#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 -7.07 -0.06 1.61 2.88 -1.26 -4.98 113.62 104.75 1vdl n SER 2 Ca 0.00 0.76 -0.08 0.00 -1.33 0.00 0.00 58.87 58.22 1vdl n SER 2 Cb 0.00 -2.87 -0.03 0.00 -0.75 0.00 0.00 64.21 60.57 1vdl n SER 2 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1vdl n SER 3 N 1.10 1.68 0.00 -3.46 2.88 -1.26 -5.12 113.62 109.44 1vdl n SER 3 Ca -0.00 0.27 0.00 0.00 -1.33 0.00 0.00 58.87 57.81 1vdl n SER 3 Cb 0.33 -0.62 0.00 0.00 -0.75 0.00 0.00 64.21 63.16 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 2.00 2.83 3.12 0.46 0.00 -1.26 -5.17 105.19 107.17 1vdl n GLY 4 Ca -0.13 -0.51 -0.17 0.00 0.00 0.00 0.00 46.02 45.21 1vdl n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1vdl s SER 5 N 0.00 1.34 -0.17 1.61 0.15 -1.26 -5.07 113.70 110.30 1vdl s SER 5 Ca 0.00 -0.55 -0.15 0.00 0.70 0.00 0.00 55.95 55.95 1vdl s SER 5 Cb 0.00 -0.03 -0.05 0.00 -1.71 0.00 0.00 66.02 64.23 1vdl s SER 5 CO 0.00 -0.10 -0.27 -0.24 1.20 0.00 0.00 173.24 173.82 1vdl n SER 6 N 1.49 1.89 -1.06 5.45 2.88 -1.26 -5.11 113.62 117.90 1vdl n SER 6 Ca -0.21 0.45 0.14 0.00 -1.33 0.00 0.00 58.87 57.91 1vdl n SER 6 Cb 0.55 -0.80 -0.05 0.00 -0.75 0.00 0.00 64.21 63.16 1vdl n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1vdl n GLY 7 N 1.51 -2.44 3.61 0.46 0.00 -1.26 -5.00 105.19 102.07 1vdl n GLY 7 Ca -0.13 -1.21 -0.28 0.00 0.00 0.00 0.00 46.02 44.40 1vdl n GLY 7 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1vdl s MET 8 N -2.89 1.95 -0.04 1.61 1.00 -1.26 -5.15 119.30 114.52 1vdl s MET 8 Ca 0.00 -2.12 0.04 0.00 0.00 0.00 0.00 55.69 53.61 1vdl s MET 8 Cb 0.00 -1.50 -0.00 0.00 0.00 0.00 0.00 34.83 33.33 1vdl s MET 8 CO 0.00 -0.12 -0.16 0.95 0.00 0.00 0.00 175.02 175.69 1vdl s THR 9 N -2.82 1.32 -0.35 2.05 -4.23 -1.26 -5.03 115.64 105.31 1vdl s THR 9 Ca 0.31 -0.66 0.14 0.00 -1.18 0.00 0.00 61.69 60.30 1vdl s THR 9 Cb 0.09 -1.13 0.43 0.00 1.34 0.00 0.00 72.50 73.22 1vdl s THR 9 CO 0.16 0.38 1.12 0.52 -0.54 0.00 0.00 174.62 176.26 1vdl n VAL 10 N 3.10 0.56 -0.02 2.29 0.31 -1.26 -4.86 118.33 118.45 1vdl n VAL 10 Ca -0.18 -2.39 0.00 0.00 -0.01 0.00 0.00 64.34 61.76 1vdl n VAL 10 Cb 0.53 0.81 0.00 0.00 -0.91 0.00 0.00 33.84 34.27 1vdl n VAL 10 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1vdl n GLU 11 N -0.29 1.42 -0.02 5.55 -0.58 -1.26 -4.53 120.64 120.93 1vdl n GLU 11 Ca 0.04 -0.33 -0.02 0.00 -0.42 0.00 0.00 57.16 56.42 1vdl n GLU 11 Cb 0.83 -0.83 -0.02 0.00 -0.57 0.00 0.00 31.44 30.85 1vdl n GLU 11 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1vdl n GLN 12 N -0.30 1.67 0.19 3.49 3.00 -1.26 -4.54 117.38 119.63 1vdl n GLN 12 Ca 0.00 0.01 0.03 0.00 -0.01 0.00 0.00 57.00 57.03 1vdl n GLN 12 Cb 0.01 -1.08 0.39 0.00 0.00 0.00 0.00 30.24 29.56 1vdl n GLN 12 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.06 176.15 1vdl h ASN 13 N 0.00 0.02 0.90 1.08 2.35 -1.89 0.35 115.58 118.40 1vdl h ASN 13 Ca -0.09 -0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.61 1vdl h ASN 13 Cb 1.16 -0.01 0.01 0.00 0.05 0.00 0.00 38.32 39.53 1vdl h ASN 13 CO -0.01 0.34 -0.43 0.58 -1.65 0.00 0.00 177.43 176.26 1vdl h VAL 14 N 0.02 0.05 -0.15 2.81 2.07 -1.81 -2.13 116.25 117.10 1vdl h VAL 14 Ca 0.00 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 1vdl h VAL 14 Cb 0.57 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1vdl h VAL 14 CO 0.04 0.00 0.04 0.17 0.02 0.00 0.00 177.57 177.85 1vdl h LEU 15 N -1.29 0.21 -1.03 2.57 8.10 -1.77 -2.63 115.31 119.48 1vdl h LEU 15 Ca -0.12 -0.21 0.41 0.00 0.11 0.00 0.00 57.88 58.07 1vdl h LEU 15 Cb 0.93 -0.06 -0.17 0.00 -0.44 0.00 0.00 40.66 40.93 1vdl h LEU 15 CO 0.20 0.37 0.57 1.56 -4.11 0.00 0.00 178.44 177.03 1vdl h GLN 16 N 0.05 0.05 -6.29 0.17 4.20 -0.28 -3.37 115.11 109.65 1vdl h GLN 16 Ca 0.05 -0.00 -0.65 0.00 0.06 0.00 0.00 58.65 58.10 1vdl h GLN 16 Cb 0.23 -0.01 0.09 0.00 0.30 0.00 0.00 27.48 28.09 1vdl h GLN 16 CO -0.00 0.03 0.05 1.04 -0.67 0.00 0.00 178.83 179.29 1vdl n GLN 17 N -5.18 0.91 0.00 1.46 6.02 -0.81 0.10 117.38 119.88 1vdl n GLN 17 Ca 0.37 0.32 0.00 0.00 -0.01 0.00 0.00 57.00 57.68 1vdl n GLN 17 Cb 1.26 -1.68 0.00 0.00 1.02 0.00 0.00 30.24 30.84 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 1.74 0.00 -0.34 1.08 7.64 -1.26 -4.29 113.62 118.19 1vdl n SER 18 Ca 0.14 0.00 0.25 0.00 1.01 0.00 0.00 58.87 60.27 1vdl n SER 18 Cb 0.26 0.00 0.49 0.00 -1.01 0.00 0.00 64.21 63.95 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 0.00 2.03 0.04 -0.43 0.00 -1.62 1.55 119.26 120.83 1vdl h ALA 19 Ca 0.00 0.18 -0.25 0.00 0.00 0.00 0.00 54.91 54.84 1vdl h ALA 19 Cb 0.00 0.15 0.01 0.00 0.00 0.00 0.00 17.79 17.95 1vdl h ALA 19 CO 0.00 -0.63 -1.05 0.00 0.00 0.00 0.00 179.25 177.57 1vdl h ALA 20 N 1.82 0.26 -0.67 0.00 0.00 0.49 -3.24 119.26 117.91 1vdl h ALA 20 Ca 0.73 -0.76 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1vdl h ALA 20 Cb 1.73 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.48 1vdl h ALA 20 CO -0.57 0.84 0.41 1.96 0.00 0.00 0.00 179.25 181.89 1vdl h GLN 21 N 0.20 0.78 -4.12 0.00 1.08 0.18 -3.17 115.11 110.06 1vdl h GLN 21 Ca -0.10 -0.05 -0.73 0.00 -1.45 0.00 0.00 58.65 56.31 1vdl h GLN 21 Cb 1.71 -0.17 -0.12 0.00 -0.05 0.00 0.00 27.48 28.84 1vdl h