#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cv5 n ARG 28 N 0.00 0.00 -2.35 1.97 3.00 -1.26 -5.11 116.66 112.91 2cv5 n ARG 28 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.85 57.84 2cv5 n ARG 28 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 32.46 32.40 2cv5 n ARG 28 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2cv5 n SER 29 N -3.00 -5.28 -4.73 6.15 7.64 -1.26 -5.01 113.62 108.14 2cv5 n SER 29 Ca 0.00 0.02 -0.37 0.00 1.01 0.00 0.00 58.87 59.53 2cv5 n SER 29 Cb 0.03 -3.43 -0.07 0.00 -1.01 0.00 0.00 64.21 59.73 2cv5 n SER 29 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2cv5 s ARG 30 N -2.81 4.26 -0.16 1.43 1.70 -1.26 -5.07 118.95 117.04 2cv5 s ARG 30 Ca 0.02 0.20 -0.01 0.00 -0.47 0.00 0.00 55.73 55.47 2cv5 s ARG 30 Cb -0.01 -3.42 -0.01 0.00 -0.57 0.00 0.00 34.95 30.94 2cv5 s ARG 30 CO 0.42 0.24 -0.11 -1.59 -1.08 0.00 0.00 175.30 173.18 2cv5 s LYS 31 N 0.45 3.35 0.67 3.89 -2.85 -1.26 -5.11 119.74 118.88 2cv5 s LYS 31 Ca 0.19 -0.68 -0.13 0.00 -1.00 0.00 0.00 55.97 54.36 2cv5 s LYS 31 Cb -0.14 -2.75 0.00 0.00 -2.06 0.00 0.00 37.83 32.89 2cv5 s LYS 31 CO 0.06 0.05 1.07 -1.21 0.10 0.00 0.00 175.35 175.42 2cv5 s GLU 32 N 0.78 2.92 0.28 1.78 2.02 -1.26 -5.07 118.70 120.14 2cv5 s GLU 32 Ca -0.04 1.12 -0.20 0.00 0.02 0.00 0.00 54.97 55.86 2cv5 s GLU 32 Cb -0.15 -1.98 0.02 0.00 0.10 0.00 0.00 34.13 32.12 2cv5 s GLU 32 CO 0.01 -1.12 0.69 0.45 0.02 0.00 0.00 175.26 175.31 2cv5 s SER 33 N -3.28 -0.23 0.00 -0.19 0.15 -1.26 -5.03 113.70 103.85 2cv5 s SER 33 Ca 0.61 -0.66 0.26 0.00 0.70 0.00 0.00 55.95 56.86 2cv5 s SER 33 Cb -0.16 0.72 0.55 0.00 -1.71 0.00 0.00 66.02 65.42 2cv5 s SER 33 CO 0.48 -1.34 1.45 -1.22 1.20 0.00 0.00 173.24 173.82 2cv5 n TYR 34 N -0.45 0.00 -0.30 3.44 4.01 -1.26 -4.64 117.16 117.95 2cv5 n TYR 34 Ca -0.04 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.83 2cv5 n TYR 34 Cb 0.59 -0.02 0.28 0.00 -0.31 0.00 0.00 39.34 39.88 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 3.00 -0.20 -0.16 7.72 0.02 -1.96 -0.68 113.55 121.29 2cv5 h SER 35 Ca 0.00 0.22 -0.15 0.00 -0.84 0.00 0.00 61.79 61.02 2cv5 h SER 35 Cb 0.71 0.35 -0.01 0.00 0.14 0.00 0.00 62.40 63.59 2cv5 h SER 35 CO 0.00 -0.23 -0.43 -0.37 -1.14 0.00 0.00 176.83 174.66 2cv5 h VAL 36 N 0.12 1.29 -0.42 2.27 -1.51 -2.00 -1.94 116.25 114.07 2cv5 h VAL 36 Ca 0.55 -1.62 -0.13 0.00 -1.23 0.00 0.00 66.70 64.27 2cv5 h VAL 36 Cb 1.12 1.53 -0.01 0.00 -2.13 0.00 0.00 31.29 31.80 2cv5 h VAL 36 CO -0.74 0.52 -0.27 1.88 -1.23 0.00 0.00 177.57 177.73 2cv5 h TYR 37 N 0.57 1.03 -0.45 5.19 0.05 -1.65 -1.39 116.97 120.33 2cv5 h TYR 37 Ca 0.04 -0.26 -0.08 0.00 0.05 0.00 0.00 58.73 58.48 2cv5 h TYR 37 Cb 0.98 -0.24 -0.02 0.00 1.01 0.00 0.00 36.73 38.46 2cv5 h TYR 37 CO 0.05 1.05 -0.03 0.28 -1.05 0.00 0.00 178.16 178.46 2cv5 h VAL 38 N 0.76 1.24 -0.43 -2.88 2.07 -1.08 -2.24 116.25 113.69 2cv5 h VAL 38 Ca 0.09 -1.03 -0.14 0.00 0.82 0.00 0.00 66.70 66.44 2cv5 h VAL 38 Cb 0.83 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 2cv5 h VAL 38 CO 0.07 0.36 -0.28 0.22 0.02 0.00 0.00 177.57 177.96 2cv5 h TYR 39 N 0.70 1.11 -0.80 1.57 3.20 -1.06 -0.88 116.97 120.81 2cv5 h TYR 39 Ca 0.13 -0.30 -0.05 0.00 3.14 0.00 0.00 58.73 61.66 2cv5 h TYR 39 Cb 0.48 -0.25 -0.04 0.00 1.54 