#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 -1.58 -0.95 5.41 0.00 -1.26 -4.75 120.51 117.38 1nhn n ALA 4 Ca 0.00 0.10 -0.30 0.00 0.00 0.00 0.00 53.44 53.24 1nhn n ALA 4 Cb 0.00 -0.83 0.01 0.00 0.00 0.00 0.00 19.45 18.63 1nhn n ALA 4 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1nhn n PRO 5 N -0.30 0.00 -3.48 0.00 -0.02 -1.26 -5.01 135.00 124.93 1nhn n PRO 5 Ca -0.05 0.00 -0.20 0.00 -2.02 0.00 0.00 63.50 61.23 1nhn n PRO 5 Cb 0.29 -0.76 -0.12 0.00 -0.02 0.00 0.00 33.50 32.88 1nhn n PRO 5 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 1nhn s LYS 6 N -0.78 0.22 -0.07 -0.52 -2.85 -1.26 -5.02 119.74 109.46 1nhn s LYS 6 Ca 0.43 0.00 -0.06 0.00 -1.00 0.00 0.00 55.97 55.34 1nhn s LYS 6 Cb -0.38 -1.09 0.01 0.00 -2.06 0.00 0.00 37.83 34.31 1nhn s LYS 6 CO 0.51 -0.80 0.10 0.54 0.10 0.00 0.00 175.35 175.80 1nhn n ARG 7 N 5.31 -0.31 -0.48 1.78 1.74 -1.26 -4.86 116.66 118.58 1nhn n ARG 7 Ca -0.05 0.24 -0.26 0.00 -0.77 0.00 0.00 57.85 57.01 1nhn n ARG 7 Cb 0.48 -0.33 0.21 0.00 -1.02 0.00 0.00 32.46 31.79 1nhn n ARG 7 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1nhn n PRO 8 N 0.05 -2.84 -1.45 5.56 -0.02 -1.26 -4.76 135.00 130.27 1nhn n PRO 8 Ca -0.01 -0.83 -0.56 0.00 -2.02 0.00 0.00 63.50 60.08 1nhn n PRO 8 Cb 0.12 -1.74 -0.09 0.00 -0.02 0.00 0.00 33.50 31.77 1nhn n PRO 8 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1nhn n PRO 9 N -3.34 0.70 -3.67 0.52 -0.02 -1.26 -4.92 135.00 123.01 1nhn n PRO 9 Ca 0.06 0.21 -0.18 0.00 -2.02 0.00 0.00 63.50 61.57 1nhn n PRO 9 Cb 0.51 -2.04 -0.17 0.00 -0.02 0.00 0.00 33.50 31.78 1nhn n PRO 9 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1nhn s SER 10 N 5.96 0.91 0.00 2.55 0.15 -1.26 -4.64 113.70 117.37 1nhn s SER 10 Ca 1.10 0.22 0.00 0.00 0.70 0.00 0.00 55.95 57.98 1nhn s SER 10 Cb -1.13 0.10 0.00 0.00 -1.71 0.00 0.00 66.02 63.27 1nhn s SER 10 CO 0.59 -0.25 0.00 0.00 1.20 0.00 0.00 173.24 174.79 1nhn n ALA 11 N 5.31 0.00 0.11 5.45 0.00 -1.26 -4.08 120.51 126.04 1nhn n ALA 11 Ca -0.04 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.37 1nhn n ALA 11 Cb 0.50 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.99 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 0.00 0.93 0.00 3.57 -1.94 -3.19 116.94 116.31 1nhn h PHE 12 Ca 0.00 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.45 1nhn h PHE 12 Cb 0.00 0.00 0.01 0.00 2.79 0.00 0.00 35.95 38.75 1nhn h PHE 12 CO 0.00 0.77 -0.45 0.35 -2.23 0.00 0.00 178.31 176.75 1nhn h PHE 13 N 0.00 -1.16 -0.83 0.41 3.57 -1.82 -0.71 116.94 116.40 1nhn h PHE 