#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 -4.94 0.22 3.17 3.02 -1.26 -4.64 115.26 110.84 2c0s n ASN 2 Ca 0.00 0.71 0.07 0.00 -0.03 0.00 0.00 54.58 55.33 2c0s n ASN 2 Cb 0.00 -2.64 0.53 0.00 -0.61 0.00 0.00 39.78 37.06 2c0s n ASN 2 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 2c0s h VAL 3 N 1.66 0.96 -0.56 2.41 -1.51 -2.04 -2.06 116.25 115.11 2c0s h VAL 3 Ca 0.00 -0.82 -0.07 0.00 -1.23 0.00 0.00 66.70 64.58 2c0s h VAL 3 Cb 0.00 1.47 -0.02 0.00 -2.13 0.00 0.00 31.29 30.61 2c0s h VAL 3 CO 0.00 0.22 0.09 0.00 -1.23 0.00 0.00 177.57 176.65 2c0s h THR 4 N 0.00 1.26 0.00 7.19 1.03 -1.99 0.42 112.91 120.81 2c0s h THR 4 Ca -0.00 -0.97 -0.16 0.00 -0.01 0.00 0.00 66.41 65.27 2c0s h THR 4 Cb 0.45 0.79 -0.02 0.00 -1.07 0.00 0.00 68.15 68.30 2c0s h THR 4 CO 0.03 0.35 -0.75 0.07 -0.01 0.00 0.00 175.52 175.21 2c0s h LYS 5 N 0.83 0.00 0.22 0.00 2.10 -1.77 -1.67 116.57 116.28 2c0s h LYS 5 Ca 0.17 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.81 2c0s h LYS 5 Cb 0.42 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.75 2c0s h LYS 5 CO 0.01 0.75 -0.11 1.25 -2.00 0.00 0.00 179.45 179.36 2c0s h LEU 6 N 0.00 -0.25 -0.82 7.07 5.85 -1.03 0.74 115.31 126.87 2c0s h LEU 6 Ca -0.01 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 2c0s h LEU 6 Cb 1.48 0.07 -0.04 0.00 0.37 0.00 0.00 40.66 42.54 2c0s h LEU 6 CO 0.10 -0.17 0.40 -1.13 -0.34 0.00 0.00 178.44 177.30 2c0s h ASN 7 N -0.31 1.06 -0.29 1.25 -0.00 -0.91 -2.22 115.58 114.16 2c0s h ASN 7 Ca -0.03 -0.13 0.00 0.00 -0.00 0.00 0.00 56.30 56.14 2c0s h ASN 7 Cb 0.24 -0.27 -0.02 0.00 -0.00 0.00 0.00 38.32 38.27 2c0s h ASN 7 CO 0.05 0.89 0.19 -0.78 -0.00 0.00 0.00 177.43 177.78 2c0s h ASP 8 N 1.15 0.32 -0.32 1.15 3.58 -1.02 -1.59 116.42 119.69 2c0s h ASP 8 Ca 0.28 -0.01 -0.04 0.00 0.42 0.00 0.00 57.03 57.68 2c0s h ASP 8 Cb 0.11 -0.08 -0.02 0.00 1.72 0.00 0.00 39.33 41.06 2c0s h ASP 8 CO -0.04 0.23 0.07 0.03 -2.88 0.00 0.00 179.24 176.66 2c0s h ARG 9 N 0.38 0.61 -0.08 0.28 3.08 -0.53 -1.15 114.38 116.96 2c0s h ARG 9 Ca 0.11 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 2c0s h ARG 9 Cb -0.04 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 29.91 2c0s h ARG 9 CO -0.03 0.58 0.03 0.82 -1.07 0.00 0.00 179.97 180.29 2c0s h ILE 10 N 0.59 1.17 -0.11 2.04 2.04 -0.97 -1.33 117.51 120.94 2c0s h ILE 10 Ca 0.13 -0.52 -0.05 0.00 1.00 0.00 0.00 64.86 65.42 2c0s h ILE 10 Cb 0.26 1.36 -0.01 0.00 -0.74 0.00 0.00 36.82 37.70 2c0s h ILE 10 CO 0.00 0.15 -0.16 -0.33 0.00 0.00 0.00 178.15 177.81 2c0s h GLU 11 N -0.05 0.18 -0.39 2.37 5.08 -0.95 0.94 114.58 121.75 2c0s h GLU 11 Ca 0.03 -0.04 -0.11 0.00 -1.00 0.00 0.00 59.36 58.24 2c0s h GLU 11 Cb 0.21 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 2c0s h GLU 11 CO -0.00 0.34 -0.19 0.00 -1.00 0.00 0.00 179.01 178.16 2c0s h ALA 12 N 1.68 0.94 0.01 3.43 0.00 -0.95 -1.21 119.26 123.16 2c0s h ALA 12 Ca 0.03 -0.35 -0.20 0.00 0.00 0.00 0.00 54.91 54.39 2c0s h ALA 12 Cb 0.38 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2c0s h ALA 12 CO 0.02 0.61 -0.92 0.87 0.00 0.00 0.00 179.25 179.84 2c0s h LYS 13 N 0.66 0.11 -0.40 0.00 1.57 -0.30 -2.17 116.57 116.03 2c0s h LYS 13 Ca 0.10 -0.14 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2c0s h LYS 13 Cb 0.68 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.01 2c0s h LYS 13 CO 0.05 0.95 0.26 0.87 -0.57 0.00 0.00 179.45 181.01 2c0s h LYS 14 N 0.05 0.54 0.00 3.15 1.57 -0.64 0.21 116.57 121.45 2c0s h LYS 14 Ca -0.04 -0.04 -0.10 0.00 -1.87 0.00 0.00 60.65 58.61 2c0s h LYS 14 Cb 1.59 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.76 2c0s h LYS 14 CO 0.13 0.36 -0.48 1.57 -0.57 0.00 0.00 179.45 180.47 2c0s h LYS 15 N 0.54 0.00 -0.30 3.15 5.09 -1.18 0.10 116.57 123.98 2c0s h LYS 15 Ca 0.15 0.00 -0.05 0.00 0.09 0.00 0.00 60.65 60.84 2c0s h LYS 15 Cb -0.05 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 32.27 2c0s h LYS 15 CO -0.03 0.48 -0.00 1.49 -2.09 0.00 0.00 179.45 179.29 2c0s h GLU 16 N 0.00 0.54 -0.72 0.07 4.57 -0.89 -0.95 114.58 117.20 2c0s h GLU 16 Ca -0.00 -0.17 -0.06 0.00 -1.18 0.00 0.00 59.36 57.94 2c0s h GLU 16 Cb 0.86 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.38 2c0s h GLU 16 CO 0.06 0.68 0.21 1.25 -1.18 0.00 0.00 179.01 180.04 2c0s h LEU 17 N 0.33 1.05 -0.27 1.64 5.85 -0.11 -1.10 115.31 122.71 2c0s h LEU 17 Ca 0.09 -0.21 0.02 0.00 0.84 0.00 0.00 57.88 58.61 2c0s h LEU 17 Cb 0.44 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 2c0s h LEU 17 CO 0.02 0.99 0.14 0.40 -0.34 0.00 0.00 178.44 179.65 2c0s h ILE 18 N 1.06 1.01 -0.73 4.05 2.04 -0.60 0.87 117.51 125.21 2c0s h ILE 18 Ca 0.23 -0.10 0.11 0.00 1.00 0.00 0.00 64.86 66.10 2c0s h ILE 18 Cb 0.32 0.68 -0.08 0.00 -0.74 0.00 0.00 36.82 37.00 2c0s h ILE 18 CO -0.01 0.06 0.34 0.22 0.00 0.00 0.00 178.15 178.76 2c0s h TYR 19 N 0.30 0.61 -0.37 1.37 5.03 -0.75 0.18 116.97 123.34 2c0s h TYR 19 Ca 0.11 0.03 -0.06 0.00 2.58 0.00 0.00 58.73 61.40 2c0s h TYR 19 Cb 0.02 -0.16 -0.01 0.00 1.55 0.00 