#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vdl s SER 2 N 0.00 -0.28 0.32 1.61 0.01 -1.26 -5.08 113.70 109.02 1vdl s SER 2 Ca 0.00 0.53 0.00 0.00 1.31 0.00 0.00 55.95 57.79 1vdl s SER 2 Cb 0.00 0.53 0.00 0.00 0.21 0.00 0.00 66.02 66.76 1vdl s SER 2 CO 0.00 -0.10 0.00 -0.24 0.41 0.00 0.00 173.24 173.31 1vdl n SER 3 N 1.87 -2.85 0.00 2.44 2.88 -1.26 -5.17 113.62 111.53 1vdl n SER 3 Ca -0.11 0.72 0.00 0.00 -1.33 0.00 0.00 58.87 58.14 1vdl n SER 3 Cb 0.56 2.79 0.00 0.00 -0.75 0.00 0.00 64.21 66.82 1vdl n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1vdl n GLY 4 N -1.37 2.60 3.22 0.46 0.00 -1.26 -5.18 105.19 103.66 1vdl n GLY 4 Ca 0.00 -0.51 -0.13 0.00 0.00 0.00 0.00 46.02 45.38 1vdl n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vdl s SER 5 N 0.00 1.49 0.21 1.61 0.01 -1.26 -5.14 113.70 110.62 1vdl s SER 5 Ca 0.00 -1.03 -0.00 0.00 1.31 0.00 0.00 55.95 56.22 1vdl s SER 5 Cb 0.00 0.04 -0.04 0.00 0.21 0.00 0.00 66.02 66.23 1vdl s SER 5 CO 0.00 -0.41 0.11 -0.44 0.41 0.00 0.00 173.24 172.91 1vdl s SER 6 N -3.13 0.46 0.48 2.44 0.01 -1.26 -5.13 113.70 107.58 1vdl s SER 6 Ca 0.16 -1.37 -0.20 0.00 1.31 0.00 0.00 55.95 55.85 1vdl s SER 6 Cb 0.04 0.31 -0.12 0.00 0.21 0.00 0.00 66.02 66.46 1vdl s SER 6 CO -0.01 -0.80 0.35 0.61 0.41 0.00 0.00 173.24 173.80 1vdl n GLY 7 N -0.31 -2.00 3.22 3.44 0.00 -1.26 -3.42 105.19 104.87 1vdl n GLY 7 Ca 0.01 -0.07 -0.28 0.00 0.00 0.00 0.00 46.02 45.68 1vdl n GLY 7 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1vdl n MET 8 N 0.68 -1.40 -4.01 1.61 0.00 -1.26 -4.99 117.12 107.76 1vdl n MET 8 Ca 0.11 1.15 -0.08 0.00 0.00 0.00 0.00 57.70 58.88 1vdl n MET 8 Cb 0.43 -1.60 -0.10 0.00 0.00 0.00 0.00 33.22 31.96 1vdl n MET 8 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 175.97 176.96 1vdl s THR 9 N -1.23 0.16 -0.46 2.03 2.01 -1.22 -5.12 115.64 111.81 1vdl s THR 9 Ca 0.27 -1.30 0.04 0.00 0.31 0.00 0.00 61.69 61.01 1vdl s THR 9 Cb -0.03 -0.88 0.12 0.00 0.01 0.00 0.00 72.50 71.72 1vdl s THR 9 CO 0.61 -0.71 0.19 -0.69 -0.69 0.00 0.00 174.62 173.33 1vdl s VAL 10 N -2.65 2.51 0.11 3.82 1.01 -1.26 -5.05 120.40 118.89 1vdl s VAL 10 Ca -0.05 -2.98 0.05 0.00 0.00 0.00 0.00 61.98 59.01 1vdl s VAL 10 Cb -0.01 -2.78 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 1vdl s VAL 10 CO -0.05 -0.73 -0.13 -1.61 0.00 0.00 0.00 175.10 172.57 1vdl s GLU 11 N 0.12 0.96 0.00 2.72 2.02 -1.26 -4.69 118.70 118.57 1vdl s GLU 11 Ca 0.15 -1.18 0.00 0.00 0.02 0.00 0.00 54.97 53.96 1vdl s GLU 11 Cb -0.23 -0.82 0.00 0.00 0.10 0.00 0.00 34.13 33.17 1vdl s GLU 11 CO -0.03 0.16 0.00 1.04 0.02 0.00 0.00 175.26 176.45 1vdl n GLN 12 N 0.64 0.00 -0.30 1.61 6.02 -1.26 -4.27 