#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cv5 n SER 29 N 0.00 0.00 0.00 6.15 7.64 -1.26 -4.64 113.62 121.52 2cv5 n SER 29 Ca 0.00 0.10 0.00 0.00 1.01 0.00 0.00 58.87 59.98 2cv5 n SER 29 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2cv5 n SER 29 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2cv5 n ARG 30 N -0.13 0.00 -3.57 1.43 5.12 -1.26 -4.49 116.66 113.76 2cv5 n ARG 30 Ca 0.00 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 55.83 2cv5 n ARG 30 Cb 0.00 0.00 -0.04 0.00 -1.16 0.00 0.00 32.46 31.26 2cv5 n ARG 30 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 2cv5 s LYS 31 N 0.00 0.58 0.28 5.56 2.47 -1.26 -5.18 119.74 122.18 2cv5 s LYS 31 Ca 0.00 0.07 0.09 0.00 -1.56 0.00 0.00 55.97 54.57 2cv5 s LYS 31 Cb 0.00 0.27 -0.04 0.00 -1.46 0.00 0.00 37.83 36.60 2cv5 s LYS 31 CO 0.00 -0.19 0.05 -1.83 0.16 0.00 0.00 175.35 173.53 2cv5 s GLU 32 N -1.43 2.40 0.13 4.03 -1.05 -1.26 -5.09 118.70 116.42 2cv5 s GLU 32 Ca 0.00 -1.39 0.01 0.00 -0.15 0.00 0.00 54.97 53.44 2cv5 s GLU 32 Cb -0.01 -2.22 -0.00 0.00 -0.44 0.00 0.00 34.13 31.46 2cv5 s GLU 32 CO -0.01 0.33 0.15 -1.13 0.95 0.00 0.00 175.26 175.56 2cv5 n SER 33 N -0.98 -0.41 -1.20 0.83 3.41 -1.26 -5.05 113.62 108.96 2cv5 n SER 33 Ca -0.06 -1.73 0.11 0.00 -0.26 0.00 0.00 58.87 56.93 2cv5 n SER 33 Cb 0.59 0.82 0.27 0.00 -0.26 0.00 0.00 64.21 65.63 2cv5 n SER 33 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2cv5 n TYR 34 N -0.22 0.75 -0.32 7.33 4.01 -1.26 -4.74 117.16 122.72 2cv5 n TYR 34 Ca 0.01 -0.41 -0.01 0.00 -0.16 0.00 0.00 57.90 57.33 2cv5 n TYR 34 Cb 0.22 -0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.29 2cv5 n TYR 34 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 2cv5 h SER 35 N 4.08 -1.26 -0.57 7.72 0.02 -1.96 -0.75 113.55 120.82 2cv5 h SER 35 Ca 0.00 0.28 0.03 0.00 -0.84 0.00 0.00 61.79 61.26 2cv5 h SER 35 Cb 0.95 0.67 -0.04 0.00 0.14 0.00 0.00 62.40 64.13 2cv5 h SER 35 CO 0.00 -0.29 0.34 -0.37 -1.14 0.00 0.00 176.83 175.36 2cv5 h VAL 36 N -0.05 1.04 -0.50 2.27 -1.51 -1.99 -0.55 116.25 114.96 2cv5 h VAL 36 Ca 0.33 -0.23 -0.09 0.00 -1.23 0.00 0.00 66.70 65.48 2cv5 h VAL 36 Cb 0.59 0.32 -0.02 0.00 -2.13 0.00 0.00 31.29 30.06 2cv5 h VAL 36 CO -0.89 0.12 -0.06 1.88 -1.23 0.00 0.00 177.57 177.40 2cv5 h TYR 37 N 0.66 1.02 -0.45 5.19 0.05 -1.73 -1.21 116.97 120.50 2cv5 h TYR 37 Ca 0.24 -0.20 -0.10 0.00 0.05 0.00 0.00 58.73 58.72 2cv5 h TYR 37 Cb 0.05 -0.26 -0.02 0.00 1.01 0.00 0.00 36.73 37.52 2cv5 h TYR 37 CO -0.07 0.96 -0.13 0.28 -1.05 0.00 0.00 178.16 178.16 2cv5 h VAL 38 N 0.78 1.26 -0.13 -2.88 2.07 -0.88 -1.99 116.25 114.47 2cv5 h VAL 38 Ca 0.13 -1.21 -0.07 0.00 0.82 0.00 0.00 66.70 66.38 2cv5 h VAL 38 Cb 0.60 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 2cv5 h VAL 38 CO 0.04 0.42 -0.21 0.22 0.02 0.00 0.00 177.57 178.05 2cv5 h TYR 39 N 0.74 0.24 -0.21 1.57 3.20 -0.84 -1.67 116.97 120.00 2cv5 h TYR 39 Ca 0.12 -0.04 -0.17 0.00 3.14 0.00 0.00 58.73 61.79 2cv5 h TYR 39 Cb 0.63 -0.07 -0.00 0.00 1.54 0.00 0.00 36.73 38.83 2cv5 h TYR 39 CO 0.03 0.43 -0.55 0.87 -1.64 0.00 0.00 178.16 177.30 2cv5 h LYS 40 N 0.21 0.63 -0.17 1.82 1.57 -0.70 -2.06 116.57 117.87 2cv5 h LYS 40 Ca 0.04 -0.40 -0.19 0.00 -1.87 0.00 0.00 60.65 58.22 2cv5 h LYS 40 Cb 0.50 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.86 2cv5 h LYS 40 CO 0.03 1.01 -0.68 0.28 -0.57 0.00 0.00 179.45 179.53 2cv5 h VAL 41 N 0.48 1.31 -0.38 0.50 2.07 -1.16 -2.81 116.25 116.27 2cv5 h VAL 41 Ca 0.01 -1.93 0.01 0.00 0.82 0.00 0.00 66.70 65.61 2cv5 h VAL 41 Cb 1.11 1.90 -0.02 0.00 -1.52 0.00 0.00 31.29 32.76 2cv5 h VAL 41 CO 0.11 0.61 0.23 0.25 0.02 0.00 0.00 177.57 178.78 2cv5 h LEU 42 N 0.48 0.37 -1.89 2.57 5.85 -1.26 -1.67 115.31 119.75 2cv5 h LEU 42 Ca -0.02 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 2cv5 h LEU 42 Cb 1.27 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 42.22 2cv5 h LEU 42 CO 0.13 0.27 -0.08 0.11 -0.34 0.00 0.00 178.44 178.53 2cv5 h LYS 43 N 0.46 0.00 -0.12 1.25 1.79 -1.29 0.20 116.57 118.86 2cv5 h LYS 43 Ca 0.15 0.00 -0.15 0.00 -2.18 0.00 0.00 60.65 58.47 2cv5 h LYS 43 Cb -0.00 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.64 2cv5 h LYS 43 CO -0.06 0.08 -0.57 1.96 -1.08 0.00 0.00 179.45 179.78 2cv5 h GLN 44 N 0.00 0.37 0.00 3.15 4.20 -1.06 -2.89 115.11 118.88 2cv5 h GLN 44 Ca -0.00 -0.24 -0.11 0.00 0.06 0.00 0.00 58.65 58.36 2cv5 h GLN 44 Cb 0.14 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.93 2cv5 h GLN 44 CO 0.01 0.83 -1.97 1.33 -0.67 0.00 0.00 178.83 178.37 2cv5 n VAL 45 N -3.92 0.53 -2.94 -0.54 0.24 -0.79 -4.75 118.33 106.16 2cv5 n VAL 45 Ca -0.03 -0.62 -0.13 0.00 -2.04 0.00 0.00 64.34 61.53 2cv5 n VAL 45 Cb 0.60 -0.22 -0.01 0.00 -1.47 0.00 0.00 33.84 32.74 2cv5 n VAL 45 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 2cv5 n HIS 46 N -2.48 -2.60 -0.09 6.34 8.25 0.65 -5.01 115.22 120.28 2cv5 n HIS 46 Ca -0.12 -2.19 0.26 0.00 -0.26 0.00 0.00 57.72 55.41 2cv5 n HIS 46 Cb 0.75 0.99 0.70 0.00 1.12 0.00 0.00 29.99 33.56 2cv5 n HIS 46 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 2cv5 h PRO 47 N 4.63 0.00 0.00 -0.41 0.11 -1.64 0.16 132.00 134.85 2cv5 h PRO 47 Ca 0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.14 2cv5 h PRO 47 Cb 1.01 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.12 2cv5 h PRO 47 CO 0.25 0.00 -0.48 0.38 -0.21 0.00 0.00 178.00 177.94 2cv5 h ASP 48 N 0.00 0.00 -3.06 -2.05 2.03 -1.91 -3.48 116.42 107.95 2cv5 h ASP 48 Ca 0.35 -0.09 -0.58 0.00 -0.73 0.00 0.00 57.03 55.99 2cv5 h ASP 48 Cb 1.69 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 40.15 2cv5 h ASP 48 CO -0.00 0.05 -0.34 -0.89 -1.03 0.00 0.00 179.24 177.02 2cv5 s THR 49 N -3.20 5.20 0.00 1.15 2.01 0.57 -5.12 115.64 116.26 2cv5 s THR 49 Ca 0.06 -0.11 0.00 0.00 0.31 0.00 0.00 61.69 61.95 2cv5 s THR 49 Cb 0.11 -3.65 0.00 0.00 0.01 0.00 0.00 72.50 68.97 2cv5 s THR 49 CO 0.70 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 175.24 2cv5 n GLY 50 N -0.06 6.21 3.32 4.40 0.00 -1.26 -4.82 105.19 112.97 2cv5 n GLY 50 Ca -0.03 -2.02 -0.13 0.00 0.00 0.00 0.00 46.02 43.84 2cv5 n GLY 50 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2cv5 s ILE 51 N -0.00 -0.01 0.94 -0.61 2.07 -1.26 -5.14 121.20 117.19 2cv5 s ILE 51 Ca 0.00 0.02 -0.12 0.00 -1.41 0.00 0.00 60.65 59.14 2cv5 s ILE 51 Cb 0.00 -0.61 0.16 0.00 0.13 0.00 0.00 42.46 42.13 2cv5 s ILE 51 CO 0.00 0.01 1.10 -0.94 -1.91 0.00 0.00 174.94 173.20 2cv5 s SER 52 N 0.49 3.13 0.20 4.50 1.04 -1.26 -4.84 113.70 116.96 2cv5 s SER 52 Ca -0.02 1.25 -0.10 0.00 0.48 0.00 0.00 55.95 57.55 2cv5 s SER 52 Cb -0.04 -1.91 0.14 0.00 0.10 0.00 0.00 66.02 64.31 2cv5 s SER 52 CO -0.02 -2.82 1.81 -1.28 0.98 0.00 0.00 173.24 171.90 2cv5 h SER 53 N -1.68 0.92 -0.19 7.02 0.87 -2.01 -1.92 113.55 116.56 2cv5 h SER 53 Ca -0.52 -0.11 -0.11 0.00 -1.23 0.00 0.00 61.79 59.82 2cv5 h SER 53 Cb 1.31 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 63.04 2cv5 h SER 53 CO 0.58 0.77 -0.32 0.11 -0.53 0.00 0.00 176.83 177.44 2cv5 h LYS 54 N 1.01 0.55 -0.84 2.24 1.57 -1.98 -1.32 116.57 117.79 2cv5 h LYS 54 Ca 0.25 -0.34 0.04 0.00 -1.87 0.00 0.00 60.65 58.74 2cv5 h LYS 54 Cb 0.07 0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.36 2cv5 h LYS 54 CO -0.04 0.94 0.55 0.00 -0.57 0.00 0.00 179.45 180.33 2cv5 h ALA 55 N 0.60 1.50 -0.30 3.86 0.00 -1.91 0.37 119.26 123.38 2cv5 h ALA 55 Ca 0.01 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 2cv5 h ALA 55 Cb 0.90 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2cv5 h ALA 55 CO 0.07 0.41 -0.25 1.98 0.00 0.00 0.00 179.25 181.45 2cv5 h MET 56 N 1.02 0.59 -0.68 0.00 1.85 -1.22 -0.80 114.93 115.69 2cv5 h MET 56 Ca 0.34 -0.23 -0.05 0.00 -0.61 0.00 0.00 59.70 59.15 2cv5 h MET 56 Cb 0.07 -0.03 -0.03 0.00 0.43 0.00 0.00 31.60 32.04 2cv5 h MET 56 CO -0.10 0.79 0.24 0.78 -0.40 0.00 0.00 176.91 178.22 2cv5 h GLY 57 N 1.01 1.09 1.00 1.39 0.00 0.45 -0.44 103.07 107.58 2cv5 h GLY 57 Ca 0.07 -0.60 -0.07 0.00 0.00 0.00 0.00 47.33 46.73 2cv5 h GLY 57 CO 0.05 0.57 0.06 -2.22 0.00 0.00 0.00 176.54 175.00 2cv5 h ILE 58 N 0.99 1.26 -0.68 2.60 2.04 0.32 -2.12 117.51 121.92 2cv5 h ILE 58 Ca 0.22 -1.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.03 2cv5 h ILE 58 Cb 0.24 0.89 -0.03 0.00 -0.74 0.00 0.00 36.82 37.18 2cv5 h ILE 58 CO -0.01 0.36 0.19 0.24 0.00 0.00 0.00 178.15 178.93 2cv5 h MET 59 N 0.75 1.06 0.05 2.37 2.86 -0.57 -0.80 114.93 120.65 2cv5 h MET 59 Ca 0.15 -0.23 0.02 0.00 -2.06 0.00 0.00 59.70 57.59 2cv5 h MET 59 Cb 0.44 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 31.92 2cv5 h MET 59 CO 0.02 0.92 -0.18 -0.97 1.06 0.00 0.00 176.91 177.76 2cv5 h ASN 60 N 1.02 -0.51 -0.13 1.22 -1.24 -0.82 -0.14 115.58 114.98 2cv5 h ASN 60 Ca 0.22 0.07 0.04 0.00 0.71 0.00 0.00 56.30 57.34 2cv5 h ASN 60 Cb 0.32 0.20 -0.04 0.00 0.73 0.00 0.00 38.32 39.53 2cv5 h ASN 60 CO -0.00 -0.25 -0.14 0.28 -1.29 0.00 0.00 177.43 176.03 2cv5 h SER 61 N -0.31 -0.43 -0.48 1.15 0.02 -1.09 -1.74 113.55 110.66 2cv5 h SER 61 Ca 0.04 0.08 0.10 0.00 -0.84 0.00 0.00 61.79 61.17 2cv5 h SER 61 Cb 0.36 0.21 -0.10 0.00 0.14 0.00 0.00 62.40 63.01 2cv5 h SER 61 CO -0.14 -0.18 -0.24 0.15 -1.14 0.00 0.00 176.83 175.28 2cv5 h PHE 62 N -0.16 -0.63 -0.07 3.45 3.57 -0.63 0.16 116.94 122.62 2cv5 h PHE 62 Ca 0.09 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.65 2cv5 h PHE 62 Cb 0.30 0.35 -0.00 0.00 2.79 0.00 0.00 35.95 39.38 2cv5 h PHE 62 CO -0.26 -0.32 0.04 0.28 -2.23 0.00 0.00 178.31 175.82 2cv5 h VAL 63 N -0.14 1.01 -0.89 1.41 2.07 -0.68 -1.47 116.25 117.57 2cv5 h VAL 63 Ca 0.22 -0.03 0.03 0.00 0.82 0.00 0.00 66.70 67.74 