#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nhn n ALA 4 N 0.00 -1.00 -1.58 5.41 0.00 -1.26 -4.88 120.51 117.20 1nhn n ALA 4 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.05 1nhn n ALA 4 Cb 0.00 -0.05 0.03 0.00 0.00 0.00 0.00 19.45 19.43 1nhn n ALA 4 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1nhn n PRO 5 N -0.25 1.00 -2.55 0.00 -0.04 -1.26 -4.91 135.00 126.99 1nhn n PRO 5 Ca 0.00 0.37 -0.11 0.00 -0.04 0.00 0.00 63.50 63.73 1nhn n PRO 5 Cb 0.00 -2.00 0.03 0.00 -0.04 0.00 0.00 33.50 31.50 1nhn n PRO 5 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1nhn n LYS 6 N -0.28 2.32 0.00 0.54 5.02 -1.26 -5.07 118.16 119.43 1nhn n LYS 6 Ca 0.11 -3.74 0.00 0.00 -2.02 0.00 0.00 58.31 52.66 1nhn n LYS 6 Cb 0.44 -1.80 0.00 0.00 -0.02 0.00 0.00 35.03 33.65 1nhn n LYS 6 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1nhn n ARG 7 N -0.54 0.00 -2.30 1.97 1.74 -1.26 -4.85 116.66 111.42 1nhn n ARG 7 Ca 0.21 0.00 -0.25 0.00 -0.77 0.00 0.00 57.85 57.04 1nhn n ARG 7 Cb 0.84 0.00 0.07 0.00 -1.02 0.00 0.00 32.46 32.35 1nhn n ARG 7 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1nhn s PRO 8 N 0.00 2.13 0.00 5.56 0.04 -1.26 -5.01 135.00 136.45 1nhn s PRO 8 Ca 0.00 -0.44 0.00 0.00 0.04 0.00 0.00 61.00 60.60 1nhn s PRO 8 Cb 0.00 -2.23 0.00 0.00 0.04 0.00 0.00 34.50 32.31 1nhn s PRO 8 CO 0.00 -1.23 0.00 -2.30 0.04 0.00 0.00 177.00 173.51 1nhn n PRO 9 N -2.85 0.00 -0.21 0.56 -0.01 -1.26 -4.84 135.00 126.38 1nhn n PRO 9 Ca 0.09 0.00 0.09 0.00 -0.01 0.00 0.00 63.50 63.67 1nhn n PRO 9 Cb 0.60 0.00 0.16 0.00 -0.01 0.00 0.00 33.50 34.26 1nhn n PRO 9 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 175.50 175.92 1nhn n SER 10 N 0.00 2.33 0.00 2.55 7.64 -1.26 -4.73 113.62 120.15 1nhn n SER 10 Ca 0.00 -3.26 0.00 0.00 1.01 0.00 0.00 58.87 56.62 1nhn n SER 10 Cb 0.00 -0.46 0.00 0.00 -1.01 0.00 0.00 64.21 62.74 1nhn n SER 10 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nhn n ALA 11 N -1.31 0.00 0.00 -0.43 0.00 -1.26 -4.42 120.51 113.09 1nhn n ALA 11 Ca 0.17 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.52 1nhn n ALA 11 Cb 0.68 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.18 1nhn n ALA 11 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1nhn h PHE 12 N 0.00 0.70 -0.82 0.00 3.57 -1.93 -2.98 116.94 115.48 1nhn h PHE 12 Ca 0.00 -0.25 0.10 0.00 3.53 0.00 0.00 57.97 61.35 1nhn h PHE 12 Cb 0.00 -0.13 -0.06 0.00 2.79 0.00 0.00 35.95 38.55 1nhn h PHE 12 CO 0.00 0.99 0.54 0.35 -2.23 0.00 0.00 178.31 177.95 1nhn h PHE 13 N 0.43 0.80 0.67 0.41 3.04 -1.92 0.84 116.94 121.22 