#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c0s n ASN 2 N 0.00 -8.38 0.15 7.83 4.13 -1.26 -4.75 115.26 112.98 2c0s n ASN 2 Ca 0.00 1.69 0.12 0.00 1.68 0.00 0.00 54.58 58.07 2c0s n ASN 2 Cb 0.00 -4.79 0.55 0.00 -1.54 0.00 0.00 39.78 34.00 2c0s n ASN 2 CO 0.00 0.00 0.00 1.33 0.28 0.00 0.00 177.26 178.87 2c0s n VAL 3 N 1.89 0.94 0.24 2.41 0.24 -1.26 -2.37 118.33 120.42 2c0s n VAL 3 Ca 0.00 0.51 0.11 0.00 -2.04 0.00 0.00 64.34 62.91 2c0s n VAL 3 Cb 0.00 -1.48 0.71 0.00 -1.47 0.00 0.00 33.84 31.60 2c0s n VAL 3 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2c0s h THR 4 N 0.00 0.86 0.00 3.34 1.03 -1.99 -1.36 112.91 114.78 2c0s h THR 4 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 66.41 66.33 2c0s h THR 4 Cb 0.17 0.97 -0.01 0.00 -1.07 0.00 0.00 68.15 68.21 2c0s h THR 4 CO 0.00 0.00 -0.34 0.07 -0.01 0.00 0.00 175.52 175.24 2c0s h LYS 5 N 0.00 0.00 -0.00 0.00 2.10 -1.76 -0.34 116.57 116.57 2c0s h LYS 5 Ca 0.03 0.00 -0.18 0.00 -2.00 0.00 0.00 60.65 58.50 2c0s h LYS 5 Cb 0.11 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.42 2c0s h LYS 5 CO -0.00 0.34 -0.81 1.25 -2.00 0.00 0.00 179.45 178.23 2c0s h LEU 6 N 0.00 0.13 -0.94 7.07 5.85 -1.47 -2.83 115.31 123.12 2c0s h LEU 6 Ca -0.00 -0.10 -0.11 0.00 0.84 0.00 0.00 57.88 58.51 2c0s h LEU 6 Cb 0.65 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 2c0s h LEU 6 CO 0.04 0.88 -0.37 0.78 -0.34 0.00 0.00 178.44 179.43 2c0s h ASN 7 N 0.06 0.32 -0.71 1.25 2.35 -0.93 0.10 115.58 118.02 2c0s h ASN 7 Ca -0.02 -0.13 0.04 0.00 -0.55 0.00 0.00 56.30 55.64 2c0s h ASN 7 Cb 1.41 -0.09 -0.05 0.00 0.05 0.00 0.00 38.32 39.65 2c0s h ASN 7 CO 0.11 0.67 0.44 -0.78 -1.65 0.00 0.00 177.43 176.22 2c0s h ASP 8 N 0.26 0.70 -0.47 5.81 1.82 -0.88 0.13 116.42 123.80 2c0s h ASP 8 Ca 0.03 0.01 -0.06 0.00 -0.39 0.00 0.00 57.03 56.61 2c0s h ASP 8 Cb 0.78 -0.14 -0.02 0.00 0.68 0.00 0.00 39.33 40.63 2c0s h ASP 8 CO 0.06 0.48 0.06 0.03 -1.61 0.00 0.00 179.24 178.26 2c0s h ARG 9 N 0.84 0.79 0.03 0.28 3.08 -1.15 -1.82 114.38 116.42 2c0s h ARG 9 Ca 0.29 -0.22 0.03 0.00 0.07 0.00 0.00 59.98 60.15 2c0s h ARG 9 Cb 0.06 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 29.99 2c0s h ARG 9 CO -0.13 0.81 -0.21 0.82 -1.07 0.00 0.00 179.97 180.19 2c0s h ILE 10 N 0.65 0.51 -0.69 2.04 2.04 -0.17 0.34 117.51 122.22 2c0s h ILE 10 Ca 0.14 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.07 2c0s h ILE 10 Cb 0.42 0.51 -0.06 0.00 -0.74 0.00 0.00 36.82 36.94 2c0s h ILE 10 CO 0.01 