0.00 36.73 38.13 2c0s h TYR 19 CO -0.09 0.18 0.02 -0.07 -1.32 0.00 0.00 178.16 176.87 2c0s h LEU 20 N 0.56 0.63 -0.87 2.82 3.38 -0.59 -1.16 115.31 120.07 2c0s h LEU 20 Ca 0.38 -0.30 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 2c0s h LEU 20 Cb 0.46 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 2c0s h LEU 20 CO -0.31 0.77 0.18 0.58 0.09 0.00 0.00 178.44 179.74 2c0s h VAL 21 N 0.47 1.25 0.07 1.22 2.07 0.23 0.37 116.25 121.93 2c0s h VAL 21 Ca 0.11 -0.89 -0.00 0.00 0.82 0.00 0.00 66.70 66.74 2c0s h VAL 21 Cb 0.44 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 30.77 2c0s h VAL 21 CO 0.02 0.34 -0.03 -0.33 0.02 0.00 0.00 177.57 177.58 2c0s h GLU 22 N 0.97 -0.09 0.05 1.57 5.08 -0.50 -2.28 114.58 119.38 2c0s h GLU 22 Ca 0.21 0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.51 2c0s h GLU 22 Cb 0.32 0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.59 2c0s h GLU 22 CO -0.00 0.11 -0.28 0.87 -1.00 0.00 0.00 179.01 178.71 2c0s h LYS 23 N -0.28 0.10 0.02 2.33 1.79 -1.02 -3.40 116.57 116.11 2c0s h LYS 23 Ca -0.01 -0.17 -0.40 0.00 -2.18 0.00 0.00 60.65 57.90 2c0s h LYS 23 Cb 0.25 0.06 -0.06 0.00 -1.58 0.00 0.00 32.23 30.90 2c0s h LYS 23 CO 0.02 1.08 -2.34 0.66 -1.08 0.00 0.00 179.45 177.78 2c0s n TYR 24 N -4.45 0.26 0.00 -1.35 4.01 0.12 -5.09 117.16 110.67 2c0s n TYR 24 Ca -0.11 0.07 0.00 0.00 -0.16 0.00 0.00 57.90 57.70 2c0s n TYR 24 Cb 0.60 -1.03 0.00 0.00 -0.31 0.00 0.00 39.34 38.59 2c0s n TYR 24 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2c0s n GLY 25 N 1.91 0.34 0.25 2.72 0.00 -0.86 -4.78 105.19 104.78 2c0s n GLY 25 Ca -0.45 -2.30 0.03 0.00 0.00 0.00 0.00 46.02 43.30 2c0s n GLY 25 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2c0s n PHE 26 N 0.17 0.04 1.08 1.61 1.16 -1.26 -3.89 117.46 116.38 2c0s n PHE 26 Ca 0.00 -0.09 0.12 0.00 -1.87 0.00 0.00 57.45 55.61 2c0s n PHE 26 Cb 0.00 -0.01 0.13 0.00 -1.61 0.00 0.00 39.48 37.99 2c0s n PHE 26 CO 0.00 0.00 0.00 2.41 -1.87 0.00 0.00 176.76 177.30 2c0s n THR 27 N 0.27 0.00 -2.64 1.97 -1.04 -1.26 -4.65 114.28 106.93 2c0s n THR 27 Ca 0.04 -0.32 -0.42 0.00 -2.04 0.00 0.00 64.05 61.31 2c0s n THR 27 Cb 0.18 1.14 -0.03 0.00 -1.82 0.00 0.00 70.33 69.81 2c0s n THR 27 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 2c0s s HIS 28 N -2.29 3.55 0.17 -1.42 5.04 -1.26 -4.96 115.29 114.12 2c0s s HIS 28 Ca 0.24 1.57 -0.15 0.00 -1.54 0.00 0.00 55.06 55.18 2c0s s HIS 28 Cb 0.19 -3.21 0.14 0.00 0.04 0.00 0.00 32.58 29.74 2c0s s HIS 28 CO 