#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vdl n SER 2 N 0.00 -8.49 -4.11 1.61 2.88 -1.26 -5.05 113.62 99.20 1vdl n SER 2 Ca 0.00 1.85 -0.11 0.00 -1.33 0.00 0.00 58.87 59.29 1vdl n SER 2 Cb 0.00 -5.08 -0.08 0.00 -0.75 0.00 0.00 64.21 58.29 1vdl n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1vdl s SER 3 N -5.30 0.09 -0.23 -3.46 0.15 -1.26 -5.17 113.70 98.52 1vdl s SER 3 Ca 0.00 -1.18 -0.15 0.00 0.70 0.00 0.00 55.95 55.32 1vdl s SER 3 Cb 0.00 0.43 0.07 0.00 -1.71 0.00 0.00 66.02 64.81 1vdl s SER 3 CO 0.00 -0.91 0.57 -0.83 1.20 0.00 0.00 173.24 173.27 1vdl s GLY 4 N -3.08 -0.48 0.11 9.45 0.00 -1.26 -5.17 107.32 106.88 1vdl s GLY 4 Ca 0.30 1.92 0.01 0.00 0.00 0.00 0.00 44.72 46.95 1vdl s GLY 4 CO 0.08 1.90 -0.03 -0.45 0.00 0.00 0.00 173.10 174.61 1vdl s SER 5 N 1.20 0.91 0.46 1.64 0.15 -1.26 -5.10 113.70 111.70 1vdl s SER 5 Ca -0.07 -1.07 0.00 0.00 0.70 0.00 0.00 55.95 55.51 1vdl s SER 5 Cb -0.06 0.15 0.00 0.00 -1.71 0.00 0.00 66.02 64.40 1vdl s SER 5 CO -0.12 -0.55 0.00 -1.20 1.20 0.00 0.00 173.24 172.57 1vdl n SER 6 N -0.07 -6.01 0.00 5.45 7.64 -1.26 -5.04 113.62 114.33 1vdl n SER 6 Ca -0.10 1.22 0.00 0.00 1.01 0.00 0.00 58.87 60.99 1vdl n SER 6 Cb 0.62 -3.63 0.00 0.00 -1.01 0.00 0.00 64.21 60.19 1vdl n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vdl n GLY 7 N -3.17 0.80 3.51 0.23 0.00 -1.26 -5.17 105.19 100.13 1vdl n GLY 7 Ca -0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.87 1vdl n GLY 7 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1vdl s MET 8 N 1.99 0.87 0.19 1.61 0.00 -1.26 -5.18 119.30 117.52 1vdl s MET 8 Ca 0.00 -0.18 0.05 0.00 0.00 0.00 0.00 55.69 55.55 1vdl s MET 8 Cb 0.00 0.41 -0.05 0.00 0.00 0.00 0.00 34.83 35.19 1vdl s MET 8 CO 0.00 -0.35 -0.08 0.95 0.00 0.00 0.00 175.02 175.54 1vdl s THR 9 N -2.64 1.26 -0.41 3.16 -4.23 -1.26 -5.03 115.64 106.48 1vdl s THR 9 Ca 0.01 -2.08 0.06 0.00 -1.18 0.00 0.00 61.69 58.50 1vdl s THR 9 Cb -0.01 -2.06 0.68 0.00 1.34 0.00 0.00 72.50 72.45 1vdl s THR 9 CO -0.06 -0.57 1.87 0.55 -0.54 0.00 0.00 174.62 175.87 1vdl n VAL 10 N -0.32 3.11 -0.04 2.29 3.14 -1.26 -4.41 118.33 120.84 1vdl n VAL 10 Ca -0.08 -1.92 0.00 0.00 -2.96 0.00 0.00 64.34 59.38 1vdl n VAL 10 Cb 0.62 -0.44 0.19 0.00 -1.06 0.00 0.00 33.84 33.15 1vdl n VAL 10 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1vdl n GLU 11 N -0.95 2.77 -2.10 1.45 1.02 -1.26 -3.86 120.64 117.72 1vdl n GLU 11 Ca 0.54 -1.66 -0.10 0.00 -0.02 0.00 0.00 57.16 55.93 1vdl n GLU 11 Cb 1.58 -1.85 0.05 0.00 -0.02 0.00 0.00 31.44 31.21 1vdl n GLU 11 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1vdl n GLN 12 N 0.18 