13 Ca -0.01 -0.03 0.15 0.00 3.53 0.00 0.00 57.97 61.61 1nhn h PHE 13 Cb 1.41 0.38 -0.15 0.00 2.79 0.00 0.00 35.95 40.38 1nhn h PHE 13 CO 0.00 -0.72 -0.31 -0.07 -2.23 0.00 0.00 178.31 174.97 1nhn h LEU 14 N -1.25 -1.14 -0.78 0.59 -0.00 -1.87 0.53 115.31 111.39 1nhn h LEU 14 Ca -0.13 0.27 0.12 0.00 -0.00 0.00 0.00 57.88 58.14 1nhn h LEU 14 Cb 0.96 0.63 -0.08 0.00 -0.00 0.00 0.00 40.66 42.16 1nhn h LEU 14 CO 0.21 -0.29 0.39 0.15 -0.00 0.00 0.00 178.44 178.90 1nhn h PHE 15 N -0.05 0.69 -0.13 1.13 3.57 -1.52 -1.64 116.94 118.98 1nhn h PHE 15 Ca 0.34 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.75 1nhn h PHE 15 Cb 0.60 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.13 1nhn h PHE 15 CO -0.74 0.20 -0.42 0.00 -2.23 0.00 0.00 178.31 175.12 1nhn h SER 17 N 0.26 -0.22 0.15 0.00 0.02 -0.07 0.36 113.55 114.04 1nhn h SER 17 Ca 0.02 0.04 -0.10 0.00 -0.84 0.00 0.00 61.79 60.91 1nhn h SER 17 Cb 0.86 0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.49 1nhn h SER 17 CO 0.07 -0.10 -0.37 -0.33 -1.14 0.00 0.00 176.83 174.96 1nhn h GLU 18 N -0.10 0.31 0.00 3.45 5.08 -1.53 -3.39 114.58 118.40 1nhn h GLU 18 Ca 0.05 -0.14 -0.31 0.00 -1.00 0.00 0.00 59.36 57.97 1nhn h GLU 18 Cb 0.17 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.36 1nhn h GLU 18 CO -0.12 0.64 -2.10 0.66 -1.00 0.00 0.00 179.01 177.09 1nhn n TYR 19 N -4.06 0.00 -0.42 4.33 4.02 -1.07 -4.46 117.16 115.50 1nhn n TYR 19 Ca -0.01 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.77 1nhn n TYR 19 Cb 0.46 -0.73 -0.10 0.00 -0.02 0.00 0.00 39.34 38.95 1nhn n TYR 19 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 1nhn h ARG 20 N -0.29 -0.00 0.00 -0.72 2.43 -0.46 0.36 114.38 115.69 1nhn h ARG 20 Ca -0.46 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.71 1nhn h ARG 20 Cb 1.57 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.12 1nhn h ARG 20 CO -0.16 -0.00 0.00 -0.35 -1.51 0.00 0.00 179.97 177.94 1nhn n PRO 21 N -5.25 0.29 -0.11 0.20 -0.04 -1.26 -0.41 135.00 128.42 1nhn n PRO 21 Ca 0.02 0.10 -0.24 0.00 -0.04 0.00 0.00 63.50 63.35 1nhn n PRO 21 Cb 0.26 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.12 1nhn n PRO 21 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1nhn n LYS 22 N -1.24 0.57 -0.07 0.54 4.81 0.11 -2.10 118.16 120.78 1nhn n LYS 22 Ca 0.09 0.48 -0.12 0.00 -0.87 0.00 0.00 58.31 57.89 1nhn n LYS 22 Cb 0.13 -1.67 -0.05 0.00 0.02 0.00 0.00 35.03 33.46 1nhn n LYS 22 CO 0.00 0.00 0.00 -0.84 1.17 0.00 0.00 177.40 177.73 1nhn h ILE 23 N -1.00 1.30 -0.84 3.15 3.07 -0.95 -1.85 117.51 