117.38 119.82 1vdl n GLN 12 Ca -0.16 0.00 0.19 0.00 -0.01 0.00 0.00 57.00 57.02 1vdl n GLN 12 Cb 0.57 0.00 0.47 0.00 1.02 0.00 0.00 30.24 32.30 1vdl n GLN 12 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.06 175.14 1vdl h ASN 13 N 0.00 0.50 -0.72 1.08 4.21 -1.98 0.95 115.58 119.62 1vdl h ASN 13 Ca 0.00 0.07 0.14 0.00 1.21 0.00 0.00 56.30 57.72 1vdl h ASN 13 Cb 0.00 -0.02 -0.05 0.00 -1.12 0.00 0.00 38.32 37.13 1vdl h ASN 13 CO 0.00 0.16 0.48 1.62 -1.29 0.00 0.00 177.43 178.40 1vdl h VAL 14 N 0.48 0.81 0.00 2.81 3.04 -1.84 0.28 116.25 121.84 1vdl h VAL 14 Ca 0.54 -0.13 -0.01 0.00 -1.01 0.00 0.00 66.70 66.09 1vdl h VAL 14 Cb 1.24 0.38 -0.00 0.00 -2.01 0.00 0.00 31.29 30.90 1vdl h VAL 14 CO -0.26 0.07 -0.09 0.25 -1.01 0.00 0.00 177.57 176.53 1vdl h LEU 15 N 0.39 0.00 -1.00 3.16 5.85 0.51 -3.32 115.31 120.90 1vdl h LEU 15 Ca 0.35 -0.40 0.31 0.00 0.84 0.00 0.00 57.88 58.97 1vdl h LEU 15 Cb 0.81 0.00 -0.14 0.00 0.37 0.00 0.00 40.66 41.69 1vdl h LEU 15 CO -0.10 0.75 0.58 -0.61 -0.34 0.00 0.00 178.44 178.71 1vdl h GLN 16 N -1.00 0.36 -6.24 1.25 4.15 -0.62 -3.39 115.11 109.62 1vdl h GLN 16 Ca -0.02 -0.02 -0.59 0.00 0.77 0.00 0.00 58.65 58.79 1vdl h GLN 16 Cb 0.47 -0.08 0.17 0.00 0.21 0.00 0.00 27.48 28.25 1vdl h GLN 16 CO -0.01 0.24 -0.76 1.04 -1.93 0.00 0.00 178.83 177.41 1vdl n GLN 17 N -5.02 0.26 0.00 1.69 6.02 0.95 0.12 117.38 121.41 1vdl n GLN 17 Ca 0.31 0.10 0.00 0.00 -0.01 0.00 0.00 57.00 57.40 1vdl n GLN 17 Cb 0.94 -1.33 0.00 0.00 1.02 0.00 0.00 30.24 30.87 1vdl n GLN 17 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 1vdl n SER 18 N 1.55 0.00 -0.29 1.08 7.64 -1.26 -4.03 113.62 118.31 1vdl n SER 18 Ca 0.10 0.00 0.12 0.00 1.01 0.00 0.00 58.87 60.10 1vdl n SER 18 Cb 0.46 0.00 0.27 0.00 -1.01 0.00 0.00 64.21 63.93 1vdl n SER 18 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1vdl h ALA 19 N -0.05 1.22 -0.64 -0.43 0.00 -1.69 0.86 119.26 118.54 1vdl h ALA 19 Ca 0.00 0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1vdl h ALA 19 Cb 0.00 0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1vdl h ALA 19 CO 0.00 -0.45 0.42 0.00 0.00 0.00 0.00 179.25 179.22 1vdl h ALA 20 N 1.76 0.81 -0.13 0.00 0.00 0.78 -0.08 119.26 122.40 1vdl h ALA 20 Ca 0.53 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.43 1vdl h ALA 20 Cb 1.05 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1vdl h ALA 20 CO -0.64 0.24 0.19 1.96 0.00 0.00 0.00 179.25 181.00 1vdl h GLN 21 N 0.86 0.00 -2.85 0.00 1.08 0.49 -3.21 115.11 111.48 1vdl h GLN 21 Ca 0.23 0.00 -0.60 0.00 -1.45 0.00 0.00 58.65 56.83 1vdl h GLN 21 Cb -0.09 0.00 -0.40 0.00 -0.05 0.00 0.00 27.48 26.94 1vdl h GLN 21 CO -0.05 0.00 -0.77 0.15 -0.95 0.00 0.00 178.83 177.21 1vdl s LYS 22 N -4.50 1.27 -0.37 1.46 3.01 -0.05 -5.05 119.74 115.51 1vdl s LYS 22 Ca -0.05 -2.09 0.02 0.00 -1.01 0.00 0.00 55.97 52.85 1vdl s LYS 22 Cb 0.14 -2.18 0.11 0.00 -1.01 0.00 0.00 37.83 34.89 1vdl s LYS 22 CO 0.49 -1.22 0.12 -3.38 0.51 0.00 0.00 175.35 171.88 1vdl s HIS 23 N 0.19 2.77 0.10 3.18 -3.43 -1.18 -4.76 115.29 112.16 1vdl s HIS 23 Ca 0.21 -2.54 -0.35 0.00 -0.80 0.00 0.00 55.06 51.58 1vdl s HIS 23 Cb -0.17 -2.37 -0.16 0.00 -1.43 0.00 0.00 32.58 28.45 1vdl s HIS 23 CO -0.05 -0.88 1.55 0.37 -2.00 0.00 0.00 174.74 173.74 1vdl h GLN 24 N 7.49 -0.82 -0.85 -0.38 -0.00 -1.94 -0.39 115.11 118.23 1vdl h GLN 24 Ca -0.07 0.06 0.15 0.00 -0.00 0.00 0.00 58.65 58.79 1vdl h GLN 24 Cb 0.99 0.19 -0.15 0.00 0.00 0.00 0.00 27.48 28.50 1vdl h GLN 24 CO 0.52 -0.55 -0.29 0.37 0.00 0.00 0.00 178.83 178.88 1vdl h GLN 25 N -0.85 -0.03 -0.64 1.69 5.75 -1.99 1.50 115.11 120.53 1vdl h GLN 25 Ca -0.03 0.00 0.08 0.00 -0.15 0.00 0.00 58.65 58.55 1vdl h GLN 25 Cb 0.80 0.01 -0.04 0.00 1.07 0.00 0.00 27.48 29.32 1vdl h GLN 25 CO -0.21 -0.02 0.43 1.15 -2.65 0.00 0.00 178.83 177.53 1vdl h THR 26 N -0.03 0.96 0.58 2.39 2.02 -1.82 0.23 112.91 117.24 1vdl h THR 26 Ca 0.36 -0.20 -0.03 0.00 0.77 0.00 0.00 66.41 67.31 1vdl h THR 26 Cb 0.61 0.34 0.01 0.00 -1.74 0.00 0.00 68.15 67.36 1vdl h THR 26 CO -0.88 0.11 -0.28 0.15 0.37 0.00 0.00 175.52 174.99 1vdl h PHE 27 N 0.58 -0.73 -0.13 3.16 3.04 0.37 0.19 116.94 123.41 1vdl h PHE 27 Ca 0.29 -0.02 0.03 0.00 3.98 0.00 0.00 57.97 62.25 1vdl h PHE 27 Cb 0.37 0.24 -0.04 0.00 2.56 0.00 0.00 35.95 39.09 1vdl h PHE 27 CO -0.00 -0.40 -0.09 -0.07 -2.02 0.00 0.00 178.31 175.73 1vdl h LEU 28 N -1.09 -0.28 -1.08 0.59 3.38 -0.57 0.43 115.31 116.69 1vdl h LEU 28 Ca -0.08 0.06 0.09 0.00 0.09 0.00 0.00 57.88 58.05 1vdl h LEU 28 Cb 0.66 0.15 -0.07 0.00 0.09 0.00 0.00 40.66 41.48 1vdl h LEU 28 CO 0.13 -0.12 0.62 0.78 0.09 0.00 0.00 178.44 179.94 1vdl h ASN 29 N -0.09 0.92 0.13 -0.43 2.35 -0.59 0.77 115.58 118.63 1vdl h ASN 29 Ca 0.08 0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 55.85 1vdl h ASN 29 Cb 0.21 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.42 1vdl h ASN 29 CO -0.19 0.54 -0.06 1.56 -1.65 0.00 0.00 177.43 177.63 1vdl h GLN 30 N 1.01 -0.17 0.00 0.81 1.08 0.91 -2.16 115.11 116.60 1vdl h GLN 30 Ca 0.44 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.66 1vdl h GLN 30 Cb 0.36 0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.82 1vdl h GLN 30 CO -0.20 0.10 0.00 1.25 -0.95 0.00 0.00 178.83 179.03 1vdl h LEU 31 N -0.44 0.00 -0.09 1.46 5.85 0.56 0.28 115.31 122.93 1vdl h LEU 31 Ca -0.02 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.62 