2.43 0.00 3.49 3.00 -1.26 -4.75 117.38 120.47 1vdl n GLN 12 Ca 0.18 -3.66 0.00 0.00 -0.01 0.00 0.00 57.00 53.51 1vdl n GLN 12 Cb 0.84 -1.78 0.00 0.00 0.00 0.00 0.00 30.24 29.30 1vdl n GLN 12 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 1vdl n ASN 13 N -0.62 0.55 -0.31 1.08 5.15 -1.25 -4.56 115.26 115.30 1vdl n ASN 13 Ca 0.25 0.00 0.17 0.00 -0.60 0.00 0.00 54.58 54.40 1vdl n ASN 13 Cb 0.90 0.00 0.35 0.00 -0.53 0.00 0.00 39.78 40.50 1vdl n ASN 13 CO 0.00 0.00 0.00 0.58 1.40 0.00 0.00 177.26 179.24 1vdl h VAL 14 N 0.00 0.31 -0.10 3.44 2.07 -1.85 1.55 116.25 121.67 1vdl h VAL 14 Ca 0.00 -0.09 -0.17 0.00 0.82 0.00 0.00 66.70 67.26 1vdl h VAL 14 Cb 0.37 0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 1vdl h VAL 14 CO 0.00 0.05 -0.66 0.17 0.02 0.00 0.00 177.57 177.14 1vdl h LEU 15 N 0.26 0.45 -2.74 2.57 8.10 -1.88 -2.79 115.31 119.28 1vdl h LEU 15 Ca 0.62 -0.28 -0.14 0.00 0.11 0.00 0.00 57.88 58.19 1vdl h LEU 15 Cb 1.30 -0.13 -0.08 0.00 -0.44 0.00 0.00 40.66 41.30 1vdl h LEU 15 CO -0.64 0.99 0.18 0.00 -4.11 0.00 0.00 178.44 174.86 1vdl n GLN 16 N -3.87 2.41 -1.11 0.17 3.00 0.48 -4.97 117.38 113.50 1vdl n GLN 16 Ca -0.04 -1.68 -0.36 0.00 -0.01 0.00 0.00 57.00 54.92 1vdl n GLN 16 Cb 0.66 -1.78 0.07 0.00 0.00 0.00 0.00 30.24 29.19 1vdl n GLN 16 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.06 178.00 1vdl n GLN 17 N -0.03 0.08 0.00 -1.09 0.00 0.18 -0.16 117.38 116.37 1vdl n GLN 17 Ca 0.24 0.06 0.00 0.00 -0.00 0.00 0.00 57.00 57.30 1vdl n GLN 17 Cb 0.96 -1.59 0.00 0.00 0.00 0.00 0.00 30.24 29.61 1vdl n GLN 17 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 1vdl n SER 18 N 0.48 0.00 -0.32 1.69 7.64 -1.26 -4.03 113.62 117.82 1vdl n SER 18 Ca 0.07 0.00 0.17 0.00 1.01 0.00 0.00 58.87 60.12 1vdl n SER 18 Cb 0.51 0.00 0.37 0.00 -1.01 0.00 0.00 64.21 64.08 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 -0.03 1.64 -0.48 -0.43 0.00 -1.85 1.46 119.26 119.57 1vdl h ALA 19 Ca 0.00 0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 1vdl h ALA 19 Cb 0.00 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1vdl h ALA 19 CO 0.00 -0.40 0.08 0.00 0.00 0.00 0.00 179.25 178.93 1vdl h ALA 20 N 1.76 1.23 -0.14 0.00 0.00 -0.69 -1.70 119.26 119.73 1vdl h ALA 20 Ca 0.63 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 55.27 1vdl h ALA 20 Cb 1.27 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1vdl h ALA 20 CO -0.55 0.52 -0.15 1.96 0.00 0.00 0.00 179.25 181.03 1vdl h GLN 21 N 0.72 0.23 -2.18 0.00 1.08 0.17 -3.21 115.11 111.91 1vdl h GLN 21 Ca 0.15 -0.05 -0.60 0.00 -1.45 0.00 0.00 58.65 56.71 1vdl h GLN 21 Cb 0.33 -0.03 -0.42 0.00 -0.05 0.00 0.00 27.48 27.31 1vdl h GLN 21 CO 0.00 0.38 -0.64 1.63 -0.95 0.00 0.00 178.83 179.26 1vdl n LYS 22 N -4.26 2.46 -3.49 1.46 4.01 -0.23 -5.01 118.16 113.10 1vdl n LYS 22 Ca -0.01 -4.58 -0.42 0.00 -0.51 0.00 0.00 58.31 52.79 1vdl n LYS 22 Cb 0.28 -2.18 -0.07 0.00 -0.51 0.00 0.00 35.03 32.55 1vdl n LYS 22 CO 0.00 0.00 0.00 -3.38 -1.11 0.00 0.00 177.40 172.91 1vdl s HIS 23 N -2.49 3.38 0.06 2.13 -3.43 -0.99 -4.83 115.29 109.12 1vdl s HIS 23 Ca 0.41 -1.73 -0.36 0.00 -0.80 0.00 0.00 55.06 52.57 1vdl s HIS 23 Cb 0.17 -3.58 -0.20 0.00 -1.43 0.00 0.00 32.58 27.54 1vdl s HIS 23 CO -0.03 -1.00 1.54 0.37 -2.00 0.00 0.00 174.74 173.62 1vdl h GLN 24 N 8.55 -1.26 -0.85 -0.38 4.15 -1.94 -1.79 115.11 121.60 1vdl h GLN 24 Ca -0.23 0.09 0.13 0.00 0.77 0.00 0.00 58.65 59.41 1vdl h GLN 24 Cb 1.08 0.29 -0.14 0.00 0.21 0.00 0.00 27.48 28.91 1vdl h GLN 24 CO 0.91 -0.84 -0.40 0.37 -1.93 0.00 0.00 178.83 176.94 1vdl h GLN 25 N -1.31 -0.06 -1.00 1.69 5.75 -1.99 1.06 115.11 119.24 1vdl h GLN 25 Ca -0.13 0.00 0.17 0.00 -0.15 0.00 0.00 58.65 58.54 1vdl h GLN 25 Cb 1.00 0.01 -0.10 0.00 1.07 0.00 0.00 27.48 29.47 1vdl h GLN 25 CO 0.22 -0.04 0.62 1.15 -2.65 0.00 0.00 178.83 178.12 1vdl h THR 26 N -0.07 0.78 0.87 2.39 2.02 -1.96 0.14 112.91 117.08 1vdl h THR 26 Ca 0.29 -0.28 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 1vdl h THR 26 Cb 0.57 -0.11 0.01 0.00 -1.74 0.00 0.00 68.15 66.87 1vdl h THR 26 CO -0.88 0.15 -0.42 0.15 0.37 0.00 0.00 175.52 174.90 1vdl h PHE 27 N 0.82 -1.08 -0.35 3.16 3.04 0.20 0.33 116.94 123.06 1vdl h PHE 27 Ca 0.54 -0.03 0.07 0.00 3.98 0.00 0.00 57.97 62.54 1vdl h PHE 27 Cb 0.78 0.36 -0.06 0.00 2.56 0.00 0.00 35.95 39.58 1vdl h PHE 27 CO -0.00 -0.67 -0.06 -0.07 -2.02 0.00 0.00 178.31 175.48 1vdl h LEU 28 N -1.20 -0.28 -1.32 0.59 3.38 -0.45 0.41 115.31 116.44 1vdl h LEU 28 Ca -0.12 0.10 0.08 0.00 0.09 0.00 0.00 57.88 58.03 1vdl h LEU 28 Cb 0.90 0.20 -0.05 0.00 0.09 0.00 0.00 40.66 41.80 1vdl h LEU 28 CO 0.20 -0.10 0.52 0.78 0.09 0.00 0.00 178.44 179.93 1vdl h ASN 29 N 0.02 0.71 0.09 -0.43 2.35 -0.65 0.97 115.58 118.64 1vdl h ASN 29 Ca 0.17 0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.93 1vdl h ASN 29 Cb 0.26 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.49 1vdl h ASN 29 CO -0.34 0.44 -0.04 1.56 -1.65 0.00 0.00 177.43 177.40 1vdl h GLN 30 N 0.80 -0.11 0.00 0.81 4.20 0.26 -2.55 115.11 118.51 1vdl h GLN 30 Ca 0.35 0.01 0.00 0.00 0.06 0.00 0.00 58.65 59.07 1vdl h GLN 30 Cb 0.33 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.13 1vdl h GLN 30 CO -0.13 0.22 0.00 1.25 -0.67 0.00 0.00 178.83 179.50 1vdl h LEU 31 N -0.45 