#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c0s s ASN 2 N 0.00 6.96 0.27 6.12 3.84 -1.26 -4.91 114.94 125.96 2c0s s ASN 2 Ca 0.00 1.41 0.12 0.00 0.21 0.00 0.00 52.86 54.60 2c0s s ASN 2 Cb 0.00 -2.54 0.29 0.00 -0.55 0.00 0.00 41.25 38.45 2c0s s ASN 2 CO 0.00 -0.79 1.56 -0.37 -2.79 0.00 0.00 177.10 174.70 2c0s h VAL 3 N 5.58 1.29 -0.91 -5.21 -1.51 -2.07 -3.35 116.25 110.08 2c0s h VAL 3 Ca -0.23 -2.25 0.13 0.00 -1.23 0.00 0.00 66.70 63.13 2c0s h VAL 3 Cb 1.08 2.27 -0.09 0.00 -2.13 0.00 0.00 31.29 32.42 2c0s h VAL 3 CO 0.99 0.61 0.52 0.74 -1.23 0.00 0.00 177.57 179.21 2c0s h THR 4 N 0.00 0.82 -0.32 7.19 2.02 -2.02 -0.56 112.91 120.04 2c0s h THR 4 Ca -0.01 -0.27 0.09 0.00 0.77 0.00 0.00 66.41 67.00 2c0s h THR 4 Cb 1.22 -0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.58 2c0s h THR 4 CO 0.08 0.14 0.30 0.07 0.37 0.00 0.00 175.52 176.49 2c0s h LYS 5 N 0.78 0.00 0.02 6.66 2.10 -1.98 -0.78 116.57 123.37 2c0s h LYS 5 Ca 0.48 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 59.13 2c0s h LYS 5 Cb 0.58 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.91 2c0s h LYS 5 CO -0.31 0.00 -0.01 1.25 -2.00 0.00 0.00 179.45 178.38 2c0s h LEU 6 N 0.00 -0.02 -1.04 7.07 5.85 -1.35 -0.17 115.31 125.65 2c0s h LEU 6 Ca 0.15 -0.20 -0.09 0.00 0.84 0.00 0.00 57.88 58.58 2c0s h LEU 6 Cb 0.76 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.78 2c0s h LEU 6 CO -0.00 0.19 -0.36 -1.13 -0.34 0.00 0.00 178.44 176.80 2c0s h ASN 7 N -0.23 0.23 -0.22 1.25 -1.24 -1.37 -1.67 115.58 112.34 2c0s h ASN 7 Ca -0.00 -0.09 -0.01 0.00 0.71 0.00 0.00 56.30 56.91 2c0s h ASN 7 Cb 0.22 -0.06 -0.01 0.00 0.73 0.00 0.00 38.32 39.19 2c0s h ASN 7 CO 0.00 0.58 0.12 -0.78 -1.29 0.00 0.00 177.43 176.07 2c0s h ASP 8 N 0.20 0.29 -0.47 1.15 3.58 -0.91 0.16 116.42 120.41 2c0s h ASP 8 Ca 0.02 -0.02 -0.13 0.00 0.42 0.00 0.00 57.03 57.33 2c0s h ASP 8 Cb 0.73 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.69 2c0s h ASP 8 CO 0.06 0.25 -0.22 0.03 -2.88 0.00 0.00 179.24 176.48 2c0s h ARG 9 N 0.34 0.99 -0.11 0.28 3.08 -0.06 -2.45 114.38 116.45 2c0s h ARG 9 Ca 0.09 -0.42 -0.01 0.00 0.07 0.00 0.00 59.98 59.71 2c0s h ARG 9 Cb 0.03 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.04 2c0s h ARG 9 CO -0.01 1.10 0.04 0.82 -1.07 0.00 0.00 179.97 180.85 2c0s h ILE 10 N 0.85 1.14 -0.53 2.04 2.04 -0.89 -2.01 117.51 120.15 2c0s h ILE 10 Ca 0.11 -0.42 0.11 0.00 1.00 0.00 0.00 64.86 65.65 2c0s h ILE 10 Cb 0.79 1.23 -0.09 0.00 -0.74 0.00 