#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cv5 n ARG 19 N 0.00 0.00 -1.88 -0.41 3.00 -1.26 -4.63 116.66 111.48 2cv5 n ARG 19 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 57.85 57.44 2cv5 n ARG 19 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 32.46 32.44 2cv5 n ARG 19 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.63 177.84 2cv5 s LYS 20 N 0.00 4.18 0.22 -0.14 2.20 -1.26 -4.90 119.74 120.05 2cv5 s LYS 20 Ca 0.00 2.46 -0.32 0.00 -0.36 0.00 0.00 55.97 57.76 2cv5 s LYS 20 Cb 0.00 -3.05 -0.14 0.00 -1.51 0.00 0.00 37.83 33.13 2cv5 s LYS 20 CO 0.00 -0.53 1.37 0.28 -0.36 0.00 0.00 175.35 176.11 2cv5 n VAL 21 N 1.99 0.90 -3.37 4.02 0.31 -1.26 -4.95 118.33 115.97 2cv5 n VAL 21 Ca 0.07 -0.23 -0.39 0.00 -0.01 0.00 0.00 64.34 63.78 2cv5 n VAL 21 Cb 0.39 -1.36 -0.09 0.00 -0.91 0.00 0.00 33.84 31.87 2cv5 n VAL 21 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2cv5 s LEU 22 N 0.22 4.06 0.04 7.52 1.43 -1.26 -5.06 118.68 125.64 2cv5 s LEU 22 Ca 0.69 0.36 0.01 0.00 -1.03 0.00 0.00 54.13 54.17 2cv5 s LEU 22 Cb -0.69 -2.47 -0.02 0.00 0.03 0.00 0.00 46.19 43.04 2cv5 s LEU 22 CO 0.50 -0.18 -0.06 -0.13 0.23 0.00 0.00 176.35 176.71 2cv5 s ARG 23 N 1.95 0.49 -1.24 1.70 0.52 -1.26 -4.91 118.95 116.21 2cv5 s ARG 23 Ca 0.16 -0.78 -0.12 0.00 -0.52 0.00 0.00 55.73 54.47 2cv5 s ARG 23 Cb -0.16 -0.15 0.11 0.00 0.52 0.00 0.00 34.95 35.28 2cv5 s ARG 23 CO 0.09 0.01 0.45 -3.47 0.02 0.00 0.00 175.30 172.40 2cv5 n ASP 24 N 1.33 -2.65 0.07 0.23 2.03 -1.26 -4.85 116.55 111.45 2cv5 n ASP 24 Ca -0.22 -0.50 0.11 0.00 0.52 0.00 0.00 54.79 54.70 2cv5 n ASP 24 Cb 0.55 -2.25 0.44 0.00 -0.72 0.00 0.00 41.12 39.14 2cv5 n ASP 24 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2cv5 n ASN 25 N -2.21 0.42 0.32 1.67 3.02 -1.26 -2.58 115.26 114.63 2cv5 n ASN 25 Ca 0.03 0.58 0.20 0.00 -0.03 0.00 0.00 54.58 55.37 2cv5 n ASN 25 Cb 0.50 -0.68 1.09 0.00 -0.61 0.00 0.00 39.78 40.08 2cv5 n ASN 25 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 2cv5 h ILE 26 N 0.00 0.13 0.00 2.41 6.09 -1.99 1.01 117.51 125.16 2cv5 h ILE 26 Ca 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 2cv5 h ILE 26 Cb 0.41 0.94 0.00 0.00 0.47 0.00 0.00 36.82 38.64 2cv5 h ILE 26 CO 0.00 0.00 0.00 0.00 -3.07 0.00 0.00 178.15 175.08 2cv5 n GLN 27 N -3.24 0.54 0.24 2.19 1.13 -1.07 -2.30 117.38 114.88 2cv5 n GLN 27 Ca -0.02 0.03 0.14 0.00 -1.94 0.00 0.00 57.00 55.20 2cv5 n GLN 27 Cb 0.14 -1.50 0.44 0.00 0.11 0.00 0.00 30.24 29.42 2cv5 n GLN 27 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 2cv5 h GLY 28 N 4.26 0.00 -7.52 1.08 0.00 0.87 -3.36 103.07 98.40 2cv5 h GLY 28 Ca 0.00 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 46.68 2cv5 h GLY 28 CO 0.00 0.00 1.79 -0.42 0.00 0.00 0.00 176.54 177.91 2cv5 s ILE 29 N -3.46 4.13 0.85 2.60 -1.09 -0.97 -4.97 121.20 118.28 2cv5 s