GLN 21 CO 0.18 0.51 2.17 1.63 -0.95 0.00 0.00 178.83 182.37 1vdl n LYS 22 N -4.70 3.35 -3.13 1.46 4.01 0.10 -4.70 118.16 114.55 1vdl n LYS 22 Ca 0.07 -3.35 0.02 0.00 -0.51 0.00 0.00 58.31 54.54 1vdl n LYS 22 Cb 0.10 -3.09 -0.01 0.00 -0.51 0.00 0.00 35.03 31.52 1vdl n LYS 22 CO 0.00 0.00 0.00 -1.01 -1.11 0.00 0.00 177.40 175.28 1vdl s HIS 23 N 1.67 -1.51 0.15 2.13 3.76 -1.20 -4.93 115.29 115.36 1vdl s HIS 23 Ca 0.43 0.36 -0.29 0.00 -0.15 0.00 0.00 55.06 55.42 1vdl s HIS 23 Cb 0.08 0.27 -0.06 0.00 1.11 0.00 0.00 32.58 33.98 1vdl s HIS 23 CO -0.01 -1.00 1.43 0.94 -0.85 0.00 0.00 174.74 175.25 1vdl n GLN 24 N 4.50 -0.41 -0.17 1.40 0.00 -1.26 0.01 117.38 121.45 1vdl n GLN 24 Ca 0.09 1.40 -0.08 0.00 -0.00 0.00 0.00 57.00 58.41 1vdl n GLN 24 Cb 0.57 -2.06 -0.03 0.00 0.00 0.00 0.00 30.24 28.73 1vdl n GLN 24 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.06 177.43 1vdl h GLN 25 N 0.00 -0.24 -0.94 3.69 5.75 -1.97 0.47 115.11 121.87 1vdl h GLN 25 Ca 0.15 0.02 0.15 0.00 -0.15 0.00 0.00 58.65 58.82 1vdl h GLN 25 Cb 0.38 0.05 -0.08 0.00 1.07 0.00 0.00 27.48 28.90 1vdl h GLN 25 CO -0.87 -0.16 0.60 1.15 -2.65 0.00 0.00 178.83 176.90 1vdl h THR 26 N -0.25 0.82 0.80 2.39 2.02 -0.73 0.13 112.91 118.09 1vdl h THR 26 Ca 0.18 -0.26 -0.04 0.00 0.77 0.00 0.00 66.41 67.06 1vdl h THR 26 Cb 0.56 -0.00 0.01 0.00 -1.74 0.00 0.00 68.15 66.98 1vdl h THR 26 CO -0.63 0.14 -0.38 0.15 0.37 0.00 0.00 175.52 175.16 1vdl h PHE 27 N 0.76 -0.99 -0.26 3.16 3.04 0.36 0.14 116.94 123.15 1vdl h PHE 27 Ca 0.49 -0.02 0.06 0.00 3.98 0.00 0.00 57.97 62.47 1vdl h PHE 27 Cb 0.74 0.33 -0.06 0.00 2.56 0.00 0.00 35.95 39.52 1vdl h PHE 27 CO -0.00 -0.60 -0.11 -0.07 -2.02 0.00 0.00 178.31 175.50 1vdl h LEU 28 N -1.16 -0.39 -1.14 0.59 3.38 -0.31 0.34 115.31 116.62 1vdl h LEU 28 Ca -0.11 0.10 0.14 0.00 0.09 0.00 0.00 57.88 58.10 1vdl h LEU 28 Cb 0.83 0.22 -0.08 0.00 0.09 0.00 0.00 40.66 41.72 1vdl h LEU 28 CO 0.18 -0.15 0.60 0.78 0.09 0.00 0.00 178.44 179.95 1vdl h ASN 29 N -0.08 0.79 0.07 -0.43 2.35 -0.70 1.51 115.58 119.09 1vdl h ASN 29 Ca 0.13 0.05 -0.00 0.00 -0.55 0.00 0.00 56.30 55.93 1vdl h ASN 29 Cb 0.28 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.54 1vdl h ASN 29 CO -0.31 0.40 -0.03 1.56 -1.65 0.00 0.00 177.43 177.40 1vdl h GLN 30 N 0.83 -0.09 0.00 0.81 4.20 0.17 -2.54 115.11 118.49 1vdl h GLN 30 Ca 0.48 0.01 0.00 0.00 0.06 0.00 0.00 58.65 59.20 1vdl h GLN 30 Cb 0.64 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.44 1vdl h GLN 30 CO -0.25 0.22 0.00 1.25 -0.67 0.00 0.00 178.83 179.39 1vdl h LEU 31 N -0.40 0.00 -0.44 1.46 5.85 0.70 0.14 115.31 