#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vgl s ARG 5 N 0.00 1.09 -0.34 1.96 1.70 -0.20 -4.94 118.95 118.21 1vgl s ARG 5 Ca 0.00 -0.57 -0.08 0.00 -0.47 0.00 0.00 55.73 54.61 1vgl s ARG 5 Cb 0.00 0.39 0.03 0.00 -0.57 0.00 0.00 34.95 34.80 1vgl s ARG 5 CO 0.00 -0.49 0.13 0.15 -1.08 0.00 0.00 175.30 174.01 1vgl s LYS 6 N -3.22 2.76 0.36 3.89 1.02 -1.26 0.55 119.74 123.84 1vgl s LYS 6 Ca 0.11 -1.09 0.07 0.00 0.02 0.00 0.00 55.97 55.07 1vgl s LYS 6 Cb -0.01 -3.53 -0.03 0.00 -0.52 0.00 0.00 37.83 33.74 1vgl s LYS 6 CO -0.00 -0.64 0.25 0.95 -0.92 0.00 0.00 175.35 174.99 1vgl s THR 7 N 1.47 0.13 -0.36 2.17 -4.23 -0.75 -4.92 115.64 109.15 1vgl s THR 7 Ca 0.00 -2.00 -0.20 0.00 -1.18 0.00 0.00 61.69 58.31 1vgl s THR 7 Cb -0.19 -2.45 0.00 0.00 1.34 0.00 0.00 72.50 71.21 1vgl s THR 7 CO 0.04 0.00 0.60 -0.31 -0.54 0.00 0.00 174.62 174.41 1vgl s TYR 8 N -3.37 3.16 -0.40 3.99 2.02 -0.91 -1.03 117.35 120.81 1vgl s TYR 8 Ca 0.36 0.27 -0.17 0.00 -0.37 0.00 0.00 57.07 57.16 1vgl s TYR 8 Cb 0.02 -3.08 0.01 0.00 -0.40 0.00 0.00 41.96 38.51 1vgl s TYR 8 CO 0.25 -0.61 0.46 0.08 -1.57 0.00 0.00 175.55 174.15 1vgl s VAL 9 N 2.61 5.06 -0.47 0.71 1.01 0.69 -1.90 120.40 128.12 1vgl s VAL 9 Ca 0.22 -0.11 -0.28 0.00 0.00 0.00 0.00 61.98 61.81 1vgl s VAL 9 Cb -0.15 -4.00 0.03 0.00 0.00 0.00 0.00 36.38 32.26 1vgl s VAL 9 CO 0.15 -0.34 1.09 -0.22 0.00 0.00 0.00 175.10 175.77 1vgl s LEU 10 N 2.23 3.73 -0.28 3.92 2.96 -0.02 -1.59 118.68 129.63 1vgl s LEU 10 Ca 0.14 0.40 -0.16 0.00 -0.22 0.00 0.00 54.13 54.29 1vgl s LEU 10 Cb -0.16 -3.46 -0.03 0.00 0.50 0.00 0.00 46.19 43.03 1vgl s LEU 10 CO 0.14 -1.20 0.42 -0.54 -1.32 0.00 0.00 176.35 173.85 1vgl s LYS 11 N 4.27 3.94 -0.27 1.98 1.02 0.88 -1.93 119.74 129.62 1vgl s LYS 11 Ca 0.45 0.04 -0.09 0.00 0.02 0.00 0.00 55.97 56.39 1vgl s LYS 11 Cb -0.08 -3.69 -0.03 0.00 -0.52 0.00 0.00 37.83 33.51 1vgl s LYS 11 CO 0.30 -0.36 0.13 -0.51 -0.92 0.00 0.00 175.35 174.00 1vgl s LEU 12 N 2.16 3.78 -0.25 3.17 1.43 -0.68 -1.02 118.68 127.27 1vgl s LEU 12 Ca 0.16 -0.17 -0.10 0.00 -1.03 0.00 0.00 54.13 52.99 1vgl s LEU 12 Cb -0.16 -2.02 -0.05 0.00 0.03 0.00 0.00 46.19 44.00 1vgl s LEU 12 CO 0.10 -0.07 0.15 -0.31 0.23 0.00 0.00 176.35 176.45 1vgl s TYR 13 N 1.68 3.24 0.16 0.29 1.51 -0.24 -0.68 117.35 123.30 1vgl s TYR 13 Ca 0.06 0.08 0.07 0.00 -1.01 0.00 0.00 57.07 56.27 1vgl s TYR 13 Cb -0.16 -2.28 -0.04 0.00 -0.11 0.00 0.00 41.96 39.37 1vgl s