ILE 29 Ca 0.03 -1.46 -0.11 0.00 -2.23 0.00 0.00 60.65 56.88 2cv5 s ILE 29 Cb 0.08 -5.10 0.10 0.00 -1.58 0.00 0.00 42.46 35.96 2cv5 s ILE 29 CO 0.61 -1.94 1.11 0.42 -1.23 0.00 0.00 174.94 173.91 2cv5 s THR 30 N 4.30 2.82 0.15 2.92 -4.23 -1.26 -4.81 115.64 115.53 2cv5 s THR 30 Ca 0.49 0.27 -0.19 0.00 -1.18 0.00 0.00 61.69 61.08 2cv5 s THR 30 Cb 0.01 -2.60 0.05 0.00 1.34 0.00 0.00 72.50 71.31 2cv5 s THR 30 CO -0.01 -0.35 1.67 0.50 -0.54 0.00 0.00 174.62 175.89 2cv5 h LYS 31 N -1.46 -0.05 -0.77 3.99 3.64 -1.93 -1.05 116.57 118.94 2cv5 h LYS 31 Ca -0.45 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 58.93 2cv5 h LYS 31 Cb 1.25 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 33.05 2cv5 h LYS 31 CO 0.49 -0.03 0.45 -1.00 -2.27 0.00 0.00 179.45 177.08 2cv5 h PRO 32 N -0.05 1.05 -0.15 1.90 0.13 -1.99 0.65 132.00 133.54 2cv5 h PRO 32 Ca 0.16 -0.10 -0.08 0.00 -0.87 0.00 0.00 66.00 65.11 2cv5 h PRO 32 Cb 0.29 -0.22 -0.01 0.00 0.13 0.00 0.00 31.00 31.19 2cv5 h PRO 32 CO -0.36 0.75 -0.27 0.00 -0.23 0.00 0.00 178.00 177.89 2cv5 h ALA 33 N 1.43 1.27 -0.08 -0.56 0.00 -1.71 -0.64 119.26 118.96 2cv5 h ALA 33 Ca 0.28 -0.32 -0.20 0.00 0.00 0.00 0.00 54.91 54.67 2cv5 h ALA 33 Cb -0.02 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2cv5 h ALA 33 CO -0.05 0.49 -0.78 0.82 0.00 0.00 0.00 179.25 179.74 2cv5 h ILE 34 N 0.25 1.36 -0.45 0.00 2.04 -0.51 -2.77 117.51 117.42 2cv5 h ILE 34 Ca 0.04 -2.14 -0.03 0.00 1.00 0.00 0.00 64.86 63.73 2cv5 h ILE 34 Cb 0.61 2.13 -0.02 0.00 -0.74 0.00 0.00 36.82 38.80 2cv5 h ILE 34 CO 0.04 0.65 0.18 -0.09 0.00 0.00 0.00 178.15 178.94 2cv5 h ARG 35 N 0.33 0.68 -0.84 2.37 2.43 -0.30 -1.12 114.38 117.94 2cv5 h ARG 35 Ca -0.04 -0.12 -0.02 0.00 -0.81 0.00 0.00 59.98 58.99 2cv5 h ARG 35 Cb 1.37 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 30.78 2cv5 h ARG 35 CO 0.14 0.62 0.46 0.00 -1.51 0.00 0.00 179.97 179.67 2cv5 h ARG 36 N 0.59 1.16 -0.41 0.20 3.08 -1.13 -0.39 114.38 117.48 2cv5 h ARG 36 Ca 0.15 -0.13 -0.04 0.00 0.07 0.00 0.00 59.98 60.02 2cv5 h ARG 36 Cb 0.19 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 2cv5 h ARG 36 CO -0.01 0.85 0.09 -0.07 -1.07 0.00 0.00 179.97 179.76 2cv5 h LEU 37 N 1.17 0.64 -1.21 3.04 3.38 -1.17 -1.23 115.31 119.93 2cv5 h LEU 37 Ca 0.29 -0.24 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 2cv5 h LEU 37 Cb 0.03 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 2cv5 h LEU 37 CO -0.05 0.71 -0.18 0.00 0.09 0.00 0.00 178.44 179.01 2cv5 h ALA 38 N 0.95 1.34 0.42 1.53 0.00 -0.78 -2.05 119.26 120.67 2cv5 h ALA 38 Ca 0.13 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 2cv5 h ALA 38 Cb 0.33 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2cv5 h ALA 38 CO 0.00 0.45 -0.20 0.00 0.00 0.00 0.00 179.25 179.50 2cv5 h ARG 39 N 0.29 -0.54 -0.67 0.00 2.47 -0.71 0.16 114.38 115.38 2cv5 