122.62 1vdl h LEU 31 Ca -0.01 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.65 1vdl h LEU 31 Cb 0.35 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 1vdl h LEU 31 CO 0.02 0.00 0.06 -0.09 -0.34 0.00 0.00 178.44 178.08 1vdl h ARG 32 N 0.00 0.74 0.02 1.25 2.43 0.25 -2.70 114.38 116.37 1vdl h ARG 32 Ca 0.00 -0.21 -0.14 0.00 -0.81 0.00 0.00 59.98 58.82 1vdl h ARG 32 Cb 0.44 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 1vdl h ARG 32 CO 0.00 0.77 -0.74 0.93 -1.51 0.00 0.00 179.97 179.42 1vdl h GLU 33 N 0.60 0.04 0.00 0.20 4.39 -1.15 -0.25 114.58 118.40 1vdl h GLU 33 Ca 0.13 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.77 1vdl h GLU 33 Cb 0.40 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.08 1vdl h GLU 33 CO 0.01 1.03 0.00 -0.89 -1.16 0.00 0.00 179.01 178.00 1vdl n ILE 34 N -4.44 0.00 0.53 3.13 5.41 0.01 -0.86 119.36 123.15 1vdl n ILE 34 Ca -0.22 1.37 0.13 0.00 1.00 0.00 0.00 62.75 65.04 1vdl n ILE 34 Cb 0.63 -1.88 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 0.71 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 -1.68 -3.47 112.91 110.50 1vdl h THR 35 Ca 0.00 -0.57 0.00 0.00 -0.55 0.00 0.00 66.41 65.29 1vdl h THR 35 Cb 0.00 1.55 0.00 0.00 -1.73 0.00 0.00 68.15 67.97 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 1.19 2.55 3.49 5.82 0.00 -0.04 -5.00 105.19 113.21 1vdl n GLY 36 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 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 2.12 -0.01 -0.61 5.41 -0.88 -4.76 119.36 118.63 1vdl n ILE 37 Ca 0.00 -0.42 -0.04 0.00 1.00 0.00 0.00 62.75 63.29 1vdl n ILE 37 Cb 0.00 -0.80 -0.01 0.00 -0.71 0.00 0.00 39.64 38.12 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 -0.36 0.55 -4.43 4.38 4.05 -1.26 -4.31 115.26 113.88 1vdl n ASN 38 Ca 0.11 0.08 -0.50 0.00 0.45 0.00 0.00 54.58 54.72 1vdl n ASN 38 Cb 0.49 -0.20 -0.04 0.00 1.23 0.00 0.00 39.78 41.26 1vdl n ASN 38 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 177.26 173.54 1vdl n ASP 39 N -3.31 -0.87 0.11 1.20 -0.08 -1.26 -4.84 116.55 107.49 1vdl n ASP 39 Ca -0.07 1.14 0.08 0.00 -1.51 0.00 0.00 54.79 54.43 1vdl n ASP 39 Cb 0.43 -0.96 0.01 0.00 2.34 0.00 0.00 41.12 42.94 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 1.48 0.64 0.00 -1.67 0.00 -1.99 -2.95 119.26 114.77 1vdl h ALA 40 Ca -0.33 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1vdl h ALA 40 Cb 1.43 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.29 1vdl h ALA 40 CO 0.59 0.31 0.00 1.96 0.00 0.00 0.00 179.25 182.11 1vdl h GLN 41 N 0.00 0.00 0.04 0.00 1.08 -1.99 -0.59 115.11 113.64 1vdl h GLN 41 