NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.4069 8.3027 118.9421 56.1993 31.3068 174.4971 3 R 4.5749 8.2368 120.9795 55.6195 31.4206 169.9252 4 V 4.5016 8.7908 126.9411 61.1302 34.3344 173.7209 5 R 5.1371 8.6829 127.3993 54.6064 33.1284 174.0898 6 I 4.6548 8.9032 126.4318 59.6415 40.6072 174.3680 7 S 5.2873 8.8647 123.1885 56.6560 64.4722 173.3778 8 I 4.3745 8.5379 118.6020 59.3204 40.0774 175.0959 9 T 4.4157 8.5061 122.1795 61.9931 68.8611 173.3120 10 A 4.6720 7.9776 128.5137 49.7576 21.9311 176.7333 11 R 3.9506 8.5858 119.1201 59.2912 30.6377 176.8841 12 T 4.6818 7.4367 110.5047 59.3107 71.5228 174.3885 13 K 3.8828 8.4075 124.0142 60.1343 32.5521 178.9802 14 K 3.9053 8.0260 120.2466 59.0945 32.1802 178.4952 15 E 4.0042 8.0280 118.1292 59.4579 29.5411 178.9326 16 A 4.1894 7.9040 120.3574 55.2858 18.4906 179.3939 17 E 3.9475 8.6365 117.4849 59.6717 28.5556 179.7677 18 K 3.9791 8.0745 117.8988 59.3753 32.0217 179.3214 19 F 4.1449 8.0179 116.6003 60.0022 38.9287 177.6300 20 A 4.0856 8.4187 120.4232 55.2389 17.7755 179.2925 21 A 3.9634 7.9654 118.9935 55.5436 18.4080 180.0463 22 I 3.6645 7.2082 114.8183 64.6074 37.1786 178.4709 23 L 3.9532 8.0696 119.8041 58.0839 41.4539 179.7673 24 I 3.8998 8.1567 119.6939 64.4205 37.0682 178.6699 25 K 4.0358 7.7590 118.8903 59.4482 31.8167 179.6379 26 V 3.5652 7.9132 118.5467 65.9535 31.3940 178.1655 27 F 4.2070 8.4433 117.5579 60.4030 38.7542 177.5289 28 A 4.1203 8.3766 120.7332 55.2197 18.0725 179.5014 29 E 4.1139 8.2547 114.2851 58.7263 29.8208 178.3057 30 L 4.5095 7.6780 118.1302 54.9835 42.1734 177.3910 31 G 4.0310 8.1793 107.5320 45.6019 0.0000 173.0812 32 Y 5.1252 8.4856 115.8250 56.6925 38.4255 175.5624 33 N 4.2490 8.1742 117.4753 55.0547 40.0195 172.5918 34 D 4.2894 8.4315 118.1993 54.8875 38.5000 173.2111 35 I 4.4143 7.2621 120.2088 60.4892 39.5827 176.6593 36 N 5.1073 9.2518 122.5992 51.4616 41.6812 173.6951 37 V 4.8629 8.5410 123.8323 60.3770 33.8194 175.5060 38 T 4.6376 8.9587 114.1439 59.7274 71.2695 172.5020 39 W 5.3124 8.5670 123.6365 54.7576 30.3813 175.9000 40 D 4.2590 9.0607 122.1980 54.7347 42.2802 175.1148 41 G 4.2599 10.1855 119.0293 45.0593 0.0000 172.3041 42 D 4.7861 8.0355 115.3306 54.0489 44.0603 175.1487 43 T 4.6721 7.9407 116.2151 61.7316 71.6430 173.1186 44 V 4.8743 8.0067 118.8678 59.9195 34.5238 174.9093 45 T 5.2315 8.5915 121.1019 61.6969 72.1521 173.3691 46 V 4.4014 9.1463 126.8146 60.7924 33.8599 174.8743 47 E 4.7842 9.3172 123.4384 54.5706 32.5866 175.2606 48 G 4.3160 9.0817 111.5522 44.1925 0.0000 170.9793 49 Q 5.1208 8.4899 116.7548 54.0723 32.6260 173.6035 50 L 4.6456 7.9770 121.3727 52.5071 44.8823 176.3345 51 E 4.5020 8.5346 123.3989 55.8711 30.3322 175.8010 52 G 4.0831 7.8315 107.2754 46.3898 0.0000 173.5369 53 G 3.4101 8.3523 108.8596 44.3663 0.0000 173.6652 54 S 3.8850 8.4683 118.2168 57.4365 63.0820 171.3842 55 L 4.8127 8.0853 119.0999 54.4207 42.7176 177.6376 56 E 4.1133 8.2040 118.2731 57.6990 30.5602 174.6883 57 H 4.4957 7.6276 112.3358 56.2424 30.2950 173.4516 58 H 4.3766 8.7462 118.6101 56.4335 30.0586 172.7284 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 2 E 8.30 4.41 0.00 2.10 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 0.00 2.26 2.45 0.00 3 R 8.24 4.57 0.00 1.94 1.90 0.00 3.37 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.64 0.00 4 V 8.79 4.50 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 1.11 0.00 0.00 1.11 0.00 0.00 5 R 8.68 5.14 0.00 1.80 1.76 0.00 3.23 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.85 0.00 6 I 8.90 4.65 2.03 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.81 0.94 0.00 0.00 7 S 8.86 5.29 0.00 3.73 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 8 I 8.54 4.37 1.66 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.90 0.88 0.00 0.00 9 T 8.51 4.42 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 1.20 0.00 0.00 10 A 7.98 4.67 1.24 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 0.00 0.00 0.00 11 R 8.59 3.95 0.00 1.78 1.97 0.00 3.18 0.00 0.00 3.15 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 12 T 7.44 4.68 4.23 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 1.23 0.00 