120.38 1nhn h ILE 23 Ca -0.44 -1.11 0.06 0.00 1.55 0.00 0.00 64.86 64.92 1nhn h ILE 23 Cb 1.37 1.58 -0.05 0.00 -0.27 0.00 0.00 36.82 39.45 1nhn h ILE 23 CO -0.27 0.34 0.55 0.50 -1.05 0.00 0.00 178.15 178.22 1nhn h LYS 24 N 0.14 0.91 -0.81 0.16 3.64 -0.91 0.59 116.57 120.29 1nhn h LYS 24 Ca 0.05 -0.05 0.19 0.00 -1.27 0.00 0.00 60.65 59.57 1nhn h LYS 24 Cb 0.55 -0.20 -0.14 0.00 -0.41 0.00 0.00 32.23 32.03 1nhn h LYS 24 CO 0.03 0.60 0.04 0.78 -2.27 0.00 0.00 179.45 178.63 1nhn h GLY 25 N 0.94 0.98 0.47 5.01 0.00 -0.77 0.87 103.07 110.56 1nhn h GLY 25 Ca 0.36 0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.79 1nhn h GLY 25 CO -0.13 -0.33 -1.31 -1.84 0.00 0.00 0.00 176.54 172.93 1nhn n GLU 26 N -5.35 0.45 -2.89 4.80 0.28 -0.66 -4.46 120.64 112.83 1nhn n GLU 26 Ca 0.16 -0.03 -0.34 0.00 -0.16 0.00 0.00 57.16 56.79 1nhn n GLU 26 Cb 0.54 -1.62 -0.02 0.00 1.43 0.00 0.00 31.44 31.78 1nhn n GLU 26 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 1nhn n HIS 27 N -2.19 3.37 -0.28 -1.84 8.25 0.20 -4.81 115.22 117.91 1nhn n HIS 27 Ca -0.00 -3.34 -0.06 0.00 -0.26 0.00 0.00 57.72 54.06 1nhn n HIS 27 Cb 0.50 -0.83 0.02 0.00 1.12 0.00 0.00 29.99 30.79 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 0.09 1.28 0.00 -0.41 -0.04 -0.57 -2.60 135.00 132.75 1nhn n PRO 28 Ca 0.36 -0.58 0.00 0.00 -0.04 0.00 0.00 63.50 63.24 1nhn n PRO 28 Cb 0.34 -1.23 0.00 0.00 -0.04 0.00 0.00 33.50 32.57 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 0.81 0.13 3.33 0.55 0.00 -1.26 -5.08 105.19 103.67 1nhn n GLY 29 Ca 0.11 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.93 1nhn n GLY 29 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nhn n LEU 30 N -0.74 0.00 -4.67 0.99 4.77 -1.07 -5.12 117.00 111.16 1nhn n LEU 30 Ca 0.00 -1.81 -0.28 0.00 -0.03 0.00 0.00 56.01 53.89 1nhn n LEU 30 Cb 0.00 -0.56 -0.10 0.00 -2.33 0.00 0.00 43.42 40.44 1nhn n LEU 30 CO 0.00 -0.92 -0.25 -0.44 -1.33 0.00 0.00 177.39 174.45 1nhn s SER 31 N -4.49 4.03 -0.09 -1.43 0.01 -1.26 -4.97 113.70 105.50 1nhn s SER 31 Ca 0.57 -1.35 0.05 0.00 1.31 0.00 0.00 55.95 56.53 1nhn s SER 31 Cb -0.03 -0.27 0.30 0.00 0.21 0.00 0.00 66.02 66.23 1nhn s SER 31 CO 0.38 -0.54 0.96 0.00 0.41 0.00 0.00 173.24 174.45 1nhn n ILE 32 N -1.08 1.01 0.00 1.44 3.06 -1.26 -1.36 119.36 121.18 1nhn n ILE 32 Ca -0.06 -0.51 0.00 0.00 -2.50 0.00 0.00 62.75 59.68 1nhn n ILE 32 Cb 0.66 -0.41 0.00 0.00 0.54 0.00 0.00 39.64 40.43 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 0.24 0.00 0.32 4.50 0.00 -1.26 -4.38 105.19 104.60 1nhn n GLY 33 