TYR 13 CO 0.07 -0.06 -0.14 0.14 -1.11 0.00 0.00 175.55 174.45 1vgl s VAL 14 N 1.29 1.51 -0.38 0.71 -7.23 0.28 -1.01 120.40 115.56 1vgl s VAL 14 Ca 0.07 -1.94 0.03 0.00 -1.81 0.00 0.00 61.98 58.33 1vgl s VAL 14 Cb -0.14 -1.77 0.11 0.00 0.56 0.00 0.00 36.38 35.13 1vgl s VAL 14 CO 0.06 -0.49 0.11 0.00 -0.31 0.00 0.00 175.10 174.47 1vgl s ALA 15 N -2.51 2.81 0.00 1.32 0.00 -0.23 -0.49 121.76 122.65 1vgl s ALA 15 Ca 0.15 -2.62 0.00 0.00 0.00 0.00 0.00 51.96 49.49 1vgl s ALA 15 Cb -0.03 -1.97 0.00 0.00 0.00 0.00 0.00 23.12 21.12 1vgl s ALA 15 CO 0.04 -1.78 0.00 0.41 0.00 0.00 0.00 175.76 174.43 1vgl n GLY 16 N 4.02 -2.29 3.51 0.00 0.00 -1.26 -4.80 105.19 104.35 1vgl n GLY 16 Ca 0.04 -1.69 -0.10 0.00 0.00 0.00 0.00 46.02 44.28 1vgl n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vgl s ASN 17 N -3.15 -0.44 0.21 1.61 2.20 -1.26 -4.95 114.94 109.17 1vgl s ASN 17 Ca 0.00 -0.07 0.04 0.00 -0.94 0.00 0.00 52.86 51.89 1vgl s ASN 17 Cb 0.00 0.52 -0.05 0.00 -2.00 0.00 0.00 41.25 39.72 1vgl s ASN 17 CO 0.00 -0.86 -0.03 0.42 -2.94 0.00 0.00 177.10 173.69 1vgl s THR 18 N -3.48 1.13 0.28 0.54 -4.23 -1.26 -4.99 115.64 103.63 1vgl s THR 18 Ca 0.04 -2.05 0.02 0.00 -1.18 0.00 0.00 61.69 58.52 1vgl s THR 18 Cb -0.01 -2.23 0.27 0.00 1.34 0.00 0.00 72.50 71.86 1vgl s THR 18 CO -0.09 -0.42 1.76 -0.65 -0.54 0.00 0.00 174.62 174.67 1vgl h PRO 19 N 2.53 0.61 -0.43 3.99 0.11 -2.02 -1.35 132.00 135.45 1vgl h PRO 19 Ca -0.38 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 65.58 1vgl h PRO 19 Cb 1.22 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1vgl h PRO 19 CO 0.64 0.40 -0.20 -0.91 -0.21 0.00 0.00 178.00 177.72 1vgl h ASN 20 N 0.63 0.86 -0.45 -2.05 2.35 -1.99 -2.04 115.58 112.89 1vgl h ASN 20 Ca 0.52 -0.31 -0.11 0.00 -0.55 0.00 0.00 56.30 55.85 1vgl h ASN 20 Cb 0.80 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.92 1vgl h ASN 20 CO -0.40 1.04 -0.13 0.77 -1.65 0.00 0.00 177.43 177.06 1vgl h SER 21 N 0.74 0.93 -0.58 5.81 4.64 -1.69 -0.18 113.55 123.23 1vgl h SER 21 Ca 0.10 -0.31 -0.09 0.00 -0.47 0.00 0.00 61.79 61.03 1vgl h SER 21 Cb 0.73 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 62.55 1vgl h SER 21 CO 0.06 1.06 0.02 0.58 -0.87 0.00 0.00 176.83 177.68 1vgl h VAL 22 N 0.83 1.26 -0.36 0.95 2.07 -1.20 -0.71 116.25 119.09 1vgl h VAL 22 Ca 0.13 -1.11 -0.04 0.00 0.82 0.00 0.00 66.70 66.50 1vgl h VAL 22 Cb 0.67 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 