NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3659 8.3044 120.3484 55.4227 32.7766 173.8999 2 E 3.8053 7.9303 121.2685 54.2046 30.6602 173.2545 3 P 4.1506 0.0000 0.0000 62.5344 31.9855 174.9657 4 N 4.1301 8.7918 122.0698 53.8650 38.8682 172.3048 5 P 4.6922 0.0000 0.0000 63.1459 31.4460 176.1027 6 N 4.8046 8.9342 114.9375 53.3048 39.1790 174.9566 7 R 4.4049 7.6572 115.4020 55.1026 30.8974 175.5278 8 Q 4.6845 8.2455 118.6489 53.2395 32.4523 173.1599 9 P 4.6084 0.0000 0.0000 62.1875 32.6268 175.4386 10 V 4.4320 7.9622 118.1504 61.1107 33.7004 174.4489 11 E 4.6292 8.3074 124.5419 54.5149 32.6948 174.9062 12 L 4.3419 8.1324 126.0848 52.5877 43.9384 175.8590 13 N 4.6311 8.4923 124.7380 52.1012 39.6643 175.7767 14 R 3.5684 8.2238 119.6761 59.8085 30.0941 178.2809 15 T 3.8997 7.7977 114.9827 66.8725 68.4231 176.5339 16 S 4.1564 9.5775 118.1150 61.2642 62.7752 176.3345 17 L 3.8967 7.6297 123.0265 58.4483 41.8200 178.5587 18 Y 4.4431 7.7371 116.3075 61.4392 37.7622 178.6033 19 L 4.2376 8.5783 120.2712 58.2234 41.7268 179.6052 20 G 3.6502 8.7230 105.9211 47.6322 0.0000 175.3653 21 L 4.0247 8.6198 122.0044 57.2355 41.8378 179.5025 22 L 3.9284 8.5206 120.2890 58.1257 41.8634 178.9503 23 L 3.9215 7.6715 120.0393 58.2225 42.1200 178.7406 24 I 3.6878 7.7623 119.6310 64.5138 37.0549 178.0289 25 L 3.9891 8.1240 119.5879 58.3453 41.5520 180.2127 26 V 3.6485 7.8419 111.8712 64.4003 31.4790 178.6294 27 L 4.1110 8.2707 118.6624 57.9228 41.4913 179.4255 28 A 4.0663 8.2086 120.6284 55.0789 18.0692 179.3838 29 L 4.0071 7.9213 117.9467 57.5653 42.1945 178.3203 30 L 4.1645 7.8744 119.7437 57.0668 42.5158 177.7455 31 F 4.5202 8.6671 117.1034 58.2199 39.4097 177.9906 32 S 3.6887 7.7065 114.6362 61.6154 62.5600 176.7161 33 S 4.1280 7.9949 118.0013 61.6372 62.3386 175.9937 34 Y 4.2993 7.7934 117.3452 60.3040 37.9152 177.5658 35 F 4.5851 8.1090 118.6951 60.6389 39.1491 177.4148 36 F 4.3442 8.6045 116.1816 58.7705 38.8478 175.1438 37 N 4.5335 8.0258 121.2450 53.9634 40.3000 173.3191 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 M 8.30 4.37 0.00 1.99 2.08 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.53 0.00 2 E 7.93 3.81 0.00 2.05 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 2.29 2.39 0.00 3 P 0.00 4.15 0.00 2.07 2.03 0.00 3.76 0.00 0.00 3.73 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 4 N 8.79 4.13 0.00 2.67 2.77 0.00 0.00 7.24 7.69 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 5 P 0.00 4.69 0.00 2.21 2.11 0.00 3.78 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 1.96 1.98 0.00 6 N 8.93 4.80 0.00 2.71 2.87 0.00 0.00 6.85 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 7 R 7.66 4.40 0.00 1.89 1.91 0.00 3.02 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.87 0.00 8 Q 8.25 4.68 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.05 0.00 0.00 0.00 0.00 0.00 2.24 2.35 0.00 9 P 0.00 4.61 0.00 2.17 2.04 0.00 3.72 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 10 V 7.96 4.43 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 0.81 0.00 0.00 0.92 0.00 0.00 11 E 8.31 4.63 0.00 1.88 1.72 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 2.16 2.26 0.00 12 L 8.13 4.34 0.00 1.54 1.47 0.90 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 13 N 8.49 4.63 0.00 2.99 2.92 0.00 0.00 5.82 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 14 R 8.22 3.57 0.00 1.74 1.81 0.00 3.14 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 1.30 0.00 15 T 7.80 3.90 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 16 S 9.58 4.16 0.00 3.85 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 17 L 7.63 3.90 0.00 1.65 1.58 0.91 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 18 Y 7.74 4.44 0.00 3.21 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 19 L 8.58 4.24 0.00 1.81 1.77 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 20 G 8.72 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 L 8.62 4.02 0.00 1.88 1.81 1.03 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 22 L 8.52 3.93 0.00 1.72 1.84 0.92 0.56 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 L 7.67 3.92 0.00 1.77 1.93 0.95 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 24 I 7.76 3.69 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.44 0.93 0.00 0.00 25 L 8.12 3.99 0.00 1.78 1.74 0.94 1.21 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 26 V 7.84 3.65 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 0.89 0.00 0.00 1.07 0.00 0.00 27 L 8.27 4.11 0.00 1.96 1.80 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 28 A 8.21 4.07 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.92 4.01 0.00 1.64 1.87 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 30 L 7.87 4.16 0.00 1.73 1.94 0.85 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 31 F 8.67 4.52 0.00 2.75 2.40 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.71 3.69 0.00 4.15 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 33 S 7.99 4.13 0.00 3.43 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 34 Y 7.79 4.30 0.00 3.30 3.20 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 0.00 35 F 8.11 4.59 0.00 2.84 2.88 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 F 8.60 4.34 0.00 3.07 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 37 N 8.03 4.53 0.00 3.12 2.95 0.00 0.00 7.03 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00