0.00 0.00 36.73 38.47 2cv5 h TYR 39 CO 0.02 1.12 0.32 0.87 -1.64 0.00 0.00 178.16 178.85 2cv5 h LYS 40 N 0.79 1.19 -0.23 1.82 1.57 -1.08 -1.29 116.57 119.33 2cv5 h LYS 40 Ca 0.09 -0.22 -0.15 0.00 -1.87 0.00 0.00 60.65 58.50 2cv5 h LYS 40 Cb 0.87 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.97 2cv5 h LYS 40 CO 0.08 0.96 -0.46 0.28 -0.57 0.00 0.00 179.45 179.74 2cv5 h VAL 41 N 1.16 1.30 -0.56 0.50 2.07 -1.27 -2.56 116.25 116.89 2cv5 h VAL 41 Ca 0.27 -1.66 -0.04 0.00 0.82 0.00 0.00 66.70 66.09 2cv5 h VAL 41 Cb 0.21 1.62 -0.02 0.00 -1.52 0.00 0.00 31.29 31.58 2cv5 h VAL 41 CO -0.02 0.52 0.21 0.25 0.02 0.00 0.00 177.57 178.55 2cv5 h LEU 42 N 0.48 0.79 -1.52 2.57 5.85 -0.81 -2.39 115.31 120.28 2cv5 h LEU 42 Ca 0.03 -0.18 -0.04 0.00 0.84 0.00 0.00 57.88 58.53 2cv5 h LEU 42 Cb 0.99 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.80 2cv5 h LEU 42 CO 0.09 0.76 -0.07 0.11 -0.34 0.00 0.00 178.44 178.99 2cv5 h LYS 43 N 0.78 0.22 0.20 1.25 1.79 -1.11 0.22 116.57 119.92 2cv5 h LYS 43 Ca 0.19 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.61 2cv5 h LYS 43 Cb 0.22 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 30.84 2cv5 h LYS 43 CO -0.01 0.31 -0.10 1.96 -1.08 0.00 0.00 179.45 180.53 2cv5 h GLN 44 N 0.21 -0.26 0.00 3.15 4.20 -1.04 -2.55 115.11 118.82 2cv5 h GLN 44 Ca 0.05 0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.75 2cv5 h GLN 44 Cb 0.27 0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.11 2cv5 h GLN 44 CO 0.01 0.06 -0.14 -0.39 -0.67 0.00 0.00 178.83 177.71 2cv5 h VAL 45 N -0.60 0.25 -1.68 -0.54 -1.51 -1.29 -3.40 116.25 107.49 2cv5 h VAL 45 Ca -0.03 -1.27 -0.32 0.00 -1.23 0.00 0.00 66.70 63.85 2cv5 h VAL 45 Cb 0.44 2.05 -0.27 0.00 -2.13 0.00 0.00 31.29 31.37 2cv5 h VAL 45 CO 0.04 0.14 -0.67 -1.00 -1.23 0.00 0.00 177.57 174.85 2cv5 s HIS 46 N -3.22 -0.52 0.55 5.19 3.76 0.75 -5.01 115.29 116.80 2cv5 s HIS 46 Ca 0.05 -0.95 0.27 0.00 -0.15 0.00 0.00 55.06 54.28 2cv5 s HIS 46 Cb 0.06 -0.24 1.46 0.00 1.11 0.00 0.00 32.58 34.97 2cv5 s HIS 46 CO 0.68 -1.04 1.99 -1.35 -0.85 0.00 0.00 174.74 174.16 2cv5 h PRO 47 N 6.22 0.00 -0.01 8.40 0.11 -1.63 -2.42 132.00 142.66 2cv5 h PRO 47 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 2cv5 h PRO 47 Cb 1.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2cv5 h PRO 47 CO 0.17 0.00 -0.22 -0.40 -0.21 0.00 0.00 178.00 177.34 2cv5 n ASP 48 N -4.16 1.47 -4.89 -2.05 5.75 -1.26 -4.96 116.55 106.46 2cv5 n ASP 48 Ca 0.08 -1.23 -0.34 0.00 -0.01 0.00 0.00 54.79 53.30 2cv5 n ASP 48 Cb 0.58 0.16 -0.05 0.00 -1.03 0.00 0.00 41.12 40.78 2cv5 n ASP 48 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2cv5 s THR 49 N -2.35 5.35 0.27 2.12 2.01 -0.91 -5.11 115.64 117.02 2cv5 s THR 49 Ca 0.26 -0.15 0.01 0.00 0.31 0.00 0.00 61.69 62.12 2cv5 s THR 49 Cb 0.19 -3.47 0.01 0.00 0.01 0.00 0.00 72.50 69.24 2cv5 s THR 49 CO 0.47 0.36 0.07 0.61 -0.69 0.00 0.00 174.62 175.44 2cv5 n GLY 50 N 1.09 3.55 3.13 4.40 0.00 -1.26 -4.80 105.19 111.31 2cv5 n GLY 50 Ca -0.12 -2.28 -0.12 0.00 0.00 0.00 0.00 46.02 43.50 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 -1.77 -0.03 0.43 -0.61 2.07 -1.26 -5.14 121.20 114.88 2cv5 s ILE 51 Ca 0.05 0.10 -0.25 0.00 -1.41 0.00 0.00 60.65 59.15 2cv5 s ILE 51 Cb -0.00 -0.44 -0.08 0.00 