0.00 -0.46 1.46 5.85 0.42 -1.14 115.31 120.99 1vdl h LEU 31 Ca -0.01 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.63 1vdl h LEU 31 Cb 0.38 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 1vdl h LEU 31 CO 0.02 0.00 -0.01 -0.09 -0.34 0.00 0.00 178.44 178.02 1vdl h ARG 32 N 0.00 0.82 0.00 1.25 2.43 0.14 -2.76 114.38 116.26 1vdl h ARG 32 Ca 0.00 -0.27 -0.13 0.00 -0.81 0.00 0.00 59.98 58.77 1vdl h ARG 32 Cb 0.39 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 1vdl h ARG 32 CO 0.00 0.88 -0.75 0.93 -1.51 0.00 0.00 179.97 179.52 1vdl h GLU 33 N 0.67 0.00 0.00 0.20 4.39 -1.29 -0.49 114.58 118.05 1vdl h GLU 33 Ca 0.13 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.83 1vdl h GLU 33 Cb 0.52 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.17 1vdl h GLU 33 CO 0.03 0.95 0.00 -0.89 -1.16 0.00 0.00 179.01 177.94 1vdl n ILE 34 N -4.51 0.00 0.54 3.13 5.41 -0.46 -0.61 119.36 122.86 1vdl n ILE 34 Ca -0.23 1.39 0.13 0.00 1.00 0.00 0.00 62.75 65.04 1vdl n ILE 34 Cb 0.58 -1.87 0.36 0.00 -0.71 0.00 0.00 39.64 37.99 1vdl n ILE 34 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 1vdl h THR 35 N 0.00 0.00 0.00 1.39 1.35 -1.70 -3.47 112.91 110.49 1vdl h THR 35 Ca 0.00 -0.59 0.00 0.00 -0.55 0.00 0.00 66.41 65.27 1vdl h THR 35 Cb 0.00 1.59 0.00 0.00 -1.73 0.00 0.00 68.15 68.01 1vdl h THR 35 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1vdl n GLY 36 N 1.26 2.49 3.48 5.82 0.00 0.22 -5.00 105.19 113.46 1vdl n GLY 36 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 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 1.21 0.01 -0.61 5.41 -0.87 -4.76 119.36 117.75 1vdl n ILE 37 Ca 0.00 -0.30 0.00 0.00 1.00 0.00 0.00 62.75 63.45 1vdl n ILE 37 Cb 0.00 -0.76 0.00 0.00 -0.71 0.00 0.00 39.64 38.17 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 -1.04 0.25 -4.45 4.38 5.15 -1.26 -4.33 115.26 113.96 1vdl n ASN 38 Ca 0.09 0.04 -0.48 0.00 -0.60 0.00 0.00 54.58 53.63 1vdl n ASN 38 Cb 0.51 -0.07 -0.03 0.00 -0.53 0.00 0.00 39.78 39.66 1vdl n ASN 38 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 1vdl n ASP 39 N -3.10 -0.52 0.06 1.20 -0.08 -1.26 -4.85 116.55 108.00 1vdl n ASP 39 Ca 0.00 1.14 -0.00 0.00 -1.51 0.00 0.00 54.79 54.42 1vdl n ASP 39 Cb 0.36 -1.03 -0.06 0.00 2.34 0.00 0.00 41.12 42.73 1vdl n ASP 39 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1vdl h ALA 40 N 1.43 0.64 0.00 -1.67 0.00 -1.98 -2.80 119.26 114.88 1vdl h ALA 40 Ca -0.32 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 53.81 1vdl h ALA 40 Cb 1.41 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.35 1vdl h ALA 40 CO 0.59 0.90 0.00 1.96 