2cv5 h VAL 63 Cb 0.49 0.91 -0.05 0.00 -1.52 0.00 0.00 31.29 31.11 2cv5 h VAL 63 CO -0.56 0.02 0.57 0.78 0.02 0.00 0.00 177.57 178.40 2cv5 h ASN 64 N 0.09 0.96 0.39 0.57 2.35 -0.57 -1.04 115.58 118.34 2cv5 h ASN 64 Ca 0.03 -0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.75 2cv5 h ASN 64 Cb -0.01 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.15 2cv5 h ASN 64 CO -0.01 0.66 -0.20 -0.78 -1.65 0.00 0.00 177.43 175.45 2cv5 h ASP 65 N 1.12 -0.47 -0.72 5.81 3.58 -0.34 -1.63 116.42 123.76 2cv5 h ASP 65 Ca 0.35 0.02 -0.03 0.00 0.42 0.00 0.00 57.03 57.80 2cv5 h ASP 65 Cb 0.01 0.13 -0.03 0.00 1.72 0.00 0.00 39.33 41.15 2cv5 h ASP 65 CO -0.12 -0.33 0.35 0.40 -2.88 0.00 0.00 179.24 176.66 2cv5 h ILE 66 N -0.54 1.23 -0.01 2.25 1.08 -1.14 -1.74 117.51 118.65 2cv5 h ILE 66 Ca -0.05 -0.66 0.02 0.00 -0.39 0.00 0.00 64.86 63.78 2cv5 h ILE 66 Cb 0.42 0.29 -0.02 0.00 -3.07 0.00 0.00 36.82 34.44 2cv5 h ILE 66 CO 0.08 0.28 -0.10 0.15 -0.69 0.00 0.00 178.15 177.87 2cv5 h PHE 67 N 1.05 -0.26 -0.80 1.37 3.04 -0.94 -1.97 116.94 118.44 2cv5 h PHE 67 Ca 0.25 0.01 -0.04 0.00 3.98 0.00 0.00 57.97 62.17 2cv5 h PHE 67 Cb 0.11 0.12 -0.04 0.00 2.56 0.00 0.00 35.95 38.70 2cv5 h PHE 67 CO 0.01 -0.15 0.33 1.49 -2.02 0.00 0.00 178.31 177.97 2cv5 h GLU 68 N -0.17 1.18 -0.48 1.11 4.57 -0.98 -0.08 114.58 119.74 2cv5 h GLU 68 Ca 0.04 -0.20 0.03 0.00 -1.18 0.00 0.00 59.36 58.05 2cv5 h GLU 68 Cb 0.22 -0.20 -0.04 0.00 -0.16 0.00 0.00 28.75 28.58 2cv5 h GLU 68 CO -0.11 0.94 0.26 0.00 -1.18 0.00 0.00 179.01 178.93 2cv5 h ARG 69 N 1.16 0.51 -0.01 1.92 3.08 -0.95 0.36 114.38 120.44 2cv5 h ARG 69 Ca 0.27 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.25 2cv5 h ARG 69 Cb 0.19 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.13 2cv5 h ARG 69 CO -0.02 0.34 -0.15 0.82 -1.07 0.00 0.00 179.97 179.88 2cv5 h ILE 70 N 0.53 1.56 -0.73 2.04 2.04 -1.16 -0.80 117.51 120.98 2cv5 h ILE 70 Ca 0.20 -1.85 0.05 0.00 1.00 0.00 0.00 64.86 64.26 2cv5 h ILE 70 Cb 0.06 2.74 -0.05 0.00 -0.74 0.00 0.00 36.82 38.83 2cv5 h ILE 70 CO -0.11 0.50 0.44 0.00 0.00 0.00 0.00 178.15 178.97 2cv5 h ALA 71 N 0.27 0.97 -0.49 1.87 0.00 -0.99 0.42 119.26 121.31 2cv5 h ALA 71 Ca -0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2cv5 h ALA 71 Cb 0.89 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2cv5 h ALA 71 CO 0.03 0.18 0.28 0.78 0.00 0.00 0.00 179.25 180.52 2cv5 h GLY 72 N 0.83 0.72 1.38 0.00 0.00 -0.29 0.89 103.07 106.60 2cv5 h GLY 72 Ca 0.31 -0.31 -0.12 0.00 0.00 0.00 0.00 47.33 47.21 2cv5 h GLY 72 CO -0.15 0.30 -0.30 -2.09 0.00 0.00 0.00 176.54 174.30 2cv5 h GLU 73 N 0.65 0.70 -0.59 4.80 4.57 -0.45 -2.57 114.58 121.68 2cv5 h GLU 73 Ca 0.17 -0.31 -0.06 0.00 -1.18 0.00 0.00 59.36 57.98 2cv5 h GLU 73 Cb 0.01 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.56 2cv5 h GLU 73 CO -0.03 0.91 0.13 0.00 -1.18 0.00 0.00 179.01 178.84 2cv5 h ALA 74 N 1.07 1.12 0.19 2.92 0.00 0.28 -0.58 119.26 124.26 2cv5 h ALA 74 Ca 0.07 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 2cv5 h ALA 74 Cb 0.81 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2cv5 h ALA 74 CO 0.07 0.59 -0.09 1.03 0.00 0.00 0.00 179.25 180.84 2cv5 h SER 75 N 0.88 -0.22 -0.81 0.00 0.87 -0.60 -0.75 113.55 112.93 2cv5 h SER 75 Ca 0.19 -0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.70 2cv5 h SER 75 Cb 0.34 0.06 -0.04 0.00 -0.44 0.00 0.00 62.40 62.32 2cv5 h SER 75 CO 0.00 -0.12 0.40 0.03 -0.53 0.00 0.00 176.83 176.60 2cv5 h ARG 76 N -0.29 1.15 -0.22 2.24 3.08 -1.26 -0.60 114.38 118.50 2cv5 h ARG 76 Ca -0.03 -0.16 0.02 0.00 0.07 0.00 0.00 59.98 59.88 2cv5 h ARG 76 Cb 0.22 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 2cv5 h ARG 76 CO 0.04 0.88 0.07 -0.07 -1.07 0.00 0.00 179.97 179.83 2cv5 h LEU 77 N 1.14 0.09 -0.82 3.04 3.38 -0.90 0.63 115.31 121.87 2cv5 h LEU 77 Ca 0.28 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.21 2cv5 h LEU 77 Cb 0.10 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 2cv5 h LEU 77 CO -0.04 0.08 0.21 0.00 0.09 0.00 0.00 178.44 178.78 2cv5 h ALA 78 N 1.13 1.04 -0.33 1.53 0.00 -0.85 -2.97 119.26 118.81 2cv5 h ALA 78 Ca 0.09 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 2cv5 h ALA 78 Cb 0.06 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2cv5 h ALA 78 CO -0.10 0.64 -0.10 0.45 0.00 0.00 0.00 179.25 180.15 2cv5 h HIS 79 N 1.05 0.74 -0.83 0.00 3.86 -0.66 0.58 115.15 119.88 2cv5 h HIS 79 Ca 0.23 -0.17 0.11 0.00 -1.16 0.00 0.00 60.37 59.38 2cv5 h HIS 79 Cb 0.31 -0.18 -0.06 0.00 1.06 0.00 0.00 27.41 28.54 2cv5 h HIS 79 CO 0.02 0.84 0.54 1.88 0.86 0.00 0.00 177.93 182.07 2cv5 h TYR 80 N 0.43 0.79 -0.46 2.45 0.05 -0.75 0.58 116.97 120.07 2cv5 h TYR 80 Ca 0.08 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.88 2cv5 h TYR 80 Cb 0.61 -0.25 0.00 0.00 1.01 0.00 0.00 36.73 38.10 2cv5 h TYR 80 CO 0.05 0.35 0.00 0.09 -1.05 0.00 0.00 178.16 177.60 2cv5 n ASN 81 N -4.52 3.96 -3.80 3.88 3.02 -1.14 -4.93 115.26 111.74 2cv5 n ASN 81 Ca 0.15 -2.46 -0.29 0.00 -0.03 0.00 0.00 54.58 51.95 2cv5 n ASN 81 Cb 0.38 -0.55 0.03 0.00 -0.61 0.00 0.00 39.78 39.03 2cv5 n ASN 81 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2cv5 n LYS 82 N 0.66 -5.63 -4.23 3.52 5.02 0.20 -4.98 118.16 112.71 2cv5 n LYS 82 Ca 0.20 0.63 -0.35 0.00 -2.02 0.00 0.00 58.31 56.76 2cv5 n LYS 82 Cb 0.79 -5.53 -0.09 0.00 -0.02 0.00 0.00 35.03 30.18 2cv5 n LYS 82 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2cv5 s ARG 83 N -6.50 3.22 0.12 1.97 3.00 0.18 -5.01 118.95 115.92 2cv5 s ARG 83 Ca 0.63 -0.34 0.23 0.00 0.00 0.00 0.00 55.73 56.24 2cv5 s ARG 83 Cb -0.31 -2.93 0.06 0.00 0.00 0.00 0.00 34.95 31.77 2cv5 s ARG 83 CO 0.77 0.66 1.05 -1.13 0.00 0.00 0.00 175.30 176.65 2cv5 n SER 84 N 2.31 0.68 -4.62 0.23 3.41 -1.26 -4.24 113.62 110.13 2cv5 n SER 84 Ca -0.19 0.11 -0.33 0.00 -0.26 0.00 0.00 58.87 58.21 2cv5 n SER 84 Cb 0.54 0.60 -0.10 0.00 -0.26 0.00 0.00 64.21 64.99 2cv5 n SER 84 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2cv5 s THR 85 N -3.29 3.82 -0.33 6.66 -1.32 -1.26 -5.09 115.64 114.84 2cv5 s THR 85 Ca 0.01 -0.64 -0.13 0.00 -1.21 0.00 0.00 61.69 59.72 2cv5 s THR 85 Cb 0.12 -2.65 -0.02 0.00 -1.51 0.00 0.00 72.50 68.44 2cv5 s THR 85 CO 0.79 0.44 0.26 -0.63 -2.21 0.00 0.00 174.62 173.27 2cv5 s ILE 86 N -0.97 5.27 0.37 5.08 1.01 -1.26 -4.94 121.20 125.74 2cv5 s ILE 86 Ca 0.16 -0.06 0.03 0.00 0.00 0.00 0.00 60.65 60.78 2cv5 s ILE 86 Cb -0.11 -3.69 0.03 0.00 0.01 0.00 0.00 42.46 38.69 2cv5 s ILE 86 CO 0.07 0.04 0.23 0.35 0.00 0.00 0.00 174.94 175.62 2cv5 n THR 87 N 5.12 0.00 0.24 2.92 -2.24 -1.26 -4.99 114.28 114.07 2cv5 n THR 87 Ca -0.12 -1.51 0.08 0.00 -2.27 0.00 0.00 64.05 60.23 2cv5 n THR 87 Cb 0.50 -0.08 0.58 0.00 -2.10 0.00 0.00 70.33 69.22 2cv5 n THR 87 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2cv5 h SER 88 N 0.52 0.00 -0.77 3.42 4.64 -1.99 -1.80 113.55 117.56 2cv5 h SER 88 Ca -0.25 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.03 2cv5 h SER 88 Cb 0.86 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.92 2cv5 h SER 88 CO 0.39 0.17 0.32 -0.09 -0.87 0.00 0.00 176.83 176.75 2cv5 h ARG 89 N 0.00 1.15 -0.04 4.77 2.43 -1.99 0.19 114.38 120.90 2cv5 h ARG 89 Ca -0.00 -0.20 -0.16 0.00 -0.81 0.00 0.00 59.98 58.80 2cv5 h ARG 89 Cb 0.33 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 2cv5 h ARG 89 CO 0.02 0.93 -0.70 0.93 -1.51 0.00 0.00 179.97 179.64 2cv5 h GLU 90 N 1.12 0.20 -0.46 0.20 3.07 -1.73 -2.42 114.58 114.56 2cv5 h GLU 90 Ca 0.26 -0.16 -0.14 0.00 -0.50 0.00 0.00 59.36 58.82 2cv5 h GLU 90 Cb 0.20 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.14 2cv5 h GLU 90 CO -0.02 0.82 -0.26 0.82 -1.40 0.00 0.00 179.01 178.96 2cv5 h ILE 91 N 0.13 1.27 0.34 3.13 1.08 -1.01 -1.58 117.51 120.88 2cv5 h ILE 91 Ca -0.02 -1.43 -0.02 0.00 -0.39 0.00 0.00 64.86 63.00 2cv5 h ILE 91 Cb 1.25 1.19 0.00 0.00 -3.07 0.00 0.00 36.82 36.20 2cv5 h ILE 91 CO 0.11 0.49 -0.16 -0.61 -0.69 0.00 0.00 178.15 177.28 2cv5 h GLN 92 N 0.83 -0.44 -0.93 2.37 4.15 -0.89 -0.02 115.11 120.19 2cv5 h GLN 92 Ca 0.10 0.03 0.05 0.00 0.77 0.00 0.00 58.65 59.60 2cv5 h GLN 92 Cb 0.85 0.10 -0.06 0.00 0.21 0.00 0.00 27.48 28.58 2cv5 h GLN 92 CO 0.07 -0.26 0.60 1.15 -1.93 0.00 0.00 178.83 178.47 2cv5 h THR 93 N -0.51 1.11 -0.79 2.39 2.02 -1.42 0.65 112.91 116.37 2cv5 h THR 93 Ca -0.05 -0.38 -0.00 0.00 0.77 0.00 0.00 66.41 66.75 2cv5 h THR 93 Cb 0.38 -0.09 -0.04 0.00 -1.74 0.00 0.00 68.15 66.66 2cv5 h THR 93 CO 0.08 0.20 0.49 0.00 0.37 0.00 0.00 175.52 176.65 2cv5 h ALA 94 N 1.48 1.00 -0.46 6.16 0.00 -0.84 -0.14 119.26 126.46 2cv5 h ALA 94 Ca 0.39 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 55.12 2cv5 h ALA 94 Cb 0.12 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2cv5 h ALA 94 CO -0.14 0.46 -0.11 0.28 0.00 0.00 0.00 179.25 179.75 2cv5 h VAL 95 N 1.08 1.26 -0.61 0.00 2.07 0.39 -0.30 116.25 120.14 2cv5 h VAL 95 Ca 0.28 -1.19 -0.04 0.00 0.82 0.00 0.00 66.70 66.57 2cv5 h VAL 95 Cb -0.06 1.02 -0.03 0.00 -1.52 0.00 0.00 31.29 30.70 2cv5 h VAL 95 CO -0.06 0.41 0.21 0.03 0.02 0.00 0.00 177.57 178.19 2cv5 h ARG 96 N 0.75 0.90 0.02 1.57 -0.00 -0.10 -0.51 114.38 117.01 2cv5 h ARG 96 Ca 0.13 -0.16 -0.21 0.00 -0.50 0.00 0.00 59.98 59.24 2cv5 h ARG 96 Cb 0.61 -0.15 -0.01 0.00 0.00 0.00 0.00 29.97 30.42 2cv5 h ARG 96 CO 0.04 0.76 -0.92 -0.07 0.00 0.00 0.00 179.97 179.78 2cv5 h LEU 97 N 0.88 0.25 0.03 3.04 3.38 -0.57 -3.38 115.31 118.94 2cv5 h LEU 97 Ca 0.20 -0.22 -0.33 0.00 0.09 0.00 0.00 57.88 57.63 2cv5 h LEU 97 Cb 0.22 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 40.84 2cv5 h LEU 97 CO -0.01 1.05 -1.94 0.18 0.09 0.00 0.00 