0.13 0.00 0.00 42.46 42.06 2cv5 s ILE 51 CO 0.03 0.04 1.22 -0.94 -1.91 0.00 0.00 174.94 173.39 2cv5 s SER 52 N 1.05 6.27 0.43 4.50 1.04 -1.26 -4.82 113.70 120.92 2cv5 s SER 52 Ca -0.07 2.45 0.15 0.00 0.48 0.00 0.00 55.95 58.96 2cv5 s SER 52 Cb -0.08 -2.62 1.05 0.00 0.10 0.00 0.00 66.02 64.47 2cv5 s SER 52 CO -0.08 -0.86 1.95 0.77 0.98 0.00 0.00 173.24 176.01 2cv5 h SER 53 N 2.41 0.36 -0.61 7.02 4.64 -2.01 0.22 113.55 125.58 2cv5 h SER 53 Ca -0.49 0.01 -0.09 0.00 -0.47 0.00 0.00 61.79 60.76 2cv5 h SER 53 Cb 1.25 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 63.25 2cv5 h SER 53 CO 0.61 0.20 0.05 0.11 -0.87 0.00 0.00 176.83 176.94 2cv5 h LYS 54 N 0.40 1.05 -0.65 4.77 1.57 -1.99 0.43 116.57 122.15 2cv5 h LYS 54 Ca 0.32 -0.30 -0.04 0.00 -1.87 0.00 0.00 60.65 58.76 2cv5 h LYS 54 Cb 0.69 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.86 2cv5 h LYS 54 CO -0.09 1.00 0.25 0.00 -0.57 0.00 0.00 179.45 180.03 2cv5 h ALA 55 N 1.07 1.22 -0.09 3.86 0.00 -1.03 -0.14 119.26 124.14 2cv5 h ALA 55 Ca 0.18 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 2cv5 h ALA 55 Cb 0.49 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2cv5 h ALA 55 CO 0.02 0.57 -0.17 1.98 0.00 0.00 0.00 179.25 181.64 2cv5 h MET 56 N 0.94 0.15 -0.52 0.00 1.85 0.04 -1.83 114.93 115.55 2cv5 h MET 56 Ca 0.22 -0.04 -0.10 0.00 -0.61 0.00 0.00 59.70 59.17 2cv5 h MET 56 Cb 0.20 -0.02 -0.02 0.00 0.43 0.00 0.00 31.60 32.19 2cv5 h MET 56 CO -0.02 0.33 -0.07 0.78 -0.40 0.00 0.00 176.91 177.53 2cv5 h GLY 57 N 0.73 1.02 0.87 1.39 0.00 0.87 0.49 103.07 108.44 2cv5 h GLY 57 Ca 0.03 -0.78 -0.02 0.00 0.00 0.00 0.00 47.33 46.55 2cv5 h GLY 57 CO 0.03 0.72 0.05 -2.22 0.00 0.00 0.00 176.54 175.12 2cv5 h ILE 58 N 0.86 1.21 -0.59 2.60 5.03 -0.66 -1.75 117.51 124.21 2cv5 h ILE 58 Ca 0.14 -0.70 0.03 0.00 -0.12 0.00 0.00 64.86 64.21 2cv5 h ILE 58 Cb 0.61 1.23 -0.04 0.00 -3.03 0.00 0.00 36.82 35.58 2cv5 h ILE 58 CO 0.04 0.22 0.34 0.24 -0.68 0.00 0.00 178.15 178.32 2cv5 h MET 59 N 0.20 0.65 -0.71 2.37 2.86 -0.96 0.68 114.93 120.02 2cv5 h MET 59 Ca 0.07 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.62 2cv5 h MET 59 Cb 0.29 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 31.77 2cv5 h MET 59 CO 0.00 0.43 0.21 -0.91 1.06 0.00 0.00 176.91 177.70 2cv5 h ASN 60 N 0.67 1.03 -0.80 1.22 4.21 -0.82 -0.92 115.58 120.16 2cv5 h ASN 60 Ca 0.24 -0.19 -0.03 0.00 1.21 0.00 0.00 56.30 57.53 2cv5 h ASN 60 Cb 0.07 -0.27 -0.04 0.00 -1.12 0.00 0.00 38.32 36.96 2cv5 h ASN 60 CO -0.12 0.96 0.37 0.28 -1.29 0.00 0.00 177.43 177.63 2cv5 h SER 61 N 1.06 1.07 -0.33 5.81 0.02 -0.48 -2.37 113.55 118.33 2cv5 h SER 61 Ca 0.23 -0.15 -0.02 0.00 -0.84 0.00 0.00 61.79 61.02 2cv5 h SER 61 Cb 0.31 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 2cv5 h SER 61 CO -0.01 0.92 0.14 0.15 -1.14 0.00 0.00 176.83 176.89 2cv5 h PHE 62 N 1.14 0.49 -0.69 3.45 3.57 -0.39 -0.57 116.94 123.94 2cv5 h PHE 62 Ca 0.27 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.73 2cv5 h PHE 62 Cb 0.15 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 2cv5 h PHE 62 CO 0.01 0.46 0.38 0.28 -2.23 0.00 0.00 178.31 177.21 2cv5 h VAL 63 N 0.38 1.21 -0.31 1.41 2.07 -1.02 -2.24 116.25 117.76 2cv5 h VAL 63 Ca 0.11 -0.54 -0.14 0.00 0.82 0.00 0.00 66.70 