h ARG 39 Ca 0.05 0.04 0.19 0.00 -1.26 0.00 0.00 59.98 59.00 2cv5 h ARG 39 Cb 0.50 0.12 -0.03 0.00 -1.65 0.00 0.00 29.97 28.91 2cv5 h ARG 39 CO 0.03 -0.28 0.48 -0.09 0.56 0.00 0.00 179.97 180.67 2cv5 h ARG 40 N -0.70 0.01 -0.47 0.04 2.43 -1.04 1.59 114.38 116.23 2cv5 h ARG 40 Ca -0.06 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2cv5 h ARG 40 Cb 0.50 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 2cv5 h ARG 40 CO 0.09 0.01 0.00 0.41 -1.51 0.00 0.00 179.97 178.97 2cv5 n GLY 41 N -1.67 0.87 2.16 2.80 0.00 -0.79 -4.90 105.19 103.66 2cv5 n GLY 41 Ca 0.13 -0.31 -0.06 0.00 0.00 0.00 0.00 46.02 45.79 2cv5 n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cv5 n GLY 42 N 0.69 0.77 3.75 -0.02 0.00 0.54 -5.03 105.19 105.90 2cv5 n GLY 42 Ca 0.09 -0.80 -0.39 0.00 0.00 0.00 0.00 46.02 44.92 2cv5 n GLY 42 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2cv5 s VAL 43 N -2.21 4.88 -0.23 1.61 1.01 0.48 -4.98 120.40 120.97 2cv5 s VAL 43 Ca 0.00 1.34 0.09 0.00 0.00 0.00 0.00 61.98 63.41 2cv5 s VAL 43 Cb 0.00 -3.98 -0.21 0.00 0.00 0.00 0.00 36.38 32.19 2cv5 s VAL 43 CO 0.00 0.39 -0.07 1.17 0.00 0.00 0.00 175.10 176.59 2cv5 n LYS 44 N 2.83 0.67 -4.63 2.72 4.81 -1.26 -4.30 118.16 118.99 2cv5 n LYS 44 Ca -0.05 0.09 -0.22 0.00 -0.87 0.00 0.00 58.31 57.25 2cv5 n LYS 44 Cb 0.51 -1.53 -0.15 0.00 0.02 0.00 0.00 35.03 33.88 2cv5 n LYS 44 CO 0.00 0.00 0.00 0.50 1.17 0.00 0.00 177.40 179.07 2cv5 s ARG 45 N -2.51 1.20 -0.13 1.64 3.52 -1.26 -5.13 118.95 116.28 2cv5 s ARG 45 Ca -0.23 -0.49 0.00 0.00 -0.13 0.00 0.00 55.73 54.88 2cv5 s ARG 45 Cb 0.08 -1.13 0.02 0.00 -1.56 0.00 0.00 34.95 32.36 2cv5 s ARG 45 CO 0.71 0.26 -0.12 0.42 -0.81 0.00 0.00 175.30 175.76 2cv5 s ILE 46 N -0.19 1.37 0.71 4.11 1.01 -1.26 -5.13 121.20 121.81 2cv5 s ILE 46 Ca 0.03 -0.51 -0.16 0.00 0.00 0.00 0.00 60.65 60.01 2cv5 s ILE 46 Cb -0.07 -1.31 0.03 0.00 0.01 0.00 0.00 42.46 41.12 2cv5 s ILE 46 CO -0.00 0.42 1.23 -0.55 0.00 0.00 0.00 174.94 176.05 2cv5 s SER 47 N 1.53 4.30 0.54 3.58 0.15 -1.26 -4.91 113.70 117.63 2cv5 s SER 47 Ca 0.04 2.44 0.29 0.00 0.70 0.00 0.00 55.95 59.42 2cv5 s SER 47 Cb -0.13 -2.60 1.53 0.00 -1.71 0.00 0.00 66.02 63.11 2cv5 s SER 47 CO -0.09 -2.20 2.09 1.23 1.20 0.00 0.00 173.24 175.47 2cv5 h GLY 48 N -0.05 0.00 0.53 9.45 0.00 -2.06 -2.86 103.07 108.09 2cv5 h GLY 48 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 2cv5 h GLY 48 CO 0.51 0.00 -0.20 1.04 0.00 0.00 0.00 176.54 177.89 2cv5 n LEU 49 N -3.57 0.79 -0.13 3.11 4.77 -1.26 -4.11 117.00 116.60 2cv5 n LEU 49 Ca -0.02 -0.14 -0.02 0.00 -0.03 0.00 0.00 56.01 55.80 2cv5 n LEU 49 Cb 0.22 -0.15 0.21 0.00 -2.33 0.00 0.00 43.42 41.37 2cv5 n LEU 49 CO 0.29 0.15 1.01 0.40 -1.33 0.00 0.00 177.39 177.91 2cv5 h ILE 50 N 0.92 1.22 -0.10 -0.08 1.08 -1.88 -3.11 117.51 115.57 2cv5 h ILE 50 Ca 0.00 -0.75 0.03 0.00 -0.39 