0.00 36.82 38.02 2c0s h ILE 10 CO 0.07 0.13 0.01 -0.33 0.00 0.00 0.00 178.15 178.02 2c0s h GLU 11 N 0.02 0.12 -0.62 2.37 4.39 -0.66 0.41 114.58 120.62 2c0s h GLU 11 Ca 0.04 -0.01 -0.06 0.00 0.34 0.00 0.00 59.36 59.67 2c0s h GLU 11 Cb 0.16 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.76 2c0s h GLU 11 CO -0.00 0.08 0.17 0.00 -1.16 0.00 0.00 179.01 178.09 2c0s h ALA 12 N 1.48 0.81 0.02 3.43 0.00 -1.30 -2.85 119.26 120.85 2c0s h ALA 12 Ca 0.27 -0.22 -0.21 0.00 0.00 0.00 0.00 54.91 54.75 2c0s h ALA 12 Cb 0.42 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2c0s h ALA 12 CO -0.44 0.51 -0.95 0.87 0.00 0.00 0.00 179.25 179.23 2c0s h LYS 13 N 0.89 0.16 -0.24 0.00 1.57 -0.51 -2.80 116.57 115.65 2c0s h LYS 13 Ca 0.20 -0.21 -0.09 0.00 -1.87 0.00 0.00 60.65 58.67 2c0s h LYS 13 Cb 0.33 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 2c0s h LYS 13 CO -0.00 1.00 -0.25 1.57 -0.57 0.00 0.00 179.45 181.19 2c0s h LYS 14 N 0.08 0.47 -0.02 3.15 2.10 -0.18 0.15 116.57 122.32 2c0s h LYS 14 Ca -0.05 -0.17 -0.12 0.00 -2.00 0.00 0.00 60.65 58.31 2c0s h LYS 14 Cb 1.62 -0.03 -0.02 0.00 -0.90 0.00 0.00 32.23 32.91 2c0s h LYS 14 CO 0.14 0.69 -0.53 0.87 -2.00 0.00 0.00 179.45 178.61 2c0s h LYS 15 N 0.41 0.06 -0.05 0.07 1.79 -1.48 -1.67 116.57 115.71 2c0s h LYS 15 Ca 0.06 -0.03 -0.18 0.00 -2.18 0.00 0.00 60.65 58.32 2c0s h LYS 15 Cb 0.66 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.33 2c0s h LYS 15 CO 0.05 0.58 -0.67 1.49 -1.08 0.00 0.00 179.45 179.81 2c0s h GLU 16 N 0.04 0.54 -0.78 3.15 4.81 -1.10 -2.81 114.58 118.43 2c0s h GLU 16 Ca -0.00 -0.52 0.02 0.00 -0.13 0.00 0.00 59.36 58.73 2c0s h GLU 16 Cb 0.96 0.13 -0.04 0.00 0.63 0.00 0.00 28.75 30.43 2c0s h GLU 16 CO 0.07 1.15 0.51 -0.07 -0.73 0.00 0.00 179.01 179.94 2c0s h LEU 17 N 0.12 0.87 -0.59 1.64 3.38 -0.59 0.76 115.31 120.90 2c0s h LEU 17 Ca -0.07 -0.01 0.05 0.00 0.09 0.00 0.00 57.88 57.93 2c0s h LEU 17 Cb 1.35 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.84 2c0s h LEU 17 CO 0.13 0.61 0.32 0.40 0.09 0.00 0.00 178.44 180.00 2c0s h ILE 18 N 1.02 0.99 -0.42 1.22 2.04 -1.25 0.41 117.51 121.51 2c0s h ILE 18 Ca 0.30 -0.21 -0.01 0.00 1.00 0.00 0.00 64.86 65.94 2c0s h ILE 18 Cb -0.06 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.31 2c0s h ILE 18 CO -0.08 0.11 0.22 0.22 0.00 0.00 0.00 178.15 178.62 2c0s h TYR 19 N 0.62 0.59 -0.59 1.37 3.20 -1.12 -1.92 116.97 119.12 2c0s h TYR 19 Ca 0.26 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.06 