Ca -0.04 0.00 -0.38 0.00 -1.45 0.00 0.00 58.65 56.78 1vdl h GLN 41 Cb 1.19 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 28.57 1vdl h GLN 41 CO 0.02 0.00 -2.33 -0.89 -0.95 0.00 0.00 178.83 174.68 1vdl n ILE 42 N -2.48 1.58 -0.02 2.54 5.41 -1.23 -3.36 119.36 121.79 1vdl n ILE 42 Ca 0.03 -0.61 -0.12 0.00 1.00 0.00 0.00 62.75 63.05 1vdl n ILE 42 Cb 0.33 -1.48 -0.07 0.00 -0.71 0.00 0.00 39.64 37.71 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 0.02 0.13 0.36 1.39 3.38 -1.46 -2.30 115.31 116.83 1vdl h LEU 43 Ca -0.53 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.13 1vdl h LEU 43 Cb 1.95 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.67 1vdl h LEU 43 CO -0.03 0.39 -0.17 1.56 0.09 0.00 0.00 178.44 180.28 1vdl h GLN 44 N -0.13 -0.46 -0.91 1.13 1.08 -1.31 -0.88 115.11 113.62 1vdl h GLN 44 Ca 0.02 0.03 0.25 0.00 -1.45 0.00 0.00 58.65 57.50 1vdl h GLN 44 Cb 0.32 0.11 -0.14 0.00 -0.05 0.00 0.00 27.48 27.71 1vdl h GLN 44 CO 0.00 -0.29 0.33 1.96 -0.95 0.00 0.00 178.83 179.88 1vdl h GLN 45 N -0.50 0.25 -0.30 1.46 1.08 -1.56 1.23 115.11 116.77 1vdl h GLN 45 Ca -0.05 -0.02 -0.04 0.00 -1.45 0.00 0.00 58.65 57.09 1vdl h GLN 45 Cb 0.38 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.74 1vdl h GLN 45 CO 0.08 0.17 0.03 0.00 -0.95 0.00 0.00 178.83 178.15 1vdl h ALA 46 N 1.79 0.41 0.37 3.87 0.00 -0.99 -1.05 119.26 123.66 1vdl h ALA 46 Ca 0.59 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 55.27 1vdl h ALA 46 Cb 1.22 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1vdl h ALA 46 CO -0.63 0.13 -0.18 1.25 0.00 0.00 0.00 179.25 179.82 1vdl h LEU 47 N 0.33 -0.42 -0.35 0.00 5.85 0.15 0.12 115.31 120.98 1vdl h LEU 47 Ca 0.09 -0.03 0.07 0.00 0.84 0.00 0.00 57.88 58.85 1vdl h LEU 47 Cb 0.39 0.11 -0.09 0.00 0.37 0.00 0.00 40.66 41.44 1vdl h LEU 47 CO 0.01 -0.25 -0.40 0.50 -0.34 0.00 0.00 178.44 177.96 1vdl h LYS 48 N -0.57 -0.33 0.22 1.25 3.64 0.13 0.86 116.57 121.76 1vdl h LYS 48 Ca -0.05 0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.36 1vdl h LYS 48 Cb 0.42 0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.28 1vdl h LYS 48 CO 0.08 -0.22 -0.48 -0.44 -2.27 0.00 0.00 179.45 176.12 1vdl h ASP 49 N -0.34 -1.41 -0.93 4.20 5.19 -1.05 0.11 116.42 122.18 1vdl h ASP 49 Ca 0.13 0.14 0.26 0.00 -0.62 0.00 0.00 57.03 56.94 1vdl h ASP 49 Cb 0.58 0.51 -0.05 0.00 0.18 0.00 0.00 39.33 40.56 1vdl h ASP 49 CO -0.53 -0.56 0.65 0.77 -3.12 0.00 0.00 179.24 176.45 1vdl h SER 50 N -0.78 0.11 0.00 6.45 4.64 0.20 -3.44 113.55 120.72 1vdl h SER 50 Ca -0.01 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 