0.00 0.00 64.86 63.75 2cv5 h ILE 50 Cb 0.45 0.61 -0.04 0.00 -3.07 0.00 0.00 36.82 34.78 2cv5 h ILE 50 CO 0.00 0.29 -0.10 1.88 -0.69 0.00 0.00 178.15 179.52 2cv5 h TYR 51 N 0.81 -0.26 -0.49 1.37 0.05 -1.79 0.11 116.97 116.78 2cv5 h TYR 51 Ca 0.18 0.02 -0.10 0.00 0.05 0.00 0.00 58.73 58.88 2cv5 h TYR 51 Cb 0.24 0.13 -0.02 0.00 1.01 0.00 0.00 36.73 38.10 2cv5 h TYR 51 CO 0.01 -0.16 -0.10 0.93 -1.05 0.00 0.00 178.16 177.80 2cv5 h GLU 52 N -0.13 0.93 -0.49 4.88 4.39 -1.85 -1.87 114.58 120.44 2cv5 h GLU 52 Ca 0.07 -0.35 0.06 0.00 0.34 0.00 0.00 59.36 59.49 2cv5 h GLU 52 Cb 0.24 -0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 28.78 2cv5 h GLU 52 CO -0.18 1.01 0.20 0.93 -1.16 0.00 0.00 179.01 179.80 2cv5 h GLU 53 N 0.78 0.38 -0.60 2.33 4.39 -1.39 0.72 114.58 121.19 2cv5 h GLU 53 Ca 0.13 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.77 2cv5 h GLU 53 Cb 0.65 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.19 2cv5 h GLU 53 CO 0.04 0.25 0.24 1.15 -1.16 0.00 0.00 179.01 179.54 2cv5 h THR 54 N 0.39 1.21 -0.54 1.13 2.02 -0.61 0.43 112.91 116.93 2cv5 h THR 54 Ca 0.23 -0.65 -0.07 0.00 0.77 0.00 0.00 66.41 66.69 2cv5 h THR 54 Cb 0.21 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.09 2cv5 h THR 54 CO -0.21 0.26 0.07 0.03 0.37 0.00 0.00 175.52 176.03 2cv5 h ARG 55 N 0.85 0.91 -0.71 6.66 3.08 -0.41 0.36 114.38 125.13 2cv5 h ARG 55 Ca 0.20 -0.26 -0.06 0.00 0.07 0.00 0.00 59.98 59.94 2cv5 h ARG 55 Cb 0.16 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.08 2cv5 h ARG 55 CO -0.02 0.90 0.22 0.78 -1.07 0.00 0.00 179.97 180.77 2cv5 h GLY 56 N 0.80 1.18 0.80 0.04 0.00 -0.07 -1.61 103.07 104.22 2cv5 h GLY 56 Ca 0.16 -0.70 -0.08 0.00 0.00 0.00 0.00 47.33 46.71 2cv5 h GLY 56 CO 0.01 0.66 -0.18 -2.08 0.00 0.00 0.00 176.54 174.95 2cv5 h VAL 57 N 1.04 1.33 -0.84 4.60 2.07 -0.74 -2.71 116.25 121.01 2cv5 h VAL 57 Ca 0.23 -1.35 0.04 0.00 0.82 0.00 0.00 66.70 66.44 2cv5 h VAL 57 Cb 0.31 1.80 -0.05 0.00 -1.52 0.00 0.00 31.29 31.82 2cv5 h VAL 57 CO -0.01 0.41 0.53 0.25 0.02 0.00 0.00 177.57 178.77 2cv5 h LEU 58 N 0.11 0.87 -0.03 2.57 5.85 -0.83 -0.52 115.31 123.32 2cv5 h LEU 58 Ca 0.03 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.76 2cv5 h LEU 58 Cb 0.73 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 2cv5 h LEU 58 CO 0.05 0.59 -0.02 0.50 -0.34 0.00 0.00 178.44 179.21 2cv5 h LYS 59 N 1.02 -0.02 -0.84 1.25 1.63 -1.26 0.38 116.57 118.72 2cv5 h LYS 59 Ca 0.34 0.00 0.04 0.00 -0.85 0.00 0.00 60.65 60.18 2cv5 h LYS 59 Cb 0.06 0.00 -0.05 0.00 -0.60 0.00 0.00 32.23 31.64 2cv5 h LYS 59 CO -0.13 -0.01 0.54 0.28 -3.45 0.00 0.00 179.45 176.67 2cv5 h VAL 60 N -0.02 1.12 -0.35 2.00 2.07 -1.10 0.19 116.25 120.17 2cv5 h VAL 60 Ca 0.02 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 67.18 2cv5 h VAL 60 Cb 0.05 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 