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.91 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 -1.54 1.61 0.28 1.61 2.03 -0.99 -2.28 116.55 117.27 1nhn n ASP 34 Ca 0.00 0.21 0.11 0.00 0.52 0.00 0.00 54.79 55.63 1nhn n ASP 34 Cb 0.15 -0.58 0.76 0.00 -0.72 0.00 0.00 41.12 40.72 1nhn n ASP 34 CO 0.00 0.00 0.00 1.62 -1.92 0.00 0.00 177.20 176.90 1nhn h VAL 35 N -0.66 0.80 0.21 5.18 3.04 -1.53 0.30 116.25 123.59 1nhn h VAL 35 Ca -0.53 -0.02 -0.28 0.00 -1.01 0.00 0.00 66.70 64.87 1nhn h VAL 35 Cb 1.50 1.01 0.03 0.00 -2.01 0.00 0.00 31.29 31.82 1nhn h VAL 35 CO -0.29 0.00 -1.23 0.00 -1.01 0.00 0.00 177.57 175.04 1nhn h ALA 36 N 2.00 -0.13 -0.69 3.17 0.00 -1.74 -3.07 119.26 118.80 1nhn h ALA 36 Ca -0.00 -0.81 0.14 0.00 0.00 0.00 0.00 54.91 54.25 1nhn h ALA 36 Cb 0.01 0.16 -0.10 0.00 0.00 0.00 0.00 17.79 17.86 1nhn h ALA 36 CO 0.00 0.58 0.15 -0.22 0.00 0.00 0.00 179.25 179.76 1nhn h LYS 37 N -0.06 0.25 0.64 0.00 3.64 -0.02 0.28 116.57 121.30 1nhn h LYS 37 Ca -0.22 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.12 1nhn h LYS 37 Cb 1.97 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.73 1nhn h LYS 37 CO 0.23 0.16 -0.34 0.87 -2.27 0.00 0.00 179.45 178.10 1nhn h LYS 38 N 0.26 -0.87 -0.45 1.90 1.57 -1.26 -2.48 116.57 115.24 1nhn h LYS 38 Ca 0.38 0.06 0.09 0.00 -1.87 0.00 0.00 60.65 59.31 1nhn h LYS 38 Cb 0.63 0.20 -0.09 0.00 0.08 0.00 0.00 32.23 33.04 1nhn h LYS 38 CO -0.48 -0.58 -0.18 -0.07 -0.57 0.00 0.00 179.45 177.57 1nhn h LEU 39 N -0.90 -0.63 -0.62 2.94 3.38 -1.19 0.10 115.31 118.40 1nhn h LEU 39 Ca -0.08 0.16 0.23 0.00 0.09 0.00 0.00 57.88 58.27 1nhn h LEU 39 Cb 0.70 0.36 -0.11 0.00 0.09 0.00 0.00 40.66 41.70 1nhn h LEU 39 CO 0.12 -0.21 0.22 0.61 0.09 0.00 0.00 178.44 179.26 1nhn n GLY 40 N -1.38 -0.61 0.06 0.83 0.00 0.90 -0.85 105.19 104.14 1nhn n GLY 40 Ca 0.03 0.54 -0.04 0.00 0.00 0.00 0.00 46.02 46.55 1nhn n GLY 40 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nhn n GLU 41 N -4.55 0.41 -0.30 1.61 -0.58 -0.06 -4.45 120.64 112.72 1nhn n GLU 41 Ca 0.20 0.49 0.29 0.00 -0.42 0.00 0.00 57.16 57.73 1nhn n GLU 41 Cb 0.68 -1.60 0.54 0.00 -0.57 0.00 0.00 31.44 30.50 1nhn n GLU 41 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 1nhn n MET 42 N -4.38 -0.05 -0.37 3.49 2.81 0.15 -0.64 117.12 118.13 1nhn n MET 42 Ca -0.07 1.25 0.04 0.00 -1.81 0.00 0.00 57.70 57.11 1nhn n MET 42 Cb 0.24 -2.25 0.19 0.00 -0.71 0.00 0.00 33.22 30.69 1nhn n MET 42 CO 0.00 0.00 0.00 2.35 1.51 0.00 0.00 175.97 179.83 1nhn h TRP 43 N 0.00 1.19 -0.36 2.03 2.91 -1.37 0.00 