66.95 2cv5 h VAL 63 Cb 0.17 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 2cv5 h VAL 63 CO -0.01 0.24 -0.37 0.78 0.02 0.00 0.00 177.57 178.23 2cv5 h ASN 64 N 0.95 0.75 0.74 0.57 2.35 -1.31 -1.63 115.58 118.01 2cv5 h ASN 64 Ca 0.24 -0.33 -0.03 0.00 -0.55 0.00 0.00 56.30 55.63 2cv5 h ASN 64 Cb 0.04 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.20 2cv5 h ASN 64 CO -0.04 1.05 -0.38 -0.78 -1.65 0.00 0.00 177.43 175.62 2cv5 h ASP 65 N 0.59 -0.93 -0.66 5.81 3.58 -0.81 -2.01 116.42 121.99 2cv5 h ASP 65 Ca 0.06 0.04 0.06 0.00 0.42 0.00 0.00 57.03 57.60 2cv5 h ASP 65 Cb 0.90 0.25 -0.05 0.00 1.72 0.00 0.00 39.33 42.15 2cv5 h ASP 65 CO 0.08 -0.63 0.37 0.40 -2.88 0.00 0.00 179.24 176.58 2cv5 h ILE 66 N -1.03 0.97 -0.09 2.25 1.08 -1.45 -0.19 117.51 119.05 2cv5 h ILE 66 Ca -0.10 -0.24 0.04 0.00 -0.39 0.00 0.00 64.86 64.17 2cv5 h ILE 66 Cb 0.81 0.23 -0.06 0.00 -3.07 0.00 0.00 36.82 34.72 2cv5 h ILE 66 CO 0.15 0.13 -0.44 0.15 -0.69 0.00 0.00 178.15 177.44 2cv5 h PHE 67 N 0.69 -1.27 -0.77 1.37 3.57 -1.17 0.21 116.94 119.57 2cv5 h PHE 67 Ca 0.30 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.85 2cv5 h PHE 67 Cb 0.17 0.57 -0.04 0.00 2.79 0.00 0.00 35.95 39.45 2cv5 h PHE 67 CO -0.08 -0.50 0.50 1.49 -2.23 0.00 0.00 178.31 177.49 2cv5 h GLU 68 N -0.53 1.02 -0.67 1.11 4.22 -0.80 0.17 114.58 119.10 2cv5 h GLU 68 Ca 0.06 -0.07 -0.01 0.00 0.08 0.00 0.00 59.36 59.43 2cv5 h GLU 68 Cb 0.65 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.64 2cv5 h GLU 68 CO -0.38 0.69 0.40 0.00 -2.18 0.00 0.00 179.01 177.53 2cv5 h ARG 69 N 1.04 0.91 0.23 1.92 3.08 -0.48 0.98 114.38 122.06 2cv5 h ARG 69 Ca 0.28 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.23 2cv5 h ARG 69 Cb -0.10 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 29.76 2cv5 h ARG 69 CO -0.06 0.66 -0.11 0.82 -1.07 0.00 0.00 179.97 180.21 2cv5 h ILE 70 N 0.91 0.67 -0.82 2.04 2.04 -0.20 -2.45 117.51 119.70 2cv5 h ILE 70 Ca 0.24 -0.94 0.12 0.00 1.00 0.00 0.00 64.86 65.28 2cv5 h ILE 70 Cb -0.01 1.10 -0.06 0.00 -0.74 0.00 0.00 36.82 37.11 2cv5 h ILE 70 CO -0.04 0.16 0.53 0.00 0.00 0.00 0.00 178.15 178.80 2cv5 h ALA 71 N -0.43 1.85 0.05 1.87 0.00 -0.68 -0.21 119.26 121.72 2cv5 h ALA 71 Ca -0.03 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2cv5 h ALA 71 Cb 0.51 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2cv5 h ALA 71 CO 0.05 -0.05 -0.03 0.78 0.00 0.00 0.00 179.25 180.00 2cv5 h GLY 72 N 0.65 -0.07 1.11 0.00 0.00 -0.81 0.22 103.07 104.17 2cv5 h GLY 72 Ca 0.40 0.03 -0.05 0.00 0.00 0.00 0.00 47.33 47.71 2cv5 h GLY 72 CO -0.16 -0.03 0.29 -2.09 0.00 0.00 0.00 176.54 174.55 2cv5 h GLU 73 N -0.17 1.13 -0.66 4.80 4.57 -0.86 -1.99 114.58 121.41 2cv5 h GLU 73 Ca -0.01 -0.21 -0.03 0.00 -1.18 0.00 0.00 59.36 57.93 2cv5 h GLU 73 Cb 0.15 -0.18 -0.03 0.00 -0.16 0.00 0.00 28.75 28.53 2cv5 h GLU 73 CO 0.01 0.93 0.28 0.00 -1.18 0.00 0.00 179.01 179.05 2cv5 h ALA 74 N 1.21 0.85 -0.50 2.92 0.00 -0.80 -0.49 119.26 122.44 2cv5 h ALA 74 Ca 0.25 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 55.02 2cv5 h ALA 74 Cb 0.23 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 2cv5 h ALA 74 CO -0.02 0.45 0.30 1.03 0.00 0.00 0.00 179.25 181.01 2cv5 h SER 75 N 0.92 0.48 -0.27 0.00 0.87 -0.09 -1.92 113.55 