0.00 0.38 -0.33 0.00 0.00 0.00 178.15 178.21 2c0s h GLU 11 N -0.36 0.67 -0.63 2.37 4.39 -1.00 0.32 114.58 120.35 2c0s h GLU 11 Ca 0.05 -0.04 -0.06 0.00 0.34 0.00 0.00 59.36 59.65 2c0s h GLU 11 Cb 0.42 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 28.89 2c0s h GLU 11 CO -0.17 0.44 0.15 0.00 -1.16 0.00 0.00 179.01 178.26 2c0s h ALA 12 N 1.37 1.07 -0.00 3.43 0.00 -0.53 -1.07 119.26 123.53 2c0s h ALA 12 Ca 0.32 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.83 2c0s h ALA 12 Cb 0.23 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2c0s h ALA 12 CO -0.20 0.61 -0.76 0.87 0.00 0.00 0.00 179.25 179.77 2c0s h LYS 13 N 0.94 0.05 -0.25 0.00 1.79 0.45 0.50 116.57 120.05 2c0s h LYS 13 Ca 0.20 -0.05 -0.04 0.00 -2.18 0.00 0.00 60.65 58.58 2c0s h LYS 13 Cb 0.34 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.00 2c0s h LYS 13 CO 0.00 0.79 -0.02 0.87 -1.08 0.00 0.00 179.45 180.01 2c0s h LYS 14 N 0.03 0.45 -0.54 3.15 1.57 -0.63 0.22 116.57 120.82 2c0s h LYS 14 Ca -0.01 -0.15 -0.06 0.00 -1.87 0.00 0.00 60.65 58.56 2c0s h LYS 14 Cb 1.34 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.59 2c0s h LYS 14 CO 0.10 0.63 0.10 0.87 -0.57 0.00 0.00 179.45 180.59 2c0s h LYS 15 N 0.21 0.84 -0.26 3.15 1.57 -1.03 0.15 116.57 121.21 2c0s h LYS 15 Ca 0.07 -0.19 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 2c0s h LYS 15 Cb 0.44 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 2c0s h LYS 15 CO 0.02 0.78 0.11 1.49 -0.57 0.00 0.00 179.45 181.28 2c0s h GLU 16 N 0.80 0.38 -0.44 3.15 4.81 -0.77 -1.97 114.58 120.54 2c0s h GLU 16 Ca 0.17 -0.06 0.02 0.00 -0.13 0.00 0.00 59.36 59.35 2c0s h GLU 16 Cb 0.34 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.63 2c0s h GLU 16 CO 0.00 0.40 0.27 1.25 -0.73 0.00 0.00 179.01 180.20 2c0s h LEU 17 N 0.27 0.44 -0.36 1.64 6.46 0.09 0.27 115.31 124.12 2c0s h LEU 17 Ca 0.09 0.00 0.04 0.00 -0.12 0.00 0.00 57.88 57.89 2c0s h LEU 17 Cb 0.15 -0.09 -0.04 0.00 -0.73 0.00 0.00 40.66 39.95 2c0s h LEU 17 CO -0.01 0.31 0.13 0.40 -0.62 0.00 0.00 178.44 178.66 2c0s h ILE 18 N 0.54 0.91 -0.64 4.05 2.04 -0.89 0.19 117.51 123.70 2c0s h ILE 18 Ca 0.17 -0.10 0.01 0.00 1.00 0.00 0.00 64.86 65.94 2c0s h ILE 18 Cb -0.01 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 36.64 2c0s h ILE 18 CO -0.07 0.05 0.42 0.22 0.00 0.00 0.00 178.15 178.77 2c0s h TYR 19 N 0.29 0.80 -0.85 1.37 3.20 -0.68 -1.39 116.97 119.71 2c0s h TYR 19 Ca 0.16 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.03 