1nhn h PHE 13 Ca 0.01 0.02 -0.03 0.00 3.98 0.00 0.00 57.97 61.95 1nhn h PHE 13 Cb 1.10 -0.26 0.01 0.00 2.56 0.00 0.00 35.95 39.36 1nhn h PHE 13 CO 0.05 0.36 -0.32 -0.07 -2.02 0.00 0.00 178.31 176.30 1nhn h LEU 14 N 0.74 -0.77 -0.83 0.59 -0.00 -1.90 -2.69 115.31 110.45 1nhn h LEU 14 Ca 0.39 -0.01 0.18 0.00 -0.00 0.00 0.00 57.88 58.44 1nhn h LEU 14 Cb 0.49 0.20 -0.16 0.00 -0.00 0.00 0.00 40.66 41.20 1nhn h LEU 14 CO -0.15 -0.42 -0.15 0.15 -0.00 0.00 0.00 178.44 177.87 1nhn h PHE 15 N -1.14 -0.33 -0.44 1.13 3.57 -1.38 0.32 116.94 118.67 1nhn h PHE 15 Ca -0.09 0.07 0.09 0.00 3.53 0.00 0.00 57.97 61.57 1nhn h PHE 15 Cb 0.73 0.28 -0.08 0.00 2.79 0.00 0.00 35.95 39.66 1nhn h PHE 15 CO 0.00 -0.34 -0.10 0.00 -2.23 0.00 0.00 178.31 175.63 1nhn h SER 17 N 0.01 -0.51 0.60 0.00 0.87 -0.60 0.23 113.55 114.15 1nhn h SER 17 Ca 0.21 0.08 -0.05 0.00 -1.23 0.00 0.00 61.79 60.81 1nhn h SER 17 Cb 0.32 0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.50 1nhn h SER 17 CO -0.45 -0.23 -0.22 -0.33 -0.53 0.00 0.00 176.83 175.07 1nhn h GLU 18 N -0.26 0.00 0.00 2.24 5.08 -1.20 -3.36 114.58 117.08 1nhn h GLU 18 Ca 0.07 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.15 1nhn h GLU 18 Cb 0.35 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.55 1nhn h GLU 18 CO -0.19 0.22 -2.04 0.66 -1.00 0.00 0.00 179.01 176.66 1nhn n TYR 19 N -3.61 0.00 -0.30 4.33 4.02 -0.78 -4.57 117.16 116.25 1nhn n TYR 19 Ca -0.01 0.00 -0.04 0.00 -0.01 0.00 0.00 57.90 57.84 1nhn n TYR 19 Cb 0.36 -0.71 -0.02 0.00 -0.02 0.00 0.00 39.34 38.94 1nhn n TYR 19 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 176.86 173.72 1nhn n ARG 20 N -2.93 -0.25 0.06 -0.72 0.63 0.78 0.01 116.66 114.23 1nhn n ARG 20 Ca -0.31 1.15 0.12 0.00 -0.92 0.00 0.00 57.85 57.90 1nhn n ARG 20 Cb 0.88 -1.70 0.48 0.00 0.45 0.00 0.00 32.46 32.56 1nhn n ARG 20 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 1nhn n PRO 21 N -5.03 0.13 -0.08 -0.14 -0.02 -1.26 -0.79 135.00 127.81 1nhn n PRO 21 Ca 0.05 0.18 -0.22 0.00 -2.02 0.00 0.00 63.50 61.48 1nhn n PRO 21 Cb 0.25 -1.68 -0.12 0.00 -0.02 0.00 0.00 33.50 31.93 1nhn n PRO 21 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1nhn n LYS 22 N -1.91 0.61 -0.08 -0.52 5.02 0.10 -2.07 118.16 119.32 1nhn n LYS 22 Ca 0.05 0.48 -0.13 0.00 -2.02 0.00 0.00 58.31 56.69 1nhn n LYS 22 Cb 0.34 -1.72 -0.05 0.00 -0.02 0.00 0.00 35.03 33.57 1nhn n LYS 22 CO 0.00 0.00 0.00 -0.84 -0.52 0.00 0.00 177.40 176.04 1nhn h ILE 23 N -0.73 1.32 -0.23 -0.18 3.07 -1.22 -2.31 117.51 117.23 1nhn h ILE 23 Ca -0.39 -1.36 -0.01 0.00 1.55 0.00 0.00 64.86 