178.44 177.80 2cv5 n LEU 98 N -3.62 1.21 -4.84 1.67 4.77 -0.17 -4.94 117.00 111.08 2cv5 n LEU 98 Ca -0.04 0.26 -0.35 0.00 -0.03 0.00 0.00 56.01 55.86 2cv5 n LEU 98 Cb 0.84 -0.10 -0.06 0.00 -2.33 0.00 0.00 43.42 41.77 2cv5 n LEU 98 CO 0.48 0.54 0.31 -0.76 -1.33 0.00 0.00 177.39 176.63 2cv5 s LEU 99 N -6.20 4.30 0.04 2.23 1.43 -0.22 -5.05 118.68 115.21 2cv5 s LEU 99 Ca -0.11 1.19 -0.23 0.00 -1.03 0.00 0.00 54.13 53.96 2cv5 s LEU 99 Cb 0.07 -3.48 -0.06 0.00 0.03 0.00 0.00 46.19 42.76 2cv5 s LEU 99 CO 0.80 0.04 0.67 -2.16 0.23 0.00 0.00 176.35 175.93 2cv5 s PRO 100 N -2.12 4.40 0.00 1.29 0.04 -1.26 -4.61 135.00 132.74 2cv5 s PRO 100 Ca 0.42 0.90 0.00 0.00 0.04 0.00 0.00 61.00 62.36 2cv5 s PRO 100 Cb -0.15 -3.33 0.00 0.00 0.04 0.00 0.00 34.50 31.06 2cv5 s PRO 100 CO 0.20 0.38 0.00 0.41 0.04 0.00 0.00 177.00 178.03 2cv5 n GLY 101 N 2.27 0.62 0.33 0.56 0.00 -1.26 -1.56 105.19 106.15 2cv5 n GLY 101 Ca -0.05 0.36 -0.05 0.00 0.00 0.00 0.00 46.02 46.27 2cv5 n GLY 101 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2cv5 h GLU 102 N 0.00 1.15 -0.86 1.61 4.57 -2.00 -2.42 114.58 116.64 2cv5 h GLU 102 Ca 0.00 -0.15 0.12 0.00 -1.18 0.00 0.00 59.36 58.14 2cv5 h GLU 102 Cb 0.00 -0.22 -0.06 0.00 -0.16 0.00 0.00 28.75 28.31 2cv5 h GLU 102 CO 0.00 0.87 0.56 1.25 -1.18 0.00 0.00 179.01 180.51 2cv5 h LEU 103 N 1.14 0.69 -0.10 1.64 5.85 -1.66 -0.16 115.31 122.72 2cv5 h LEU 103 Ca 0.28 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 59.00 2cv5 h LEU 103 Cb 0.08 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 40.99 2cv5 h LEU 103 CO -0.04 0.39 -0.06 0.00 -0.34 0.00 0.00 178.44 178.38 2cv5 h ALA 104 N 1.59 0.15 -0.31 1.25 0.00 -1.41 -1.44 119.26 119.09 2cv5 h ALA 104 Ca 0.41 -0.27 0.05 0.00 0.00 0.00 0.00 54.91 55.11 2cv5 h ALA 104 Cb 0.55 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 2cv5 h ALA 104 CO -0.18 -0.06 -0.01 0.87 0.00 0.00 0.00 179.25 179.88 2cv5 h LYS 105 N -0.15 0.08 -0.22 0.00 1.79 -0.85 0.24 116.57 117.46 2cv5 h LYS 105 Ca 0.02 -0.00 -0.11 0.00 -2.18 0.00 0.00 60.65 58.38 2cv5 h LYS 105 Cb 0.54 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.16 2cv5 h LYS 105 CO 0.02 0.05 -0.33 0.45 -1.08 0.00 0.00 179.45 178.56 2cv5 h HIS 106 N 0.08 0.54 -0.25 -1.35 3.86 -1.08 -2.19 115.15 114.76 2cv5 h HIS 106 Ca 0.15 -0.13 -0.13 0.00 -1.16 0.00 0.00 60.37 59.10 2cv5 h HIS 106 Cb 0.20 -0.12 -0.00 0.00 1.06 0.00 0.00 27.41 28.55 2cv5 h HIS 106 CO -0.23 0.75 -0.34 0.00 0.86 0.00 0.00 177.93 178.96 2cv5 h ALA 107 N 1.24 0.37 -0.48 2.45 0.00 -0.75 -1.63 119.26 120.48 2cv5 h ALA 107 Ca 0.05 -0.43 -0.00 0.00 0.00 0.00 0.00 54.91 54.53 2cv5 h ALA 107 Cb 0.78 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2cv5 h ALA 107 CO 0.06 0.43 0.28 0.28 0.00 0.00 0.00 179.25 180.31 2cv5 h VAL 108 N 0.38 1.14 -0.06 0.00 2.07 -0.45 -0.35 116.25 118.99 2cv5 h VAL 108 Ca 0.03 -0.31 -0.05 0.00 0.82 0.00 0.00 66.70 67.19 2cv5 h VAL 108 Cb 0.93 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 2cv5 h VAL 108 CO 0.08 0.15 -0.15 -1.28 0.02 0.00 0.00 177.57 176.39 2cv5 h SER 109 N 0.65 0.23 -0.94 0.57 0.87 -1.24 -2.63 113.55 111.07 2cv5 h SER 109 Ca 0.17 -0.59 0.02 0.00 -1.23 0.00 0.00 61.79 60.16 2cv5 