0.46 -0.38 1.70 1.25 -2.34 0.00 0.00 174.74 175.43 2c0s h HIS 29 N 6.93 0.03 0.00 3.88 2.76 -1.96 -1.12 115.15 125.68 2c0s h HIS 29 Ca -0.38 0.03 -0.05 0.00 -2.20 0.00 0.00 60.37 57.77 2c0s h HIS 29 Cb 1.20 0.05 -0.01 0.00 1.55 0.00 0.00 27.41 30.20 2c0s h HIS 29 CO 0.69 -0.06 -0.24 1.57 -1.30 0.00 0.00 177.93 178.59 2c0s h LYS 30 N 0.14 0.00 -0.42 5.26 2.10 -1.98 -0.46 116.57 121.21 2c0s h LYS 30 Ca 0.21 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 58.76 2c0s h LYS 30 Cb 0.30 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.62 2c0s h LYS 30 CO -0.33 0.24 -0.16 0.28 -2.00 0.00 0.00 179.45 177.48 2c0s h VAL 31 N 0.00 1.28 -0.38 0.07 2.07 -1.57 -0.18 116.25 117.54 2c0s h VAL 31 Ca -0.00 -1.29 -0.09 0.00 0.82 0.00 0.00 66.70 66.14 2c0s h VAL 31 Cb 0.53 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 2c0s h VAL 31 CO 0.03 0.43 -0.13 0.40 0.02 0.00 0.00 177.57 178.32 2c0s h ILE 32 N 0.66 1.25 -0.36 4.57 2.04 -0.93 -1.61 117.51 123.14 2c0s h ILE 32 Ca 0.10 -1.15 -0.00 0.00 1.00 0.00 0.00 64.86 64.81 2c0s h ILE 32 Cb 0.71 1.10 -0.02 0.00 -0.74 0.00 0.00 36.82 37.88 2c0s h ILE 32 CO 0.05 0.39 0.22 -1.28 0.00 0.00 0.00 178.15 177.52 2c0s h SER 33 N 0.62 0.43 0.27 1.72 0.87 -0.52 -2.15 113.55 114.79 2c0s h SER 33 Ca 0.11 -0.05 -0.07 0.00 -1.23 0.00 0.00 61.79 60.54 2c0s h SER 33 Cb 0.58 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.42 2c0s h SER 33 CO 0.04 0.35 -0.31 -0.26 -0.53 0.00 0.00 176.83 176.12 2c0s h PHE 34 N 0.46 0.07 -0.51 2.24 0.04 -0.72 -2.30 116.94 116.21 2c0s h PHE 34 Ca 0.13 -0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.87 2c0s h PHE 34 Cb 0.00 -0.02 -0.03 0.00 2.20 0.00 0.00 35.95 38.11 2c0s h PHE 34 CO -0.04 0.37 0.25 1.03 -0.60 0.00 0.00 178.31 179.32 2c0s h SER 35 N 0.06 0.64 -0.65 2.17 0.87 -0.66 0.11 113.55 116.09 2c0s h SER 35 Ca 0.01 -0.06 -0.06 0.00 -1.23 0.00 0.00 61.79 60.45 2c0s h SER 35 Cb 0.58 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.35 2c0s h SER 35 CO 0.04 0.55 0.18 1.56 -0.53 0.00 0.00 176.83 178.63 2c0s h GLN 36 N 0.72 1.03 -0.45 2.24 1.08 -1.02 -0.65 115.11 118.05 2c0s h GLN 36 Ca 0.18 -0.24 -0.04 0.00 -1.45 0.00 0.00 58.65 57.10 2c0s h GLN 36 Cb 0.08 -0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 27.35 2c0s h GLN 36 CO -0.02 0.91 0.12 0.93 -0.95 0.00 0.00 178.83 179.82 2c0s h GLU 37 N 0.96 0.71 -0.80 1.46 4.39 -0.96 -1.19 114.58 119.15 2c0s h GLU 37 Ca 0.21 -0.16 -0.04 0.00 0.34 0.00 0.00 59.36 59.70 2c0s h GLU 37 Cb 0.33 -0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 28.85 2c0s h GLU 37 CO -0.00 0.70 0.35 -0.07 -1.16 0.00 0.00 179.01 178.83 2c0s h LEU 38 N 0.60 1.08 -0.57 1.33 -0.00 -0.65 -1.03 115.31 116.07 2c0s h LEU 38 Ca 0.14 -0.15 0.04 0.00 -0.00 0.00 0.00 57.88 57.91 2c0s h LEU 38 Cb 0.30 -0.28 -0.04 0.00 -0.00 0.00 0.00 40.66 40.64 2c0s h LEU 38 CO -0.00 0.93 0.32 -0.78 -0.00 0.00 0.00 178.44 178.91 2c0s h ASP 39 N 1.15 0.49 -0.68 -0.43 3.58 -0.73 0.29 116.42 120.09 2c0s h ASP 39 Ca 0.27 0.02 0.01 0.00 0.42 0.00 0.00 57.03 57.74 2c0s h ASP 39 Cb 0.17 -0.08 -0.03 0.00 1.72 0.00 0.00 39.33 41.10 2c0s h ASP 39 CO -0.03 0.34 0.45 0.03 -2.88 0.00 0.00 179.24 177.15 2c0s h ARG 40 N 0.62 0.90 -0.38 0.28 3.08 -0.81 -1.15 114.38 116.93 2c0s h ARG 40 Ca 0.24 -0.06 -0.14 0.00 0.07 0.00 0.00 59.98 60.09 2c0s h ARG 40 Cb 0.09 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 29.93 2c0s h ARG 40 CO -0.13 0.60 -0.34 -0.07 -1.07 0.00 0.00 179.97 178.96 2c0s h LEU 41 N 0.92 0.90 -1.43 3.04 3.38 -0.43 -2.64 115.31 119.05 2c0s h LEU 41 Ca 0.25 -0.39 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 2c0s h LEU 41 Cb -0.10 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.37 2c0s h LEU 41 CO -0.05 1.15 0.31 -0.07 0.09 0.00 0.00 178.44 179.87 2c0s h LEU 42 N 0.71 0.61 -1.42 1.67 3.38 -0.12 -0.17 115.31 119.97 2c0s h LEU 42 Ca 0.07 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2c0s h LEU 42 Cb 0.90 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.50 2c0s h LEU 42 CO 0.08 0.47 0.00 0.78 0.09 0.00 0.00 178.44 179.86 2c0s h ASN 43 N 0.71 0.00 -0.03 -0.43 2.35 -0.87 -1.22 115.58 116.08 2c0s h ASN 43 Ca 0.19 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.69 2c0s h ASN 43 Cb -0.03 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.36 2c0s h ASN 43 CO -0.04 0.00 -0.92 -0.07 -1.65 0.00 0.00 177.43 174.75 2c0s h LEU 44 N 0.00 0.87 -0.98 1.61 3.38 -0.78 -2.50 115.31 116.91 2c0s h LEU 44 Ca 0.00 -0.72 -0.03 0.00 0.09 0.00 0.00 57.88 57.22 2c0s h LEU 44 Cb 0.40 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 2c0s h LEU 44 CO 0.00 1.47 0.31 -0.07 0.09 0.00 0.00 178.44 180.24 2c0s h LEU 45 N 0.36 0.95 -1.13 1.67 3.38 -1.09 -2.16 115.31 117.29 2c0s h LEU 45 Ca -0.11 -0.12 0.06 0.00 0.09 0.00 0.00 57.88 57.81 2c0s h LEU 45 Cb 1.58 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 42.02 2c0s h LEU 45 CO 0.18 0.83 0.60 0.40 0.09 0.00 0.00 178.44 180.54 2c0s h ILE 46 N 1.03 1.07 -0.49 1.22 2.04 -1.20 -1.36 