64.65 1nhn h ILE 23 Cb 1.50 1.69 -0.01 0.00 -0.27 0.00 0.00 36.82 39.73 1nhn h ILE 23 CO -0.15 0.42 0.10 0.50 -1.05 0.00 0.00 178.15 177.97 1nhn h LYS 24 N 0.24 0.31 -0.10 0.16 3.11 -1.13 1.18 116.57 120.33 1nhn h LYS 24 Ca 0.04 -0.03 -0.01 0.00 -2.81 0.00 0.00 60.65 57.84 1nhn h LYS 24 Cb 0.75 -0.06 -0.01 0.00 -1.00 0.00 0.00 32.23 31.91 1nhn h LYS 24 CO 0.05 0.25 0.02 0.78 -2.81 0.00 0.00 179.45 177.74 1nhn h GLY 25 N 0.42 0.14 0.19 5.01 0.00 -0.87 -0.57 103.07 107.38 1nhn h GLY 25 Ca 0.08 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.35 1nhn h GLY 25 CO -0.01 0.06 -1.79 1.18 0.00 0.00 0.00 176.54 175.98 1nhn n GLU 26 N -4.47 0.63 -3.13 4.80 -0.58 0.12 -4.50 120.64 113.51 1nhn n GLU 26 Ca -0.01 -0.14 -0.27 0.00 -0.42 0.00 0.00 57.16 56.32 1nhn n GLU 26 Cb 0.12 -1.58 -0.06 0.00 -0.57 0.00 0.00 31.44 29.36 1nhn n GLU 26 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1nhn n HIS 27 N -2.31 3.88 -0.12 -0.32 8.25 0.38 -4.87 115.22 120.11 1nhn n HIS 27 Ca -0.03 -4.06 0.00 0.00 -0.26 0.00 0.00 57.72 53.37 1nhn n HIS 27 Cb 0.56 -0.52 0.00 0.00 1.12 0.00 0.00 29.99 31.15 1nhn n HIS 27 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1nhn n PRO 28 N 0.18 0.98 0.00 -0.41 -0.04 -0.34 -2.16 135.00 133.21 1nhn n PRO 28 Ca 0.31 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.77 1nhn n PRO 28 Cb 0.40 -1.01 0.00 0.00 -0.04 0.00 0.00 33.50 32.85 1nhn n PRO 28 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nhn n GLY 29 N 1.26 0.44 4.02 0.55 0.00 -1.26 -5.08 105.19 105.11 1nhn n GLY 29 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1nhn n GLY 29 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nhn s LEU 30 N -1.35 2.98 0.00 0.99 1.43 -0.92 -5.13 118.68 116.67 1nhn s LEU 30 Ca 0.00 -0.72 0.01 0.00 -1.03 0.00 0.00 54.13 52.39 1nhn s LEU 30 Cb 0.00 -1.59 -0.00 0.00 0.03 0.00 0.00 46.19 44.63 1nhn s LEU 30 CO 0.00 -1.70 0.04 -1.20 0.23 0.00 0.00 176.35 173.73 1nhn n SER 31 N -2.58 2.32 -1.28 2.29 7.64 -1.26 -4.95 113.62 115.79 1nhn n SER 31 Ca 0.17 -2.68 0.04 0.00 1.01 0.00 0.00 58.87 57.41 1nhn n SER 31 Cb 0.61 0.47 0.23 0.00 -1.01 0.00 0.00 64.21 64.52 1nhn n SER 31 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nhn n ILE 32 N -0.86 1.55 0.00 0.44 3.06 -1.26 -1.00 119.36 121.28 1nhn n ILE 32 Ca -0.11 -0.80 0.00 0.00 -2.50 0.00 0.00 62.75 59.34 1nhn n ILE 32 Cb 0.48 -0.33 0.00 0.00 0.54 0.00 0.00 39.64 40.33 1nhn n ILE 32 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1nhn n GLY 33 N 0.41 0.00 0.28 4.50 0.00 -1.26 -4.39 105.19 104.73 1nhn n GLY 33 Ca 0.16 