1vgl h VAL 22 CO 0.05 0.40 0.07 -0.09 0.02 0.00 0.00 177.57 178.03 1vgl h ARG 23 N 0.94 0.59 -0.69 1.57 2.43 -1.11 -1.85 114.38 116.26 1vgl h ARG 23 Ca 0.17 -0.15 -0.02 0.00 -0.81 0.00 0.00 59.98 59.17 1vgl h ARG 23 Cb 0.52 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.96 1vgl h ARG 23 CO 0.02 0.65 0.35 0.00 -1.51 0.00 0.00 179.97 179.48 1vgl h ALA 24 N 0.92 1.31 -0.22 2.80 0.00 -0.74 -1.39 119.26 121.94 1vgl h ALA 24 Ca 0.11 -0.13 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 1vgl h ALA 24 Cb 0.33 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1vgl h ALA 24 CO 0.00 0.54 -0.43 -0.07 0.00 0.00 0.00 179.25 179.30 1vgl h LEU 25 N 0.98 0.58 -0.73 0.00 3.38 -0.93 0.11 115.31 118.70 1vgl h LEU 25 Ca 0.24 -0.27 -0.12 0.00 0.09 0.00 0.00 57.88 57.82 1vgl h LEU 25 Cb 0.07 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1vgl h LEU 25 CO -0.03 0.94 -0.33 0.11 0.09 0.00 0.00 178.44 179.22 1vgl h LYS 26 N 0.45 0.61 -0.31 1.13 1.57 -0.89 0.76 116.57 119.88 1vgl h LYS 26 Ca 0.03 -0.27 -0.13 0.00 -1.87 0.00 0.00 60.65 58.41 1vgl h LYS 26 Cb 0.94 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.23 1vgl h LYS 26 CO 0.08 0.85 -0.31 1.15 -0.57 0.00 0.00 179.45 180.66 1vgl h THR 27 N 0.51 1.29 -0.07 -0.16 2.02 -1.04 -1.35 112.91 114.12 1vgl h THR 27 Ca 0.06 -1.48 -0.00 0.00 0.77 0.00 0.00 66.41 65.76 1vgl h THR 27 Cb 0.81 1.54 -0.00 0.00 -1.74 0.00 0.00 68.15 68.76 1vgl h THR 27 CO 0.07 0.48 0.04 0.25 0.37 0.00 0.00 175.52 176.72 1vgl h LEU 28 N 0.51 0.08 -1.17 2.58 5.85 -0.66 -0.58 115.31 121.92 1vgl h LEU 28 Ca 0.05 -0.06 0.05 0.00 0.84 0.00 0.00 57.88 58.75 1vgl h LEU 28 Cb 0.88 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.84 1vgl h LEU 28 CO 0.08 0.12 0.57 -1.13 -0.34 0.00 0.00 178.44 177.74 1vgl h ASN 29 N 0.04 0.91 -0.30 1.25 -1.24 -0.80 -1.93 115.58 113.50 1vgl h ASN 29 Ca 0.02 -0.00 -0.10 0.00 0.71 0.00 0.00 56.30 56.93 1vgl h ASN 29 Cb 0.05 -0.20 -0.01 0.00 0.73 0.00 0.00 38.32 38.89 1vgl h ASN 29 CO -0.00 0.61 -0.22 -1.13 -1.29 0.00 0.00 177.43 175.40 1vgl h ASN 30 N 1.05 0.72 -0.63 1.15 -1.24 -0.59 -2.58 115.58 113.45 1vgl h ASN 30 Ca 0.36 -0.44 0.01 0.00 0.71 0.00 0.00 56.30 56.94 1vgl h ASN 30 Cb 0.09 -0.20 -0.03 0.00 0.73 0.00 0.00 38.32 38.91 1vgl h ASN 30 CO -0.12 1.00 0.41 0.40 -1.29 0.00 0.00 177.43 177.84 1vgl h ILE 31 N 0.44 1.14 -0.01 2.57 2.04 -0.77 -1.64 117.51 121.28 1vgl h ILE 31 Ca 0.06 -0.29 -0.00 