1vdl h LEU 31 Cb 0.35 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.38 1vdl h LEU 31 CO 0.03 0.00 -0.25 -0.09 -0.34 0.00 0.00 178.44 177.79 1vdl h ARG 32 N 0.00 0.32 0.08 1.25 2.43 0.11 -3.06 114.38 115.51 1vdl h ARG 32 Ca 0.00 -0.23 -0.18 0.00 -0.81 0.00 0.00 59.98 58.75 1vdl h ARG 32 Cb 0.29 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 1vdl h ARG 32 CO 0.00 0.85 -0.91 0.93 -1.51 0.00 0.00 179.97 179.32 1vdl h GLU 33 N -0.15 0.17 0.00 0.20 4.39 -0.96 0.11 114.58 118.35 1vdl h GLU 33 Ca -0.01 -0.30 0.00 0.00 0.34 0.00 0.00 59.36 59.40 1vdl h GLU 33 Cb 0.87 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.63 1vdl h GLU 33 CO 0.05 1.14 0.00 -0.89 -1.16 0.00 0.00 179.01 178.16 1vdl n ILE 34 N -4.20 0.00 0.69 3.13 5.41 0.95 -1.14 119.36 124.20 1vdl n ILE 34 Ca -0.20 1.46 0.13 0.00 1.00 0.00 0.00 62.75 65.15 1vdl n ILE 34 Cb 0.76 -2.00 0.37 0.00 -0.71 0.00 0.00 39.64 38.05 1vdl n ILE 34 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1vdl n THR 35 N -2.77 0.42 0.00 1.39 -2.24 -1.16 -4.91 114.28 105.01 1vdl n THR 35 Ca 0.00 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 1vdl n THR 35 Cb 0.00 -0.41 0.00 0.00 -2.10 0.00 0.00 70.33 67.82 1vdl n THR 35 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vdl n GLY 36 N 1.35 2.65 3.20 3.38 0.00 0.31 -5.00 105.19 111.08 1vdl n GLY 36 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 1vdl n GLY 36 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1vdl n ILE 37 N -2.00 0.18 0.01 -0.61 5.41 -0.70 -4.71 119.36 116.94 1vdl n ILE 37 Ca 0.00 -0.39 0.00 0.00 1.00 0.00 0.00 62.75 63.36 1vdl n ILE 37 Cb 0.00 -0.28 0.00 0.00 -0.71 0.00 0.00 39.64 38.65 1vdl n ILE 37 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 1vdl n ASN 38 N 1.43 0.12 -4.46 4.38 2.85 -1.26 -4.35 115.26 113.97 1vdl n ASN 38 Ca 0.03 0.04 -0.53 0.00 -0.11 0.00 0.00 54.58 54.01 1vdl n ASN 38 Cb 0.54 -0.02 -0.05 0.00 1.24 0.00 0.00 39.78 41.49 1vdl n ASN 38 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1vdl n ASP 39 N -2.96 -0.54 0.11 1.20 2.03 -1.26 -4.83 116.55 110.30 1vdl n ASP 39 Ca 0.00 1.14 0.04 0.00 0.52 0.00 0.00 54.79 56.49 1vdl n ASP 39 Cb 0.29 -0.95 0.01 0.00 -0.72 0.00 0.00 41.12 39.75 1vdl n ASP 39 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1vdl h ALA 40 N 2.06 0.68 0.00 -1.67 0.00 -1.98 -2.60 119.26 115.75 1vdl h ALA 40 Ca -0.40 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.05 1vdl h ALA 40 Cb 1.43 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.26 1vdl h ALA 40 CO 0.61 0.57 0.00 1.96 0.00 0.00 0.00 179.25 182.39 1vdl h GLN 41 N 0.00 0.00 0.03 0.00 7.50 -1.99 -0.46 115.11 120.19 1vdl