#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 4.62 -1.52 5.41 0.00 -1.26 -4.97 120.51 122.79 1nhn n ALA 4 Ca 0.00 -4.57 -0.14 0.00 0.00 0.00 0.00 53.44 48.73 1nhn n ALA 4 Cb 0.00 -0.71 -0.10 0.00 0.00 0.00 0.00 19.45 18.64 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 -0.26 0.33 -3.74 0.00 -0.04 -1.26 -4.87 135.00 125.15 1nhn n PRO 5 Ca 0.32 -0.94 -0.29 0.00 -0.04 0.00 0.00 63.50 62.56 1nhn n PRO 5 Cb 0.45 -3.29 -0.12 0.00 -0.04 0.00 0.00 33.50 30.50 1nhn n PRO 5 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 1nhn s LYS 6 N 8.38 1.69 -0.09 0.54 -2.85 -1.26 -4.47 119.74 121.67 1nhn s LYS 6 Ca 0.89 -2.55 0.10 0.00 -1.00 0.00 0.00 55.97 53.41 1nhn s LYS 6 Cb -0.19 -2.64 -0.14 0.00 -2.06 0.00 0.00 37.83 32.80 1nhn s LYS 6 CO 0.16 -1.24 0.08 2.89 0.10 0.00 0.00 175.35 177.34 1nhn n ARG 7 N 2.83 1.86 0.00 1.78 1.85 -1.26 -5.09 116.66 118.63 1nhn n ARG 7 Ca 0.16 -0.02 0.00 0.00 -1.00 0.00 0.00 57.85 56.99 1nhn n ARG 7 Cb 0.37 -1.28 0.00 0.00 -1.05 0.00 0.00 32.46 30.50 1nhn n ARG 7 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 1nhn n PRO 8 N -2.31 0.00 -0.21 2.89 -0.02 -1.26 -4.96 135.00 129.12 1nhn n PRO 8 Ca -0.15 0.00 -0.04 0.00 -2.02 0.00 0.00 63.50 61.29 1nhn n PRO 8 Cb 0.75 0.00 0.03 0.00 -0.02 0.00 0.00 33.50 34.27 1nhn n PRO 8 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1nhn n PRO 9 N 0.00 -0.84 0.00 0.52 -0.04 -1.26 -5.06 135.00 128.32 1nhn n PRO 9 Ca 0.00 -0.28 0.00 0.00 -0.04 0.00 0.00 63.50 63.18 1nhn n PRO 9 Cb 0.00 -0.23 0.00 0.00 -0.04 0.00 0.00 33.50 33.23 1nhn n PRO 9 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1nhn n SER 10 N -3.22 1.57 0.00 3.54 2.88 -1.26 -4.99 113.62 112.15 1nhn n SER 10 Ca 0.02 -1.78 0.00 0.00 -1.33 0.00 0.00 58.87 55.78 1nhn n SER 10 Cb 0.09 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.55 1nhn n SER 10 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1nhn n ALA 11 N -0.39 0.00 0.19 -1.46 0.00 -1.26 -4.64 120.51 112.95 1nhn n ALA 11 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 1nhn n ALA 11 Cb 0.30 0.00 0.38 0.00 0.00 0.00 0.00 19.45 20.13 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 -0.76 0.00 3.57 -1.94 -2.99 116.94 114.82 1nhn h PHE 12 Ca 0.00 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 1nhn h PHE 12 Cb 0.00 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 38.70 1nhn h PHE 12 CO 0.00 0.35 0.42 0.35 -2.23 0.00 0.00 178.31 177.20 1nhn h PHE 13 N 0.00 1.04 0.23 0.41 3.04 -1.95 -0.29 116.94 119.43 1nhn h PHE 13 Ca -0.00 -0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.93 1nhn h PHE 13 Cb 0.62 -0.33 -0.03 0.00 2.56 0.00 0.00 35.95 38.77 1nhn h PHE 13 CO 0.00 0.73 -0.47 -0.07 -2.02 0.00 0.00 178.31 176.48 1nhn h LEU 14 N 1.05 -1.37 -0.97 0.59 -0.00 -1.89 -2.00 115.31 110.72 1nhn h LEU 14 Ca 0.27 0.13 0.21 0.00 -0.00 0.00 0.00 57.88 58.49 1nhn h LEU 14 Cb 0.03 0.49 -0.11 0.00 -0.00 0.00 0.00 40.66 41.06 1nhn h LEU 14 CO -0.04 -0.53 0.56 0.15 -0.00 0.00 0.00 178.44 178.57 1nhn h PHE 15 N -0.75 0.97 -0.08 1.13 3.57 -1.59 -1.65 116.94 118.54 1nhn h PHE 15 Ca -0.02 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.49 1nhn h PHE 15 Cb 0.72 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.17 1nhn h PHE 15 CO -0.37 0.13 -0.07 0.00 -2.23 0.00 0.00 178.31 175.77 1nhn h SER 17 N 0.11 0.20 -0.07 0.00 4.64 -0.96 -1.43 113.55 116.04 1nhn h SER 17 Ca 0.03 -0.79 0.02 0.00 -0.47 0.00 0.00 61.79 60.58 1nhn h SER 17 Cb 0.20 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1nhn h SER 17 CO 0.01 1.46 0.09 -0.33 -0.87 0.00 0.00 176.83 177.19 1nhn h GLU 18 N -0.64 0.00 0.00 4.77 5.08 -1.47 -3.14 114.58 119.18 1nhn h GLU 18 Ca -0.26 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 57.84 1nhn h GLU 18 Cb 1.48 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.69 1nhn h GLU 18 CO -0.03 0.00 -1.99 0.66 -1.00 0.00 0.00 179.01 176.65 1nhn n TYR 19 N -3.71 0.00 -0.25 4.33 4.02 -0.98 -4.64 117.16 115.93 1nhn n TYR 19 Ca -0.01 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 57.82 1nhn n TYR 19 Cb 0.18 -0.68 -0.05 0.00 -0.02 0.00 0.00 39.34 38.77 1nhn n TYR 19 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1nhn n ARG 20 N -2.92 -0.25 0.00 -0.72 1.74 -0.54 -0.17 116.66 113.80 1nhn n ARG 20 Ca -0.29 0.91 0.15 0.00 -0.77 0.00 0.00 57.85 57.84 1nhn n ARG 20 Cb 0.85 -1.34 0.73 0.00 -1.02 0.00 0.00 32.46 31.68 1nhn n ARG 20 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1nhn n PRO 21 N -4.77 0.33 -0.07 5.56 -0.04 -1.26 -1.30 135.00 133.45 1nhn n PRO 21 Ca 0.02 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.28 1nhn n PRO 21 Cb 0.17 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.00 1nhn n PRO 21 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1nhn h LYS 22 N 0.00 0.05 -0.22 0.54 3.64 -0.82 -2.73 116.57 117.03 1nhn h LYS 22 Ca 0.00 -0.09 -0.16 0.00 -1.27 0.00 0.00 60.65 59.13 1nhn h LYS 22 Cb 0.33 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 1nhn h LYS 22 CO 0.00 1.04 -0.50 -0.84 -2.27 0.00 0.00 179.45 176.89 1nhn h ILE 23 N -0.84 1.30 -0.73 2.00 3.07 -1.48 -2.45 