117.51 119.82 2c0s h ILE 46 Ca 0.24 -0.36 0.08 0.00 1.00 0.00 0.00 64.86 65.82 2c0s h ILE 46 Cb 0.16 -0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.14 2c0s h ILE 46 CO -0.03 0.19 0.33 -0.33 0.00 0.00 0.00 178.15 178.32 2c0s h GLU 47 N 1.05 0.32 0.00 2.37 4.39 -0.92 0.49 114.58 122.29 2c0s h GLU 47 Ca 0.39 -0.02 -0.18 0.00 0.34 0.00 0.00 59.36 59.90 2c0s h GLU 47 Cb 0.19 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.74 2c0s h GLU 47 CO -0.15 0.21 -0.84 -0.07 -1.16 0.00 0.00 179.01 177.00 2c0s h LEU 48 N 0.33 0.00 -0.02 1.33 -0.00 -1.24 -2.92 115.31 112.80 2c0s h LEU 48 Ca 0.22 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 58.09 2c0s h LEU 48 Cb 0.45 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.11 2c0s h LEU 48 CO -0.05 0.84 -0.02 0.11 -0.00 0.00 0.00 178.44 179.32 2c0s h LYS 49 N 0.00 0.05 0.00 1.13 1.57 -0.80 -3.24 116.57 115.28 2c0s h LYS 49 Ca -0.01 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 2c0s h LYS 49 Cb 1.52 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.83 2c0s h LYS 49 CO 0.11 0.53 -0.08 1.79 -0.57 0.00 0.00 179.45 181.23 2c0s h THR 50 N -0.44 0.24 0.00 -0.16 1.35 -1.06 -1.64 112.91 111.21 2c0s h THR 50 Ca 0.00 -0.63 0.00 0.00 -0.55 0.00 0.00 66.41 65.24 2c0s h THR 50 Cb 0.52 1.50 0.00 0.00 -1.73 0.00 0.00 68.15 68.44 2c0s h THR 50 CO 0.00 0.08 0.00 0.11 -0.25 0.00 0.00 175.52 175.46 2c0s h LYS 51 N 0.00 0.00 -0.23 4.72 1.57 -1.54 -3.46 116.57 117.62 2c0s h LYS 51 Ca -0.00 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 2c0s h LYS 51 Cb 0.49 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.78 2c0s h LYS 51 CO 0.01 0.00 -0.05 0.36 -0.57 0.00 0.00 179.45 179.20 2c0s n LYS 52 N -2.47 -1.88 -0.22 3.15 2.85 -0.62 -4.75 118.16 114.23 2c0s n LYS 52 Ca 0.03 0.47 0.10 0.00 -1.05 0.00 0.00 58.31 57.86 2c0s n LYS 52 Cb 0.32 -4.51 0.27 0.00 -0.65 0.00 0.00 35.03 30.46 2c0s n LYS 52 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 177.40 177.71 2c0s n LYS 53 N 0.23 2.27 -2.66 -1.58 2.85 -1.26 -4.85 118.16 113.16 2c0s n LYS 53 Ca -0.03 -1.95 -0.21 0.00 -1.05 0.00 0.00 58.31 55.07 2c0s n LYS 53 Cb 0.40 -1.46 0.04 0.00 -0.65 0.00 0.00 35.03 33.36 2c0s n LYS 53 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 2c0s s ARG 54 N -1.43 2.47 0.00 -1.58 0.52 -1.26 -4.97 118.95 112.70 2c0s s ARG 54 Ca 0.37 -0.86 0.17 0.00 -0.52 0.00 0.00 55.73 54.89 2c0s s ARG 54 Cb 0.20 -2.49 1.01 0.00 0.52 0.00 0.00 34.95 34.19 2c0s s ARG 54 CO 0.28 -0.77 1.56 0.66 