h SER 109 Cb -0.02 -0.07 -0.05 0.00 -0.44 0.00 0.00 62.40 61.83 2cv5 h SER 109 CO -0.03 0.78 0.62 -0.33 -0.53 0.00 0.00 176.83 177.34 2cv5 h GLU 110 N -0.31 1.21 0.61 2.24 4.39 -1.04 0.10 114.58 121.78 2cv5 h GLU 110 Ca -0.00 -0.07 -0.03 0.00 0.34 0.00 0.00 59.36 59.60 2cv5 h GLU 110 Cb 0.75 -0.27 0.01 0.00 -0.10 0.00 0.00 28.75 29.14 2cv5 h GLU 110 CO 0.03 0.80 -0.29 0.78 -1.16 0.00 0.00 179.01 179.17 2cv5 h GLY 111 N 1.24 -0.86 1.04 -3.84 0.00 -1.09 0.16 103.07 99.73 2cv5 h GLY 111 Ca 0.35 0.32 0.10 0.00 0.00 0.00 0.00 47.33 48.10 2cv5 h GLY 111 CO -0.09 -0.31 0.41 -0.91 0.00 0.00 0.00 176.54 175.64 2cv5 h THR 112 N -0.95 0.91 -0.12 4.70 1.35 -1.43 0.88 112.91 118.25 2cv5 h THR 112 Ca -0.08 -0.15 -0.00 0.00 -0.55 0.00 0.00 66.41 65.62 2cv5 h THR 112 Cb 0.63 0.43 -0.01 0.00 -1.73 0.00 0.00 68.15 67.47 2cv5 h THR 112 CO 0.14 0.08 0.06 0.50 -0.25 0.00 0.00 175.52 176.05 2cv5 h LYS 113 N 0.44 0.17 -0.63 4.72 3.64 -0.62 -1.90 116.57 122.38 2cv5 h LYS 113 Ca 0.28 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.59 2cv5 h LYS 113 Cb 0.52 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.28 2cv5 h LYS 113 CO -0.08 0.22 0.21 0.00 -2.27 0.00 0.00 179.45 177.52 2cv5 h ALA 114 N 0.94 1.17 0.05 5.00 0.00 0.16 -2.31 119.26 124.29 2cv5 h ALA 114 Ca 0.04 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 2cv5 h ALA 114 Cb 0.10 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.64 2cv5 h ALA 114 CO -0.01 0.58 -0.02 0.28 0.00 0.00 0.00 179.25 180.08 2cv5 h VAL 115 N 0.92 0.96 0.07 0.00 2.07 -0.80 -0.13 116.25 119.35 2cv5 h VAL 115 Ca 0.21 -0.05 0.02 0.00 0.82 0.00 0.00 66.70 67.71 2cv5 h VAL 115 Cb 0.25 1.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.97 2cv5 h VAL 115 CO -0.01 0.01 -0.37 0.74 0.02 0.00 0.00 177.57 177.97 2cv5 h THR 116 N -0.09 0.24 -0.19 2.57 2.02 -1.17 0.40 112.91 116.69 2cv5 h THR 116 Ca -0.01 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.21 2cv5 h THR 116 Cb 0.07 0.24 -0.04 0.00 -1.74 0.00 0.00 68.15 66.68 2cv5 h THR 116 CO 0.01 0.00 -0.08 0.50 0.37 0.00 0.00 175.52 176.32 2cv5 h LYS 117 N -0.57 -0.05 -0.97 6.66 3.64 -1.30 1.02 116.57 125.01 2cv5 h LYS 117 Ca 0.04 0.00 0.12 0.00 -1.27 0.00 0.00 60.65 59.54 2cv5 h LYS 117 Cb 0.62 0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 32.37 2cv5 h LYS 117 CO -0.24 -0.03 0.60 -0.92 -2.27 0.00 0.00 179.45 176.58 2cv5 h TYR 118 N -0.05 1.08 -0.02 1.91 3.20 -0.41 -1.27 116.97 121.42 2cv5 h TYR 118 Ca 0.10 0.03 -0.24 0.00 3.14 0.00 0.00 58.73 61.76 2cv5 h TYR 118 Cb 0.20 -0.34 0.01 0.00 1.54 0.00 0.00 36.73 38.14 2cv5 h TYR 118 CO -0.23 0.42 -0.96 1.15 -1.64 0.00 0.00 178.16 176.90 2cv5 h THR 119 N 0.94 1.34 0.00 1.81 2.02 0.89 -3.39 112.91 116.53 2cv5 h THR 119 Ca 0.48 -2.32 0.00 0.00 0.77 0.00 0.00 66.41 65.35 2cv5 h THR 119 Cb 0.49 2.35 0.00 0.00 -1.74 0.00 0.00 68.15 69.25 2cv5 h THR 119 CO -0.27 0.70 0.00 -1.20 0.37 0.00 0.00 175.52 175.12 2cv5 n SER 120 N -3.81 0.00 0.00 4.18 7.64 0.34 -5.07 113.62 116.91 2cv5 n SER 120 Ca -0.08 0.00 0.16 0.00 1.01 0.00 0.00 58.87 59.95 2cv5 n SER 120 Cb 0.84 0.00 0.93 0.00 -1.01 0.00 0.00 64.21 64.97 2cv5 n SER 120 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03