2c0s h TYR 19 Cb 0.12 -0.27 -0.04 0.00 1.54 0.00 0.00 36.73 38.09 2c0s h TYR 19 CO -0.14 0.50 0.45 -0.07 -1.64 0.00 0.00 178.16 177.26 2c0s h LEU 20 N 0.86 1.08 -0.77 2.82 3.38 0.32 -0.90 115.31 122.11 2c0s h LEU 20 Ca 0.24 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 2c0s h LEU 20 Cb -0.08 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.36 2c0s h LEU 20 CO -0.06 0.89 0.31 0.58 0.09 0.00 0.00 178.44 180.25 2c0s h VAL 21 N 1.20 1.26 -0.49 1.22 2.07 -0.18 0.27 116.25 121.59 2c0s h VAL 21 Ca 0.30 -0.80 -0.01 0.00 0.82 0.00 0.00 66.70 67.01 2c0s h VAL 21 Cb 0.06 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.15 2c0s h VAL 21 CO -0.04 0.32 0.26 -0.33 0.02 0.00 0.00 177.57 177.80 2c0s h GLU 22 N 1.10 0.68 0.03 1.57 4.39 -0.58 0.18 114.58 121.94 2c0s h GLU 22 Ca 0.26 -0.07 -0.08 0.00 0.34 0.00 0.00 59.36 59.81 2c0s h GLU 22 Cb 0.20 -0.14 -0.00 0.00 -0.10 0.00 0.00 28.75 28.72 2c0s h GLU 22 CO -0.02 0.51 -0.40 0.87 -1.16 0.00 0.00 179.01 178.81 2c0s h LYS 23 N 0.68 0.06 0.06 2.33 1.79 -0.55 -3.39 116.57 117.56 2c0s h LYS 23 Ca 0.17 -0.11 -0.19 0.00 -2.18 0.00 0.00 60.65 58.34 2c0s h LYS 23 Cb 0.04 0.04 0.02 0.00 -1.58 0.00 0.00 32.23 30.75 2c0s h LYS 23 CO -0.03 1.05 -0.80 1.88 -1.08 0.00 0.00 179.45 180.48 2c0s h TYR 24 N -0.85 0.68 0.00 -1.35 -1.99 -0.44 -3.50 116.97 109.53 2c0s h TYR 24 Ca -0.09 -0.42 0.00 0.00 2.00 0.00 0.00 58.73 60.22 2c0s h TYR 24 Cb 1.20 -0.06 0.00 0.00 2.00 0.00 0.00 36.73 39.87 2c0s h TYR 24 CO 0.23 1.27 0.00 0.41 -0.00 0.00 0.00 178.16 180.07 2c0s n GLY 25 N 1.30 1.36 1.48 3.88 0.00 0.61 -5.07 105.19 108.75 2c0s n GLY 25 Ca -0.12 -0.59 -0.13 0.00 0.00 0.00 0.00 46.02 45.19 2c0s n GLY 25 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2c0s n PHE 26 N 0.00 0.16 -1.66 1.61 3.01 -1.26 -4.66 117.46 114.65 2c0s n PHE 26 Ca 0.00 -0.99 -0.42 0.00 1.01 0.00 0.00 57.45 57.05 2c0s n PHE 26 Cb 0.00 -0.14 -0.01 0.00 -0.01 0.00 0.00 39.48 39.32 2c0s n PHE 26 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 2c0s n THR 27 N -0.61 3.50 -2.48 4.37 -1.04 -1.26 -4.71 114.28 112.05 2c0s n THR 27 Ca -0.07 -2.91 -0.16 0.00 -2.04 0.00 0.00 64.05 58.86 2c0s n THR 27 Cb 0.26 -2.60 0.09 0.00 -1.82 0.00 0.00 70.33 66.25 2c0s n THR 27 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2c0s n HIS 28 N 5.83 -3.10 -0.35 -1.42 1.44 -1.26 -4.82 115.22 111.55 2c0s n HIS 28 Ca 0.55 -1.23 0.10 0.00 -2.01 0.00 0.00 57.72 55.13 2c0s n HIS 28 Cb 0.37 -0.52 0.27 0.00 0.12 0.00 