0.00 0.00 0.00 179.25 182.70 1vdl h GLN 41 N 0.00 0.00 0.03 0.00 4.20 -1.99 0.99 115.11 118.34 1vdl h GLN 41 Ca -0.11 0.00 -0.39 0.00 0.06 0.00 0.00 58.65 58.21 1vdl h GLN 41 Cb 1.57 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 29.29 1vdl h GLN 41 CO 0.06 0.00 -2.31 -0.89 -0.67 0.00 0.00 178.83 175.02 1vdl n ILE 42 N -2.66 1.57 0.01 2.54 5.41 -1.23 -3.33 119.36 121.67 1vdl n ILE 42 Ca 0.01 -0.53 -0.12 0.00 1.00 0.00 0.00 62.75 63.12 1vdl n ILE 42 Cb 0.25 -1.61 -0.07 0.00 -0.71 0.00 0.00 39.64 37.51 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 -0.21 0.06 0.25 1.39 3.38 -1.34 -2.16 115.31 116.68 1vdl h LEU 43 Ca -0.55 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.25 1vdl h LEU 43 Cb 1.85 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.58 1vdl h LEU 43 CO -0.11 0.20 -0.12 1.56 0.09 0.00 0.00 178.44 180.06 1vdl h GLN 44 N -0.09 -0.32 -0.89 1.13 1.08 -1.02 -1.16 115.11 113.84 1vdl h GLN 44 Ca 0.01 0.02 0.24 0.00 -1.45 0.00 0.00 58.65 57.48 1vdl h GLN 44 Cb 0.16 0.07 -0.15 0.00 -0.05 0.00 0.00 27.48 27.52 1vdl h GLN 44 CO -0.00 -0.18 0.19 1.96 -0.95 0.00 0.00 178.83 179.84 1vdl h GLN 45 N -0.38 0.15 -0.32 1.46 1.08 -1.54 1.35 115.11 116.91 1vdl h GLN 45 Ca -0.03 -0.01 -0.04 0.00 -1.45 0.00 0.00 58.65 57.12 1vdl h GLN 45 Cb 0.29 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.67 1vdl h GLN 45 CO 0.06 0.10 0.04 0.00 -0.95 0.00 0.00 178.83 178.07 1vdl h ALA 46 N 1.82 0.43 0.41 3.87 0.00 -1.01 -1.40 119.26 123.37 1vdl h ALA 46 Ca 0.56 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 55.24 1vdl h ALA 46 Cb 1.13 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1vdl h ALA 46 CO -0.71 0.14 -0.20 1.25 0.00 0.00 0.00 179.25 179.74 1vdl h LEU 47 N 0.36 -0.46 -0.39 0.00 5.85 0.15 0.65 115.31 121.46 1vdl h LEU 47 Ca 0.10 -0.00 0.07 0.00 0.84 0.00 0.00 57.88 58.88 1vdl h LEU 47 Cb 0.37 0.12 -0.09 0.00 0.37 0.00 0.00 40.66 41.43 1vdl h LEU 47 CO 0.01 -0.30 -0.44 0.50 -0.34 0.00 0.00 178.44 177.87 1vdl h LYS 48 N -0.58 -0.33 0.15 1.25 3.64 0.15 0.78 116.57 121.63 1vdl h LYS 48 Ca -0.06 0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.36 1vdl h LYS 48 Cb 0.44 0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 32.29 1vdl h LYS 48 CO 0.09 -0.22 -0.52 -0.44 -2.27 0.00 0.00 179.45 176.09 1vdl h ASP 49 N -0.34 -1.55 -1.01 4.20 3.32 -1.10 0.16 116.42 120.10 1vdl h ASP 49 Ca 0.13 0.16 0.28 0.00 0.02 0.00 0.00 57.03 57.62 1vdl h ASP 49 Cb 0.59 0.57 -0.06 0.00 0.22 0.00 0.00 39.33 40.65 1vdl h ASP 49 CO -0.57 -0.56 0.70 0.77 -1.72 0.00 0.00 179.24 177.86 1vdl h SER 50 N -0.77 0.16 0.00 6.45 4.64 0.17 -3.44 113.55 120.76 