29.80 2cv5 h VAL 60 CO -0.05 0.19 0.17 0.15 0.02 0.00 0.00 177.57 178.06 2cv5 h PHE 61 N 1.03 0.49 -0.42 1.57 3.57 -0.46 -1.98 116.94 120.74 2cv5 h PHE 61 Ca 0.34 -0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.73 2cv5 h PHE 61 Cb 0.04 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.61 2cv5 h PHE 61 CO -0.03 0.42 -0.08 -0.07 -2.23 0.00 0.00 178.31 176.32 2cv5 h LEU 62 N 0.43 0.81 -0.45 0.59 3.38 -0.45 -2.56 115.31 117.04 2cv5 h LEU 62 Ca 0.12 -0.35 0.01 0.00 0.09 0.00 0.00 57.88 57.75 2cv5 h LEU 62 Cb 0.10 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 2cv5 h LEU 62 CO -0.02 0.97 0.28 -0.33 0.09 0.00 0.00 178.44 179.44 2cv5 h GLU 63 N 0.63 0.55 -0.77 1.13 5.08 -0.91 0.41 114.58 120.69 2cv5 h GLU 63 Ca 0.11 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.44 2cv5 h GLU 63 Cb 0.61 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.69 2cv5 h GLU 63 CO 0.04 0.37 0.51 -0.91 -1.00 0.00 0.00 179.01 178.01 2cv5 h ASN 64 N 0.57 0.89 0.01 1.42 2.35 -1.28 -0.01 115.58 119.53 2cv5 h ASN 64 Ca 0.18 -0.03 -0.02 0.00 -0.55 0.00 0.00 56.30 55.88 2cv5 h ASN 64 Cb -0.02 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.13 2cv5 h ASN 64 CO -0.06 0.65 -0.09 0.58 -1.65 0.00 0.00 177.43 176.85 2cv5 h VAL 65 N 1.05 1.66 -0.79 2.81 2.07 -1.03 -3.07 116.25 118.96 2cv5 h VAL 65 Ca 0.28 -2.06 0.05 0.00 0.82 0.00 0.00 66.70 65.80 2cv5 h VAL 65 Cb -0.11 3.04 -0.05 0.00 -1.52 0.00 0.00 31.29 32.65 2cv5 h VAL 65 CO -0.06 0.54 0.52 0.40 0.02 0.00 0.00 177.57 178.99 2cv5 h ILE 66 N -0.77 1.07 0.44 4.57 2.04 -0.18 0.50 117.51 125.17 2cv5 h ILE 66 Ca -0.01 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.53 2cv5 h ILE 66 Cb 0.94 0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 2cv5 h ILE 66 CO 0.02 0.16 -0.41 -0.09 0.00 0.00 0.00 178.15 177.83 2cv5 h ARG 67 N 0.90 -0.81 -0.93 2.37 2.43 -1.04 0.16 114.38 117.45 2cv5 h ARG 67 Ca 0.33 0.06 0.10 0.00 -0.81 0.00 0.00 59.98 59.66 2cv5 h ARG 67 Cb 0.16 0.18 -0.08 0.00 -0.42 0.00 0.00 29.97 29.82 2cv5 h ARG 67 CO -0.11 -0.54 0.57 -0.44 -1.51 0.00 0.00 179.97 177.94 2cv5 h ASP 68 N -0.84 0.84 -0.05 -3.80 5.19 -1.34 -0.70 116.42 115.71 2cv5 h ASP 68 Ca -0.06 0.04 0.01 0.00 -0.62 0.00 0.00 57.03 56.41 2cv5 h ASP 68 Cb 0.73 -0.12 -0.01 0.00 0.18 0.00 0.00 39.33 40.10 2cv5 h ASP 68 CO -0.04 0.47 -0.02 0.00 -3.12 0.00 0.00 179.24 176.53 2cv5 h ALA 69 N 1.50 0.03 -1.01 3.45 0.00 -0.48 -2.00 119.26 120.75 2cv5 h ALA 69 Ca 0.45 0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.41 2cv5 h ALA 69 Cb 0.41 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.19 2cv5 h ALA 69 CO -0.25 -0.50 0.66 0.28 0.00 0.00 0.00 179.25 179.45 2cv5 h VAL 70 N -0.00 1.21 -0.92 0.00 2.07 0.11 -0.84 116.25 117.87 2cv5 h VAL 70 Ca 0.03 -0.45 0.04 0.00 0.82 0.00 0.00 66.70 67.14 2cv5 h VAL 70 Cb 0.04 -0.22 -0.06 0.00 -1.52 0.00 0.00 31.29 29.54 2cv5 h VAL 70 CO -0.06 0.24 0.59 0.74 0.02 0.00 0.00 177.57 179.10 2cv5 h THR 71 N 1.31 1.13 -0.67 2.57 2.02 -0.73 0.25 112.91 118.79 2cv5 h THR 71 Ca 0.39 -0.39 -0.07 0.00 0.77 0.00 0.00 66.41 67.12 2cv5 h THR 71 Cb -0.06 -0.10 -0.03 0.00 -1.74 0.00 0.00 68.15 66.22 2cv5 h THR 71 CO -0.11 0.21 0.16 1.88 0.37 0.00 0.00 175.52 178.03 2cv5 h TYR 72 N 1.13 1.12 0.13 3.16 0.05 -0.48 -1.33 116.97 120.75 2cv5 h TYR 72 Ca 0.38 -0.13 -0.01 0.00 0.05 0.00 0.00 58.73 59.02 2cv5 h TYR 72 Cb 0.05 -0.32 0.00 0.00 1.01 0.00 0.00 36.73 37.48 2cv5 h TYR 72 CO -0.01 0.93 -0.06 1.15 -1.05 0.00 0.00 178.16 179.11 2cv5 h THR 73 N 1.00 0.89 -0.70 -2.88 2.02 0.10 -1.13 112.91 112.20 2cv5 h THR 73 Ca 0.21 -0.07 -0.03 0.00 0.77 0.00 0.00 66.41 67.29 2cv5 h THR 73 Cb 0.37 0.94 -0.03 0.00 -1.74 0.00 0.00 68.15 67.68 2cv5 h THR 73 CO 0.00 0.02 0.32 -0.33 0.37 0.00 0.00 175.52 175.90 2cv5 h GLU 74 N -0.20 1.01 -0.06 6.66 5.08 -0.51 -1.72 114.58 124.84 2cv5 h GLU 74 Ca -0.02 -0.15 -0.06 0.00 -1.00 0.00 0.00 59.36 58.14 2cv5 h GLU 74 Cb 0.16 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 2cv5 h GLU 74 CO 0.03 0.79 -0.22 1.25 -1.00 0.00 0.00 179.01 179.86 2cv5 h HIS 75 N 1.00 0.11 -0.06 4.33 2.76 -0.95 0.14 115.15 122.47 2cv5 h HIS 75 Ca 0.24 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.40 2cv5 h HIS 75 Cb 0.13 -0.03 0.00 0.00 1.55 0.00 0.00 27.41 29.06 2cv5 h HIS 75 CO 0.01 0.32 0.00 0.00 -1.30 0.00 0.00 177.93 176.97 2cv5 n ALA 76 N -2.49 2.58 -2.33 5.26 0.00 -0.45 -4.88 120.51 118.20 2cv5 n ALA 76 Ca -0.02 -0.27 -0.18 0.00 0.00 0.00 0.00 53.44 52.97 2cv5 n ALA 76 Cb 0.31 -1.22 -0.02 0.00 0.00 0.00 0.00 19.45 18.52 2cv5 n ALA 76 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2cv5 n LYS 77 N -0.37 -1.82 -3.03 0.00 5.02 0.49 -4.97 118.16 113.48 2cv5 n LYS 77 Ca 0.15 0.90 -0.19 0.00 -2.02 0.00 0.00 58.31 57.15 2cv5 n LYS 77 Cb 0.17 -5.51 0.01 0.00 -0.02 0.00 0.00 35.03 29.67 2cv5 n LYS 77 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2cv5 s ARG 78 N -4.89 2.85 0.00 1.97 0.52 -0.75 -5.01 118.95 113.63 2cv5 s ARG 78 Ca 0.00 -1.05 0.04 0.00 -0.52 0.00 0.00 55.73 54.20 2cv5 s ARG 78 Cb 0.00 -2.70 0.06 0.00 0.52 0.00 0.00 34.95 32.82 2cv5 s ARG 78 CO 0.00 -0.29 0.77 1.63 0.02 0.00 0.00 175.30 177.43 2cv5 n LYS 79 N -1.92 0.61 -4.11 3.54 5.02 -1.26 -4.48 118.16 115.56 2cv5 n LYS 79 Ca 0.06 -1.04 -0.33 0.00 -2.02 0.00 0.00 58.31 54.98 2cv5 n LYS 79 Cb 0.59 -1.08 -0.16 0.00 -0.02 0.00 0.00 35.03 34.36 2cv5 n LYS 79 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2cv5 s THR 80 N -0.54 2.09 -0.12 -0.18 2.01 -1.26 -5.09 115.64 112.55 2cv5 s THR 80 Ca 0.06 -1.00 -0.29 0.00 0.31 0.00 0.00 61.69 60.76 2cv5 s THR 80 Cb 0.04 -1.91 -0.02 0.00 0.01 0.00 0.00 72.50 70.61 2cv5 s THR 80 CO 0.05 0.48 1.30 -0.69 -0.69 0.00 