0.00 13 K 8.41 3.88 0.00 1.89 1.94 0.00 1.43 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.43 1.43 7.81 14 K 8.03 3.91 0.00 1.87 1.85 0.00 1.58 0.00 0.00 1.79 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.58 7.81 15 E 8.03 4.00 0.00 2.28 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 0.00 2.44 2.35 0.00 16 A 7.90 4.19 1.34 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 0.00 0.00 0.00 17 E 8.64 3.95 0.00 2.17 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 0.00 2.33 2.33 0.00 18 K 8.07 3.98 0.00 2.01 1.75 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.69 7.81 19 F 8.02 4.14 0.00 3.38 3.11 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 0.00 20 A 8.42 4.09 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 21 A 7.97 3.96 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.21 3.66 1.98 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.70 0.87 0.00 0.00 23 L 8.07 3.95 0.00 2.01 1.93 0.77 0.76 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 24 I 8.16 3.90 2.10 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.01 0.98 0.00 0.00 25 K 7.76 4.04 0.00 1.91 1.87 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.60 1.59 7.81 26 V 7.91 3.57 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.89 0.00 0.00 27 F 8.44 4.21 0.00 3.39 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 28 A 8.38 4.12 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 29 E 8.25 4.11 0.00 2.16 2.24 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 2.31 2.65 0.00 30 L 7.68 4.51 0.00 2.12 2.18 0.65 1.48 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 31 G 8.18 4.03 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 0.00 0.00 0.00 32 Y 8.49 5.13 0.00 3.22 3.01 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 0.00 0.00 0.00 0.00 33 N 8.17 4.25 0.00 2.69 2.77 0.00 0.00 7.21 8.49 0.00 0.00 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 D 8.43 4.29 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 35 I 7.26 4.41 1.85 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.35 0.91 0.00 0.00 36 N 9.25 5.11 0.00 2.58 2.66 0.00 0.00 6.76 7.61 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 37 V 8.54 4.86 2.14 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 0.80 0.00 0.00 1.09 0.00 0.00 38 T 8.96 4.64 4.17 0.00 0.00 0.00 0.00 0.00 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 39 W 8.57 5.31 0.00 3.45 3.11 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 0.00 40 D 9.06 4.26 0.00 2.69 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 G 10.19 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 0.00 0.00 0.00 0.00 42 D 8.04 4.79 0.00 2.64 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 T 7.94 4.67 4.29 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 1.28 0.00 0.00 44 V 8.01 4.87 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.02 0.00 0.00 45 T 8.59 5.23 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 1.27 0.00 0.00 46 V 9.15 4.40 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 0.92 0.00 0.00 0.92 0.00 0.00 47 E 9.32 4.78 0.00 2.02 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 2.18 2.20 0.00 48 G 9.08 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.49 5.12 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.93 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 50 L 7.98 4.65 0.00 1.31 1.49 0.81 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 51 E 8.53 4.50 0.00 2.05 1.94 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 2.12 2.19 0.00 52 G 7.83 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 0.00 0.00 0.00 53 G 8.35 3.41 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 0.00 54 S 8.47 3.89 0.00 4.13 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 55 L 8.09 4.81 0.00 1.57 1.61 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 56 E 8.20 4.11 0.00 2.01 1.97 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 2.26 2.29 0.00 57 H 7.63 4.50 0.00 3.21 3.30 0.00 5.49 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 H 8.75 4.38 0.00 3.10 3.14 0.00 5.76 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00