2c0s h TYR 19 Cb 0.13 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.19 2c0s h TYR 19 CO -0.08 0.46 0.19 -0.07 -1.64 0.00 0.00 178.16 177.01 2c0s h LEU 20 N 0.55 0.85 -1.49 2.82 3.38 -0.13 -2.10 115.31 119.20 2c0s h LEU 20 Ca 0.15 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 2c0s h LEU 20 Cb 0.07 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2c0s h LEU 20 CO -0.02 0.83 0.07 0.58 0.09 0.00 0.00 178.44 179.98 2c0s h VAL 21 N 0.83 1.14 0.03 1.22 2.07 -0.00 0.58 116.25 122.11 2c0s h VAL 21 Ca 0.19 -0.49 -0.00 0.00 0.82 0.00 0.00 66.70 67.22 2c0s h VAL 21 Cb 0.28 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 2c0s h VAL 21 CO -0.01 0.17 -0.01 -0.33 0.02 0.00 0.00 177.57 177.41 2c0s h GLU 22 N 0.40 -0.04 0.04 1.57 5.08 -0.94 -2.61 114.58 118.08 2c0s h GLU 22 Ca 0.10 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.37 2c0s h GLU 22 Cb 0.16 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 2c0s h GLU 22 CO -0.00 0.37 -0.46 0.87 -1.00 0.00 0.00 179.01 178.79 2c0s h LYS 23 N -0.46 0.08 0.02 2.33 6.56 -1.04 -3.39 116.57 120.67 2c0s h LYS 23 Ca -0.00 -0.14 -0.40 0.00 -1.06 0.00 0.00 60.65 59.05 2c0s h LYS 23 Cb 0.43 0.05 -0.06 0.00 -0.57 0.00 0.00 32.23 32.08 2c0s h LYS 23 CO 0.01 1.07 -2.40 0.66 -2.06 0.00 0.00 179.45 176.72 2c0s n TYR 24 N -4.43 0.18 0.00 -1.35 4.01 0.18 -5.06 117.16 110.68 2c0s n TYR 24 Ca -0.15 0.05 0.00 0.00 -0.16 0.00 0.00 57.90 57.63 2c0s n TYR 24 Cb 0.61 -1.02 0.00 0.00 -0.31 0.00 0.00 39.34 38.62 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 2.02 0.69 0.00 2.72 0.00 0.33 -4.81 105.19 106.14 2c0s n GLY 25 Ca -0.46 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 44.57 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 6.55 0.00 0.00 1.61 3.72 -1.26 -4.13 117.46 123.95 2c0s n PHE 26 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2c0s n PHE 26 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 2c0s n PHE 26 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2c0s n THR 27 N 0.00 0.00 -1.75 4.37 -2.24 -1.26 -4.89 114.28 108.51 2c0s n THR 27 Ca 0.00 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.36 2c0s n THR 27 Cb 0.00 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.20 2c0s n THR 27 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 2c0s s HIS 28 N 0.00 1.43 0.38 4.78 5.65 -1.26 -4.87 115.29 121.40 2c0s s HIS 28 Ca 0.00 0.09 0.05 0.00 0.25 0.00 0.00 55.06 55.45 2c0s s HIS 28 Cb 0.00 -4.08 0.74 0.00 -1.18 0.00 0.00 32.58 28.07 2c0s s HIS 28 CO 0.00 -4.50 2.02 0.45 -0.65 0.00 0.00 174.74 172.06 2c0s h HIS 29 N 12.03 0.68 -0.49 3.88 -0.00 -1.98 -1.86 115.15 127.41 2c0s h HIS 29 Ca -0.43 0.02 -0.02 0.00 -0.00 0.00 0.00 60.37 59.93 2c0s h HIS 29 Cb 1.22 -0.23 -0.02 0.00 -0.00 0.00 0.00 27.41 28.38 2c0s h HIS 29 CO 0.94 0.41 0.22 0.87 -0.00 0.00 0.00 177.93 180.38 2c0s h LYS 30 N 0.72 0.72 -0.49 2.45 1.79 -1.99 0.43 116.57 120.21 2c0s h LYS 30 Ca 0.22 -0.11 0.01 0.00 -2.18 0.00 0.00 60.65 58.59 2c0s h LYS 30 Cb 0.01 -0.12 -0.03 0.00 -1.58 0.00 0.00 32.23 30.50 2c0s h LYS 30 CO -0.06 0.61 0.31 0.28 -1.08 0.00 0.00 179.45 179.52 2c0s h VAL 31 N 0.65 1.09 -0.36 0.50 2.07 -1.71 0.10 116.25 118.59 2c0s h VAL 31 Ca 0.17 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 2c0s h VAL 31 Cb 0.15 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 2c0s h VAL 31 CO -0.02 0.11 0.18 0.40 0.02 0.00 0.00 177.57 178.26 2c0s h ILE 32 N 0.62 1.16 -0.43 4.57 2.04 -1.20 -0.73 117.51 123.54 2c0s h ILE 32 Ca 0.19 -0.46 -0.06 0.00 1.00 0.00 0.00 64.86 65.52 2c0s h ILE 32 Cb -0.03 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 36.83 2c0s h ILE 32 CO -0.06 0.17 0.01 0.28 0.00 0.00 0.00 178.15 178.55 2c0s h SER 33 N 0.44 0.66 -0.18 1.72 0.02 -0.20 -1.46 113.55 114.57 2c0s h SER 33 Ca 0.12 -0.15 -0.19 0.00 -0.84 0.00 0.00 61.79 60.74 2c0s h SER 33 Cb 0.11 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.48 2c0s h SER 33 CO -0.02 0.73 -0.60 -0.26 -1.14 0.00 0.00 176.83 175.55 2c0s h PHE 34 N 0.66 1.00 -0.19 3.45 0.04 -0.53 -2.43 116.94 118.94 2c0s h PHE 34 Ca 0.13 -0.37 -0.05 0.00 2.80 0.00 0.00 57.97 60.49 2c0s h PHE 34 Cb 0.40 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 38.36 2c0s h PHE 34 CO 0.02 1.18 -0.09 1.03 -0.60 0.00 0.00 178.31 179.85 2c0s h SER 35 N 0.59 0.27 -0.55 2.17 0.87 -0.75 0.82 113.55 116.96 2c0s h SER 35 Ca -0.00 -0.05 -0.11 0.00 -1.23 0.00 0.00 61.79 60.39 2c0s h SER 35 Cb 1.20 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 63.07 2c0s h SER 35 CO 0.13 0.40 -0.10 1.56 -0.53 0.00 0.00 176.83 178.28 2c0s h GLN 36 N 0.28 1.04 -0.38 2.24 4.20 -1.09 -2.08 115.11 119.32 2c0s h GLN 36 Ca 0.06 -0.39 -0.11 0.00 0.06 0.00 0.00 58.65 58.28 2c0s h GLN 36 Cb 0.34 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 2c0s h GLN 36 CO 0.02 1.08 -0.19 1.49 -0.67 0.00 0.00 178.83 180.56 2c0s h GLU 37 N 0.92 0.79 -0.11 1.46 4.81 -0.82 -2.05 114.58 119.58 2c0s h GLU 