54.1485 32.0775 174.3014 26 R 4.6878 8.4382 121.1232 55.9035 30.7773 175.4707 27 V 4.9867 8.9442 119.7975 59.3703 36.4726 174.9247 28 G 4.3472 9.1219 108.6558 44.5803 0.0000 171.8504 29 V 4.8104 10.0442 125.4356 61.2582 32.9837 174.1906 30 K 4.5241 9.1125 129.9836 54.6700 33.6074 175.7080 31 L 4.2259 7.5746 125.9915 53.5924 42.2077 177.4668 32 K 3.9598 7.8600 120.7322 59.2787 31.9672 178.5611 33 F 4.5766 6.6817 113.2896 58.2267 38.4050 175.9818 34 N 4.7837 7.9107 115.6452 52.1707 39.1694 174.9614 35 S 4.2154 8.1033 111.6601 59.0482 60.9615 169.5990 36 T 4.8382 7.2142 114.7340 61.2083 71.0681 172.7756 37 E 4.7496 8.7193 126.5742 54.5673 32.7690 174.0057 38 Y 5.1385 8.8112 123.3549 56.5737 40.2616 174.7997 39 R 4.9698 9.6342 124.5354 53.8091 33.0691 176.4495 40 G 4.0445 8.1482 108.9285 46.7640 0.0000 171.0223 41 T 4.6586 8.2512 117.2126 63.0709 69.9816 174.8786 42 L 4.3600 8.8768 129.5755 54.0948 41.3009 177.0831 43 V 3.7598 8.3127 124.8818 64.8770 31.5594 175.8728 44 S 4.8127 7.3942 112.0037 57.4363 67.2978 171.7115 45 T 4.8403 7.9077 112.5464 62.9112 72.0316 172.4954 46 D 5.0180 8.1134 123.2083 50.3283 43.2802 176.4194 47 N 4.8168 8.2767 115.8623 52.9614 36.7050 175.5629 48 Y 4.5642 7.7299 112.5767 57.4160 42.3585 174.8520 49 F 3.6626 8.3865 115.9536 58.5677 36.9077 174.4207 50 N 5.1463 7.9963 118.9954 52.8724 39.9861 174.0635 51 L 4.9454 8.7387 121.7977 54.2438 44.5291 174.6344 52 Q 4.4671 8.6219 122.2510 54.5211 31.1181 173.9052 53 L 4.8990 8.5107 127.9915 53.2618 45.3076 174.5509 54 N 5.0745 9.8757 125.3676 51.9303 41.7280 173.8500 55 E 3.8091 8.4974 120.8331 57.3689 27.9052 175.4006 56 A 4.5979 7.7261 120.0334 52.1166 20.1447 177.7220 57 E 5.0473 9.8966 122.5611 54.3395 33.6689 173.7417 58 E 5.1162 8.6444 126.6630 54.5861 32.1870 174.3566 59 F 5.0247 9.1134 125.4715 55.6842 42.5041 174.1069 60 V 4.6588 9.3364 124.4401 60.2931 33.4805 175.1960 61 A 3.8616 9.3577 129.9663 53.1490 16.5766 177.6827 62 G 4.0351 8.7982 105.5165 46.7236 0.0000 174.1857 63 V 4.4628 7.8391 119.4221 60.6229 33.8243 174.4557 64 S 4.0363 8.4391 120.4357 58.0854 62.7131 173.5290 65 H 4.7165 8.3972 125.1232 55.9850 29.2931 173.6195 66 G 3.8932 7.1199 105.6954 44.6925 0.0000 173.6235 67 T 4.8516 8.1823 115.5393 61.5733 70.2511 174.4922 68 L 4.4346 8.3019 126.9680 54.1133 43.4420 178.9254 69 G 3.9400 8.8891 112.4136 47.1959 0.0000 175.4821 70 E 5.0642 9.4091 120.1921 54.6811 31.2749 175.3163 71 I 4.7200 8.4706 117.3355 59.0134 41.3676 174.2634 72 F 5.1564 8.9982 122.6222 56.0449 41.0758 174.6323 73 I 4.5015 9.1598 125.4527 59.6777 39.7524 174.9909 74 R 4.9842 8.6118 127.2643 55.8921 31.4839 177.8983 75 S 4.3245 9.3907 121.7595 61.5640 62.4980 173.4364 76 N 4.2884 8.4134 116.9411 56.3554 38.4344 175.9023 77 N 4.5486 8.6602 114.0628 54.2138 39.0628 174.7805 78 V 4.2555 7.4880 119.0081 61.7945 32.7678 174.9236 79 L 4.3506 9.4719 129.9211 56.5568 42.4569 175.7613 80 Y 4.9398 6.9501 113.9878 56.3692 40.9901 172.3085 81 I 5.3108 8.7821 120.9061 59.6519 40.1956 175.2149 82 R 4.8621 8.7790 121.7909 54.2518 33.0941 174.4287 83 E 4.7381 8.7451 118.3605 55.9912 31.6070 175.3545 84 L 4.6311 8.4574 120.7020 51.9026 44.2821 175.8092 85 P 4.2289 0.0000 0.0000 63.4709 32.1543 175.8763 86 N 4.5182 8.5570 122.2642 53.1784 37.3253 174.7661 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 19 L 8.04 4.18 0.00 1.48 1.55 0.10 0.31 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 20 K 7.82 3.76 0.00 1.92 1.85 0.00 1.71 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.47 7.81 21 G 8.81 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 22 L 7.99 4.39 0.00 1.75 1.67 0.89 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.19 3.90 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 0.82 0.00 0.00 0.97 0.00 0.00 24 N 8.59 4.21 0.00 2.86 2.79 0.00 0.00 6.87 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 25 H 8.29 4.85 0.00 3.27 3.20 0.00 5.80 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 R 8.44 4.69 0.00 1.90 1.83 0.00 3.12 0.00 0.00 3.59 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 27 V 8.94 4.99 2.23 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 0.76 0.00 0.00 0.99 0.00 0.00 28 G 9.12 4.35 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 0.00 29 V 10.04 4.81 2.31 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 1.00 0.00 0.00 1.07 0.00 0.00 30 K 9.11 4.52 0.00 1.21 0.74 0.00 1.34 0.00 0.00 1.40 0.00 0.00 2.76 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.59 1.02 7.81 31 L 7.57 4.23 0.00 1.32 1.05 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 32 K 7.86 3.96 0.00 1.49 1.76 0.00 1.95 0.00 0.00 1.87 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.29 1.30 7.81 33 F 6.68 4.58 0.00 3.13 3.16 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 34 N 7.91 4.78 0.00 2.77 2.85 0.00 0.00 6.81 7.57 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 35 S 8.10 4.22 0.00 4.