h GLN 41 Ca -0.05 0.00 -0.39 0.00 0.50 0.00 0.00 58.65 58.71 1vdl h GLN 41 Cb 1.36 0.00 -0.06 0.00 0.05 0.00 0.00 27.48 28.83 1vdl h GLN 41 CO 0.05 0.00 -2.29 -0.89 -1.50 0.00 0.00 178.83 174.19 1vdl n ILE 42 N -2.67 1.56 0.07 2.54 5.41 -1.21 -3.39 119.36 121.68 1vdl n ILE 42 Ca 0.02 -0.50 -0.13 0.00 1.00 0.00 0.00 62.75 63.14 1vdl n ILE 42 Cb 0.31 -1.64 -0.08 0.00 -0.71 0.00 0.00 39.64 37.53 1vdl n ILE 42 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1vdl h LEU 43 N -0.29 -0.10 0.18 1.39 3.38 -1.41 -1.50 115.31 116.97 1vdl h LEU 43 Ca -0.56 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.34 1vdl h LEU 43 Cb 1.82 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 42.59 1vdl h LEU 43 CO -0.14 0.01 -0.12 1.56 0.09 0.00 0.00 178.44 179.84 1vdl h GLN 44 N -0.20 -0.28 -0.75 1.13 1.08 -1.29 -1.69 115.11 113.10 1vdl h GLN 44 Ca -0.01 0.02 0.17 0.00 -1.45 0.00 0.00 58.65 57.38 1vdl h GLN 44 Cb 0.17 0.06 -0.13 0.00 -0.05 0.00 0.00 27.48 27.53 1vdl h GLN 44 CO 0.02 -0.19 0.02 1.96 -0.95 0.00 0.00 178.83 179.69 1vdl h GLN 45 N -0.30 0.11 -0.28 1.46 1.08 -1.55 1.43 115.11 117.06 1vdl h GLN 45 Ca -0.02 -0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 57.16 1vdl h GLN 45 Cb 0.25 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.64 1vdl h GLN 45 CO 0.01 0.07 0.11 0.00 -0.95 0.00 0.00 178.83 178.07 1vdl h ALA 46 N 1.70 1.66 -0.00 3.87 0.00 -0.86 -0.45 119.26 125.18 1vdl h ALA 46 Ca 0.41 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.23 1vdl h ALA 46 Cb 0.73 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1vdl h ALA 46 CO -0.65 0.27 -0.00 1.25 0.00 0.00 0.00 179.25 180.11 1vdl h LEU 47 N 0.40 0.00 0.05 0.00 5.85 0.23 -1.87 115.31 119.98 1vdl h LEU 47 Ca 0.10 -0.70 0.02 0.00 0.84 0.00 0.00 57.88 58.13 1vdl h LEU 47 Cb 0.10 -0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.08 1vdl h LEU 47 CO -0.01 0.71 -0.49 0.50 -0.34 0.00 0.00 178.44 178.81 1vdl h LYS 48 N -0.70 -0.63 0.06 1.25 3.64 0.17 0.44 116.57 120.81 1vdl h LYS 48 Ca -0.00 0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.44 1vdl h LYS 48 Cb 0.71 0.14 -0.05 0.00 -0.41 0.00 0.00 32.23 32.62 1vdl h LYS 48 CO 0.00 -0.42 -0.48 -0.44 -2.27 0.00 0.00 179.45 175.84 1vdl h ASP 49 N -0.65 -1.45 -1.35 4.20 5.19 -1.20 0.27 116.42 121.42 1vdl h ASP 49 Ca 0.00 0.16 0.39 0.00 -0.62 0.00 0.00 57.03 56.96 1vdl h ASP 49 Cb 0.68 0.54 -0.06 0.00 0.18 0.00 0.00 39.33 40.67 1vdl h ASP 49 CO -0.30 -0.49 0.96 0.77 -3.12 0.00 0.00 179.24 177.07 1vdl h SER 50 N -0.64 0.05 0.00 6.45 4.64 -0.94 -3.44 113.55 119.67 1vdl h SER 50 Ca 0.00 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1vdl h SER 50 Cb 0.66 