0.00 1.00 0.00 0.00 64.86 65.63 1vgl h ILE 31 Cb 0.77 0.23 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 1vgl h ILE 31 CO 0.06 0.15 0.01 -0.07 0.00 0.00 0.00 178.15 178.30 1vgl h LEU 32 N 0.83 0.02 -1.56 1.44 3.38 -1.30 0.12 115.31 118.25 1vgl h LEU 32 Ca 0.24 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 1vgl h LEU 32 Cb -0.07 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1vgl h LEU 32 CO -0.06 0.16 -0.23 -0.33 0.09 0.00 0.00 178.44 178.06 1vgl h GLU 33 N -0.12 0.00 0.15 1.13 4.39 -1.35 0.24 114.58 119.02 1vgl h GLU 33 Ca 0.00 0.00 -0.32 0.00 0.34 0.00 0.00 59.36 59.38 1vgl h GLU 33 Cb 0.14 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.80 1vgl h GLU 33 CO -0.00 0.23 -1.62 -0.22 -1.16 0.00 0.00 179.01 176.24 1vgl h LYS 34 N 0.00 0.33 0.16 2.33 1.63 -1.18 -3.18 116.57 116.66 1vgl h LYS 34 Ca -0.00 -0.56 -0.33 0.00 -0.85 0.00 0.00 60.65 58.91 1vgl h LYS 34 Cb 0.49 0.21 0.01 0.00 -0.60 0.00 0.00 32.23 32.34 1vgl h LYS 34 CO 0.03 1.27 -1.64 0.93 -3.45 0.00 0.00 179.45 176.59 1vgl h GLU 35 N -0.07 0.35 -2.23 1.90 5.08 -0.74 -3.40 114.58 115.48 1vgl h GLU 35 Ca -0.33 -0.59 -0.57 0.00 -1.00 0.00 0.00 59.36 56.86 1vgl h GLU 35 Cb 1.95 0.22 -0.42 0.00 0.50 0.00 0.00 28.75 31.01 1vgl h GLU 35 CO 0.12 1.28 -0.73 1.19 -1.00 0.00 0.00 179.01 179.88 1vgl n PHE 36 N -3.70 3.32 -1.30 4.33 3.01 0.85 -5.01 117.46 118.96 1vgl n PHE 36 Ca -0.25 -3.98 -0.09 0.00 1.01 0.00 0.00 57.45 54.14 1vgl n PHE 36 Cb 1.02 -0.48 -0.08 0.00 -0.01 0.00 0.00 39.48 39.92 1vgl n PHE 36 CO 0.00 0.00 0.00 0.36 1.01 0.00 0.00 176.76 178.13 1vgl n LYS 37 N 0.01 0.08 0.00 -1.08 0.00 -1.20 -1.21 118.16 114.77 1vgl n LYS 37 Ca 0.30 -0.53 0.00 0.00 -0.00 0.00 0.00 58.31 58.07 1vgl n LYS 37 Cb 0.44 -2.05 0.00 0.00 -0.00 0.00 0.00 35.03 33.42 1vgl n LYS 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1vgl n GLY 38 N 5.35 1.61 0.19 2.58 0.00 -1.26 -4.91 105.19 108.75 1vgl n GLY 38 Ca 0.28 -0.08 -0.01 0.00 0.00 0.00 0.00 46.02 46.22 1vgl n GLY 38 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1vgl h VAL 39 N 0.00 1.30 -3.17 1.61 2.07 -1.51 -3.42 116.25 113.14 1vgl h VAL 39 Ca 0.00 -1.48 -0.41 0.00 0.82 0.00 0.00 66.70 65.63 1vgl h VAL 39 Cb 0.00 1.70 -0.14 0.00 -1.52 0.00 0.00 31.29 31.33 1vgl h VAL 39 CO 0.00 0.44 -0.65 -0.31 0.02 0.00 0.00 177.57 177.06 1vgl s TYR 40 N -4.14 1.68 -0.19 1.57 1.51 -1.16 -2.13 117.35 114.48 1vgl s TYR 40 Ca -0.04 -0.91 -0.27 