117.51 118.38 1nhn h ILE 23 Ca -0.25 -1.71 0.10 0.00 1.55 0.00 0.00 64.86 64.54 1nhn h ILE 23 Cb 1.33 1.81 -0.05 0.00 -0.27 0.00 0.00 36.82 39.65 1nhn h ILE 23 CO -0.10 0.54 0.48 0.50 -1.05 0.00 0.00 178.15 178.53 1nhn h LYS 24 N 0.45 0.61 -0.83 0.16 3.64 -1.33 0.93 116.57 120.20 1nhn h LYS 24 Ca 0.00 -0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.37 1nhn h LYS 24 Cb 1.11 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 32.75 1nhn h LYS 24 CO 0.11 0.40 0.55 0.78 -2.27 0.00 0.00 179.45 179.02 1nhn h GLY 25 N 0.62 1.17 1.22 5.01 0.00 -1.11 -1.34 103.07 108.65 1nhn h GLY 25 Ca 0.34 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 47.25 1nhn h GLY 25 CO -0.12 0.39 -0.73 0.83 0.00 0.00 0.00 176.54 176.91 1nhn h GLU 26 N 1.07 0.00 -2.24 4.80 4.39 -0.47 -3.38 114.58 118.76 1nhn h GLU 26 Ca 0.32 0.00 -0.59 0.00 0.34 0.00 0.00 59.36 59.43 1nhn h GLU 26 Cb -0.04 0.00 -0.42 0.00 -0.10 0.00 0.00 28.75 28.19 1nhn h GLU 26 CO -0.08 0.00 -0.65 0.72 -1.16 0.00 0.00 179.01 177.83 1nhn n HIS 27 N -2.61 3.68 -0.81 4.33 8.25 0.29 -4.89 115.22 123.47 1nhn n HIS 27 Ca 0.02 -4.04 -0.09 0.00 -0.26 0.00 0.00 57.72 53.35 1nhn n HIS 27 Cb 0.52 -0.51 -0.06 0.00 1.12 0.00 0.00 29.99 31.06 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 0.19 1.57 0.00 -0.41 -0.04 -0.70 -3.16 135.00 132.46 1nhn n PRO 28 Ca 0.30 -0.76 0.00 0.00 -0.04 0.00 0.00 63.50 63.00 1nhn n PRO 28 Cb 0.41 -1.52 0.00 0.00 -0.04 0.00 0.00 33.50 32.35 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 1.61 0.00 0.00 0.55 0.00 -1.26 -5.11 105.19 100.98 1nhn n GLY 29 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1nhn n GLY 29 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1nhn n LEU 30 N -0.78 0.00 -4.86 0.99 -0.00 -1.19 -5.15 117.00 106.01 1nhn n LEU 30 Ca 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 56.01 55.76 1nhn n LEU 30 Cb 0.07 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.46 1nhn n LEU 30 CO 0.00 -0.21 -0.01 -0.55 -0.00 0.00 0.00 177.39 176.62 1nhn s SER 31 N -0.80 4.65 -0.01 1.45 0.15 -1.26 -4.99 113.70 112.89 1nhn s SER 31 Ca 0.00 -1.14 0.06 0.00 0.70 0.00 0.00 55.95 55.57 1nhn s SER 31 Cb 0.00 0.08 0.19 0.00 -1.71 0.00 0.00 66.02 64.58 1nhn s SER 31 CO 0.00 -0.91 1.12 0.00 1.20 0.00 0.00 173.24 174.64 1nhn n ILE 32 N -1.61 0.35 -0.01 6.45 0.13 -1.26 -1.47 119.36 121.94 1nhn n ILE 32 Ca -0.01 -0.30 0.01 0.00 -1.10 0.00 0.00 62.75 61.35 1nhn n ILE 32 Cb 0.64 0.06 -0.03 0.00 -0.84 0.00 0.00 39.64 39.47 1nhn n ILE 32 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1nhn