115.95 120.36 1nhn h TRP 43 Ca 0.77 0.03 -0.16 0.00 1.13 0.00 0.00 58.89 60.66 1nhn h TRP 43 Cb 2.07 -0.39 -0.01 0.00 -0.51 0.00 0.00 29.16 30.32 1nhn h TRP 43 CO -0.01 0.59 -0.40 -0.91 -1.03 0.00 0.00 178.44 176.67 1nhn h ASN 44 N 1.14 0.95 -0.41 2.65 2.35 -1.11 -2.74 115.58 118.42 1nhn h ASN 44 Ca 0.45 -0.44 -0.25 0.00 -0.55 0.00 0.00 56.30 55.51 1nhn h ASN 44 Cb 0.24 -0.27 -0.12 0.00 0.05 0.00 0.00 38.32 38.21 1nhn h ASN 44 CO -0.19 1.23 0.32 0.59 -1.65 0.00 0.00 177.43 177.72 1nhn n ASN 45 N -4.05 4.83 -1.23 5.81 3.02 -0.24 -4.88 115.26 118.52 1nhn n ASN 45 Ca -0.02 -2.82 0.00 0.00 -0.03 0.00 0.00 54.58 51.71 1nhn n ASN 45 Cb 0.55 -0.86 0.00 0.00 -0.61 0.00 0.00 39.78 38.87 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 0.17 0.00 -0.81 3.41 5.66 -0.18 -4.90 114.28 117.63 1nhn n THR 46 Ca 0.25 0.00 -0.04 0.00 -3.05 0.00 0.00 64.05 61.21 1nhn n THR 46 Cb 0.77 -1.05 0.29 0.00 -1.55 0.00 0.00 70.33 68.80 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 4.31 -0.90 1.79 0.00 -1.26 -4.91 120.51 116.54 1nhn n ALA 47 Ca 0.00 -2.04 0.00 0.00 0.00 0.00 0.00 53.44 51.40 1nhn n ALA 47 Cb 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.23 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 0.00 -0.23 0.00 0.00 0.00 -1.26 -3.78 120.51 115.25 1nhn n ALA 48 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.79 1nhn n ALA 48 Cb 1.27 -0.14 0.00 0.00 0.00 0.00 0.00 19.45 20.58 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 -0.22 1.27 -0.14 0.00 -0.08 -1.26 -4.71 116.55 111.41 1nhn n ASP 49 Ca 0.00 0.00 0.15 0.00 -1.51 0.00 0.00 54.79 53.43 1nhn n ASP 49 Cb 0.11 0.12 0.82 0.00 2.34 0.00 0.00 41.12 44.51 1nhn n ASP 49 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1nhn n ASP 50 N -0.95 0.44 0.05 1.67 -0.08 -1.25 -2.90 116.55 113.53 1nhn n ASP 50 Ca 0.00 -1.11 0.02 0.00 -1.51 0.00 0.00 54.79 52.19 1nhn n ASP 50 Cb 0.13 -0.01 -0.06 0.00 2.34 0.00 0.00 41.12 43.52 1nhn n ASP 50 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 1nhn h LYS 51 N 0.68 0.00 -0.33 -0.67 1.57 -1.89 -3.35 116.57 112.58 1nhn h LYS 51 Ca 0.00 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.83 1nhn h LYS 51 Cb 0.16 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.42 1nhn h LYS 51 CO 0.00 0.25 0.04 1.96 -0.57 0.00 0.00 179.45 181.13 1nhn h GLN 52 N 0.00 0.14 0.33 3.15 1.08 -1.86 0.20 115.11 118.14 1nhn h GLN 52 Ca -0.12 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.07 1nhn h GLN 52 Cb 1.46 -0.03 -0.03 0.00 -0.05 0.00 0.00 27.48 28.83 1nhn h GLN 52 CO 0.04 0.09 -0.46 -1.00 -0.95 0.00 0.00 178.83 176.55 1nhn h PRO 53 N 0.14 -0.80 -0.70 1.46 0.13 -1.76 -2.95 132.00 127.51 1nhn h PRO 53 Ca 0.16 0.05 0.14 0.00 -0.87 0.00 0.00 66.00 65.48 1nhn h PRO 53 Cb 0.19 0.18 -0.10 0.00 0.13 0.00 0.00 31.00 31.41 1nhn h PRO 53 CO -0.23 -0.53 0.21 1.88 -0.23 0.00 0.00 178.00 179.10 1nhn h TYR 54 N -0.83 0.35 0.20 1.56 0.05 -1.58 -2.64 116.97 114.08 1nhn h TYR 54 Ca -0.03 0.04 -0.01 0.00 0.05 0.00 0.00 58.73 58.78 1nhn h TYR 54 Cb 0.77 -0.05 0.00 0.00 1.01 0.00 0.00 36.73 38.46 1nhn h TYR 54 CO -0.30 -0.01 -0.10 1.05 -1.05 0.00 0.00 178.16 177.76 1nhn h GLU 55 N 0.34 -0.26 -1.22 4.88 4.11 -0.62 0.86 114.58 122.68 1nhn h GLU 55 Ca 0.38 0.02 0.36 0.00 0.07 0.00 0.00 59.36 60.19 1nhn h GLU 55 Cb 0.60 0.06 -0.09 0.00 0.50 0.00 0.00 28.75 29.81 1nhn h GLU 55 CO -0.43 -0.04 0.82 0.87 0.07 0.00 0.00 179.01 180.30 1nhn h LYS 56 N -0.44 0.17 0.00 1.06 1.79 -1.29 0.20 116.57 118.06 1nhn h LYS 56 Ca -0.03 -0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 58.39 1nhn h LYS 56 Cb 0.34 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.94 1nhn h LYS 56 CO 0.04 0.11 -0.24 -0.22 -1.08 0.00 0.00 179.45 178.07 1nhn h LYS 57 N 0.18 0.00 -0.90 3.15 3.11 -1.34 -3.07 116.57 117.69 1nhn h LYS 57 Ca 0.68 0.00 0.23 0.00 -2.81 0.00 0.00 60.65 58.74 1nhn h LYS 57 Cb 2.16 0.00 -0.16 0.00 -1.00 0.00 0.00 32.23 33.23 1nhn h LYS 57 CO -0.24 0.72 0.00 0.00 -2.81 0.00 0.00 179.45 177.13 1nhn h ALA 58 N -0.36 0.99 0.35 5.00 0.00 0.67 0.45 119.26 126.36 1nhn h ALA 58 Ca -0.06 0.30 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 1nhn h ALA 58 Cb 0.81 0.54 -0.03 0.00 0.00 0.00 0.00 17.79 19.11 1nhn h ALA 58 CO -0.04 -0.49 -0.39 0.00 0.00 0.00 0.00 179.25 178.34 1nhn h ALA 59 N 1.88 -0.82 -0.96 0.00 0.00 -0.80 -0.63 119.26 117.92 1nhn h ALA 59 Ca 0.52 -0.13 0.15 0.00 0.00 0.00 0.00 54.91 55.45 1nhn h ALA 59 Cb 1.00 0.57 -0.15 0.00 0.00 0.00 0.00 17.79 19.20 1nhn h ALA 59 CO -0.83 -1.00 -0.39 1.17 0.00 0.00 0.00 179.25 178.20 1nhn n LYS 60 N -5.48 -0.24 0.32 0.00 0.00 0.15 -0.45 118.16 112.46 1nhn n LYS 60 Ca -0.10 1.48 -0.17 0.00 0.00 0.00 0.00 58.31 59.52 1nhn n LYS 60 Cb 0.38 -2.20 -0.09 0.00 0.00 0.00 0.00 35.03 33.13 1nhn n LYS 60 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 1nhn h LEU 61 N 0.00 -1.05 -1.31 3.14 3.38 -0.60 -2.12 115.31 116.75 1nhn h LEU 61 Ca 0.33 0.07 0.16 0.00 0.09 0.00 0.00 57.88 58.53 1nhn h LEU 61 Cb 0.57 0.32 -0.07 0.00 0.09 0.00 0.00 40.66 41.57 1nhn h LEU 61 CO -0.95 -0.60 0.58 0.11 0.09 0.00 0.00 178.44 177.67 1nhn h LYS 62 N -0.93 