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.99 1nhn n GLY 33 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1nhn n ASP 34 N -1.62 1.68 -0.23 1.61 -0.08 -1.09 -2.68 116.55 114.14 1nhn n ASP 34 Ca 0.00 0.29 0.24 0.00 -1.51 0.00 0.00 54.79 53.81 1nhn n ASP 34 Cb 0.21 -0.68 0.61 0.00 2.34 0.00 0.00 41.12 43.61 1nhn n ASP 34 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 1nhn h VAL 35 N -0.83 0.59 -0.13 5.18 2.07 -1.38 0.30 116.25 122.05 1nhn h VAL 35 Ca -0.39 -0.07 -0.04 0.00 0.82 0.00 0.00 66.70 67.02 1nhn h VAL 35 Cb 1.28 0.36 -0.00 0.00 -1.52 0.00 0.00 31.29 31.41 1nhn h VAL 35 CO -0.23 0.04 -0.09 0.00 0.02 0.00 0.00 177.57 177.30 1nhn h ALA 36 N 1.58 0.18 -0.14 1.67 0.00 -1.73 0.44 119.26 121.25 1nhn h ALA 36 Ca 0.47 -0.29 -0.11 0.00 0.00 0.00 0.00 54.91 54.98 1nhn h ALA 36 Cb 1.50 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 1nhn h ALA 36 CO -0.11 0.00 -0.41 1.57 0.00 0.00 0.00 179.25 180.30 1nhn h LYS 37 N -0.09 0.33 0.47 0.00 2.10 -0.31 0.28 116.57 119.35 1nhn h LYS 37 Ca 0.02 -0.16 -0.02 0.00 -2.00 0.00 0.00 60.65 58.49 1nhn h LYS 37 Cb 0.59 -0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.92 1nhn h LYS 37 CO 0.02 0.69 -0.23 -0.22 -2.00 0.00 0.00 179.45 177.71 1nhn h LYS 38 N 0.27 -0.61 -0.68 0.07 3.64 -0.87 -1.84 116.57 116.55 1nhn h LYS 38 Ca 0.02 0.04 0.10 0.00 -1.27 0.00 0.00 60.65 59.55 1nhn h LYS 38 Cb 0.84 0.14 -0.07 0.00 -0.41 0.00 0.00 32.23 32.73 1nhn h LYS 38 CO 0.07 -0.31 0.31 -0.07 -2.27 0.00 0.00 179.45 177.17 1nhn h LEU 39 N -1.03 0.37 -1.44 5.20 3.38 -0.88 0.12 115.31 121.04 1nhn h LEU 39 Ca -0.06 0.07 0.48 0.00 0.09 0.00 0.00 57.88 58.46 1nhn h LEU 39 Cb 0.58 0.02 -0.13 0.00 0.09 0.00 0.00 40.66 41.21 1nhn h LEU 39 CO 0.11 0.20 0.93 1.23 0.09 0.00 0.00 178.44 181.00 1nhn h GLY 40 N 0.52 1.28 0.00 0.83 0.00 -0.16 0.14 103.07 105.67 1nhn h GLY 40 Ca 0.34 -0.09 -0.10 0.00 0.00 0.00 0.00 47.33 47.49 1nhn h GLY 40 CO -0.30 -0.45 -1.03 1.18 0.00 0.00 0.00 176.54 175.95 1nhn n GLU 41 N -4.68 0.51 -0.41 4.80 -0.58 0.22 -4.42 120.64 116.08 1nhn n GLU 41 Ca 0.41 0.42 0.33 0.00 -0.42 0.00 0.00 57.16 57.90 1nhn n GLU 41 Cb 1.60 -1.61 0.61 0.00 -0.57 0.00 0.00 31.44 31.47 1nhn n GLU 41 CO 0.00 0.00 0.00 0.52 -0.48 0.00 0.00 177.13 177.17 1nhn h MET 42 N -1.00 0.14 -0.73 3.49 2.86 0.24 0.13 114.93 120.06 1nhn h MET 42 Ca -0.15 -0.01 0.11 0.00 -2.06 0.00 0.00 59.70 57.59 1nhn h MET 42 Cb 0.92 -0.03 -0.05 0.00 0.06 0.00 0.00 31.60 32.50 1nhn h MET 42 CO -0.09 0.09 0.48 2.35 1.06 0.00 0.00 176.91 180.80 1nhn h TRP 43 N 0.14 0.61 0.06 -0.22 2.91 -1.23 0.42 115.95 118.63 