1vdl h SER 50 Ca -0.01 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1vdl h SER 50 Cb 0.76 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 1vdl h SER 50 CO -0.27 0.04 0.00 -3.20 -0.87 0.00 0.00 176.83 172.53 1vdl n ASN 51 N -4.36 -2.75 0.00 4.97 5.15 0.26 -3.69 115.26 114.85 1vdl n ASN 51 Ca 0.22 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.20 1vdl n ASN 51 Cb 0.99 -0.52 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 -2.81 1.58 2.79 8.20 0.00 -1.10 -5.00 105.19 108.84 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 4.18 0.15 1.61 -0.87 -1.24 -5.00 114.94 111.77 1vdl s ASN 53 Ca 0.00 -1.79 -0.22 0.00 -1.57 0.00 0.00 52.86 49.28 1vdl s ASN 53 Cb 0.00 -1.04 0.03 0.00 -0.02 0.00 0.00 41.25 40.22 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 -0.74 -1.80 0.60 5.85 -1.95 0.45 115.31 125.65 1vdl h LEU 54 Ca -0.11 0.13 0.41 0.00 0.84 0.00 0.00 57.88 59.15 1vdl h LEU 54 Cb 1.01 0.35 -0.08 0.00 0.37 0.00 0.00 40.66 42.32 1vdl h LEU 54 CO 0.48 -0.27 0.98 -0.33 -0.34 0.00 0.00 178.44 178.96 1vdl h GLU 55 N -0.24 0.07 0.13 1.25 5.08 -1.98 1.45 114.58 120.32 1vdl h GLU 55 Ca 0.13 -0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.17 1vdl h GLU 55 Cb 0.45 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 1vdl h GLU 55 CO -0.37 0.04 -1.66 -0.07 -1.00 0.00 0.00 179.01 175.95 1vdl h LEU 56 N 0.07 0.43 -1.56 1.33 -0.00 -0.83 -1.94 115.31 112.80 1vdl h LEU 56 Ca 0.71 -0.66 -0.05 0.00 -0.00 0.00 0.00 57.88 57.89 1vdl h LEU 56 Cb 2.62 -0.14 -0.01 0.00 -0.00 0.00 0.00 40.66 43.13 1vdl h LEU 56 CO -0.12 1.56 -0.22 0.00 -0.00 0.00 0.00 178.44 179.65 1vdl h ALA 57 N 0.38 1.61 0.06 1.53 0.00 0.57 0.17 119.26 123.57 1vdl h ALA 57 Ca -0.30 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.27 1vdl h ALA 57 Cb 2.04 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.79 1vdl h ALA 57 CO 0.15 0.28 -0.71 0.28 0.00 0.00 0.00 179.25 179.25 1vdl h VAL 58 N 0.00 1.42 -0.77 0.00 2.07 0.65 -2.73 116.25 116.89 1vdl h VAL 58 Ca -0.00 -2.38 0.09 0.00 0.82 0.00 0.00 66.70 65.23 1vdl h VAL 58 Cb 0.40 3.01 -0.07 0.00 -1.52 0.00 0.00 31.29 33.11 1vdl h VAL 58 CO 0.03 0.60 0.42 0.00 0.02 0.00 0.00 177.57 178.65 1vdl h ALA 59 N -0.07 1.07 -0.33 1.67 0.00 -1.11 1.60 119.26 122.09 1vdl h ALA 59 Ca -0.16 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1vdl h ALA 59 Cb 1.37 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1vdl h ALA 59 CO 0.01 0.06 0.07 0.74 0.00 0.00 0.00 179.25 180.13 1vdl h PHE 60 N 0.73 0.57 0.12 0.00 0.04 -0.79 -0.07 116.94 117.54 1vdl h PHE 60 Ca 0.37 -0.07 -0.01 0.00 2.80 0.00 0.00 57.97 61.06 1vdl h PHE 