n GLY 33 N 0.75 -0.21 0.13 4.50 0.00 -1.26 -4.12 105.19 104.99 1nhn n GLY 33 Ca 0.07 -0.10 -0.22 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.78 1.99 0.25 1.61 2.03 -1.06 -2.36 116.55 117.22 1nhn n ASP 34 Ca -0.02 0.08 0.12 0.00 0.52 0.00 0.00 54.79 55.49 1nhn n ASP 34 Cb 0.25 -0.63 0.62 0.00 -0.72 0.00 0.00 41.12 40.64 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 -0.34 0.53 0.09 5.18 3.04 -1.53 0.45 116.25 123.67 1nhn h VAL 35 Ca -0.58 -0.78 -0.27 0.00 -1.01 0.00 0.00 66.70 64.06 1nhn h VAL 35 Cb 1.80 1.52 0.01 0.00 -2.01 0.00 0.00 31.29 32.61 1nhn h VAL 35 CO -0.17 0.16 -1.16 0.00 -1.01 0.00 0.00 177.57 175.38 1nhn h ALA 36 N 1.84 0.13 -0.64 3.17 0.00 -1.72 -2.66 119.26 119.39 1nhn h ALA 36 Ca -0.00 -0.79 0.02 0.00 0.00 0.00 0.00 54.91 54.14 1nhn h ALA 36 Cb 0.51 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 1nhn h ALA 36 CO 0.02 0.82 0.40 -0.22 0.00 0.00 0.00 179.25 180.27 1nhn h LYS 37 N 0.19 0.78 -0.05 0.00 3.64 -0.58 0.23 116.57 120.78 1nhn h LYS 37 Ca -0.14 -0.05 0.04 0.00 -1.27 0.00 0.00 60.65 59.23 1nhn h LYS 37 Cb 1.84 -0.18 -0.06 0.00 -0.41 0.00 0.00 32.23 33.43 1nhn h LYS 37 CO 0.21 0.52 -0.38 -0.22 -2.27 0.00 0.00 179.45 177.30 1nhn h LYS 38 N 0.81 -0.49 -0.45 1.90 1.63 -1.08 0.83 116.57 119.73 1nhn h LYS 38 Ca 0.25 0.03 0.07 0.00 -0.85 0.00 0.00 60.65 60.15 1nhn h LYS 38 Cb -0.02 0.11 -0.06 0.00 -0.60 0.00 0.00 32.23 31.66 1nhn h LYS 38 CO -0.08 -0.33 0.11 -0.07 -3.45 0.00 0.00 179.45 175.63 1nhn h LEU 39 N -0.51 0.05 -1.00 5.20 3.38 -1.05 0.38 115.31 121.76 1nhn h LEU 39 Ca 0.07 0.07 0.22 0.00 0.09 0.00 0.00 57.88 58.32 1nhn h LEU 39 Cb 0.61 0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.42 1nhn h LEU 39 CO -0.33 0.06 1.07 1.23 0.09 0.00 0.00 178.44 180.56 1nhn h GLY 40 N 0.25 0.00 0.00 0.83 0.00 0.19 -0.65 103.07 103.69 1nhn h GLY 40 Ca 0.22 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.48 1nhn h GLY 40 CO -0.27 0.00 -1.00 1.18 0.00 0.00 0.00 176.54 176.45 1nhn n GLU 41 N -3.15 0.38 -0.36 4.80 -0.58 -0.23 -4.67 120.64 116.82 1nhn n GLU 41 Ca 0.17 0.15 0.33 0.00 -0.42 0.00 0.00 57.16 57.39 1nhn n GLU 41 Cb 1.30 -1.15 0.59 0.00 -0.57 0.00 0.00 31.44 31.61 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 -4.10 -0.05 -0.34 3.49 2.81 -0.04 -1.37 117.12 117.52 1nhn n MET 42 Ca -0.16 1.23 -0.02 0.00 -1.81 0.00 0.00 57.70 56.94 1nhn n MET 42 Cb 0.45 -2.31 0.12 0.00 -0.71 0.00 0.00 33.22 30.78 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 1.22 0.00 2.03 2.91 -1.51 -0.24 115.95 120.36 