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 1vdl h SER 50 CO -0.28 -0.00 0.00 -3.20 -0.87 0.00 0.00 176.83 172.47 1vdl n ASN 51 N -4.19 -3.25 0.00 4.97 5.15 0.15 -3.58 115.26 114.51 1vdl n ASN 51 Ca 0.30 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.28 1vdl n ASN 51 Cb 1.40 -0.93 0.00 0.00 -0.53 0.00 0.00 39.78 39.72 1vdl n ASN 51 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1vdl n GLY 52 N -2.36 1.24 2.71 8.20 0.00 -1.03 -5.01 105.19 108.94 1vdl n GLY 52 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1vdl n GLY 52 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1vdl s ASN 53 N -2.00 3.93 0.16 1.61 -0.87 -1.23 -5.00 114.94 111.53 1vdl s ASN 53 Ca 0.00 -1.74 -0.21 0.00 -1.57 0.00 0.00 52.86 49.34 1vdl s ASN 53 Cb 0.00 -0.84 0.05 0.00 -0.02 0.00 0.00 41.25 40.44 1vdl s ASN 53 CO 0.00 -0.40 1.63 0.25 -2.57 0.00 0.00 177.10 176.01 1vdl h LEU 54 N 7.93 -0.75 -1.79 0.60 5.85 -1.93 0.56 115.31 125.78 1vdl h LEU 54 Ca -0.12 0.14 0.34 0.00 0.84 0.00 0.00 57.88 59.08 1vdl h LEU 54 Cb 1.00 0.37 -0.05 0.00 0.37 0.00 0.00 40.66 42.36 1vdl h LEU 54 CO 0.46 -0.26 0.97 -0.33 -0.34 0.00 0.00 178.44 178.94 1vdl h GLU 55 N -0.21 0.00 0.10 1.25 5.08 -1.98 1.85 114.58 120.67 1vdl h GLU 55 Ca 0.15 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.18 1vdl h GLU 55 Cb 0.45 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 1vdl h GLU 55 CO -0.42 0.00 -1.83 -0.07 -1.00 0.00 0.00 179.01 175.69 1vdl h LEU 56 N 0.00 0.33 -0.82 1.33 -0.00 -0.45 -2.83 115.31 112.87 1vdl h LEU 56 Ca 0.55 -0.66 -0.12 0.00 -0.00 0.00 0.00 57.88 57.66 1vdl h LEU 56 Cb 2.49 -0.11 -0.01 0.00 -0.00 0.00 0.00 40.66 43.03 1vdl h LEU 56 CO -0.01 1.58 -0.37 0.00 -0.00 0.00 0.00 178.44 179.65 1vdl h ALA 57 N 0.37 0.99 -0.15 1.53 0.00 0.51 0.52 119.26 123.04 1vdl h ALA 57 Ca -0.35 -0.41 -0.16 0.00 0.00 0.00 0.00 54.91 53.99 1vdl h ALA 57 Cb 2.03 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 19.72 1vdl h ALA 57 CO 0.11 0.61 -0.54 0.28 0.00 0.00 0.00 179.25 179.70 1vdl h VAL 58 N 0.37 1.33 0.81 0.00 2.07 0.21 -2.99 116.25 118.05 1vdl h VAL 58 Ca 0.04 -1.81 -0.04 0.00 0.82 0.00 0.00 66.70 65.71 1vdl h VAL 58 Cb 0.82 2.04 0.01 0.00 -1.52 0.00 0.00 31.29 32.64 1vdl h VAL 58 CO 0.07 0.56 -0.39 0.00 0.02 0.00 0.00 177.57 177.82 1vdl h ALA 59 N 0.53 -1.09 -0.58 1.67 0.00 -1.32 0.60 119.26 119.06 1vdl h ALA 59 Ca -0.03 -0.25 0.17 0.00 0.00 0.00 0.00 54.91 54.81 1vdl h ALA 59 Cb 1.17 0.42 -0.02 0.00 0.00 0.00 0.00 17.79 19.36 1vdl h ALA 59 CO 0.11 -1.06 0.82 0.74 0.00 0.00 0.00 179.25 179.87 1vdl h PHE 60 N -1.20 0.00 0.00 0.00 0.04 -0.98 1.44 116.94 116.23 1vdl h PHE 60 Ca -0.11 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.66 