NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 E 4.2871 8.4444 120.2258 55.7540 31.4284 174.7231 4 S 4.7353 7.8532 113.2654 56.4598 64.8079 172.9120 5 C 4.6291 9.3594 120.9645 56.2550 41.6412 173.2734 6 K 4.3450 7.0445 121.1957 57.1162 31.7342 175.9993 7 G 4.0213 8.9087 113.7586 46.7482 0.0000 173.6124 8 R 4.7012 8.0443 115.6636 55.6793 31.4626 176.4542 9 C 4.7097 8.1953 114.2623 58.4742 40.1525 173.9060 10 T 4.5679 7.8625 113.8992 62.8550 70.2093 174.0290 11 E 4.3763 8.3618 118.6349 55.3607 31.1116 177.2229 12 G 3.8403 8.0142 107.4495 44.5382 0.0000 172.3144 13 F 4.3191 8.6465 121.0707 58.1045 40.2446 175.6034 14 N 4.5489 8.6327 125.7811 51.1663 39.8195 174.9555 15 V 3.3878 7.9168 125.9100 64.2921 31.6921 177.6274 16 D 4.4349 7.6156 119.4220 56.2660 40.9914 177.0659 17 K 4.2794 7.3710 117.5508 55.5770 32.7773 177.4649 18 K 4.1782 8.4650 121.1600 58.8278 32.4210 176.2814 19 C 4.9422 7.7233 110.8730 53.8348 38.9744 173.0803 20 Q 4.6416 8.9824 120.2760 55.0425 30.4127 175.7030 21 C 5.3001 8.4130 113.0353 56.5579 40.6702 174.3928 22 D 4.8507 7.9656 120.2049 52.7191 39.8538 177.1526 23 E 4.2829 8.7930 118.8216 58.3157 29.7593 178.0529 24 L 4.9200 8.1935 117.6065 54.3603 42.4623 175.6974 25 C 4.4587 8.2166 116.5151 58.3564 38.5736 176.3437 26 S 3.8560 7.8869 114.8023 61.3022 62.5826 175.7263 27 Y 4.0833 7.8059 117.2778 59.8250 37.5663 176.0825 28 Y 4.5026 7.8072 115.7150 56.7141 38.9559 175.4164 29 Q 3.4057 7.7887 118.2327 57.3614 27.0392 174.2531 30 S 4.6873 7.6798 107.4910 57.5414 64.8718 174.4921 31 C 4.7261 8.0872 119.3839 57.1384 41.5406 174.2788 32 C 4.5270 8.5647 121.5876 57.4129 40.3923 175.3665 33 T 3.6543 8.5723 119.3813 66.1545 68.4154 174.8659 34 D 4.8250 7.9907 119.6255 53.3166 39.9274 177.2723 35 Y 4.0312 8.3164 123.1340 61.6810 38.3931 178.4185 36 T 3.8619 8.0312 114.1994 66.8075 68.7735 176.0951 37 A 4.1174 7.8746 120.0716 54.1931 18.7629 178.9391 38 E 4.1146 8.0365 117.3063 58.8253 29.8699 176.0015 39 C 4.2607 8.0121 119.5246 56.9172 41.3650 173.5734 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 3 E 8.44 4.29 0.00 1.97 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 2.21 2.30 0.00 4 S 7.85 4.74 0.00 3.88 3.72 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 0.00 0.00 0.00 5 C 9.36 4.63 0.00 3.29 3.10 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 0.00 0.00 0.00 0.00 6 K 7.04 4.34 0.00 1.65 1.76 0.00 1.79 0.00 0.00 1.55 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.55 7.81 7 G 8.91 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.04 4.70 0.00 2.03 1.91 0.00 3.12 0.00 0.00 3.39 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 9 C 8.20 4.71 0.00 2.94 3.09 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 0.00 0.00 0.00 0.00 10 T 7.86 4.57 4.25 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 1.22 0.00 0.00 11 E 8.36 4.38 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.27 0.00 12 G 8.01 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 13 F 8.65 4.32 0.00 2.95 2.96 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 0.00 0.00 0.00 0.00 14 N 8.63 4.55 0.00 2.49 2.41 0.00 0.00 6.74 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 V 7.92 3.39 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 0.79 0.00 0.00 1.04 0.00 0.00 16 D 7.62 4.43 0.00 2.78 2.72 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 0.00 0.00 0.00 17 K 7.37 4.28 0.00 1.66 1.66 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.48 7.81 18 K 8.47 4.18 0.00 1.73 1.86 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.41 7.81 19 C 7.72 4.94 0.00 3.24 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 20 Q 8.98 4.64 0.00 2.07 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.76 0.00 0.00 0.00 0.00 0.00 2.30 2.60 0.00 21 C 8.41 5.30 0.00 3.07 3.19 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 0.00 0.00 0.00 0.00 22 D 7.97 4.85 0.00 2.94 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 E 8.79 4.28 0.00 2.09 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 0.00 2.46 2.42 0.00 24 L 8.19 4.92 0.00 2.11 2.02 1.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 25 C 8.22 4.46 0.00 3.09 3.56 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.89 3.86 0.00 3.77 3.92 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 0.00 0.00 0.00 0.00 27 Y 7.81 4.08 0.00 2.91 2.57 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 0.00 0.00 0.00 0.00 28 Y 7.81 4.50 0.00 3.13 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 29 Q 7.79 3.41 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.78 0.00 0.00 0.00 0.00 0.00 2.30 2.29 0.00 30 S 7.68 4.69 0.00 4.00 4.25 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 31 C 8.09 4.73 0.00 2.90 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 32 C 8.56 4.53 0.00 3.09 3.18 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 0.00 0.00 0.00 0.00 33 T 8.57 3.65 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 1.23 0.00 0.00 34 D 7.99 4.82 0.00 2.90 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 35 Y 8.32 4.03 0.00 3.17 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 36 T 8.03 3.86 4.28 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 1.23 0.00 0.00 37 A 7.87 4.12 1.28 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 0.00 0.00 38 E 8.04 4.11 0.00 1.98 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 0.00 2.38 2.52 0.00 39 C 8.01 4.26 0.00 1.76 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00