1nhn h TRP 43 Ca 0.79 0.02 -0.26 0.00 1.13 0.00 0.00 58.89 60.57 1nhn h TRP 43 Cb 2.33 -0.20 0.02 0.00 -0.51 0.00 0.00 29.16 30.80 1nhn h TRP 43 CO -0.01 0.27 -1.04 -0.91 -1.03 0.00 0.00 178.44 175.73 1nhn h ASN 44 N 0.56 0.81 -0.61 2.65 2.35 -1.21 -3.14 115.58 117.00 1nhn h ASN 44 Ca 0.35 -0.79 -0.38 0.00 -0.55 0.00 0.00 56.30 54.93 1nhn h ASN 44 Cb 0.59 -0.25 -0.18 0.00 0.05 0.00 0.00 38.32 38.53 1nhn h ASN 44 CO -0.12 1.51 0.49 0.59 -1.65 0.00 0.00 177.43 178.25 1nhn n ASN 45 N -3.91 5.71 -0.72 5.81 3.02 -0.30 -4.89 115.26 119.98 1nhn n ASN 45 Ca -0.12 -3.16 0.00 0.00 -0.03 0.00 0.00 54.58 51.27 1nhn n ASN 45 Cb 0.89 -0.93 0.00 0.00 -0.61 0.00 0.00 39.78 39.12 1nhn n ASN 45 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 1nhn n THR 46 N -0.14 0.00 -0.98 3.41 5.66 0.13 -4.88 114.28 117.49 1nhn n THR 46 Ca 0.38 0.00 0.07 0.00 -3.05 0.00 0.00 64.05 61.44 1nhn n THR 46 Cb 0.80 0.00 0.32 0.00 -1.55 0.00 0.00 70.33 69.90 1nhn n THR 46 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1nhn n ALA 47 N -3.00 3.50 -0.70 1.79 0.00 -1.26 -4.94 120.51 115.89 1nhn n ALA 47 Ca 0.00 -2.18 0.00 0.00 0.00 0.00 0.00 53.44 51.26 1nhn n ALA 47 Cb 0.00 -0.92 0.00 0.00 0.00 0.00 0.00 19.45 18.53 1nhn n ALA 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nhn n ALA 48 N -0.04 -0.03 0.00 0.00 0.00 -1.26 -3.87 120.51 115.31 1nhn n ALA 48 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.70 1nhn n ALA 48 Cb 1.06 -0.17 0.00 0.00 0.00 0.00 0.00 19.45 20.34 1nhn n ALA 48 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1nhn n ASP 49 N 0.58 1.74 -0.08 0.00 -0.08 -1.26 -4.73 116.55 112.71 1nhn n ASP 49 Ca 0.00 0.00 0.13 0.00 -1.51 0.00 0.00 54.79 53.41 1nhn n ASP 49 Cb 0.01 0.24 0.41 0.00 2.34 0.00 0.00 41.12 44.12 1nhn n ASP 49 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1nhn n ASP 50 N -0.82 0.54 -0.03 1.67 8.00 -1.25 -3.76 116.55 120.90 1nhn n ASP 50 Ca 0.00 -0.35 -0.22 0.00 0.71 0.00 0.00 54.79 54.94 1nhn n ASP 50 Cb 0.11 0.05 -0.13 0.00 -0.02 0.00 0.00 41.12 41.12 1nhn n ASP 50 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1nhn h LYS 51 N 0.38 0.18 -0.84 -1.24 1.57 -1.90 -3.33 116.57 111.39 1nhn h LYS 51 Ca 0.00 -0.30 0.11 0.00 -1.87 0.00 0.00 60.65 58.58 1nhn h LYS 51 Cb 0.47 0.11 -0.12 0.00 0.08 0.00 0.00 32.23 32.77 1nhn h LYS 51 CO 0.00 1.14 -0.39 1.04 -0.57 0.00 0.00 179.45 180.67 1nhn n GLN 52 N -3.87 -0.27 0.27 3.15 1.13 -1.25 0.11 117.38 116.66 1nhn n GLN 52 Ca -0.31 1.28 -0.16 0.00 -1.94 0.00 0.00 57.00 55.87 1nhn n GLN 52 Cb 0.91 -1.89 -0.08 0.00 0.11 0.00 0.00 30.24 29.28 