37 Ca 0.14 -0.35 0.04 0.00 -0.13 0.00 0.00 59.36 59.07 2c0s h GLU 37 Cb 0.68 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.98 2c0s h GLU 37 CO 0.05 0.97 -0.23 1.25 -0.73 0.00 0.00 179.01 180.32 2c0s h LEU 38 N 0.59 -0.72 -0.80 1.64 6.46 -0.78 0.24 115.31 121.94 2c0s h LEU 38 Ca 0.08 0.11 0.06 0.00 -0.12 0.00 0.00 57.88 58.02 2c0s h LEU 38 Cb 0.74 0.32 -0.06 0.00 -0.73 0.00 0.00 40.66 40.92 2c0s h LEU 38 CO 0.06 -0.29 0.48 -0.78 -0.62 0.00 0.00 178.44 177.29 2c0s h ASP 39 N -0.30 0.74 0.61 1.25 3.58 -1.26 -1.40 116.42 119.63 2c0s h ASP 39 Ca 0.10 0.02 -0.11 0.00 0.42 0.00 0.00 57.03 57.46 2c0s h ASP 39 Cb 0.45 -0.13 -0.02 0.00 1.72 0.00 0.00 39.33 41.35 2c0s h ASP 39 CO -0.29 0.47 -0.54 0.03 -2.88 0.00 0.00 179.24 176.03 2c0s h ARG 40 N 0.87 0.00 -0.46 0.28 2.47 -0.60 -1.45 114.38 115.50 2c0s h ARG 40 Ca 0.36 0.00 -0.08 0.00 -1.26 0.00 0.00 59.98 58.99 2c0s h ARG 40 Cb 0.20 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.50 2c0s h ARG 40 CO -0.18 0.54 -0.05 -0.07 0.56 0.00 0.00 179.97 180.76 2c0s h LEU 41 N 0.00 0.78 -0.92 3.04 3.38 0.47 -1.66 115.31 120.39 2c0s h LEU 41 Ca -0.01 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 2c0s h LEU 41 Cb 0.98 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.49 2c0s h LEU 41 CO 0.07 0.88 0.44 -0.07 0.09 0.00 0.00 178.44 179.84 2c0s h LEU 42 N 0.73 1.08 -1.85 1.67 -0.00 -0.68 -2.06 115.31 114.21 2c0s h LEU 42 Ca 0.13 -0.11 -0.03 0.00 -0.00 0.00 0.00 57.88 57.88 2c0s h LEU 42 Cb 0.52 -0.28 -0.00 0.00 -0.00 0.00 0.00 40.66 40.90 2c0s h LEU 42 CO 0.03 0.89 -0.13 0.78 -0.00 0.00 0.00 178.44 180.01 2c0s h ASN 43 N 1.20 0.00 -0.20 -0.43 -0.26 -0.56 0.08 115.58 115.41 2c0s h ASN 43 Ca 0.30 0.00 -0.20 0.00 -0.56 0.00 0.00 56.30 55.83 2c0s h ASN 43 Cb 0.07 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 37.34 2c0s h ASN 43 CO -0.04 0.13 -0.66 -0.07 -1.06 0.00 0.00 177.43 175.72 2c0s h LEU 44 N 0.00 0.93 -0.83 1.61 3.38 -0.66 -2.74 115.31 117.00 2c0s h LEU 44 Ca -0.00 -0.59 -0.07 0.00 0.09 0.00 0.00 57.88 57.30 2c0s h LEU 44 Cb 0.27 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 2c0s h LEU 44 CO 0.02 1.36 0.07 -0.07 0.09 0.00 0.00 178.44 179.91 2c0s h LEU 45 N 0.54 0.91 -1.83 1.67 3.38 -0.64 -1.95 115.31 117.39 2c0s h LEU 45 Ca -0.03 -0.21 0.03 0.00 0.09 0.00 0.00 57.88 57.76 2c0s h LEU 45 Cb 1.29 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 2c0s h LEU 45 CO 0.14 0.93 0.17 0.40 0.09 0.00 0.00 178.44 180.17 2c0s h ILE 