113.55 2cv5 h SER 75 Ca 0.22 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.76 2cv5 h SER 75 Cb 0.17 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.03 2cv5 h SER 75 CO -0.02 0.34 0.06 0.03 -0.53 0.00 0.00 176.83 176.71 2cv5 h ARG 76 N 0.60 0.43 -0.29 2.24 3.08 -0.97 -2.14 114.38 117.33 2cv5 h ARG 76 Ca 0.20 -0.11 0.05 0.00 0.07 0.00 0.00 59.98 60.20 2cv5 h ARG 76 Cb 0.02 -0.05 -0.08 0.00 0.08 0.00 0.00 29.97 29.94 2cv5 h ARG 76 CO -0.09 0.53 -0.46 -0.07 -1.07 0.00 0.00 179.97 178.80 2cv5 h LEU 77 N 0.26 -1.51 -1.68 3.04 -0.00 -0.78 0.61 115.31 115.25 2cv5 h LEU 77 Ca 0.08 0.21 0.04 0.00 -0.00 0.00 0.00 57.88 58.21 2cv5 h LEU 77 Cb 0.30 0.63 -0.02 0.00 -0.00 0.00 0.00 40.66 41.56 2cv5 h LEU 77 CO 0.00 -0.41 0.28 0.00 -0.00 0.00 0.00 178.44 178.31 2cv5 h ALA 78 N 0.15 1.86 -0.02 1.53 0.00 -1.34 -1.28 119.26 120.18 2cv5 h ALA 78 Ca 0.09 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2cv5 h ALA 78 Cb 0.62 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2cv5 h ALA 78 CO -0.51 0.08 -0.03 1.25 0.00 0.00 0.00 179.25 180.04 2cv5 h HIS 79 N 0.42 0.06 -0.57 0.00 -0.00 -0.00 0.24 115.15 115.30 2cv5 h HIS 79 Ca 0.17 -0.02 0.08 0.00 -0.00 0.00 0.00 60.37 60.60 2cv5 h HIS 79 Cb 0.16 -0.01 -0.03 0.00 -0.00 0.00 0.00 27.41 27.53 2cv5 h HIS 79 CO -0.00 0.60 0.38 1.88 -0.00 0.00 0.00 177.93 180.80 2cv5 h TYR 80 N -0.50 0.47 -0.43 5.26 0.05 0.60 -0.71 116.97 121.71 2cv5 h TYR 80 Ca 0.00 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.79 2cv5 h TYR 80 Cb 0.60 -0.16 0.00 0.00 1.01 0.00 0.00 36.73 38.19 2cv5 h TYR 80 CO 0.12 0.24 0.00 0.09 -1.05 0.00 0.00 178.16 177.56 2cv5 n ASN 81 N -4.47 2.97 -3.55 3.88 3.02 -0.53 -4.93 115.26 111.64 2cv5 n ASN 81 Ca 0.09 -2.20 -0.25 0.00 -0.03 0.00 0.00 54.58 52.19 2cv5 n ASN 81 Cb 0.30 -0.41 0.06 0.00 -0.61 0.00 0.00 39.78 39.12 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 0.69 -6.62 -5.04 3.52 4.76 -0.27 -4.99 118.16 110.21 2cv5 n LYS 82 Ca 0.16 0.78 -0.32 0.00 -2.87 0.00 0.00 58.31 56.06 2cv5 n LYS 82 Cb 0.54 -5.75 -0.14 0.00 -1.84 0.00 0.00 35.03 27.84 2cv5 n LYS 82 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2cv5 s ARG 83 N -6.25 2.22 0.00 1.97 0.52 0.80 -5.01 118.95 113.20 2cv5 s ARG 83 Ca 0.54 -0.87 0.27 0.00 -0.52 0.00 0.00 55.73 55.16 2cv5 s ARG 83 Cb -0.25 -2.18 0.90 0.00 0.52 0.00 0.00 34.95 33.94 2cv5 s ARG 83 CO 0.67 0.58 1.65 -1.13 0.02 0.00 0.00 175.30 177.09 2cv5 n SER 84 N 2.23 1.32 -4.07 0.23 3.41 -1.26 -4.29 113.62 111.19 2cv5 n SER 84 Ca -0.17 -1.24 -0.27 0.00 -0.26 0.00 0.00 58.87 56.94 2cv5 n SER 84 Cb 0.52 0.06 -0.17 0.00 -0.26 0.00 0.00 64.21 64.36 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 -2.23 1.39 -0.15 6.66 -1.32 -1.26 -5.10 115.64 113.63 2cv5 s THR 85 Ca 0.32 -0.62 -0.24 0.00 -1.21 0.00 0.00 61.69 59.93 2cv5 s THR 85 Cb 0.20 -1.25 -0.02 0.00 -1.51 0.00 0.00 72.50 69.92 2cv5 s THR 85 CO 0.42 0.41 0.78 -0.63 -2.21 0.00 0.00 174.62 173.39 2cv5 s ILE 86 N 0.65 4.93 0.50 5.08 1.01 -1.26 -4.93 121.20 127.18 2cv5 s ILE 86 Ca -0.14 1.54 0.03 0.00 0.00 0.00 0.00 60.65 62.08 2cv5 s ILE 86 Cb -0.16 -4.10 -0.01 0.00 0.01 0.00 0.00 42.46 38.20 2cv5 s ILE 86 CO 0.04 0.08 0.08 0.42 0.00 0.00 0.00 174.94 175.57 2cv5 s THR 87 N 1.85 1.39 0.65 2.92 -4.23 -1.26 -4.98 