1nhn n GLN 52 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 1nhn h PRO 53 N 0.00 -0.77 -0.91 -1.09 0.13 -1.74 -2.51 132.00 125.11 1nhn h PRO 53 Ca 0.23 0.05 0.18 0.00 -0.87 0.00 0.00 66.00 65.59 1nhn h PRO 53 Cb 0.44 0.18 -0.10 0.00 0.13 0.00 0.00 31.00 31.64 1nhn h PRO 53 CO -0.81 -0.51 0.48 1.88 -0.23 0.00 0.00 178.00 178.80 1nhn h TYR 54 N -0.80 0.83 0.75 1.56 -1.99 -1.10 -2.08 116.97 114.14 1nhn h TYR 54 Ca -0.04 0.04 -0.04 0.00 2.00 0.00 0.00 58.73 60.68 1nhn h TYR 54 Cb 0.69 -0.23 0.01 0.00 2.00 0.00 0.00 36.73 39.19 1nhn h TYR 54 CO -0.16 0.15 -0.36 0.93 -0.00 0.00 0.00 178.16 178.72 1nhn h GLU 55 N 0.61 -0.97 -0.67 4.88 4.39 -0.23 0.13 114.58 122.72 1nhn h GLU 55 Ca 0.52 0.07 0.20 0.00 0.34 0.00 0.00 59.36 60.48 1nhn h GLU 55 Cb 0.82 0.22 -0.03 0.00 -0.10 0.00 0.00 28.75 29.67 1nhn h GLU 55 CO -0.41 -0.65 0.71 0.87 -1.16 0.00 0.00 179.01 178.38 1nhn h LYS 56 N -1.03 0.00 0.00 2.33 1.57 -0.94 0.12 116.57 118.62 1nhn h LYS 56 Ca -0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1nhn h LYS 56 Cb 0.77 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.08 1nhn h LYS 56 CO 0.17 0.00 -0.04 -0.22 -0.57 0.00 0.00 179.45 178.79 1nhn h LYS 57 N 0.00 0.00 -0.89 3.15 3.64 -0.81 -1.13 116.57 120.53 1nhn h LYS 57 Ca 0.32 0.00 0.24 0.00 -1.27 0.00 0.00 60.65 59.94 1nhn h LYS 57 Cb 1.74 0.00 -0.14 0.00 -0.41 0.00 0.00 32.23 33.42 1nhn h LYS 57 CO -0.00 0.00 0.30 0.00 -2.27 0.00 0.00 179.45 177.48 1nhn h ALA 58 N -1.31 1.37 0.37 5.00 0.00 -0.20 0.25 119.26 124.74 1nhn h ALA 58 Ca 0.00 0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1nhn h ALA 58 Cb 0.04 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1nhn h ALA 58 CO 0.00 -0.44 -0.18 0.00 0.00 0.00 0.00 179.25 178.63 1nhn h ALA 59 N 1.77 -0.50 -0.89 0.00 0.00 -0.89 -0.20 119.26 118.54 1nhn h ALA 59 Ca 0.57 -0.13 0.20 0.00 0.00 0.00 0.00 54.91 55.54 1nhn h ALA 59 Cb 1.14 0.19 -0.17 0.00 0.00 0.00 0.00 17.79 18.96 1nhn h ALA 59 CO -0.62 -0.74 -0.12 -0.22 0.00 0.00 0.00 179.25 177.56 1nhn h LYS 60 N -0.58 0.02 0.20 0.00 3.64 0.80 0.17 116.57 120.81 1nhn h LYS 60 Ca -0.05 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 1nhn h LYS 60 Cb 0.43 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1nhn h LYS 60 CO 0.08 0.01 -0.10 -0.07 -2.27 0.00 0.00 179.45 177.11 1nhn h LEU 61 N 0.02 -0.23 -1.19 5.20 3.38 -1.17 -2.41 115.31 118.91 1nhn h LEU 61 Ca 0.47 -0.30 0.12 0.00 0.09 0.00 0.00 57.88 58.27 1nhn h LEU 61 Cb 0.81 0.06 -0.07 0.00 0.09 0.00 0.00 40.66 41.55 1nhn h LEU 61 CO -0.87 0.27 0.59 0.11 0.09 0.00 0.00 178.44 178.62 1nhn h