0.62 0.59 1.13 1.57 0.32 -1.09 116.57 118.79 1nhn h LYS 62 Ca -0.06 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.66 1nhn h LYS 62 Cb 0.78 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.94 1nhn h LYS 62 CO 0.03 0.41 -0.43 1.49 -0.57 0.00 0.00 179.45 180.38 1nhn h GLU 63 N 0.64 -0.95 -0.61 3.15 4.22 -0.47 -0.28 114.58 120.28 1nhn h GLU 63 Ca 0.46 0.06 0.10 0.00 0.08 0.00 0.00 59.36 60.07 1nhn h GLU 63 Cb 0.83 0.22 -0.11 0.00 0.50 0.00 0.00 28.75 30.18 1nhn h GLU 63 CO -0.22 -0.63 -0.41 -0.22 -2.18 0.00 0.00 179.01 175.35 1nhn h LYS 64 N -0.99 -0.19 -0.09 1.92 3.64 -0.55 -2.08 116.57 118.24 1nhn h LYS 64 Ca -0.07 0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.34 1nhn h LYS 64 Cb 0.82 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.65 1nhn h LYS 64 CO 0.03 -0.12 -0.25 -0.92 -2.27 0.00 0.00 179.45 175.92 1nhn h TYR 65 N -0.19 -0.74 -1.46 1.91 3.20 -1.02 -1.03 116.97 117.65 1nhn h TYR 65 Ca 0.20 0.03 0.45 0.00 3.14 0.00 0.00 58.73 62.55 1nhn h TYR 65 Cb 0.56 0.33 -0.09 0.00 1.54 0.00 0.00 36.73 39.08 1nhn h TYR 65 CO -0.71 -0.24 1.01 0.39 -1.64 0.00 0.00 178.16 176.97 1nhn n GLU 66 N -3.87 -0.01 0.01 1.82 1.02 -0.15 0.52 120.64 119.99 1nhn n GLU 66 Ca -0.02 0.98 -0.20 0.00 -0.02 0.00 0.00 57.16 57.89 1nhn n GLU 66 Cb 0.17 -2.10 -0.14 0.00 -0.02 0.00 0.00 31.44 29.34 1nhn n GLU 66 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1nhn h LYS 67 N 0.00 0.23 -0.63 3.49 6.56 -1.06 -2.34 116.57 122.82 1nhn h LYS 67 Ca 0.77 -0.38 0.10 0.00 -1.06 0.00 0.00 60.65 60.08 1nhn h LYS 67 Cb 2.86 0.14 -0.04 0.00 -0.57 0.00 0.00 32.23 34.62 1nhn h LYS 67 CO -0.18 1.18 0.42 0.22 -2.06 0.00 0.00 179.45 179.04 1nhn h ASP 68 N -0.44 0.42 -0.18 0.86 3.58 0.85 0.54 116.42 122.04 1nhn h ASP 68 Ca -0.23 0.01 -0.14 0.00 0.42 0.00 0.00 57.03 57.09 1nhn h ASP 68 Cb 1.62 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 42.60 1nhn h ASP 68 CO 0.07 0.25 -0.42 -0.29 -2.88 0.00 0.00 179.24 175.96 1nhn h ILE 69 N 0.47 1.33 0.00 2.25 -0.00 -1.08 -0.38 117.51 120.10 1nhn h ILE 69 Ca 0.29 -1.67 -0.02 0.00 -0.00 0.00 0.00 64.86 63.46 1nhn h ILE 69 Cb 0.52 1.92 -0.00 0.00 -0.00 0.00 0.00 36.82 39.25 1nhn h ILE 69 CO -0.09 0.51 -0.11 0.00 -0.00 0.00 0.00 178.15 178.47 1nhn h ALA 70 N 0.58 1.73 -0.00 0.18 0.00 -0.43 0.35 119.26 121.67 1nhn h ALA 70 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1nhn h ALA 70 Cb 1.03 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1nhn h ALA 70 CO 0.09 0.14 -0.26 0.00 0.00 0.00 0.00 179.25 179.22 1nhn n ALA 71 N -2.48 3.06 -0.11 