0.00 29.99 30.23 2c0s n HIS 28 CO 0.00 0.00 0.00 1.25 -2.81 0.00 0.00 176.34 174.78 2c0s h HIS 29 N -0.57 1.06 -0.00 -1.40 -0.00 -1.99 -0.52 115.15 111.73 2c0s h HIS 29 Ca -0.24 0.03 0.03 0.00 -0.00 0.00 0.00 60.37 60.19 2c0s h HIS 29 Cb 0.86 -0.33 -0.04 0.00 -0.00 0.00 0.00 27.41 27.91 2c0s h HIS 29 CO 0.00 0.32 -0.18 0.87 -0.00 0.00 0.00 177.93 178.93 2c0s h LYS 30 N 0.84 -0.28 -0.50 5.26 1.79 -1.94 -0.30 116.57 121.44 2c0s h LYS 30 Ca 0.53 0.02 -0.06 0.00 -2.18 0.00 0.00 60.65 58.96 2c0s h LYS 30 Cb 0.70 0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 31.39 2c0s h LYS 30 CO -0.33 -0.19 0.08 0.28 -1.08 0.00 0.00 179.45 178.21 2c0s h VAL 31 N -0.29 1.23 0.02 0.50 2.07 -1.47 -1.21 116.25 117.09 2c0s h VAL 31 Ca 0.06 -0.86 0.01 0.00 0.82 0.00 0.00 66.70 66.73 2c0s h VAL 31 Cb 0.37 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 2c0s h VAL 31 CO -0.18 0.31 -0.06 0.40 0.02 0.00 0.00 177.57 178.07 2c0s h ILE 32 N 0.75 0.86 -0.92 4.57 1.08 -0.77 -0.65 117.51 122.43 2c0s h ILE 32 Ca 0.16 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.67 2c0s h ILE 32 Cb 0.34 0.86 -0.06 0.00 -3.07 0.00 0.00 36.82 34.89 2c0s h ILE 32 CO 0.01 0.00 0.59 0.28 -0.69 0.00 0.00 178.15 178.34 2c0s h SER 33 N -0.11 0.97 0.24 1.72 0.02 -0.54 0.55 113.55 116.40 2c0s h SER 33 Ca 0.02 -0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.86 2c0s h SER 33 Cb 0.13 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.44 2c0s h SER 33 CO -0.04 0.65 -0.41 -0.26 -1.14 0.00 0.00 176.83 175.62 2c0s h PHE 34 N 1.12 0.26 -0.21 3.45 0.04 -0.81 -1.24 116.94 119.55 2c0s h PHE 34 Ca 0.38 -0.07 -0.16 0.00 2.80 0.00 0.00 57.97 60.91 2c0s h PHE 34 Cb 0.06 -0.06 0.00 0.00 2.20 0.00 0.00 35.95 38.15 2c0s h PHE 34 CO -0.02 0.61 -0.51 0.77 -0.60 0.00 0.00 178.31 178.56 2c0s h SER 35 N 0.19 0.81 0.19 2.17 0.02 -0.26 -2.84 113.55 113.83 2c0s h SER 35 Ca 0.02 -0.57 -0.07 0.00 -0.84 0.00 0.00 61.79 60.33 2c0s h SER 35 Cb 0.81 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.11 2c0s h SER 35 CO 0.06 1.23 -0.28 1.56 -1.14 0.00 0.00 176.83 178.27 2c0s h GLN 36 N 0.43 0.16 -0.88 3.45 4.20 -0.70 -1.57 115.11 120.20 2c0s h GLN 36 Ca -0.00 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.66 2c0s h GLN 36 Cb 1.13 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.85 2c0s h GLN 36 CO 0.11 0.43 0.56 1.49 -0.67 0.00 0.00 178.83 180.75 2c0s h GLU 37 N 0.14 1.18 -0.24 1.46 4.57 -1.13 -0.11 114.58 120.45 2c0s h GLU 37 Ca 0.02 -0.09 -0.11 