115.64 111.97 2cv5 s THR 87 Ca 0.37 -1.89 0.40 0.00 -1.18 0.00 0.00 61.69 59.39 2cv5 s THR 87 Cb -0.17 -2.28 0.42 0.00 1.34 0.00 0.00 72.50 71.81 2cv5 s THR 87 CO 0.13 0.00 2.32 0.77 -0.54 0.00 0.00 174.62 177.31 2cv5 h SER 88 N 1.29 0.00 -0.21 3.99 4.64 -1.99 -0.21 113.55 121.06 2cv5 h SER 88 Ca -0.43 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 60.73 2cv5 h SER 88 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 2cv5 h SER 88 CO 0.72 0.00 -0.50 -0.09 -0.87 0.00 0.00 176.83 176.08 2cv5 h ARG 89 N 0.00 0.71 -0.61 4.77 2.43 -1.99 -1.38 114.38 118.31 2cv5 h ARG 89 Ca 0.00 -0.48 -0.05 0.00 -0.81 0.00 0.00 59.98 58.64 2cv5 h ARG 89 Cb 0.03 0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.63 2cv5 h ARG 89 CO -0.00 1.11 0.18 0.93 -1.51 0.00 0.00 179.97 180.68 2cv5 h GLU 90 N 0.42 0.95 -0.63 0.20 3.07 -1.44 -2.12 114.58 115.03 2cv5 h GLU 90 Ca -0.00 -0.21 0.02 0.00 -0.50 0.00 0.00 59.36 58.67 2cv5 h GLU 90 Cb 1.12 -0.14 -0.04 0.00 -0.84 0.00 0.00 28.75 28.85 2cv5 h GLU 90 CO 0.11 0.85 0.40 0.82 -1.40 0.00 0.00 179.01 179.79 2cv5 h ILE 91 N 0.87 1.11 0.15 3.13 1.08 -1.29 -1.73 117.51 120.83 2cv5 h ILE 91 Ca 0.20 -0.28 -0.00 0.00 -0.39 0.00 0.00 64.86 64.39 2cv5 h ILE 91 Cb 0.30 0.24 -0.01 0.00 -3.07 0.00 0.00 36.82 34.28 2cv5 h ILE 91 CO -0.00 0.15 -0.10 -0.61 -0.69 0.00 0.00 178.15 176.89 2cv5 h GLN 92 N 0.80 -0.24 -0.21 2.37 4.15 -0.86 -0.06 115.11 121.05 2cv5 h GLN 92 Ca 0.25 0.02 -0.07 0.00 0.77 0.00 0.00 58.65 59.62 2cv5 h GLN 92 Cb -0.02 0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.71 2cv5 h GLN 92 CO -0.08 -0.16 -0.16 1.79 -1.93 0.00 0.00 178.83 178.28 2cv5 h THR 93 N -0.25 1.22 -0.77 2.39 1.35 -1.29 -0.89 112.91 114.66 2cv5 h THR 93 Ca -0.01 -0.99 -0.01 0.00 -0.55 0.00 0.00 66.41 64.85 2cv5 h THR 93 Cb 0.22 1.25 -0.04 0.00 -1.73 0.00 0.00 68.15 67.85 2cv5 h THR 93 CO 0.00 0.31 0.45 0.00 -0.25 0.00 0.00 175.52 176.03 2cv5 h ALA 94 N 1.51 0.99 -0.85 6.62 0.00 -0.93 0.30 119.26 126.90 2cv5 h ALA 94 Ca 0.06 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2cv5 h ALA 94 Cb 0.49 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 2cv5 h ALA 94 CO 0.03 0.48 0.44 0.28 0.00 0.00 0.00 179.25 180.48 2cv5 h VAL 95 N 1.06 1.25 0.00 0.00 2.07 0.06 0.13 116.25 120.82 2cv5 h VAL 95 Ca 0.27 -0.66 -0.07 0.00 0.82 0.00 0.00 66.70 67.06 2cv5 h VAL 95 Cb -0.00 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 29.89 2cv5 h VAL 95 CO -0.05 0.29 -0.35 0.03 0.02 0.00 0.00 177.57 177.51 2cv5 h ARG 96 N 1.19 0.00 0.21 1.57 3.08 -0.35 -1.90 114.38 118.18 2cv5 h ARG 96 Ca 0.30 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 60.05 2cv5 h ARG 96 Cb 0.06 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.14 2cv5 h ARG 96 CO -0.04 0.35 -1.35 -0.07 -1.07 0.00 0.00 179.97 177.79 2cv5 h LEU 97 N 0.00 0.71 0.15 3.04 3.38 -0.15 -3.39 115.31 119.05 2cv5 h LEU 97 Ca -0.00 -0.93 -0.31 0.00 0.09 0.00 0.00 57.88 56.73 2cv5 h LEU 97 Cb 0.78 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.30 2cv5 h LEU 97 CO 0.05 1.64 -1.50 -0.07 0.09 0.00 0.00 178.44 178.65 2cv5 h LEU 98 N -0.01 0.49 -9.67 1.67 -0.00 -0.78 -3.47 115.31 103.54 2cv5 h LEU 98 Ca -0.24 -0.62 -0.59 0.00 -0.00 0.00 0.00 57.88 56.42 2cv5 h LEU 98 Cb 2.02 -0.16 -0.05 0.00 -0.00 0.00 