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.21 4.84 4.11 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 1.04 0.00 0.00 37 E 8.72 4.75 0.00 1.93 1.71 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 2.16 2.21 0.00 38 Y 8.81 5.14 0.00 3.04 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 39 R 9.63 4.97 0.00 1.98 1.84 0.00 2.21 0.00 0.00 2.80 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.43 0.00 40 G 8.15 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 8.25 4.66 4.22 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 1.20 0.00 0.00 42 L 8.88 4.36 0.00 1.76 1.58 0.99 1.04 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 V 8.31 3.76 1.96 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 0.88 0.00 0.00 0.87 0.00 0.00 44 S 7.39 4.81 0.00 3.89 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 45 T 7.91 4.84 4.20 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 1.17 0.00 0.00 46 D 8.11 5.02 0.00 2.76 2.79 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 47 N 8.28 4.82 0.00 2.86 2.95 0.00 0.00 6.58 7.46 0.00 0.00 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 Y 7.73 4.56 0.00 3.26 2.93 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 49 F 8.39 3.66 0.00 3.29 3.25 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 50 N 8.00 5.15 0.00 2.98 2.84 0.00 0.00 6.54 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 51 L 8.74 4.95 0.00 1.72 1.69 0.97 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 52 Q 8.62 4.47 0.00 1.92 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.79 0.00 0.00 0.00 0.00 0.00 1.56 1.16 0.00 53 L 8.51 4.90 0.00 1.64 1.35 0.97 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 54 N 9.88 5.07 0.00 2.67 2.59 0.00 0.00 6.95 7.53 0.00 0.00 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 E 8.50 3.81 0.00 2.14 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 2.27 2.24 0.00 56 A 7.73 4.60 1.26 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 0.00 0.00 0.00 57 E 9.90 5.05 0.00 2.09 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 0.00 1.81 2.25 0.00 58 E 8.64 5.12 0.00 2.31 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 2.10 2.10 0.00 59 F 9.11 5.02 0.00 2.96 2.90 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 60 V 9.34 4.66 1.77 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 1.32 0.00 0.00 0.58 0.00 0.00 61 A 9.36 3.86 1.36 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 0.00 0.00 0.00 62 G 8.80 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 V 7.84 4.46 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 1.02 0.00 0.00 64 S 8.44 4.04 0.00 3.37 3.58 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 0.00 0.00 0.00 0.00 65 H 8.40 4.72 0.00 3.03 3.22 0.00 5.70 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 66 G 7.12 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 67 T 8.18 4.85 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 1.27 0.00 0.00 68 L 8.30 4.43 0.00 1.56 1.59 0.99 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.89 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 70 E 9.41 5.06 0.00 1.90 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 2.25 0.00 71 I 8.47 4.72 1.77 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.17 0.83 0.00 0.00 72 F 9.00 5.16 0.00 2.80 2.99 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 73 I 9.16 4.50 2.00 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 1.05 0.83 0.97 0.00 0.00 74 R 8.61 4.98 0.00 1.80 1.92 0.00 3.68 0.00 0.00 3.44 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.62 0.00 75 S 9.39 4.32 0.00 3.66 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 76 N 8.41 4.29 0.00 2.76 2.98 0.00 0.00 6.93 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 N 8.66 4.55 0.00 2.78 2.88 0.00 0.00 6.54 8.08 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 78 V 7.49 4.26 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 0.85 0.00 0.00 1.05 0.00 0.00 79 L 9.47 4.35 0.00 1.44 1.28 0.89 0.71 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 80 Y 6.95 4.94 0.00 2.99 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 8.78 5.31 1.98 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.95 1.03 0.00 0.00 82 R 8.78 4.86 0.00 1.84 1.90 0.00 2.76 0.00 0.00 3.28 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.73 0.00 83 E 8.75 4.74 0.00 1.96 1.95 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 2.23 2.33 0.00 84 L 8.46 4.63 0.00 1.63 1.55 0.94 0.92 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 85 P 0.00 4.23 0.00 2.01 2.09 0.00 3.64 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 86 N 8.56 4.52 0.00 2.77 2.80 0.00 0.00 6.68 7.43 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