0.00 0.00 0.17 -0.74 120.51 120.41 1nhn n ALA 71 Ca -0.03 -0.34 -0.24 0.00 0.00 0.00 0.00 53.44 52.84 1nhn n ALA 71 Cb 0.19 -1.20 -0.11 0.00 0.00 0.00 0.00 19.45 18.32 1nhn n ALA 71 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1nhn n TYR 72 N -0.97 0.41 -0.02 0.00 9.36 0.00 -4.51 117.16 121.44 1nhn n TYR 72 Ca 0.11 0.14 -0.02 0.00 3.32 0.00 0.00 57.90 61.44 1nhn n TYR 72 Cb 0.33 -1.05 -0.03 0.00 -0.63 0.00 0.00 39.34 37.96 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 -3.93 2.67 -1.45 2.98 3.00 -0.53 -4.71 116.66 114.69 1nhn n ARG 73 Ca -0.44 0.00 -0.26 0.00 -0.00 0.00 0.00 57.85 57.15 1nhn n ARG 73 Cb 0.89 -1.10 0.09 0.00 0.00 0.00 0.00 32.46 32.35 1nhn n ARG 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1nhn n ALA 74 N -2.25 5.54 0.00 5.13 0.00 -0.79 -4.91 120.51 123.24 1nhn n ALA 74 Ca -0.07 -3.47 0.00 0.00 0.00 0.00 0.00 53.44 49.90 1nhn n ALA 74 Cb 0.62 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.94 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 -0.91 0.00 0.00 0.00 3.00 0.08 -4.66 118.16 115.67 1nhn n LYS 75 Ca 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.83 1nhn n LYS 75 Cb 0.91 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.94 1nhn n LYS 75 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1nhn n GLY 76 N -0.46 2.65 0.35 3.14 0.00 -1.26 -4.67 105.19 104.94 1nhn n GLY 76 Ca 0.00 -0.62 0.05 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.10 -0.17 1.61 5.02 -1.26 -1.71 118.16 121.55 1nhn n LYS 77 Ca 0.00 1.51 -0.01 0.00 -2.02 0.00 0.00 58.31 57.78 1nhn n LYS 77 Cb 0.00 -2.25 0.08 0.00 -0.02 0.00 0.00 35.03 32.84 1nhn n LYS 77 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 1nhn h PRO 78 N 0.00 0.17 0.00 1.97 0.11 -1.98 -3.47 132.00 128.81 1nhn h PRO 78 Ca 0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.55 1nhn h PRO 78 Cb 0.69 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.76 1nhn h PRO 78 CO -0.99 0.12 0.00 -3.47 -0.21 0.00 0.00 178.00 173.44 1nhn n ASP 79 N -5.18 0.00 -4.11 -2.05 -0.08 -0.69 -5.06 116.55 99.38 1nhn n ASP 79 Ca 0.07 0.00 -0.38 0.00 -1.51 0.00 0.00 54.79 52.97 1nhn n ASP 79 Cb 0.29 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 43.70 1nhn n ASP 79 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1nhn n ALA 80 N 0.00 4.01 0.72 -1.67 0.00 -1.26 -5.13 120.51 117.17 1nhn n ALA 80 Ca 0.00 -4.64 0.06 0.00 0.00 0.00 0.00 53.44 48.86 1nhn n ALA 80 Cb 0.00 -1.85 0.34 0.00 0.00 0.00 0.00 19.45 17.95 1nhn n ALA 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50