60 Cb 0.33 -0.16 0.00 0.00 2.20 0.00 0.00 35.95 38.32 1vdl h PHE 60 CO -0.08 0.59 -0.06 -0.07 -0.60 0.00 0.00 178.31 178.09 1vdl h LEU 61 N 0.38 -0.14 -1.27 1.54 3.38 -0.97 -2.95 115.31 115.28 1vdl h LEU 61 Ca 0.10 -0.31 0.19 0.00 0.09 0.00 0.00 57.88 57.95 1vdl h LEU 61 Cb 0.31 0.04 -0.08 0.00 0.09 0.00 0.00 40.66 41.01 1vdl h LEU 61 CO 0.00 0.25 0.60 0.71 0.09 0.00 0.00 178.44 180.10 1vdl h THR 62 N -0.55 0.72 0.00 0.22 1.35 0.23 1.68 112.91 116.57 1vdl h THR 62 Ca -0.02 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.64 1vdl h THR 62 Cb 0.44 0.06 0.00 0.00 -1.73 0.00 0.00 68.15 66.92 1vdl h THR 62 CO 0.03 0.11 0.00 0.00 -0.25 0.00 0.00 175.52 175.41 1vdl n ALA 63 N -2.43 1.55 -0.05 6.62 0.00 -0.04 -3.37 120.51 122.78 1vdl n ALA 63 Ca 0.21 -0.04 -0.06 0.00 0.00 0.00 0.00 53.44 53.55 1vdl n ALA 63 Cb 0.61 -1.19 -0.02 0.00 0.00 0.00 0.00 19.45 18.85 1vdl n ALA 63 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1vdl n LYS 64 N -1.49 0.34 -3.80 0.00 5.02 0.54 -4.97 118.16 113.80 1vdl n LYS 64 Ca 0.03 0.13 -0.28 0.00 -2.02 0.00 0.00 58.31 56.17 1vdl n LYS 64 Cb 0.13 -1.07 -0.16 0.00 -0.02 0.00 0.00 35.03 33.91 1vdl n LYS 64 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1vdl s ASN 65 N -5.46 3.00 0.03 4.39 0.01 0.81 -5.11 114.94 112.61 1vdl s ASN 65 Ca -0.18 -0.82 0.02 0.00 -0.71 0.00 0.00 52.86 51.16 1vdl s ASN 65 Cb 0.03 -0.74 -0.02 0.00 0.41 0.00 0.00 41.25 40.93 1vdl s ASN 65 CO 0.27 -0.27 -0.08 0.00 -1.51 0.00 0.00 177.10 175.52 1vdl s ALA 66 N 1.75 0.60 0.09 0.60 0.00 -1.22 -4.27 121.76 119.30 1vdl s ALA 66 Ca -0.01 -0.58 0.09 0.00 0.00 0.00 0.00 51.96 51.46 1vdl s ALA 66 Cb -0.17 -0.04 -0.03 0.00 0.00 0.00 0.00 23.12 22.88 1vdl s ALA 66 CO -0.07 0.06 -0.25 0.15 0.00 0.00 0.00 175.76 175.64 1vdl s LYS 67 N -1.01 1.45 -0.25 0.00 1.02 -1.26 -5.08 119.74 114.60 1vdl s LYS 67 Ca -0.04 -1.19 -0.29 0.00 0.02 0.00 0.00 55.97 54.47 1vdl s LYS 67 Cb -0.07 -1.77 -0.03 0.00 -0.52 0.00 0.00 37.83 35.45 1vdl s LYS 67 CO 0.00 0.43 1.71 0.95 -0.92 0.00 0.00 175.35 177.53 1vdl s THR 68 N -0.97 3.57 -0.14 2.17 -4.23 -1.26 -4.95 115.64 109.83 1vdl s THR 68 Ca 0.11 0.62 -0.29 0.00 -1.18 0.00 0.00 61.69 60.95 1vdl s THR 68 Cb -0.10 -3.65 -0.02 0.00 1.34 0.00 0.00 72.50 70.08 1vdl s THR 68 CO 0.04 -0.33 1.26 -2.16 -0.54 0.00 0.00 174.62 172.89 1vdl s PRO 69 N 5.09 4.26 -0.84 3.99 0.04 -1.26 -4.90 135.00 141.37 1vdl s PRO 69 Ca 0.76 1.68 -0.07 0.00 0.04 0.00 0.00 61.00 63.41 1vdl s PRO 69 Cb -0.25 -3.72 -0.11 0.00 0.04 0.00 0.00 34.50 30.46 1vdl s PRO 69 CO 0.32 -0.65 2.60 -0.35 0.04 0.00 0.00 177.00 178.95 1vdl n PRO 70 N 6.31 2.39 -3.71 0.56 -0.04 -1.26 -4.74 135.00 134.51 1vdl n PRO 70 Ca 0.13 -1.46 -0.05 0.00 -0.04 0.00 0.00 63.50 62.09 1vdl n PRO 70 Cb 0.45 -2.37 -0.02 0.00 -0.04 0.00 0.00 33.50 31.52 1vdl n PRO 70 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1vdl s GLN 71 N 2.44 1.21 -0.24 0.54 -0.21 -1.26 -5.14 119.66 117.00 1vdl s GLN 71 Ca 0.52 -0.63 -0.19 0.00 0.02 0.00 0.00 55.36 55.08 1vdl s GLN 71 Cb 0.17 0.44 -0.03 0.00 1.00 0.00 0.00 33.01 34.59 1vdl s GLN 71 CO -0.03 -0.55 0.55 -1.21 -2.12 0.00 0.00 175.29 171.93 1vdl s GLU 72 N -3.35 4.12 -0.28 2.91 2.02 -1.26 -5.02 118.70 117.83 1vdl s GLU 72 Ca 0.10 0.43 -0.23 0.00 0.02 0.00 0.00 54.97 55.29 1vdl s GLU 72 Cb -0.02 -3.62 0.13 0.00 0.10 0.00 0.00 34.13 30.72 1vdl s GLU 72 CO 0.00 -0.30 1.04 -2.00 0.02 0.00 0.00 175.26 174.02 1vdl s GLU 73 N 2.14 0.45 -0.15 1.61 2.12 -1.26 -5.14 118.70 118.47 1vdl s GLU 73 Ca 0.24 0.59 -0.25 0.00 0.36 0.00 0.00 54.97 55.90 1vdl s GLU 73 Cb -0.16 0.20 -0.02 0.00 0.26 0.00 0.00 34.13 34.41 1vdl s GLU 73 CO 0.09 -0.06 0.82 0.99 -0.54 0.00 0.00 175.26 176.56 1vdl s THR 74 N 0.45 4.90 -0.41 -1.70 2.01 -1.26 -4.96 115.64 114.66 1vdl s THR 74 Ca 0.01 1.63 0.01 0.00 0.31 0.00 0.00 61.69 63.65 1vdl s THR 74 Cb -0.05 -4.13 0.19 0.00 0.01 0.00 0.00 72.50 68.52 1vdl s THR 74 CO -0.09 0.06 0.84 -0.55 -0.69 0.00 0.00 174.62 174.19 1vdl s SER 75 N 1.11 -1.02 -0.38 3.53 0.15 -1.26 -5.09 113.70 110.73 1vdl s SER 75 Ca 0.39 -0.88 0.02 0.00 0.70 0.00 0.00 55.95 56.19 1vdl s SER 75 Cb -0.17 1.32 0.15 0.00 -1.71 0.00 0.00 66.02 65.62 1vdl s SER 75 CO 0.14 -0.07 0.32 -0.83 1.20 0.00 0.00 173.24 173.99 1vdl s GLY 76 N 1.39 0.58 0.96 9.45 0.00 -1.26 -5.14 107.32 113.29 1vdl s GLY 76 Ca 0.22 -1.69 -0.14 0.00 0.00 0.00 0.00 44.72 43.11 1vdl s GLY 76 CO -0.09 2.37 1.16 2.56 0.00 0.00 0.00 173.10 179.10 1vdl s PRO 77 N 0.91 0.74 -0.33 2.90 0.04 -1.26 -5.00 135.00 133.01 1vdl s PRO 77 Ca 0.22 0.14 -0.23 0.00 0.04 0.00 0.00 61.00 61.17 1vdl s PRO 77 Cb -0.13 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.61 1vdl s PRO 77 CO -0.05 -2.44 0.77 -1.12 0.04 0.00 0.00 177.00 174.20 1vdl s SER 78 N -4.13 6.61 -0.30 6.66 0.01 -1.26 -4.98 113.70 116.31 1vdl s SER 78 Ca 0.66 0.53 -0.16 0.00 1.31 0.00 0.00 55.95 58.30 1vdl s SER 78 Cb -0.12 -2.39 0.17 0.00 0.21 0.00 0.00 66.02 63.88 1vdl s SER 78 CO 0.54 -0.64 1.06 -0.94 0.41 0.00 0.00 173.24 173.67 1vdl s SER 79 N 1.69 -0.45 0.00 2.44 1.04 -1.26 -5.15 113.70 112.01 1vdl s SER 79 Ca 0.31 0.63 0.00 0.00 0.48 0.00 0.00 55.95 57.37 1vdl s SER 79 Cb -0.14 1.50 0.00 0.00 0.10 0.00 0.00 66.02 67.48 1vdl s SER 79 CO 0.14 -0.09 0.00 0.61 0.98 0.00 0.00 173.24 174.88