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 -0.22 0.03 0.00 -3.20 -0.87 0.00 0.00 176.83 172.58 1vdl n ASN 51 N -4.33 -2.75 0.00 4.97 2.85 0.29 -3.64 115.26 112.65 1vdl n ASN 51 Ca 0.20 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.67 1vdl n ASN 51 Cb 0.93 -0.61 0.00 0.00 1.24 0.00 0.00 39.78 41.35 1vdl n ASN 51 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1vdl n GLY 52 N -2.66 1.60 2.79 8.20 0.00 -1.08 -5.00 105.19 109.03 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 4.12 0.15 1.61 -0.87 -1.24 -5.00 114.94 111.72 1vdl s ASN 53 Ca 0.00 -1.92 -0.22 0.00 -1.57 0.00 0.00 52.86 49.15 1vdl s ASN 53 Cb 0.00 -1.06 0.04 0.00 -0.02 0.00 0.00 41.25 40.21 1vdl s ASN 53 CO 0.00 -0.38 1.62 0.25 -2.57 0.00 0.00 177.10 176.02 1vdl h LEU 54 N 7.75 -0.83 -1.80 0.60 5.85 -1.95 0.48 115.31 125.41 1vdl h LEU 54 Ca -0.10 0.15 0.41 0.00 0.84 0.00 0.00 57.88 59.18 1vdl h LEU 54 Cb 1.00 0.39 -0.08 0.00 0.37 0.00 0.00 40.66 42.35 1vdl h LEU 54 CO 0.49 -0.29 0.97 -0.33 -0.34 0.00 0.00 178.44 178.94 1vdl h GLU 55 N -0.25 0.07 0.13 1.25 5.08 -1.98 1.57 114.58 120.44 1vdl h GLU 55 Ca 0.15 -0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.18 1vdl h GLU 55 Cb 0.48 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 1vdl h GLU 55 CO -0.42 0.04 -1.63 -0.07 -1.00 0.00 0.00 179.01 175.93 1vdl h LEU 56 N 0.07 0.42 -1.18 1.33 -0.00 -0.66 -2.27 115.31 113.01 1vdl h LEU 56 Ca 0.71 -0.63 -0.07 0.00 -0.00 0.00 0.00 57.88 57.89 1vdl h LEU 56 Cb 2.61 -0.14 -0.01 0.00 -0.00 0.00 0.00 40.66 43.12 1vdl h LEU 56 CO -0.12 1.53 -0.22 0.00 -0.00 0.00 0.00 178.44 179.62 1vdl h ALA 57 N 0.41 1.32 0.03 1.53 0.00 0.57 0.80 119.26 123.91 1vdl h ALA 57 Ca -0.28 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.24 1vdl h ALA 57 Cb 2.04 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 19.74 1vdl h ALA 57 CO 0.15 0.46 -0.40 0.28 0.00 0.00 0.00 179.25 179.74 1vdl h VAL 58 N 0.26 1.55 -0.08 0.00 2.07 0.12 -2.88 116.25 117.31 1vdl h VAL 58 Ca 0.04 -2.15 0.03 0.00 0.82 0.00 0.00 66.70 65.44 1vdl h VAL 58 Cb 0.55 2.91 -0.03 0.00 -1.52 0.00 0.00 31.29 33.20 1vdl h VAL 58 CO 0.04 0.60 -0.12 0.00 0.02 0.00 0.00 177.57 178.11 1vdl h ALA 59 N 0.20 -0.07 -0.48 1.67 0.00 -1.21 1.69 119.26 121.06 1vdl h ALA 59 Ca -0.06 0.03 0.12 0.00 0.00 0.00 0.00 54.91 55.01 1vdl h ALA 59 Cb 1.20 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 19.20 1vdl h ALA 59 CO 0.08 -0.59 0.34 0.74 0.00 0.00 0.00 179.25 179.82 1vdl h PHE 60 N -0.16 0.11 0.00 0.00 0.04 -0.94 0.56 116.94 116.55 1vdl h PHE 60 Ca 0.07 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.79 