LYS 62 N -0.83 0.80 0.47 1.13 1.57 -0.39 -2.16 116.57 117.15 1nhn h LYS 62 Ca -0.03 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.68 1nhn h LYS 62 Cb 0.52 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.65 1nhn h LYS 62 CO 0.05 0.53 -0.23 1.49 -0.57 0.00 0.00 179.45 180.71 1nhn h GLU 63 N 0.82 -0.62 -0.89 3.15 4.81 -0.73 0.64 114.58 121.77 1nhn h GLU 63 Ca 0.45 0.04 0.19 0.00 -0.13 0.00 0.00 59.36 59.92 1nhn h GLU 63 Cb 0.57 0.14 -0.11 0.00 0.63 0.00 0.00 28.75 29.98 1nhn h GLU 63 CO -0.22 -0.41 0.44 1.57 -0.73 0.00 0.00 179.01 179.66 1nhn h LYS 64 N -0.64 0.51 0.25 1.92 2.10 -1.21 -2.33 116.57 117.17 1nhn h LYS 64 Ca -0.06 -0.03 -0.01 0.00 -2.00 0.00 0.00 60.65 58.55 1nhn h LYS 64 Cb 0.49 -0.11 -0.00 0.00 -0.90 0.00 0.00 32.23 31.70 1nhn h LYS 64 CO 0.10 0.34 -0.18 -0.92 -2.00 0.00 0.00 179.45 176.79 1nhn h TYR 65 N 0.52 -0.50 -1.76 0.07 3.20 -1.22 0.01 116.97 117.29 1nhn h TYR 65 Ca 0.53 -0.00 0.51 0.00 3.14 0.00 0.00 58.73 62.91 1nhn h TYR 65 Cb 0.91 0.19 -0.07 0.00 1.54 0.00 0.00 36.73 39.30 1nhn h TYR 65 CO -0.10 -0.26 1.28 0.39 -1.64 0.00 0.00 178.16 177.83 1nhn n GLU 66 N -3.41 0.00 -0.08 1.82 -0.58 0.20 0.95 120.64 119.54 1nhn n GLU 66 Ca -0.05 0.97 -0.14 0.00 -0.42 0.00 0.00 57.16 57.52 1nhn n GLU 66 Cb 0.18 -2.25 -0.10 0.00 -0.57 0.00 0.00 31.44 28.70 1nhn n GLU 66 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 1nhn h LYS 67 N 0.00 0.00 -1.10 3.49 6.56 -1.28 -2.97 116.57 121.28 1nhn h LYS 67 Ca 0.84 0.00 0.30 0.00 -1.06 0.00 0.00 60.65 60.73 1nhn h LYS 67 Cb 3.39 0.00 -0.07 0.00 -0.57 0.00 0.00 32.23 34.98 1nhn h LYS 67 CO -0.01 0.80 0.75 -0.44 -2.06 0.00 0.00 179.45 178.49 1nhn h ASP 68 N -1.00 0.23 0.02 0.86 5.19 0.26 0.35 116.42 122.32 1nhn h ASP 68 Ca -0.10 0.05 -0.00 0.00 -0.62 0.00 0.00 57.03 56.35 1nhn h ASP 68 Cb 0.92 0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.45 1nhn h ASP 68 CO -0.06 0.04 -0.01 -0.29 -3.12 0.00 0.00 179.24 175.80 1nhn h ILE 69 N 0.20 1.46 -0.28 0.35 -0.00 -0.94 -1.23 117.51 117.07 1nhn h ILE 69 Ca 0.58 -1.51 0.08 0.00 -0.00 0.00 0.00 64.86 64.01 1nhn h ILE 69 Cb 1.86 2.46 -0.01 0.00 -0.00 0.00 0.00 36.82 41.13 1nhn h ILE 69 CO -0.16 0.38 0.23 0.00 -0.00 0.00 0.00 178.15 178.60 1nhn h ALA 70 N 0.28 2.10 0.00 0.18 0.00 -0.62 0.29 119.26 121.49 1nhn h ALA 70 Ca -0.00 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.74 1nhn h ALA 70 Cb 0.64 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 1nhn h ALA 70 CO 0.00 -0.38 -0.92 0.00 0.00 0.00 0.00 179.25 177.96 1nhn h ALA 71 N 1.79 0.58 0.00 0.00 0.00 -0.32 -0.95 119.26 120.37 1nhn