46 N 0.89 0.99 -0.48 1.22 2.04 -0.98 0.15 117.51 121.35 2c0s h ILE 46 Ca 0.18 -0.08 -0.12 0.00 1.00 0.00 0.00 64.86 65.84 2c0s h ILE 46 Cb 0.42 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.24 2c0s h ILE 46 CO 0.01 0.04 -0.19 -0.08 0.00 0.00 0.00 178.15 177.94 2c0s h GLU 47 N 0.23 0.96 -0.17 2.37 4.81 -1.04 0.17 114.58 121.90 2c0s h GLU 47 Ca 0.11 -0.39 -0.14 0.00 -0.13 0.00 0.00 59.36 58.81 2c0s h GLU 47 Cb 0.15 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 2c0s h GLU 47 CO -0.02 1.06 -0.50 -0.07 -0.73 0.00 0.00 179.01 178.75 2c0s h LEU 48 N 0.83 0.49 -0.81 1.64 -0.00 -0.94 -2.69 115.31 113.84 2c0s h LEU 48 Ca 0.12 -0.24 0.03 0.00 -0.00 0.00 0.00 57.88 57.78 2c0s h LEU 48 Cb 0.75 -0.14 -0.05 0.00 -0.00 0.00 0.00 40.66 41.22 2c0s h LEU 48 CO 0.06 0.91 0.52 0.11 -0.00 0.00 0.00 178.44 180.04 2c0s h LYS 49 N 0.36 1.00 0.00 1.13 1.79 -0.38 -1.82 116.57 118.65 2c0s h LYS 49 Ca 0.02 -0.06 -0.01 0.00 -2.18 0.00 0.00 60.65 58.42 2c0s h LYS 49 Cb 1.00 -0.23 -0.00 0.00 -1.58 0.00 0.00 32.23 31.42 2c0s h LYS 49 CO 0.09 0.66 -0.04 1.15 -1.08 0.00 0.00 179.45 180.23 2c0s h THR 50 N 1.03 0.21 0.00 -0.16 2.02 -0.65 0.15 112.91 115.51 2c0s h THR 50 Ca 0.32 -0.37 -0.01 0.00 0.77 0.00 0.00 66.41 67.12 2c0s h THR 50 Cb -0.03 1.30 -0.00 0.00 -1.74 0.00 0.00 68.15 67.68 2c0s h THR 50 CO -0.10 0.04 -0.03 0.11 0.37 0.00 0.00 175.52 175.92 2c0s h LYS 51 N 0.00 0.00 0.00 6.66 1.79 -1.14 -3.46 116.57 120.42 2c0s h LYS 51 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2c0s h LYS 51 Cb 0.29 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.94 2c0s h LYS 51 CO 0.01 0.03 0.00 0.36 -1.08 0.00 0.00 179.45 178.76 2c0s n LYS 52 N -3.11 -0.70 -0.73 3.15 2.85 0.04 -4.68 118.16 114.98 2c0s n LYS 52 Ca 0.02 0.12 0.08 0.00 -1.05 0.00 0.00 58.31 57.48 2c0s n LYS 52 Cb 0.44 -3.67 0.37 0.00 -0.65 0.00 0.00 35.03 31.52 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 -0.45 4.21 -3.97 -1.58 2.85 -1.26 -4.65 118.16 113.31 2c0s n LYS 53 Ca 0.00 -3.01 -0.25 0.00 -1.05 0.00 0.00 58.31 54.00 2c0s n LYS 53 Cb 0.12 -2.06 -0.03 0.00 -0.65 0.00 0.00 35.03 32.40 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 -2.42 3.35 0.00 -1.58 1.81 -1.26 -4.94 118.95 113.91 2c0s s ARG 54 Ca 0.51 -0.69 0.13 0.00 -1.72 0.00 0.00 55.73 53.97 2c0s s ARG 54 Cb 0.37 -2.89 0.56 0.00 -0.45 0.00 0.00 34.95 32.54 2c0s s ARG 54 CO 0.18 0.49 1.41 0.66 -0.68 0.00 0.00 175.30 177.36 2c0s n TYR 55 N -0.74 0.00 0.20 -0.53 4.01 -1.26 -1.10 117.16 117.74 2c0s n TYR 55 Ca -0.08 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.74 2c0s n TYR 55 Cb 0.55 -0.49 0.37 0.00 -0.31 0.00 0.00 39.34 39.46 2c0s n TYR 55 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2c0s h SER 56 N 0.00 0.00 0.00 7.72 4.64 -1.94 -1.76 113.55 122.20 2c0s h SER 56 Ca 0.00 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.15 2c0s h SER 56 Cb 0.22 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.28 2c0s h SER 56 CO 0.00 0.30 -1.68 0.18 -0.87 0.00 0.00 176.83 174.76 2c0s n LEU 57 N -3.44 0.00 0.06 5.97 4.77 -0.51 -4.62 117.00 119.24 2c0s n LEU 57 Ca 0.00 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.92 2c0s n LEU 57 Cb 0.48 0.24 0.10 0.00 -2.33 0.00 0.00 43.42 41.91 2c0s n LEU 57 CO 0.35 0.24 0.47 -0.07 -1.33 0.00 0.00 177.39 177.05 2c0s h LEU 58 N 0.00 0.36 -8.62 2.23 3.38 -1.17 -3.40 115.31 108.09 2c0s h LEU 58 Ca -0.26 -0.20 -0.66 0.00 0.09 0.00 0.00 57.88 56.85 2c0s h LEU 58 Cb 1.56 -0.11 -0.22 0.00 0.09 0.00 0.00 40.66 41.99 2c0s h LEU 58 CO 0.01 0.87 -0.59 -1.61 0.09 0.00 0.00 178.44 177.22 2c0s s GLU 59 N -3.82 3.53 -0.22 1.13 0.41 -0.66 -5.03 118.70 114.04 2c0s s GLU 59 Ca -0.05 -0.58 -0.29 0.00 -0.41 0.00 0.00 54.97 53.65 2c0s s GLU 59 Cb 0.12 -3.46 -0.04 0.00 -1.78 0.00 0.00 34.13 28.97 2c0s s GLU 59 CO 0.81 -0.29 1.87 -3.38 -0.49 0.00 0.00 175.26 173.78 2c0s s HIS 60 N 1.62 1.66 -0.05 1.61 -3.43 -1.26 -4.67 115.29 110.78 2c0s s HIS 60 Ca 0.06 0.43 -0.00 0.00 -0.80 0.00 0.00 55.06 54.74 2c0s s HIS 60 Cb -0.16 -4.04 0.03 0.00 -1.43 0.00 0.00 32.58 26.97 2c0s s HIS 60 CO 0.05 -3.60 -0.00 -3.38 -2.00 0.00 0.00 174.74 165.82 2c0s s HIS 61 N 6.40 0.50 -0.19 0.38 -3.43 -1.26 -5.01 115.29 112.68 2c0s s HIS 61 Ca 0.84 -0.07 -0.09 0.00 -0.80 0.00 0.00 55.06 54.94 2c0s s HIS 61 Cb -0.29 -0.62 0.03 0.00 -1.43 0.00 0.00 32.58 30.28 2c0s s HIS 61 CO 0.34 -0.22 0.17 1.58 -2.00 0.00 0.00 174.74 174.61 2c0s n HIS 62 N 4.64 -3.92 -3.30 0.38 -0.00 -1.26 -4.97 115.22 106.79 2c0s n HIS 62 Ca -0.16 2.17 -0.40 0.00 -0.00 0.00 0.00 57.72 59.33 2c0s n HIS 62 Cb 0.50 -3.69 -0.08 0.00 -0.00 0.00 0.00 29.99 26.72 2c0s n HIS 62 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2c0s s HIS 63 N -0.79 3.24 -1.63 1.57 2.46 -1.26 -5.27 115.29 113.61 2c0s s HIS 63 Ca -0.20 0.43 0.13 0.00 0.47 0.00 0.00 55.06 55.89 2c0s s HIS 63 Cb 0.01 -2.71 0.10 0.00 -0.13 0.00 0.00 32.58 29.86 2c0s s HIS 63 CO 0.71 -0.33 0.91 1.58 -2.47 0.00 0.00 174.74 175.15