1vdl h PHE 60 Cb 0.26 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 38.37 1vdl h PHE 60 CO -0.21 0.05 -0.32 -0.07 -0.60 0.00 0.00 178.31 177.15 1vdl h LEU 61 N 0.10 0.00 -1.42 1.54 3.38 -0.82 -3.22 115.31 114.87 1vdl h LEU 61 Ca 0.23 -0.69 0.14 0.00 0.09 0.00 0.00 57.88 57.65 1vdl h LEU 61 Cb 0.77 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.46 1vdl h LEU 61 CO -0.02 1.03 0.54 0.71 0.09 0.00 0.00 178.44 180.79 1vdl h THR 62 N -1.00 0.83 0.00 0.22 1.35 0.30 1.43 112.91 116.04 1vdl h THR 62 Ca -0.08 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 65.58 1vdl h THR 62 Cb 0.90 0.20 0.00 0.00 -1.73 0.00 0.00 68.15 67.52 1vdl h THR 62 CO -0.05 0.11 0.00 0.00 -0.25 0.00 0.00 175.52 175.33 1vdl n ALA 63 N -2.47 2.20 -0.09 6.62 0.00 0.19 -3.07 120.51 123.88 1vdl n ALA 63 Ca 0.16 -0.11 -0.15 0.00 0.00 0.00 0.00 53.44 53.33 1vdl n ALA 63 Cb 0.48 -1.37 -0.08 0.00 0.00 0.00 0.00 19.45 18.48 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 -1.26 0.44 -3.55 0.00 5.02 0.43 -4.98 118.16 114.25 1vdl n LYS 64 Ca 0.12 0.13 -0.08 0.00 -2.02 0.00 0.00 58.31 56.45 1vdl n LYS 64 Cb 0.17 -1.31 -0.09 0.00 -0.02 0.00 0.00 35.03 33.78 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 -6.05 -0.15 -0.15 4.39 0.01 0.22 -5.10 114.94 108.12 1vdl s ASN 65 Ca -0.25 0.77 -0.34 0.00 -0.71 0.00 0.00 52.86 52.33 1vdl s ASN 65 Cb 0.08 1.31 0.14 0.00 0.41 0.00 0.00 41.25 43.18 1vdl s ASN 65 CO 0.40 -0.25 1.26 0.00 -1.51 0.00 0.00 177.10 176.99 1vdl s ALA 66 N 2.60 -2.15 -0.19 0.60 0.00 -1.23 -4.14 121.76 117.26 1vdl s ALA 66 Ca 0.03 1.36 0.00 0.00 0.00 0.00 0.00 51.96 53.35 1vdl s ALA 66 Cb -0.13 -0.00 0.04 0.00 0.00 0.00 0.00 23.12 23.03 1vdl s ALA 66 CO -0.14 -0.73 -0.08 0.15 0.00 0.00 0.00 175.76 174.96 1vdl s LYS 67 N -2.37 1.79 -0.26 0.00 -0.14 -1.26 -5.07 119.74 112.43 1vdl s LYS 67 Ca 0.11 -0.72 -0.29 0.00 -1.36 0.00 0.00 55.97 53.72 1vdl s LYS 67 Cb 0.01 -2.26 -0.03 0.00 -1.68 0.00 0.00 37.83 33.87 1vdl s LYS 67 CO -0.04 -0.43 1.71 0.95 -0.76 0.00 0.00 175.35 176.78 1vdl s THR 68 N 1.49 3.57 0.59 2.17 -4.23 -1.26 -4.98 115.64 112.99 1vdl s THR 68 Ca -0.01 0.62 -0.16 0.00 -1.18 0.00 0.00 61.69 60.97 1vdl s THR 68 Cb -0.16 -3.65 -0.04 0.00 1.34 0.00 0.00 72.50 69.99 1vdl s THR 68 CO -0.08 -0.33 1.05 -2.16 -0.54 0.00 0.00 174.62 172.56 1vdl s PRO 69 N 5.09 3.38 -1.02 3.99 0.04 -1.26 -4.90 135.00 140.32 1vdl s PRO 69 Ca 0.76 1.16 -0.07 0.00 0.04 0.00 0.00 61.00 62.89 1vdl s PRO 69 Cb -0.25 -2.04 -0.09 0.00 0.04 0.00 0.00 34.50 32.16 1vdl s PRO 69 CO 0.32 -0.75 2.53 -0.35 0.04 0.00 0.00 177.00 178.79 1vdl n PRO 70 N -2.03 2.57 -4.37 0.56 -0.04 -1.26 -4.84 135.00 125.59 1vdl n PRO 70 Ca 0.08 -1.61 -0.29 0.00 -0.04 0.00 0.00 63.50 61.65 1vdl n PRO 70 Cb 0.53 -2.48 -0.12 0.00 -0.04 0.00 0.00 33.50 31.38 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 2.66 1.51 0.28 0.54 2.00 -1.26 -5.15 119.66 120.24 1vdl s GLN 71 Ca 0.52 -1.33 0.10 0.00 -2.00 0.00 0.00 55.36 52.64 1vdl s GLN 71 Cb 0.15 -1.94 -0.05 0.00 0.80 0.00 0.00 33.01 31.96 1vdl s GLN 71 CO -0.04 0.45 -0.14 -2.00 -0.50 0.00 0.00 175.29 173.06 1vdl s GLU 72 N -2.16 1.61 0.01 1.67 2.56 -1.26 -5.15 118.70 115.97 1vdl s GLU 72 Ca 0.16 -1.77 0.01 0.00 0.00 0.00 0.00 54.97 53.37 1vdl s GLU 72 Cb -0.10 -1.50 -0.01 0.00 2.00 0.00 0.00 34.13 34.51 1vdl s GLU 72 CO 0.07 0.21 -0.03 -2.00 -0.56 0.00 0.00 175.26 172.95 1vdl s GLU 73 N -3.60 0.28 0.21 4.30 2.12 -1.26 -5.16 118.70 115.59 1vdl s GLU 73 Ca 0.29 -0.38 0.07 0.00 0.36 0.00 0.00 54.97 55.31 1vdl s GLU 73 Cb -0.01 -0.10 -0.05 0.00 0.26 0.00 0.00 34.13 34.24 1vdl s GLU 73 CO 0.13 0.01 -0.13 -0.08 -0.54 0.00 0.00 175.26 174.66 1vdl s THR 74 N -0.77 1.68 1.05 -1.70 -1.32 -1.26 -5.14 115.64 108.18 1vdl s THR 74 Ca -0.07 -2.19 -0.12 0.00 -1.21 0.00 0.00 61.69 58.10 1vdl s THR 74 Cb -0.06 -2.09 0.22 0.00 -1.51 0.00 0.00 72.50 69.07 1vdl s THR 74 CO -0.00 -0.56 1.07 -0.44 -2.21 0.00 0.00 174.62 172.47 1vdl s SER 75 N -3.32 1.98 0.44 8.08 0.01 -1.26 -5.06 113.70 114.57 1vdl s SER 75 Ca 0.23 1.50 0.02 0.00 1.31 0.00 0.00 55.95 59.01 1vdl s SER 75 Cb 0.00 -2.20 0.02 0.00 0.21 0.00 0.00 66.02 64.05 1vdl s SER 75 CO 0.07 -3.57 0.14 0.61 0.41 0.00 0.00 173.24 170.90 1vdl n GLY 76 N -0.06 3.31 3.38 3.44 0.00 -1.26 -5.15 105.19 108.86 1vdl n GLY 76 Ca 0.05 -2.32 -0.27 0.00 0.00 0.00 0.00 46.02 43.48 1vdl n GLY 76 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1vdl n PRO 77 N -1.28 -2.07 -4.41 1.61 -0.04 -1.26 -5.08 135.00 122.48 1vdl n PRO 77 Ca -0.11 -1.75 -0.31 0.00 -0.04 0.00 0.00 63.50 61.29 1vdl n PRO 77 Cb 0.54 -1.38 -0.11 0.00 -0.04 0.00 0.00 33.50 32.51 1vdl n PRO 77 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1vdl s SER 78 N -4.85 4.28 0.55 3.54 1.04 -1.26 -5.13 113.70 111.87 1vdl s SER 78 Ca 0.67 -0.34 0.01 0.00 0.48 0.00 0.00 55.95 56.77 1vdl s SER 78 Cb -0.04 -0.83 0.03 0.00 0.10 0.00 0.00 66.02 65.28 1vdl s SER 78 CO 0.49 0.23 0.78 -0.94 0.98 0.00 0.00 173.24 174.78 1vdl s SER 79 N -1.78 5.30 0.00 7.02 1.04 -1.26 -5.38 113.70 118.64 1vdl s SER 79 Ca 0.18 0.06 0.07 0.00 0.48 0.00 0.00 55.95 56.74 1vdl s SER 79 Cb -0.11 -0.96 0.44 0.00 0.10 0.00 0.00 66.02 65.49 1vdl s SER 79 CO 0.10 -1.13 0.90 0.61 0.98 0.00 0.00 173.24 174.69