1nhn h TRP 43 Ca 0.80 0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.84 1nhn h TRP 43 Cb 2.34 -0.41 0.00 0.00 -0.51 0.00 0.00 29.16 30.58 1nhn h TRP 43 CO -0.01 0.79 0.00 0.27 -1.03 0.00 0.00 178.44 178.46 1nhn n ASN 44 N -4.37 0.00 -1.72 2.65 0.23 -0.47 -2.47 115.26 109.11 1nhn n ASN 44 Ca 0.11 0.26 -0.18 0.00 -0.53 0.00 0.00 54.58 54.24 1nhn n ASN 44 Cb 0.04 -0.41 0.11 0.00 -2.08 0.00 0.00 39.78 37.43 1nhn n ASN 44 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1nhn n ASN 45 N -1.41 4.42 -0.57 0.53 3.02 -0.16 -5.00 115.26 116.08 1nhn n ASN 45 Ca 0.09 -3.78 0.00 0.00 -0.03 0.00 0.00 54.58 50.86 1nhn n ASN 45 Cb 0.28 -0.59 0.00 0.00 -0.61 0.00 0.00 39.78 38.86 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 -0.93 0.00 -1.07 3.41 5.66 -0.83 -4.93 114.28 115.59 1nhn n THR 46 Ca 0.43 0.00 0.05 0.00 -3.05 0.00 0.00 64.05 61.48 1nhn n THR 46 Cb 0.93 0.00 0.27 0.00 -1.55 0.00 0.00 70.33 69.98 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 3.46 -0.69 1.79 0.00 -1.26 -4.95 120.51 115.87 1nhn n ALA 47 Ca 0.00 -2.42 0.00 0.00 0.00 0.00 0.00 53.44 51.02 1nhn n ALA 47 Cb 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 18.63 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 -0.48 -0.01 0.00 0.00 0.00 -1.26 -3.95 120.51 114.81 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 1.00 -0.17 0.00 0.00 0.00 0.00 0.00 19.45 20.28 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 0.66 1.99 -0.19 0.00 2.03 -1.26 -4.71 116.55 115.08 1nhn n ASP 49 Ca 0.00 0.00 0.13 0.00 0.52 0.00 0.00 54.79 55.44 1nhn n ASP 49 Cb 0.00 0.31 0.43 0.00 -0.72 0.00 0.00 41.12 41.14 1nhn n ASP 49 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1nhn n ASP 50 N -0.82 0.83 0.09 1.67 9.92 -1.25 -3.70 116.55 123.28 1nhn n ASP 50 Ca 0.00 -0.74 -0.13 0.00 -0.53 0.00 0.00 54.79 53.39 1nhn n ASP 50 Cb 0.09 0.08 -0.07 0.00 -0.64 0.00 0.00 41.12 40.57 1nhn n ASP 50 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 1nhn h LYS 51 N 0.94 0.29 -0.18 -1.24 1.79 -1.90 -3.33 116.57 112.94 1nhn h LYS 51 Ca 0.00 -0.38 0.05 0.00 -2.18 0.00 0.00 60.65 58.14 1nhn h LYS 51 Cb 0.47 0.12 -0.07 0.00 -1.58 0.00 0.00 32.23 31.17 1nhn h LYS 51 CO 0.00 1.11 -0.40 1.96 -1.08 0.00 0.00 179.45 181.04 1nhn h GLN 52 N 0.14 -0.42 0.15 3.15 7.50 -1.90 0.38 115.11 124.10 1nhn h GLN 52 Ca -0.09 0.03 0.02 0.00 0.50 0.00 0.00 58.65 59.11 1nhn h GLN 52 Cb 1.71 0.10 -0.04 0.00 0.05 0.00 0.00 27.48 29.30 1nhn h GLN 52 CO 0.17 -0.28 -0.34 -1.00 -1.50 0.00 0.00 178.83 175.88 1nhn h PRO 53 N -0.44 -0.57 -0.79 1.46 0.13 -1.79 -2.21 132.00 127.79 1nhn h PRO 53 Ca 0.09 0.04 0.18 0.00 -0.87 0.00 0.00 66.00 65.45 1nhn h PRO 53 Cb 0.60 0.13 -0.12 0.00 0.13 0.00 0.00 31.00 31.74 1nhn h PRO 53 CO -0.42 -0.38 0.16 1.88 -0.23 0.00 0.00 178.00 179.02 1nhn h TYR 54 N -0.59 0.24 0.03 1.56 0.05 -1.56 -1.23 116.97 115.47 1nhn h TYR 54 Ca 0.02 0.05 -0.00 0.00 0.05 0.00 0.00 58.73 58.85 1nhn h TYR 54 Cb 0.60 0.02 0.00 0.00 1.01 0.00 0.00 36.73 38.36 1nhn h TYR 54 CO -0.29 -0.15 -0.01 1.05 -1.05 0.00 0.00 178.16 177.71 1nhn h GLU 55 N 0.22 -0.03 -1.01 4.88 4.11 -0.74 -0.27 114.58 121.74 1nhn h GLU 55 Ca 0.46 0.00 0.26 0.00 0.07 0.00 0.00 59.36 60.15 1nhn h GLU 55 Cb 0.83 0.01 -0.13 0.00 0.50 0.00 0.00 28.75 29.96 1nhn h GLU 55 CO -0.58 0.42 0.60 0.87 0.07 0.00 0.00 179.01 180.38 1nhn h LYS 56 N -0.50 0.52 0.46 1.06 1.57 -0.73 0.93 116.57 119.87 1nhn h LYS 56 Ca -0.00 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 1nhn h LYS 56 Cb 0.47 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.67 1nhn h LYS 56 CO 0.01 0.34 -0.22 0.87 -0.57 0.00 0.00 179.45 179.88 1nhn h LYS 57 N 0.53 -0.59 -0.94 3.15 1.57 -1.07 -1.97 116.57 117.24 1nhn h LYS 57 Ca 0.66 0.04 0.18 0.00 -1.87 0.00 0.00 60.65 59.66 1nhn h LYS 57 Cb 1.32 0.14 -0.18 0.00 0.08 0.00 0.00 32.23 33.58 1nhn h LYS 57 CO -0.49 -0.40 -0.25 0.00 -0.57 0.00 0.00 179.45 177.75 1nhn n ALA 58 N -2.51 0.20 0.25 3.86 0.00 -0.13 -0.64 120.51 121.53 1nhn n ALA 58 Ca -0.08 1.03 -0.16 0.00 0.00 0.00 0.00 53.44 54.23 1nhn n ALA 58 Cb 0.24 -0.60 -0.08 0.00 0.00 0.00 0.00 19.45 19.01 1nhn n ALA 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nhn h ALA 59 N 1.83 -0.77 -0.64 0.00 0.00 -0.87 -0.53 119.26 118.29 1nhn h ALA 59 Ca 0.44 -0.13 0.10 0.00 0.00 0.00 0.00 54.91 55.32 1nhn h ALA 59 Cb 0.68 0.46 -0.08 0.00 0.00 0.00 0.00 17.79 18.85 1nhn h ALA 59 CO -0.97 -0.96 0.24 -0.22 0.00 0.00 0.00 179.25 177.34 1nhn h LYS 60 N -0.75 0.40 0.41 0.00 3.64 -0.07 -0.13 116.57 120.08 1nhn h LYS 60 Ca -0.04 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.30 1nhn h LYS 60 Cb 0.65 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.39 1nhn h LYS 60 CO -0.02 0.27 -0.20 -0.07 -2.27 0.00 0.00 179.45 177.16 1nhn h LEU 61 N 0.42 -0.47 -1.37 5.20 3.38 -0.87 -1.86 115.31 119.75 1nhn h LEU 61 Ca 0.33 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.30 1nhn h LEU 61 Cb 0.42 0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 1nhn h LEU 61 CO -0.33 -0.30 0.43 0.07 0.09 0.00 0.00 178.44 178.40 1nhn h LYS 62 N -0.59 0.84 0.23 1.13 2.10 -0.80 -2.69 116.57 116.79 1nhn h LYS 62 Ca -0.06 -0.05 -0.01 0.00 -2.00 0.00 0.00 60.65 58.53 1nhn h LYS 62 Cb 0.44 -0.19 -0.00 0.00 -0.90 0.00 0.00 32.23 31.58 1nhn h LYS 62 CO 0.09 0.55 -0.15 1.49 -2.00 0.00 0.00 179.45 179.43 1nhn h GLU 63 N 0.86 -0.35 -0.75 0.07 4.81 -0.75 0.47 114.58 118.96 1nhn h GLU 63 Ca 0.25 0.02 0.14 0.00 -0.13 0.00 0.00 59.36 59.64 1nhn h GLU 63 Cb -0.06 0.08 -0.14 0.00 0.63 0.00 0.00 28.75 29.26 1nhn h GLU 63 CO -0.06 -0.23 -0.23 0.87 -0.73 0.00 0.00 179.01 178.63 1nhn h LYS 64 N -0.36 -0.03 0.00 1.92 1.57 -1.26 -2.68 116.57 115.73 1nhn h LYS 64 Ca -0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1nhn h LYS 64 Cb 0.29 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1nhn h LYS 64 CO 0.02 -0.02 0.00 0.98 -0.57 0.00 0.00 179.45 179.86 1nhn n TYR 65 N -5.49 0.00 -0.43 -1.35 9.36 -1.02 -3.02 117.16 115.22 1nhn n TYR 65 Ca 0.09 0.00 0.34 0.00 3.32 0.00 0.00 57.90 61.65 1nhn n TYR 65 Cb 0.39 -0.17 0.52 0.00 -0.63 0.00 0.00 39.34 39.45 1nhn n TYR 65 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 1nhn n GLU 66 N -1.02 0.00 0.10 2.98 1.02 0.17 0.58 120.64 124.47 1nhn n GLU 66 Ca 0.00 0.77 -0.23 0.00 -0.02 0.00 0.00 57.16 57.68 1nhn n GLU 66 Cb 0.00 -1.80 -0.15 0.00 -0.02 0.00 0.00 31.44 29.47 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 0.46 -0.33 3.49 6.56 -1.48 0.51 116.57 125.79 1nhn h LYS 67 Ca 0.60 -0.76 -0.10 0.00 -1.06 0.00 0.00 60.65 59.33 1nhn h LYS 67 Cb 2.57 0.28 -0.01 0.00 -0.57 0.00 0.00 32.23 34.50 1nhn h LYS 67 CO -0.01 1.36 -0.21 0.22 -2.06 0.00 0.00 179.45 178.75 1nhn h ASP 68 N -0.04 0.62 0.04 0.86 3.58 0.23 0.17 116.42 121.89 1nhn h ASP 68 Ca -0.20 -0.21 -0.18 0.00 0.42 0.00 0.00 57.03 56.86 1nhn h ASP 68 Cb 1.93 -0.17 0.02 0.00 1.72 0.00 0.00 39.33 42.82 1nhn h ASP 68 CO 0.22 0.83 -0.71 -0.29 -2.88 0.00 0.00 179.24 176.41 1nhn h ILE 69 N 0.55 1.43 -0.93 2.25 6.09 -1.41 -2.70 117.51 122.80 1nhn h ILE 69 Ca 0.08 -2.23 0.19 0.00 -1.37 0.00 0.00 64.86 61.54 1nhn h ILE 69 Cb 0.67 2.75 -0.11 0.00 0.47 0.00 0.00 36.82 40.60 1nhn h ILE 69 CO 0.05 0.65 0.50 0.00 -3.07 0.00 0.00 178.15 176.27 1nhn h ALA 70 N 0.26 1.50 0.15 0.18 0.00 -0.64 -0.54 119.26 120.17 1nhn h ALA 70 Ca -0.10 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1nhn h ALA 70 Cb 1.45 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.26 1nhn h ALA 70 CO 0.14 -0.17 -0.07 0.00 0.00 0.00 0.00 179.25 179.15 1nhn h ALA 71 N 1.65 -0.21 -0.75 0.00 0.00 -0.83 0.28 119.26 119.40 1nhn h ALA 71 Ca 0.55 -0.05 0.17 0.00 0.00 0.00 0.00 54.91 55.57 1nhn