0.00 40.66 42.47 2cv5 h LEU 98 CO 0.22 1.51 -0.12 -0.76 -0.00 0.00 0.00 178.44 179.29 2cv5 s LEU 99 N -7.13 4.49 0.36 1.67 1.43 -0.72 -5.06 118.68 113.71 2cv5 s LEU 99 Ca -0.09 1.09 -0.26 0.00 -1.03 0.00 0.00 54.13 53.84 2cv5 s LEU 99 Cb 0.06 -2.73 -0.09 0.00 0.03 0.00 0.00 46.19 43.46 2cv5 s LEU 99 CO 0.87 0.29 1.10 -2.16 0.23 0.00 0.00 176.35 176.68 2cv5 s PRO 100 N -1.00 4.30 0.00 1.29 0.04 -1.26 -4.54 135.00 133.83 2cv5 s PRO 100 Ca 0.26 1.70 0.00 0.00 0.04 0.00 0.00 61.00 63.01 2cv5 s PRO 100 Cb -0.18 -2.80 0.00 0.00 0.04 0.00 0.00 34.50 31.56 2cv5 s PRO 100 CO 0.16 -0.07 0.00 0.41 0.04 0.00 0.00 177.00 177.54 2cv5 n GLY 101 N 0.71 0.00 0.36 0.56 0.00 -1.26 -1.74 105.19 103.82 2cv5 n GLY 101 Ca 0.03 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.07 2cv5 n GLY 101 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2cv5 h GLU 102 N 0.00 1.06 -0.80 1.61 4.39 -2.01 -1.16 114.58 117.66 2cv5 h GLU 102 Ca 0.00 -0.06 0.10 0.00 0.34 0.00 0.00 59.36 59.74 2cv5 h GLU 102 Cb 0.00 -0.24 -0.06 0.00 -0.10 0.00 0.00 28.75 28.36 2cv5 h GLU 102 CO 0.00 0.70 0.52 1.25 -1.16 0.00 0.00 179.01 180.32 2cv5 h LEU 103 N 1.09 0.65 0.29 1.33 5.85 -1.70 -1.94 115.31 120.87 2cv5 h LEU 103 Ca 0.36 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 59.08 2cv5 h LEU 103 Cb 0.06 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 40.97 2cv5 h LEU 103 CO -0.11 0.38 -0.14 0.00 -0.34 0.00 0.00 178.44 178.23 2cv5 h ALA 104 N 1.60 -0.39 -0.69 1.25 0.00 -0.92 -2.00 119.26 118.11 2cv5 h ALA 104 Ca 0.37 -0.19 0.14 0.00 0.00 0.00 0.00 54.91 55.23 2cv5 h ALA 104 Cb 0.48 0.15 -0.10 0.00 0.00 0.00 0.00 17.79 18.32 2cv5 h ALA 104 CO -0.15 -0.48 0.14 0.87 0.00 0.00 0.00 179.25 179.63 2cv5 h LYS 105 N -0.85 0.24 0.24 0.00 1.57 -1.24 0.16 116.57 116.69 2cv5 h LYS 105 Ca -0.04 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2cv5 h LYS 105 Cb 0.52 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.75 2cv5 h LYS 105 CO 0.06 0.16 -0.25 0.45 -0.57 0.00 0.00 179.45 179.30 2cv5 h HIS 106 N 0.25 -0.67 -0.96 -1.35 3.86 -1.37 -0.27 115.15 114.64 2cv5 h HIS 106 Ca 0.38 0.01 0.08 0.00 -1.16 0.00 0.00 60.37 59.67 2cv5 h HIS 106 Cb 0.62 0.26 -0.07 0.00 1.06 0.00 0.00 27.41 29.29 2cv5 h HIS 106 CO -0.27 -0.37 0.61 0.00 0.86 0.00 0.00 177.93 178.75 2cv5 h ALA 107 N 0.13 1.35 -0.38 2.45 0.00 -0.51 -0.48 119.26 121.82 2cv5 h ALA 107 Ca -0.00 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2cv5 h ALA 107 Cb 0.50 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2cv5 h ALA 107 CO -0.06 0.34 0.25 0.28 0.00 0.00 0.00 179.25 180.06 2cv5 h VAL 108 N 1.07 1.09 0.10 0.00 2.07 -0.29 0.17 116.25 120.45 2cv5 h VAL 108 Ca 0.43 -0.17 0.02 0.00 0.82 0.00 0.00 66.70 67.80 2cv5 h VAL 108 Cb 0.24 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 30.51 2cv5 h VAL 108 CO -0.20 0.09 -0.29 0.28 0.02 0.00 0.00 177.57 177.47 2cv5 h SER 109 N 0.50 -0.84 -0.59 0.57 0.02 0.49 0.33 113.55 114.04 2cv5 h SER 109 Ca 0.14 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 61.20 2cv5 h SER 109 Cb -0.05 0.32 -0.03 0.00 0.14 0.00 0.00 62.40 62.79 2cv5 h SER 109 CO -0.04 -0.38 0.38 -0.33 -1.14 0.00 0.00 176.83 175.33 2cv5 h GLU 110 N -0.50 0.78 0.06 3.45 4.39 -1.05 0.05 114.58 121.76 2cv5 h GLU 110 Ca 0.04 