0.00 174.62 175.07 2cv5 s VAL 81 N 1.27 4.17 0.29 3.82 1.01 -1.26 -4.96 120.40 124.75 2cv5 s VAL 81 Ca 0.04 1.44 0.06 0.00 0.00 0.00 0.00 61.98 63.52 2cv5 s VAL 81 Cb -0.14 -3.93 -0.02 0.00 0.00 0.00 0.00 36.38 32.29 2cv5 s VAL 81 CO -0.12 -0.09 0.40 0.42 0.00 0.00 0.00 175.10 175.70 2cv5 s THR 82 N 3.22 4.57 0.32 3.92 -4.23 -1.26 -5.00 115.64 117.19 2cv5 s THR 82 Ca 0.57 -1.04 0.04 0.00 -1.18 0.00 0.00 61.69 60.09 2cv5 s THR 82 Cb -0.24 -3.59 0.30 0.00 1.34 0.00 0.00 72.50 70.31 2cv5 s THR 82 CO 0.18 -0.24 1.89 0.00 -0.54 0.00 0.00 174.62 175.91 2cv5 h ALA 83 N 1.07 1.65 -0.60 3.99 0.00 -1.95 -1.38 119.26 122.04 2cv5 h ALA 83 Ca -0.48 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.43 2cv5 h ALA 83 Cb 1.24 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 2cv5 h ALA 83 CO 0.57 0.16 0.39 0.52 0.00 0.00 0.00 179.25 180.89 2cv5 h MET 84 N 0.87 0.77 -0.28 0.00 2.86 -1.95 0.60 114.93 117.81 2cv5 h MET 84 Ca 0.42 -0.05 0.03 0.00 -2.06 0.00 0.00 59.70 58.04 2cv5 h MET 84 Cb 0.44 -0.17 -0.03 0.00 0.06 0.00 0.00 31.60 31.89 2cv5 h MET 84 CO -0.18 0.51 0.09 -0.44 1.06 0.00 0.00 176.91 177.95 2cv5 h ASP 85 N 0.80 0.10 -0.63 1.22 3.32 -1.63 0.44 116.42 120.04 2cv5 h ASP 85 Ca 0.22 0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.28 2cv5 h ASP 85 Cb -0.07 0.02 -0.03 0.00 0.22 0.00 0.00 39.33 39.47 2cv5 h ASP 85 CO -0.06 0.09 0.30 0.58 -1.72 0.00 0.00 179.24 178.44 2cv5 h VAL 86 N 0.22 1.22 -0.55 -1.35 2.07 -0.78 -0.75 116.25 116.32 2cv5 h VAL 86 Ca 0.12 -0.62 -0.00 0.00 0.82 0.00 0.00 66.70 67.02 2cv5 h VAL 86 Cb 0.09 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.30 2cv5 h VAL 86 CO -0.13 0.25 0.33 0.58 0.02 0.00 0.00 177.57 178.62 2cv5 h VAL 87 N 0.87 1.17 -0.50 2.57 2.07 0.13 0.27 116.25 122.83 2cv5 h VAL 87 Ca 0.22 -0.39 -0.07 0.00 0.82 0.00 0.00 66.70 67.27 2cv5 h VAL 87 Cb 0.12 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 2cv5 h VAL 87 CO -0.03 0.18 0.02 1.88 0.02 0.00 0.00 177.57 179.64 2cv5 h TYR 88 N 0.74 0.87 -0.38 1.57 0.05 0.10 -1.94 116.97 117.99 2cv5 h TYR 88 Ca 0.20 -0.12 -0.09 0.00 0.05 0.00 0.00 58.73 58.77 2cv5 h TYR 88 Cb -0.00 -0.24 -0.01 0.00 1.01 0.00 0.00 36.73 37.49 2cv5 h TYR 88 CO -0.02 0.79 -0.12 0.00 -1.05 0.00 0.00 178.16 177.76 2cv5 h ALA 89 N 1.25 0.53 -0.96 3.88 0.00 -0.49 -2.35 119.26 121.11 2cv5 h ALA 89 Ca 0.15 -0.33 0.03 0.00 0.00 0.00 0.00 54.91 54.77 2cv5 h ALA 89 Cb 0.44 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.04 2cv5 h ALA 89 CO 0.02 0.42 0.63 -0.07 0.00 0.00 0.00 179.25 180.24 2cv5 h LEU 90 N 0.56 1.06 -0.53 0.00 3.38 -0.81 -2.41 115.31 116.56 2cv5 h LEU 90 Ca 0.09 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 2cv5 h LEU 90 Cb 0.65 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 2cv5 h LEU 90 CO 0.04 0.73 0.14 0.50 0.09 0.00 0.00 178.44 179.95 2cv5 h LYS 91 