h ALA 71 Cb 0.91 0.08 -0.12 0.00 0.00 0.00 0.00 17.79 18.66 1nhn h ALA 71 CO -0.43 -0.61 0.17 -0.92 0.00 0.00 0.00 179.25 177.46 1nhn h TYR 72 N -0.22 0.25 0.00 0.00 3.20 -0.79 0.13 116.97 119.53 1nhn h TYR 72 Ca -0.02 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.89 1nhn h TYR 72 Cb 0.17 0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.45 1nhn h TYR 72 CO -0.06 -0.11 -0.64 -0.09 -1.64 0.00 0.00 178.16 175.61 1nhn h ARG 73 N 0.25 0.00 -1.12 1.82 2.43 -1.25 -3.33 114.38 113.18 1nhn h ARG 73 Ca 0.43 0.00 -0.62 0.00 -0.81 0.00 0.00 59.98 58.98 1nhn h ARG 73 Cb 0.75 0.00 -0.37 0.00 -0.42 0.00 0.00 29.97 29.93 1nhn h ARG 73 CO -0.54 0.00 -0.13 0.00 -1.51 0.00 0.00 179.97 177.78 1nhn n ALA 74 N -1.89 5.56 -2.81 2.80 0.00 0.98 -5.02 120.51 120.13 1nhn n ALA 74 Ca 0.03 -3.86 -0.21 0.00 0.00 0.00 0.00 53.44 49.40 1nhn n ALA 74 Cb 0.46 -0.94 -0.01 0.00 0.00 0.00 0.00 19.45 18.95 1nhn n ALA 74 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1nhn s LYS 75 N -3.71 3.39 0.00 0.00 2.20 -0.07 -4.61 119.74 116.95 1nhn s LYS 75 Ca 0.54 -0.70 0.00 0.00 -0.36 0.00 0.00 55.97 55.45 1nhn s LYS 75 Cb 0.44 -2.82 0.00 0.00 -1.51 0.00 0.00 37.83 33.94 1nhn s LYS 75 CO -0.07 0.29 0.00 0.41 -0.36 0.00 0.00 175.35 175.62 1nhn n GLY 76 N -1.55 2.65 0.34 5.54 0.00 -1.26 -4.91 105.19 106.00 1nhn n GLY 76 Ca -0.06 -0.79 0.09 0.00 0.00 0.00 0.00 46.02 45.26 1nhn n GLY 76 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nhn h LYS 77 N 0.00 0.01 -0.66 1.61 6.56 -2.00 0.77 116.57 122.87 1nhn h LYS 77 Ca 0.00 -0.00 0.19 0.00 -1.06 0.00 0.00 60.65 59.78 1nhn h LYS 77 Cb 0.00 -0.00 -0.03 0.00 -0.57 0.00 0.00 32.23 31.63 1nhn h LYS 77 CO 0.00 0.01 0.70 -1.35 -2.06 0.00 0.00 179.45 176.75 1nhn h PRO 78 N 0.01 0.00 -6.20 3.15 0.11 -1.91 -3.46 132.00 123.71 1nhn h PRO 78 Ca 0.51 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 66.33 1nhn h PRO 78 Cb 0.92 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.04 1nhn h PRO 78 CO -0.94 0.00 -0.90 -3.47 -0.21 0.00 0.00 178.00 172.49 1nhn n ASP 79 N -3.61 -6.13 -4.07 -2.05 -0.08 0.26 -4.91 116.55 95.97 1nhn n ASP 79 Ca 0.13 -0.20 -0.41 0.00 -1.51 0.00 0.00 54.79 52.81 1nhn n ASP 79 Cb 0.93 -2.87 -0.02 0.00 2.34 0.00 0.00 41.12 41.51 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 -0.98 4.50 0.45 -1.67 0.00 -1.26 -5.16 120.51 116.39 1nhn n ALA 80 Ca -0.09 -4.72 0.05 0.00 0.00 0.00 0.00 53.44 48.68 1nhn n ALA 80 Cb 0.62 -2.10 0.04 0.00 0.00 0.00 0.00 19.45 18.01 1nhn n ALA 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50