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.68 2cv5 h GLU 110 Cb 0.54 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 2cv5 h GLU 110 CO -0.18 0.53 -0.03 0.78 -1.16 0.00 0.00 179.01 178.95 2cv5 h GLY 111 N 0.79 -0.08 0.98 -3.84 0.00 -0.21 -0.64 103.07 100.07 2cv5 h GLY 111 Ca 0.21 0.03 -0.00 0.00 0.00 0.00 0.00 47.33 47.57 2cv5 h GLY 111 CO -0.04 -0.03 0.21 -0.84 0.00 0.00 0.00 176.54 175.83 2cv5 h THR 112 N -0.17 1.12 -0.35 4.70 2.02 -0.18 -1.87 112.91 118.17 2cv5 h THR 112 Ca -0.01 -0.27 0.06 0.00 0.77 0.00 0.00 66.41 66.96 2cv5 h THR 112 Cb 0.15 0.68 -0.06 0.00 -1.74 0.00 0.00 68.15 67.18 2cv5 h THR 112 CO 0.01 0.12 0.00 0.50 0.37 0.00 0.00 175.52 176.52 2cv5 h LYS 113 N 0.44 0.10 -0.76 6.66 3.64 -0.85 -1.23 116.57 124.58 2cv5 h LYS 113 Ca 0.12 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.48 2cv5 h LYS 113 Cb 0.01 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.77 2cv5 h LYS 113 CO -0.02 0.06 0.41 0.00 -2.27 0.00 0.00 179.45 177.63 2cv5 h ALA 114 N 1.30 1.29 0.30 5.00 0.00 -0.87 -1.67 119.26 124.62 2cv5 h ALA 114 Ca 0.17 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2cv5 h ALA 114 Cb 0.23 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2cv5 h ALA 114 CO -0.28 0.57 -0.14 0.28 0.00 0.00 0.00 179.25 179.67 2cv5 h VAL 115 N 1.06 0.69 -0.75 0.00 2.07 -0.55 -1.14 116.25 117.63 2cv5 h VAL 115 Ca 0.27 -0.65 0.13 0.00 0.82 0.00 0.00 66.70 67.27 2cv5 h VAL 115 Cb 0.04 1.01 -0.09 0.00 -1.52 0.00 0.00 31.29 30.73 2cv5 h VAL 115 CO -0.04 0.12 0.33 0.71 0.02 0.00 0.00 177.57 178.71 2cv5 h THR 116 N -0.78 0.72 -0.54 2.57 1.35 -1.18 0.14 112.91 115.19 2cv5 h THR 116 Ca -0.04 -0.17 -0.06 0.00 -0.55 0.00 0.00 66.41 65.59 2cv5 h THR 116 Cb 0.51 0.17 -0.02 0.00 -1.73 0.00 0.00 68.15 67.07 2cv5 h THR 116 CO 0.07 0.09 0.10 0.50 -0.25 0.00 0.00 175.52 176.03 2cv5 h LYS 117 N 0.51 0.85 -0.11 4.72 3.64 -1.28 -2.63 116.57 122.27 2cv5 h LYS 117 Ca 0.40 -0.19 -0.06 0.00 -1.27 0.00 0.00 60.65 59.53 2cv5 h LYS 117 Cb 0.56 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.26 2cv5 h LYS 117 CO -0.36 0.78 -0.18 -0.92 -2.27 0.00 0.00 179.45 176.50 2cv5 h TYR 118 N 0.81 0.39 -0.16 1.91 3.20 0.28 -2.20 116.97 121.19 2cv5 h TYR 118 Ca 0.17 -0.13 -0.03 0.00 3.14 0.00 0.00 58.73 61.88 2cv5 h TYR 118 Cb 0.34 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.52 2cv5 h TYR 118 CO 0.02 0.78 -0.04 1.79 -1.64 0.00 0.00 178.16 179.07 2cv5 h THR 119 N -0.11 1.13 0.00 1.81 1.35 -0.75 -0.14 112.91 116.19 2cv5 h THR 119 Ca 0.01 -0.52 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 2cv5 h THR 119 Cb 0.75 1.05 0.00 0.00 -1.73 0.00 0.00 68.15 68.22 2cv5 h THR 119 CO 0.04 0.17 0.00 -1.20 -0.25 0.00 0.00 175.52 174.28 2cv5 n SER 120 N -4.36 0.30 -1.61 5.36 7.64 -1.00 -4.78 113.62 115.17 2cv5 n SER 120 Ca -0.01 -1.76 -0.12 0.00 1.01 0.00 0.00 58.87 58.00 2cv5 n SER 120 Cb 0.20 -0.15 -0.04 0.00 -1.01 0.00 0.00 64.21 63.21 2cv5 n SER 120 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2cv5 n ALA 121 N -0.31 -0.33 0.30 -0.43 0.00 -0.07 -5.08 120.51 114.59 2cv5 n ALA 121 Ca 0.00 0.17 0.02 0.00 0.00 0.00 0.00 53.44 53.63 2cv5 n ALA 121 Cb 0.07 -1.31 0.14 0.00 0.00 0.00 0.00 19.45 18.36 2cv5 n ALA 121 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13