h ALA 71 Ca 0.13 -0.74 0.00 0.00 0.00 0.00 0.00 54.91 54.30 1nhn h ALA 71 Cb 0.60 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1nhn h ALA 71 CO -0.00 0.94 -0.59 0.98 0.00 0.00 0.00 179.25 180.58 1nhn n TYR 72 N -3.18 0.29 -0.04 0.00 9.36 0.50 -3.44 117.16 120.65 1nhn n TYR 72 Ca -0.02 0.09 0.01 0.00 3.32 0.00 0.00 57.90 61.29 1nhn n TYR 72 Cb 0.84 -0.47 -0.12 0.00 -0.63 0.00 0.00 39.34 38.96 1nhn n TYR 72 CO 0.00 0.00 0.00 -2.13 0.22 0.00 0.00 176.86 174.95 1nhn n ARG 73 N -1.84 0.98 0.00 2.98 0.63 0.74 -4.45 116.66 115.70 1nhn n ARG 73 Ca 0.04 -0.08 0.13 0.00 -0.92 0.00 0.00 57.85 57.02 1nhn n ARG 73 Cb 0.39 -1.38 0.32 0.00 0.45 0.00 0.00 32.46 32.25 1nhn n ARG 73 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1nhn n ALA 74 N -2.27 3.00 -4.07 5.13 0.00 -0.36 -4.94 120.51 117.00 1nhn n ALA 74 Ca -0.12 -0.48 -0.18 0.00 0.00 0.00 0.00 53.44 52.66 1nhn n ALA 74 Cb 0.66 -1.05 -0.05 0.00 0.00 0.00 0.00 19.45 19.01 1nhn n ALA 74 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1nhn n LYS 75 N -0.20 0.58 0.00 0.00 4.81 -1.22 -4.86 118.16 117.26 1nhn n LYS 75 Ca 0.13 -2.33 0.00 0.00 -0.87 0.00 0.00 58.31 55.24 1nhn n LYS 75 Cb 0.39 1.44 0.00 0.00 0.02 0.00 0.00 35.03 36.88 1nhn n LYS 75 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1nhn n GLY 76 N 0.02 3.42 0.43 3.14 0.00 -1.26 -4.84 105.19 106.09 1nhn n GLY 76 Ca -0.01 -1.01 -0.08 0.00 0.00 0.00 0.00 46.02 44.92 1nhn n GLY 76 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nhn n LYS 77 N 0.00 0.19 -0.68 1.61 4.76 -1.26 -4.64 118.16 118.14 1nhn n LYS 77 Ca 0.00 0.06 0.51 0.00 -2.87 0.00 0.00 58.31 56.02 1nhn n LYS 77 Cb 0.00 -0.96 0.79 0.00 -1.84 0.00 0.00 35.03 33.02 1nhn n LYS 77 CO 0.00 0.00 0.00 -2.30 -1.37 0.00 0.00 177.40 173.73 1nhn n PRO 78 N -3.10 -0.00 -3.34 1.97 -0.02 -1.26 -2.28 135.00 126.97 1nhn n PRO 78 Ca -0.16 1.07 -0.40 0.00 -2.02 0.00 0.00 63.50 61.99 1nhn n PRO 78 Cb 0.63 -2.44 -0.02 0.00 -0.02 0.00 0.00 33.50 31.65 1nhn n PRO 78 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1nhn n ASP 79 N -3.94 5.24 -2.90 2.55 2.03 -1.26 -4.88 116.55 113.39 1nhn n ASP 79 Ca 0.43 -3.21 -0.30 0.00 0.52 0.00 0.00 54.79 52.24 1nhn n ASP 79 Cb 1.94 -1.19 -0.02 0.00 -0.72 0.00 0.00 41.12 41.13 1nhn n ASP 79 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1nhn n ALA 80 N 2.01 5.10 0.32 -1.67 0.00 -0.97 -4.87 120.51 120.43 1nhn n ALA 80 Ca 0.24 -4.55 0.04 0.00 0.00 0.00 0.00 53.44 49.17 1nhn n ALA 80 Cb 0.37 -0.95 0.03 0.00 0.00 0.00 0.00 19.45 18.90 1nhn n ALA 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50