NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 F 4.8589 8.3249 119.3922 57.8682 41.2029 175.5535 7 T 4.2780 7.7639 115.9996 62.0809 67.1142 174.2166 8 D 4.6435 7.8792 122.4862 55.1316 42.7939 176.6642 9 S 4.3368 8.0824 113.6181 61.2338 63.4120 174.8471 10 Y 4.3528 7.9108 121.8463 59.4653 39.3687 176.6175 11 S 3.6053 7.6409 113.4854 58.9480 63.5383 175.9642 12 R 3.8113 7.1859 122.6789 59.9577 29.9614 177.6961 13 Y 4.3267 7.2558 116.2228 59.3278 37.9282 177.4245 14 R 3.8611 6.5996 119.4147 58.4032 29.7889 177.9727 15 K 4.2600 7.2135 115.3917 57.4304 32.1160 178.0030 16 Q 4.3696 7.9201 118.8897 57.0397 29.5879 176.1973 17 M 4.5138 7.8072 116.3203 54.9230 32.6551 176.5396 18 A 4.5174 7.0109 122.1675 53.9190 19.7758 179.4769 19 V 3.8522 7.6331 118.7512 64.1051 32.5427 178.0564 20 K 4.1809 7.9756 118.3219 58.9521 32.8443 178.1691 21 K 4.2026 7.8496 118.3709 59.1980 32.6710 177.8560 22 Y 4.2177 8.1962 119.6600 60.5241 38.7394 177.9836 23 L 3.4215 7.7336 119.6436 57.8584 41.6225 179.2480 24 A 4.1921 7.7500 117.3988 53.8133 19.1286 179.1604 25 A 4.0332 7.6942 119.8745 55.4063 18.3176 179.7934 26 V 3.8944 7.7911 116.2500 64.6059 31.9042 176.2710 27 L 4.9240 7.2108 117.2539 54.3224 41.8607 176.8305 28 G 4.2088 7.7084 107.0066 46.4307 0.0000 175.5007 29 K 4.0943 7.8385 119.7173 59.3774 32.5738 178.4085 30 R 3.9391 7.3110 116.5345 59.3377 30.1276 177.1104 31 Y 4.5051 7.4226 114.2517 58.0987 38.6643 174.6164 32 K 4.8555 8.5041 119.6490 58.1719 39.1639 176.7058 33 Q 4.7346 7.9050 117.0390 55.4756 31.4746 175.7114 34 R 4.4460 8.1404 120.7658 55.1973 29.2338 176.8552 35 V 3.1935 8.5350 109.1553 62.3836 28.6535 173.6874 36 K 4.2888 7.7911 118.0473 58.2277 32.8062 178.8039 37 N 4.4814 8.0266 115.8612 54.2709 37.7634 174.9172 38 K 4.1089 7.2905 123.3659 56.3939 32.4325 175.2038 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 6 F 8.32 4.86 0.00 3.11 3.08 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 7 T 7.76 4.28 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 1.21 0.00 0.00 8 D 7.88 4.64 0.00 2.85 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 9 S 8.08 4.34 0.00 4.18 4.06 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 0.00 0.00 0.00 0.00 10 Y 7.91 4.35 0.00 2.98 2.98 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 0.00 0.00 0.00 11 S 7.64 3.61 0.00 3.84 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 12 R 7.19 3.81 0.00 2.15 2.03 0.00 3.38 0.00 0.00 3.27 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.83 0.00 13 Y 7.26 4.33 0.00 3.18 3.14 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 14 R 6.60 3.86 0.00 1.66 1.71 0.00 3.03 0.00 0.00 2.82 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.69 0.00 15 K 7.21 4.26 0.00 1.81 1.82 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.41 1.60 7.81 16 Q 7.92 4.37 0.00 2.23 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.68 6.89 0.00 0.00 0.00 0.00 0.00 2.47 2.57 0.00 17 M 7.81 4.51 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.53 0.00 18 A 7.01 4.52 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.63 3.85 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 0.84 0.00 0.00 0.96 0.00 0.00 20 K 7.98 4.18 0.00 1.94 1.85 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.46 1.48 7.81 21 K 7.85 4.20 0.00 1.89 1.99 0.00 1.65 0.00 0.00 1.77 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.59 7.81 22 Y 8.20 4.22 0.00 3.11 3.28 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 0.00 23 L 7.73 3.42 0.00 1.82 1.62 0.93 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 24 A 7.75 4.19 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 25 A 7.69 4.03 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 V 7.79 3.89 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 1.16 0.00 0.00 1.15 0.00 0.00 27 L 7.21 4.92 0.00 1.96 1.64 0.60 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 28 G 7.71 4.21 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 0.00 0.00 0.00 29 K 7.84 4.09 0.00 1.99 1.82 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.80 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.55 7.81 30 R 7.31 3.94 0.00 1.25 1.67 0.00 3.15 0.00 0.00 3.06 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 31 Y 7.42 4.51 0.00 3.01 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 32 K 8.50 4.86 0.00 1.84 1.88 0.00 1.53 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.48 7.81 33 Q 7.90 4.73 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.90 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 34 R 8.14 4.45 0.00 1.94 1.13 0.00 3.50 0.00 0.00 3.39 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.70 0.00 35 V 8.53 3.19 1.90 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 0.69 0.00 0.00 0.80 0.00 0.00 36 K 7.79 4.29 0.00 1.84 1.87 0.00 1.67 0.00 0.00 1.87 0.00 0.00 3.10 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.48 1.41 7.81 37 N 8.03 4.48 0.00 2.79 2.94 0.00 0.00 5.71 7.01 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 38 K 7.29 4.11 0.00 1.63 1.61 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.29 1.34 7.81