0.00 -1.01 0.00 0.00 57.07 54.84 1vgl s TYR 40 Cb 0.14 -0.99 0.09 0.00 -0.11 0.00 0.00 41.96 41.08 1vgl s TYR 40 CO 0.76 -0.00 0.81 0.00 -1.11 0.00 0.00 175.55 176.00 1vgl s ALA 41 N -3.36 -1.84 -0.07 3.71 0.00 -0.80 -4.73 121.76 114.68 1vgl s ALA 41 Ca 0.30 1.73 -0.03 0.00 0.00 0.00 0.00 51.96 53.96 1vgl s ALA 41 Cb 0.06 -0.82 -0.04 0.00 0.00 0.00 0.00 23.12 22.32 1vgl s ALA 41 CO 0.10 -0.32 0.08 -1.17 0.00 0.00 0.00 175.76 174.45 1vgl s LEU 42 N -0.31 3.99 -0.10 0.00 2.96 -1.26 -0.84 118.68 123.13 1vgl s LEU 42 Ca -0.03 0.27 -0.03 0.00 -0.22 0.00 0.00 54.13 54.13 1vgl s LEU 42 Cb -0.03 -2.07 0.04 0.00 0.50 0.00 0.00 46.19 44.63 1vgl s LEU 42 CO 0.02 0.36 0.05 -0.75 -1.32 0.00 0.00 176.35 174.71 1vgl s LYS 43 N -1.21 0.22 -0.20 1.98 2.20 -0.81 0.34 119.74 122.25 1vgl s LYS 43 Ca 0.17 0.09 -0.10 0.00 -0.36 0.00 0.00 55.97 55.77 1vgl s LYS 43 Cb -0.12 -1.17 -0.05 0.00 -1.51 0.00 0.00 37.83 34.99 1vgl s LYS 43 CO 0.07 -0.45 0.14 0.08 -0.36 0.00 0.00 175.35 174.83 1vgl s VAL 44 N 2.07 5.40 -0.23 4.02 1.01 -1.26 -1.69 120.40 129.71 1vgl s VAL 44 Ca 0.03 0.20 0.00 0.00 0.00 0.00 0.00 61.98 62.22 1vgl s VAL 44 Cb -0.14 -3.48 0.04 0.00 0.00 0.00 0.00 36.38 32.80 1vgl s VAL 44 CO -0.06 0.43 -0.11 -0.63 0.00 0.00 0.00 175.10 174.73 1vgl s ILE 45 N 0.45 2.45 -0.52 2.22 1.09 0.14 -4.96 121.20 122.06 1vgl s ILE 45 Ca 0.08 -1.19 -0.17 0.00 -1.10 0.00 0.00 60.65 58.27 1vgl s ILE 45 Cb -0.11 -2.25 0.09 0.00 -1.06 0.00 0.00 42.46 39.12 1vgl s ILE 45 CO -0.01 0.21 0.55 -0.62 -0.10 0.00 0.00 174.94 174.97 1vgl s ASP 46 N 1.25 6.18 0.59 3.58 -1.08 -1.26 -0.56 116.67 125.38 1vgl s ASP 46 Ca -0.01 -1.31 0.31 0.00 -0.52 0.00 0.00 52.55 51.02 1vgl s ASP 46 Cb -0.17 -2.24 1.87 0.00 -1.46 0.00 0.00 42.92 40.91 1vgl s ASP 46 CO -0.07 -0.86 2.25 0.58 0.52 0.00 0.00 175.17 177.60 1vgl h VAL 47 N 5.85 0.46 -0.73 1.11 2.07 -1.03 -1.53 116.25 122.45 1vgl h VAL 47 Ca -0.29 -0.05 -0.07 0.00 0.82 0.00 0.00 66.70 67.11 1vgl h VAL 47 Cb 1.10 1.03 -0.03 0.00 -1.52 0.00 0.00 31.29 31.87 1vgl h VAL 47 CO 0.98 0.01 0.20 -0.07 0.02 0.00 0.00 177.57 178.71 1vgl h LEU 48 N 0.00 1.09 -0.45 2.57 4.07 -1.92 -1.38 115.31 119.29 1vgl h LEU 48 Ca -0.00 -0.22 -0.17 0.00 0.08 0.00 0.00 57.88 57.57 1vgl h LEU 48 Cb 0.03 -0.29 -0.02 0.00 1.08 0.00 0.00 40.66 41.47 1vgl h LEU 48 CO 0.00 1.03 -0.77 0.11 -1.08 0.00 0.00 178.44 177.73 1vgl h LYS 49 N 1.10 0.05 -2.68 1.13 1.57 -1.68 -3.39 116.57 112.67 1vgl h