0.00 -1.18 0.00 0.00 59.36 58.01 2c0s h GLU 37 Cb 0.57 -0.26 -0.00 0.00 -0.16 0.00 0.00 28.75 28.90 2c0s h GLU 37 CO 0.04 0.80 -0.26 1.25 -1.18 0.00 0.00 179.01 179.66 2c0s h LEU 38 N 1.21 0.65 -1.28 1.64 7.12 -1.07 -1.86 115.31 121.71 2c0s h LEU 38 Ca 0.32 -0.48 -0.03 0.00 0.13 0.00 0.00 57.88 57.81 2c0s h LEU 38 Cb -0.10 -0.18 -0.02 0.00 -0.53 0.00 0.00 40.66 39.83 2c0s h LEU 38 CO -0.06 1.00 0.12 0.44 -0.13 0.00 0.00 178.44 179.80 2c0s h ASP 39 N 0.31 0.55 -0.89 1.25 3.32 -1.07 -1.71 116.42 118.18 2c0s h ASP 39 Ca 0.04 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 2c0s h ASP 39 Cb 0.83 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 40.19 2c0s h ASP 39 CO 0.06 0.55 0.50 -0.09 -1.72 0.00 0.00 179.24 178.54 2c0s h ARG 40 N 0.60 1.24 -0.34 3.56 2.43 -0.73 -0.05 114.38 121.08 2c0s h ARG 40 Ca 0.14 -0.14 -0.07 0.00 -0.81 0.00 0.00 59.98 59.10 2c0s h ARG 40 Cb 0.20 -0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 2c0s h ARG 40 CO -0.01 0.90 -0.10 -0.07 -1.51 0.00 0.00 179.97 179.18 2c0s h LEU 41 N 1.24 0.55 -0.55 3.80 3.38 -0.49 -0.24 115.31 123.00 2c0s h LEU 41 Ca 0.31 -0.14 -0.08 0.00 0.09 0.00 0.00 57.88 58.06 2c0s h LEU 41 Cb 0.01 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 2c0s h LEU 41 CO -0.05 0.70 0.04 0.25 0.09 0.00 0.00 178.44 179.47 2c0s h LEU 42 N 0.53 0.91 -1.83 1.67 5.85 -0.75 -2.31 115.31 119.38 2c0s h LEU 42 Ca 0.10 -0.28 -0.01 0.00 0.84 0.00 0.00 57.88 58.52 2c0s h LEU 42 Cb 0.50 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.28 2c0s h LEU 42 CO 0.03 0.97 -0.03 0.78 -0.34 0.00 0.00 178.44 179.85 2c0s h ASN 43 N 0.82 0.06 0.29 1.25 -0.26 -0.18 -1.23 115.58 116.33 2c0s h ASN 43 Ca 0.16 -0.00 -0.09 0.00 -0.56 0.00 0.00 56.30 55.80 2c0s h ASN 43 Cb 0.48 -0.01 -0.01 0.00 -1.06 0.00 0.00 38.32 37.71 2c0s h ASN 43 CO 0.02 0.10 -0.39 -0.07 -1.06 0.00 0.00 177.43 176.03 2c0s h LEU 44 N 0.07 0.14 -0.54 1.61 3.38 -0.51 -0.31 115.31 119.15 2c0s h LEU 44 Ca 0.02 -0.05 -0.16 0.00 0.09 0.00 0.00 57.88 57.77 2c0s h LEU 44 Cb 0.10 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2c0s h LEU 44 CO 0.00 0.52 -0.55 -0.07 0.09 0.00 0.00 178.44 178.44 2c0s h LEU 45 N 0.12 0.58 -1.23 1.67 3.38 -1.00 -2.95 115.31 115.88 2c0s h LEU 45 Ca 0.01 -0.31 -0.06 0.00 0.09 0.00 0.00 57.88 57.61 2c0s h LEU 45 Cb 0.74 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 2c0s h LEU 45 CO 0.06 1.01 -0.30 0.40 0.09 0.00 0.00 178.44 179.70 2c0s h ILE 46 N 0.40 0.83 -0.81 1.22 2.04 -0.93 -2.94 117.51 117.33 2c0s h ILE 46 Ca 0.01 -1.21 0.13 0.00 1.00 0.00 0.00 64.86 64.79 2c0s h ILE 46 Cb 1.08 1.74 -0.06 0.00 -0.74 0.00 0.00 36.82 38.84 2c0s h ILE 46 CO 0.10 0.29 0.53 -0.08 0.00 0.00 0.00 178.15 178.99 2c0s h GLU 47 N 0.00 0.60 0.02 2.37 4.57 -0.88 0.41 114.58 121.67 2c0s h GLU 47 Ca -0.00 -0.04 -0.07 0.00 -1.18 0.00 0.00 59.36 58.07 2c0s h GLU 47 Cb 0.71 -0.14 0.01 0.00 -0.16 0.00 0.00 28.75 29.17 2c0s h GLU 47 CO 0.04 0.40 -0.29 -0.07 -1.18 0.00 0.00 179.01 177.90 2c0s h LEU 48 N 0.62 0.22 -1.65 1.64 -0.00 -1.64 -3.34 115.31 111.17 2c0s h LEU 48 Ca 0.39 -0.85 -0.04 0.00 -0.00 0.00 0.00 57.88 57.39 2c0s h LEU 48 Cb 0.66 -0.07 -0.01 0.00 -0.00 0.00 0.00 40.66 41.25 2c0s h LEU 48 CO -0.16 1.04 -0.20 0.11 -0.00 0.00 0.00 178.44 179.24 2c0s h LYS 49 N -0.57 0.00 0.00 1.13 1.57 -1.27 0.22 116.57 117.65 2c0s h LYS 49 Ca -0.04 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.66 2c0s h LYS 49 Cb 1.10 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.40 2c0s h LYS 49 CO 0.06 0.20 -0.37 0.00 -0.57 0.00 0.00 179.45 178.76 2c0s h THR 50 N 0.00 1.00 0.00 -0.16 1.03 -0.36 -2.76 112.91 111.66 2c0s h THR 50 Ca -0.00 -1.41 -0.19 0.00 -0.01 0.00 0.00 66.41 64.79 2c0s h THR 50 Cb 0.44 1.83 -0.03 0.00 -1.07 0.00 0.00 68.15 69.31 2c0s h THR 50 CO 0.03 0.36 -1.39 0.11 -0.01 0.00 0.00 175.52 174.62 2c0s h LYS 51 N 0.00 0.00 0.00 0.00 1.57 -1.30 -3.47 116.57 113.37 2c0s h LYS 51 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2c0s h LYS 51 Cb 0.80 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.11 2c0s h LYS 51 CO 0.05 0.39 0.00 0.36 -0.57 0.00 0.00 179.45 179.68 2c0s n LYS 52 N -2.98 0.00 0.18 3.15 2.85 -0.07 -4.40 118.16 116.89 2c0s n LYS 52 Ca -0.10 0.00 0.02 0.00 -1.05 0.00 0.00 58.31 57.19 2c0s n LYS 52 Cb 0.89 -0.43 0.33 0.00 -0.65 0.00 0.00 35.03 35.17 2c0s n LYS 52 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 177.40 178.92 2c0s h LYS 53 N 0.00 0.00 -4.64 -1.58 2.10 -1.90 -0.13 116.57 110.42 2c0s h LYS 53 Ca 0.00 0.00 -0.71 0.00 -2.00 0.00 0.00 60.65 57.94 2c0s h LYS 53 Cb 0.00 0.00 -0.20 0.00 -0.90 0.00 0.00 32.23 31.13 2c0s h LYS 53 CO 0.00 0.42 0.16 1.03 -2.00 0.00 0.00 179.45 179.06 2c0s s ARG 54 N -3.98 3.12 -1.30 0.07 0.52 -1.26 -4.49 118.95 111.62 2c0s s ARG 54 Ca -0.02 -1.44 -0.19 0.00 -0.52 0.00 0.00 55.73 53.56 2c0s s ARG 54 Cb 0.14 -4.33 0.02 0.00 0.52 0.00 0.00 34.95 31.30 2c0s s ARG 54 CO 0.72 -1.54 0.51 0.98 0.02 0.00 0.00 175.30 175.99 2c0s n TYR 55 