NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4431 8.3049 120.3264 54.5750 33.9001 176.7025 2 K 4.2234 8.2069 118.8737 57.7503 32.5274 171.5673 3 V 4.9739 7.2227 118.8032 60.2161 34.5699 173.7630 4 R 4.3762 7.8778 120.7331 55.9968 31.4407 175.1992 5 A 3.8532 8.9157 122.9388 54.1985 18.7036 177.5083 6 S 4.5134 7.8942 110.5448 56.6879 62.6425 172.9530 7 V 4.3511 8.2013 127.7676 60.9300 32.9690 174.8339 8 K 4.7388 7.8612 125.7413 54.2609 36.1665 176.1932 9 R 4.0973 8.3996 119.6764 56.6173 30.5346 176.7093 10 I 3.9861 8.3092 124.1933 62.9503 38.0965 175.6114 11 C 4.9247 7.4611 112.8365 55.5674 32.3174 174.2209 12 D 4.4035 8.6047 118.7924 55.8922 38.7496 177.4667 13 K 4.2316 7.8872 117.2361 57.3168 32.6195 176.3441 14 C 4.5978 8.0986 118.4246 59.5446 28.6465 173.3063 15 K 4.5577 9.0553 123.3746 54.7896 34.9706 175.8044 16 V 4.5354 8.2870 123.7720 61.6298 31.0737 175.1450 17 I 4.1843 8.0044 127.0508 60.4108 39.2595 174.9615 18 R 5.0798 8.4254 123.7032 54.4898 31.3483 173.5179 19 R 4.4741 7.9970 121.1121 55.1869 32.0419 175.9295 20 H 3.7908 9.3329 118.0761 57.0141 25.5922 176.9644 21 G 4.0425 8.2601 105.7570 45.8555 0.0000 173.8125 22 R 4.6449 7.5386 118.8239 54.4170 32.5170 175.1075 23 V 4.4309 8.2675 120.6889 62.3047 31.6706 174.5961 24 Y 5.1925 8.8227 126.3535 56.4978 42.0043 174.9474 25 V 4.6282 8.1683 119.3142 62.3569 34.1173 174.0123 26 I 4.6398 8.4996 129.4445 60.9871 39.1963 174.5950 27 C 4.9230 8.1293 123.4153 58.8388 34.3996 173.7477 28 E 4.0413 8.9739 121.4977 58.7805 29.4996 176.1552 29 N 4.7750 7.8484 116.4995 50.5782 39.0257 173.3432 30 P 4.2815 0.0000 0.0000 66.2573 31.2141 178.5099 31 K 3.6436 7.2540 117.4240 59.2708 31.9865 177.1444 32 H 4.6134 7.9185 113.1301 55.7214 28.8173 174.9599 33 K 4.3516 9.0996 124.5117 56.8243 32.6694 176.0727 34 Q 5.0381 8.0117 126.2200 54.4978 32.1512 175.6691 35 R 3.9376 8.1100 115.3350 55.5150 33.0337 173.2845 36 Q 4.7532 8.5253 129.4673 56.0700 29.6161 176.3643 37 G 3.8475 8.4188 112.8661 47.1743 0.0000 172.8056 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 4.44 0.00 1.99 2.16 0.00 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.63 0.00 2 K 8.21 4.22 0.00 1.73 1.83 0.00 2.11 0.00 0.00 1.73 0.00 0.00 2.78 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.52 1.26 7.81 3 V 7.22 4.97 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 0.99 0.00 0.00 0.86 0.00 0.00 4 R 7.88 4.38 0.00 1.84 1.94 0.00 2.99 0.00 0.00 3.40 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.63 0.00 5 A 8.92 3.85 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 6 S 7.89 4.51 0.00 3.81 3.78 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 7 V 8.20 4.35 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 0.95 0.00 0.00 0.91 0.00 0.00 8 K 7.86 4.74 0.00 1.90 1.63 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.38 7.81 9 R 8.40 4.10 0.00 1.80 1.87 0.00 3.20 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.66 0.00 10 I 8.31 3.99 1.60 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.43 0.68 0.00 0.00 11 C 7.46 4.92 0.00 3.09 3.07 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 12 D 8.60 4.40 0.00 2.81 2.86 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.89 4.23 0.00 1.79 1.91 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 1.46 7.81 14 C 8.10 4.60 0.00 2.99 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 15 K 9.06 4.56 0.00 1.70 1.69 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.77 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.37 1.36 7.81 16 V 8.29 4.54 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 0.95 0.00 0.00 17 I 8.00 4.18 1.87 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 1.11 0.90 0.81 0.00 0.00 18 R 8.43 5.08 0.00 1.77 1.79 0.00 3.19 0.00 0.00 3.28 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 19 R 8.00 4.47 0.00 1.83 1.70 0.00 2.64 0.00 0.00 2.94 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.98 0.00 20 H 9.33 3.79 0.00 3.41 3.45 0.00 5.90 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 G 8.26 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 22 R 7.54 4.64 0.00 2.21 2.10 0.00 3.31 0.00 0.00 3.20 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 23 V 8.27 4.43 2.26 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 1.12 0.00 0.00 0.98 0.00 0.00 24 Y 8.82 5.19 0.00 2.88 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 25 V 8.17 4.63 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 1.05 0.00 0.00 1.01 0.00 0.00 26 I 8.50 4.64 1.90 0.00 0.00 0.86 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 0.51 0.94 0.00 0.00 27 C 8.13 4.92 0.00 2.98 2.81 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 0.00 0.00 0.00 28 E 8.97 4.04 0.00 1.97 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 2.28 2.29 0.00 29 N 7.85 4.78 0.00 2.93 2.87 0.00 0.00 5.86 7.76 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 30 P 0.00 4.28 0.00 2.23 2.37 0.00 3.71 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 2.06 2.01 0.00 31 K 7.25 3.64 0.00 1.74 1.98 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.49 1.46 7.81 32 H 7.92 4.61 0.00 3.09 3.30 0.00 5.67 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 9.10 4.35 0.00 1.94 1.72 0.00 1.61 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.46 7.81 34 Q 8.01 5.04 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.64 0.00 0.00 0.00 0.00 0.00 2.49 2.46 0.00 35 R 8.11 3.94 0.00 1.31 1.45 0.00 2.78 0.00 0.00 2.76 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.50 0.00 36 Q 8.53 4.75 0.00 2.08 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.69 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 37 G 8.42 3.85 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 0.00 0.00 0.00