1vdl h PHE 60 Cb 0.85 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.00 1vdl h PHE 60 CO -0.00 0.00 -0.40 -0.07 -0.60 0.00 0.00 178.31 177.23 1vdl h LEU 61 N 0.00 0.00 -2.14 1.54 3.38 -1.23 -3.36 115.31 113.51 1vdl h LEU 61 Ca 0.28 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.29 1vdl h LEU 61 Cb 1.92 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.67 1vdl h LEU 61 CO -0.00 0.62 0.30 0.71 0.09 0.00 0.00 178.44 180.16 1vdl h THR 62 N -0.84 0.20 0.00 0.22 1.35 0.16 1.38 112.91 115.38 1vdl h THR 62 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1vdl h THR 62 Cb 0.40 0.73 0.00 0.00 -1.73 0.00 0.00 68.15 67.55 1vdl h THR 62 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 1vdl n ALA 63 N -2.12 1.93 0.01 6.62 0.00 0.48 -3.75 120.51 123.68 1vdl n ALA 63 Ca 0.01 -0.07 -0.03 0.00 0.00 0.00 0.00 53.44 53.35 1vdl n ALA 63 Cb 0.40 -1.33 -0.01 0.00 0.00 0.00 0.00 19.45 18.51 1vdl n ALA 63 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1vdl n LYS 64 N -1.49 0.09 -3.16 0.00 4.81 0.44 -4.89 118.16 113.96 1vdl n LYS 64 Ca 0.05 0.04 -0.46 0.00 -0.87 0.00 0.00 58.31 57.07 1vdl n LYS 64 Cb 0.23 -0.66 -0.02 0.00 0.02 0.00 0.00 35.03 34.60 1vdl n LYS 64 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 1vdl s ASN 65 N -5.82 6.73 0.45 3.14 0.01 0.10 -4.99 114.94 114.57 1vdl s ASN 65 Ca -0.05 -2.46 0.03 0.00 -0.71 0.00 0.00 52.86 49.67 1vdl s ASN 65 Cb 0.01 -2.29 -0.01 0.00 0.41 0.00 0.00 41.25 39.37 1vdl s ASN 65 CO 0.08 -0.77 0.11 0.00 -1.51 0.00 0.00 177.10 175.00 1vdl n ALA 66 N 5.03 0.55 -2.17 0.60 0.00 -1.25 -4.38 120.51 118.90 1vdl n ALA 66 Ca 0.19 -2.21 -0.42 0.00 0.00 0.00 0.00 53.44 51.01 1vdl n ALA 66 Cb 0.48 1.40 -0.03 0.00 0.00 0.00 0.00 19.45 21.29 1vdl n ALA 66 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1vdl s LYS 67 N -3.69 4.39 0.26 0.00 1.02 -1.26 -5.00 119.74 115.46 1vdl s LYS 67 Ca 0.15 1.96 -0.21 0.00 0.02 0.00 0.00 55.97 57.89 1vdl s LYS 67 Cb 0.01 -3.26 -0.09 0.00 -0.52 0.00 0.00 37.83 33.97 1vdl s LYS 67 CO 0.11 -0.29 0.79 -0.08 -0.92 0.00 0.00 175.35 174.96 1vdl s THR 68 N 0.64 4.47 0.95 2.17 -1.32 -1.26 -5.07 115.64 116.23 1vdl s THR 68 Ca 0.59 1.42 -0.14 0.00 -1.21 0.00 0.00 61.69 62.35 1vdl s THR 68 Cb -0.34 -3.88 0.16 0.00 -1.51 0.00 0.00 72.50 66.93 1vdl s THR 68 CO 0.33 0.16 1.16 -2.16 -2.21 0.00 0.00 174.62 171.90 1vdl s PRO 69 N -2.06 0.78 -1.05 7.08 0.04 -1.26 -4.88 135.00 133.65 1vdl s PRO 69 Ca 0.46 0.15 -0.07 0.00 0.04 0.00 0.00 61.00 61.58 1vdl s PRO 69 Cb -0.17 -1.81 -0.09 0.00 0.04 0.00 0.00 34.50 32.48 1vdl s PRO 69 CO 0.21 -2.41 2.53 -0.35 0.04 0.00 0.00 177.00 177.02 1vdl n PRO 70 N -3.89 2.61 -4.92 0.56 -0.04 -1.26 -4.82 135.00 123.24 1vdl n PRO 70 Ca 0.08 -1.63 -0.27 0.00 -0.04 0.00 0.00 63.50 61.64 1vdl n PRO 70 Cb 0.59 -2.50 -0.15 0.00 -0.04 0.00 0.00 33.50 31.40 1vdl n PRO 70 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 1vdl s GLN 71 N 2.69 1.64 -0.08 0.54 0.74 -1.26 -5.13 119.66 118.79 1vdl s GLN 71 Ca 0.52 -0.86 -0.04 0.00 0.05 0.00 0.00 55.36 55.04 1vdl s GLN 71 Cb 0.15 -1.66 -0.04 0.00 1.10 0.00 0.00 33.01 32.56 1vdl s GLN 71 CO -0.04 0.44 0.08 -2.00 -0.55 0.00 0.00 175.29 173.22 1vdl s GLU 72 N -0.79 3.20 0.00 1.67 2.56 -1.26 -5.05 118.70 119.04 1vdl s GLU 72 Ca 0.08 -0.31 0.00 0.00 0.00 0.00 0.00 54.97 54.75 1vdl s GLU 72 Cb -0.09 -2.98 0.00 0.00 2.00 0.00 0.00 34.13 33.07 1vdl s GLU 72 CO 0.00 0.72 0.00 -1.91 -0.56 0.00 0.00 175.26 173.52 1vdl n GLU 73 N 1.85 0.00 -3.77 4.30 2.13 -1.26 -5.17 120.64 118.72 1vdl n GLU 73 Ca -0.18 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.51 1vdl n GLU 73 Cb 0.54 0.00 -0.10 0.00 0.27 0.00 0.00 31.44 32.15 1vdl n GLU 73 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 1vdl s THR 74 N 0.00 0.03 -0.03 6.31 2.01 -1.26 -5.08 115.64 117.62 1vdl s THR 74 Ca 0.00 -0.23 -0.08 0.00 0.31 0.00 0.00 61.69 61.70 1vdl s THR 74 Cb 0.00 -0.51 -0.04 0.00 0.01 0.00 0.00 72.50 71.96 1vdl s THR 74 CO 0.00 -0.12 0.43 0.28 -0.69 0.00 0.00 174.62 174.52 1vdl h SER 75 N 4.87 -0.23 -3.15 3.53 0.02 -2.08 -3.50 113.55 113.01 1vdl h SER 75 Ca -0.28 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 1vdl h SER 75 Cb 1.18 0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.78 1vdl h SER 75 CO 0.35 0.05 -0.10 0.61 -1.14 0.00 0.00 176.83 176.59 1vdl n GLY 76 N 0.81 -3.05 3.81 -3.77 0.00 -1.26 -5.03 105.19 96.70 1vdl n GLY 76 Ca -0.03 -0.21 -0.33 0.00 0.00 0.00 0.00 46.02 45.45 1vdl n GLY 76 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1vdl s PRO 77 N -0.64 3.40 -0.07 1.61 0.04 -1.26 -5.01 135.00 133.07 1vdl s PRO 77 Ca -0.01 1.17 -0.10 0.00 0.04 0.00 0.00 61.00 62.10 1vdl s PRO 77 Cb 0.00 -2.05 -0.04 0.00 0.04 0.00 0.00 34.50 32.46 1vdl s PRO 77 CO 0.06 -0.74 -0.20 0.45 0.04 0.00 0.00 177.00 176.61 1vdl n SER 78 N -1.97 1.55 -2.19 6.66 2.88 -1.26 -5.12 113.62 114.18 1vdl n SER 78 Ca 0.08 0.24 -0.01 0.00 -1.33 0.00 0.00 58.87 57.86 1vdl n SER 78 Cb 0.53 -0.56 -0.01 0.00 -0.75 0.00 0.00 64.21 63.42 1vdl n SER 78 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1vdl n SER 79 N -4.02 -6.11 -0.55 -3.46 2.88 -1.26 -5.37 113.62 95.73 1vdl n SER 79 Ca -0.10 1.42 0.07 0.00 -1.33 0.00 0.00 58.87 58.93 1vdl n SER 79 Cb 0.33 -4.49 0.06 0.00 -0.75 0.00 0.00 64.21 59.35 1vdl n SER 79 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42