N 1.24 0.85 -0.84 1.13 1.63 -1.18 0.30 116.57 119.69 2cv5 h LYS 91 Ca 0.38 -0.20 0.06 0.00 -0.85 0.00 0.00 60.65 60.04 2cv5 h LYS 91 Cb -0.03 -0.12 -0.05 0.00 -0.60 0.00 0.00 32.23 31.43 2cv5 h LYS 91 CO -0.11 0.79 0.55 0.00 -3.45 0.00 0.00 179.45 177.23 2cv5 h ARG 92 N 0.75 0.92 -0.02 1.90 3.08 -0.94 0.17 114.38 120.24 2cv5 h ARG 92 Ca 0.17 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.16 2cv5 h ARG 92 Cb 0.32 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.16 2cv5 h ARG 92 CO -0.00 0.61 0.00 1.04 -1.07 0.00 0.00 179.97 180.55 2cv5 n GLN 93 N -4.48 0.97 -2.87 0.04 1.13 -1.01 -4.82 117.38 106.34 2cv5 n GLN 93 Ca 0.12 0.00 -0.17 0.00 -1.94 0.00 0.00 57.00 55.01 2cv5 n GLN 93 Cb 0.19 -1.01 0.03 0.00 0.11 0.00 0.00 30.24 29.56 2cv5 n GLN 93 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2cv5 n GLY 94 N 0.46 -0.21 2.04 1.08 0.00 0.59 -4.91 105.19 104.24 2cv5 n GLY 94 Ca 0.00 -0.09 -0.13 0.00 0.00 0.00 0.00 46.02 45.79 2cv5 n GLY 94 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2cv5 n ARG 95 N -3.26 2.76 -1.51 1.61 3.00 0.10 -5.01 116.66 114.36 2cv5 n ARG 95 Ca -0.08 -3.81 -0.57 0.00 -0.00 0.00 0.00 57.85 53.39 2cv5 n ARG 95 Cb 0.59 -1.94 -0.07 0.00 0.00 0.00 0.00 32.46 31.04 2cv5 n ARG 95 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 2cv5 n THR 96 N -0.67 0.22 -5.24 5.15 -1.04 -1.22 -4.41 114.28 107.07 2cv5 n THR 96 Ca 0.30 -0.06 -0.32 0.00 -2.04 0.00 0.00 64.05 61.94 2cv5 n THR 96 Cb 0.91 -0.15 -0.17 0.00 -1.82 0.00 0.00 70.33 69.10 2cv5 n THR 96 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 2cv5 s LEU 97 N 0.37 2.09 -0.09 -4.42 2.96 -1.26 -4.99 118.68 113.34 2cv5 s LEU 97 Ca 0.87 -0.52 -0.03 0.00 -0.22 0.00 0.00 54.13 54.24 2cv5 s LEU 97 Cb -1.18 -1.39 -0.03 0.00 0.50 0.00 0.00 46.19 44.09 2cv5 s LEU 97 CO 0.55 0.22 0.02 -0.31 -1.32 0.00 0.00 176.35 175.51 2cv5 s TYR 98 N -0.04 3.21 0.00 5.38 2.02 -1.26 -4.66 117.35 121.99 2cv5 s TYR 98 Ca -0.07 0.22 0.00 0.00 -0.37 0.00 0.00 57.07 56.84 2cv5 s TYR 98 Cb -0.15 -1.81 0.00 0.00 -0.40 0.00 0.00 41.96 39.60 2cv5 s TYR 98 CO 0.05 0.48 0.00 0.41 -1.57 0.00 0.00 175.55 174.92 2cv5 n GLY 99 N 2.19 1.12 0.14 0.71 0.00 -1.26 -4.99 105.19 103.10 2cv5 n GLY 99 Ca -0.19 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.86 2cv5 n GLY 99 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2cv5 n PHE 100 N -0.21 0.00 1.45 1.61 3.01 -1.26 -4.63 117.46 117.43 2cv5 n PHE 100 Ca 0.00 -0.43 0.02 0.00 1.01 0.00 0.00 57.45 58.05 2cv5 n PHE 100 Cb 0.00 -0.07 0.06 0.00 -0.01 0.00 0.00 39.48 39.46 2cv5 n PHE 100 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2cv5 n GLY 101 N -0.56 -0.09 0.95 1.37 0.00 -1.26 -4.55 105.19 101.05 2cv5 n GLY 101 Ca 0.05 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2cv5 n GLY 101 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93