N 6.17 -1.50 0.00 -0.53 9.36 -1.26 -4.59 117.16 124.80 2c0s n TYR 55 Ca -0.06 0.37 0.00 0.00 3.32 0.00 0.00 57.90 61.53 2c0s n TYR 55 Cb 0.43 -3.07 0.00 0.00 -0.63 0.00 0.00 39.34 36.07 2c0s n TYR 55 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 2c0s n SER 56 N -2.55 0.00 -1.07 2.98 7.64 -1.23 -4.84 113.62 114.55 2c0s n SER 56 Ca -0.19 0.00 0.08 0.00 1.01 0.00 0.00 58.87 59.77 2c0s n SER 56 Cb 0.62 0.00 0.28 0.00 -1.01 0.00 0.00 64.21 64.10 2c0s n SER 56 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2c0s n LEU 57 N -1.51 4.22 -0.02 -3.43 4.77 -0.06 -4.23 117.00 116.75 2c0s n LEU 57 Ca 0.00 -3.04 -0.13 0.00 -0.03 0.00 0.00 56.01 52.81 2c0s n LEU 57 Cb 0.00 -0.57 -0.14 0.00 -2.33 0.00 0.00 43.42 40.37 2c0s n LEU 57 CO 0.00 0.69 -0.67 0.18 -1.33 0.00 0.00 177.39 176.26 2c0s n LEU 58 N -0.36 1.49 0.00 2.23 4.77 -1.26 -4.89 117.00 118.98 2c0s n LEU 58 Ca 0.23 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.53 2c0s n LEU 58 Cb 0.96 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.76 2c0s n LEU 58 CO 0.19 0.57 0.00 -1.84 -1.33 0.00 0.00 177.39 174.97 2c0s n GLU 59 N -3.19 3.24 -0.19 3.23 -0.00 -1.26 -5.09 120.64 117.38 2c0s n GLU 59 Ca -0.23 0.00 0.03 0.00 -0.00 0.00 0.00 57.16 56.95 2c0s n GLU 59 Cb 1.05 0.00 -0.01 0.00 -0.00 0.00 0.00 31.44 32.49 2c0s n GLU 59 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 2c0s n HIS 60 N -0.06 -2.20 -3.00 -1.84 8.25 0.43 -4.84 115.22 111.96 2c0s n HIS 60 Ca 0.00 0.24 -0.02 0.00 -0.26 0.00 0.00 57.72 57.68 2c0s n HIS 60 Cb 0.00 -0.19 0.00 0.00 1.12 0.00 0.00 29.99 30.93 2c0s n HIS 60 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2c0s n HIS 61 N -2.27 -3.08 -0.99 4.41 -0.00 -1.26 -3.22 115.22 108.81 2c0s n HIS 61 Ca 0.00 1.19 0.00 0.00 -0.00 0.00 0.00 57.72 58.91 2c0s n HIS 61 Cb 0.09 -4.09 0.00 0.00 -0.00 0.00 0.00 29.99 25.99 2c0s n HIS 61 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2c0s n HIS 62 N -1.42 0.00 -3.26 1.57 8.25 -1.26 -4.88 115.22 114.22 2c0s n HIS 62 Ca 0.03 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.43 2c0s n HIS 62 Cb 0.49 -1.32 -0.04 0.00 1.12 0.00 0.00 29.99 30.24 2c0s n HIS 62 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2c0s s HIS 63 N -1.35 -1.22 0.00 4.41 5.65 -1.20 -5.26 115.29 116.32 2c0s s HIS 63 Ca 0.00 0.31 0.00 0.00 0.25 0.00 0.00 55.06 55.62 2c0s s HIS 63 Cb 0.00 -0.01 0.00 0.00 -1.18 0.00 0.00 32.58 31.39 2c0s s HIS 63 CO 0.00 -1.04 0.08 1.58 -0.65 0.00 0.00 174.74 174.71