0.02 0.00 0.00 175.30 177.05 2c0s n TYR 55 N -2.36 0.00 0.30 -0.53 4.02 -1.26 -3.90 117.16 113.43 2c0s n TYR 55 Ca 0.09 0.00 0.18 0.00 -0.01 0.00 0.00 57.90 58.16 2c0s n TYR 55 Cb 0.60 0.00 0.95 0.00 -0.02 0.00 0.00 39.34 40.87 2c0s n TYR 55 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 2c0s h SER 56 N 0.00 0.00 0.10 7.72 0.87 -1.92 0.51 113.55 120.82 2c0s h SER 56 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2c0s h SER 56 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 2c0s h SER 56 CO 0.00 0.03 -0.79 0.18 -0.53 0.00 0.00 176.83 175.73 2c0s n LEU 57 N -3.39 1.09 -0.12 2.23 4.77 -1.25 -4.07 117.00 116.26 2c0s n LEU 57 Ca -0.02 -0.45 -0.26 0.00 -0.03 0.00 0.00 56.01 55.25 2c0s n LEU 57 Cb 0.15 -0.05 -0.11 0.00 -2.33 0.00 0.00 43.42 41.08 2c0s n LEU 57 CO 0.25 0.25 -1.13 0.18 -1.33 0.00 0.00 177.39 175.61 2c0s n LEU 58 N -1.20 2.07 -4.31 2.23 4.77 -0.24 -4.65 117.00 115.66 2c0s n LEU 58 Ca 0.06 0.31 -0.46 0.00 -0.03 0.00 0.00 56.01 55.89 2c0s n LEU 58 Cb 0.36 -0.89 -0.05 0.00 -2.33 0.00 0.00 43.42 40.50 2c0s n LEU 58 CO 0.38 0.54 0.14 -1.61 -1.33 0.00 0.00 177.39 175.51 2c0s s GLU 59 N -2.47 2.99 -0.05 3.23 0.41 0.16 -5.02 118.70 117.96 2c0s s GLU 59 Ca -0.35 -1.69 -0.30 0.00 -0.41 0.00 0.00 54.97 52.23 2c0s s GLU 59 Cb 0.11 -4.30 -0.06 0.00 -1.78 0.00 0.00 34.13 28.11 2c0s s GLU 59 CO 0.55 -1.33 1.67 -1.58 -0.49 0.00 0.00 175.26 174.08 2c0s s HIS 60 N 1.62 1.93 -0.13 1.61 2.46 -1.26 -4.35 115.29 117.19 2c0s s HIS 60 Ca 0.03 0.16 -0.30 0.00 0.47 0.00 0.00 55.06 55.43 2c0s s HIS 60 Cb -0.30 -3.94 -0.14 0.00 -0.13 0.00 0.00 32.58 28.08 2c0s s HIS 60 CO 0.03 -3.94 0.88 1.58 -2.47 0.00 0.00 174.74 170.82 2c0s n HIS 61 N 7.20 0.73 -1.64 3.88 -0.00 -1.26 -4.75 115.22 119.38 2c0s n HIS 61 Ca 0.17 0.76 -0.51 0.00 0.46 0.00 0.00 57.72 58.61 2c0s n HIS 61 Cb 0.43 -1.50 -0.06 0.00 -0.12 0.00 0.00 29.99 28.74 2c0s n HIS 61 CO 0.00 0.00 0.00 -2.39 0.46 0.00 0.00 176.34 174.41 2c0s n HIS 62 N 1.68 2.10 -2.37 1.57 1.44 -1.26 -4.87 115.22 113.51 2c0s n HIS 62 Ca 0.17 0.17 -0.43 0.00 -2.01 0.00 0.00 57.72 55.62 2c0s n HIS 62 Cb 0.02 -2.59 -0.02 0.00 0.12 0.00 0.00 29.99 27.51 2c0s n HIS 62 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 2c0s s HIS 63 N 4.88 2.89 0.00 -1.40 3.76 -1.26 -5.32 115.29 118.84 2c0s s HIS 63 Ca 0.98 0.98 0.00 0.00 -0.15 0.00 0.00 55.06 56.87 2c0s s HIS 63 Cb -0.80 -3.54 0.00 0.00 1.11 0.00 0.00 32.58 29.36 2c0s s HIS 63 CO 0.54 -1.87 0.00 1.58 -0.85 0.00 0.00 174.74 174.14