LYS 49 Ca 0.23 -0.05 -0.59 0.00 -1.87 0.00 0.00 60.65 58.36 1vgl h LYS 49 Cb 0.35 0.01 -0.39 0.00 0.08 0.00 0.00 32.23 32.28 1vgl h LYS 49 CO -0.00 0.80 -0.83 0.54 -0.57 0.00 0.00 179.45 179.39 1vgl s ASN 50 N -6.83 2.89 0.19 0.86 2.20 -0.87 -5.01 114.94 108.38 1vgl s ASN 50 Ca -0.01 -2.66 -0.12 0.00 -0.94 0.00 0.00 52.86 49.12 1vgl s ASN 50 Cb 0.11 -0.68 0.20 0.00 -2.00 0.00 0.00 41.25 38.89 1vgl s ASN 50 CO 0.79 -0.24 1.72 -0.65 -2.94 0.00 0.00 177.10 175.78 1vgl h PRO 51 N 6.45 0.24 -6.43 3.55 0.11 -1.47 -3.41 132.00 131.05 1vgl h PRO 51 Ca 0.10 -0.01 -0.54 0.00 0.11 0.00 0.00 66.00 65.66 1vgl h PRO 51 Cb 0.93 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.98 1vgl h PRO 51 CO 0.39 0.16 0.69 -0.65 -0.21 0.00 0.00 178.00 178.38 1vgl s GLN 52 N -6.14 4.36 -0.12 1.05 1.11 -1.26 -4.99 119.66 113.67 1vgl s GLN 52 Ca -0.13 1.86 -0.25 0.00 0.01 0.00 0.00 55.36 56.84 1vgl s GLN 52 Cb 0.16 -3.43 -0.02 0.00 -1.01 0.00 0.00 33.01 28.70 1vgl s GLN 52 CO 0.73 -0.41 0.81 -0.51 0.01 0.00 0.00 175.29 175.92 1vgl s LEU 53 N 1.67 4.24 0.19 2.90 1.43 -1.26 -4.99 118.68 122.86 1vgl s LEU 53 Ca 0.61 1.24 -0.32 0.00 -1.03 0.00 0.00 54.13 54.63 1vgl s LEU 53 Cb -0.30 -3.24 -0.15 0.00 0.03 0.00 0.00 46.19 42.53 1vgl s LEU 53 CO 0.27 -0.30 1.17 0.00 0.23 0.00 0.00 176.35 177.72 1vgl n ALA 54 N 4.64 -0.53 -0.34 4.21 0.00 -1.26 -4.81 120.51 122.43 1vgl n ALA 54 Ca 0.03 0.45 0.25 0.00 0.00 0.00 0.00 53.44 54.17 1vgl n ALA 54 Cb 0.50 -2.05 0.53 0.00 0.00 0.00 0.00 19.45 18.43 1vgl n ALA 54 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1vgl h GLU 55 N 3.27 0.33 0.00 0.00 4.81 -2.05 0.13 114.58 121.07 1vgl h GLU 55 Ca -0.43 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 1vgl h GLU 55 Cb 1.34 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.64 1vgl h GLU 55 CO 0.69 0.22 0.00 0.39 -0.73 0.00 0.00 179.01 179.58 1vgl n GLU 56 N -4.63 0.52 -4.04 1.92 4.71 -1.26 -4.80 120.64 113.05 1vgl n GLU 56 Ca 0.27 0.04 -0.26 0.00 -0.01 0.00 0.00 57.16 57.20 1vgl n GLU 56 Cb 0.97 -1.50 -0.04 0.00 -1.01 0.00 0.00 31.44 29.86 1vgl n GLU 56 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1vgl s ASP 57 N -2.26 5.80 0.01 1.62 -0.00 0.46 -5.12 116.67 117.18 1vgl s ASP 57 Ca 0.27 -0.04 -0.19 0.00 -0.00 0.00 0.00 52.55 52.59 1vgl s ASP 57 Cb 0.15 -1.60 0.04 0.00 -0.00 0.00 0.00 42.92 41.51 1vgl s ASP 57 CO 0.29 0.05 0.42 -1.59 -0.00 0.00 0.00 175.17 174.34 1vgl s LYS 58 N -3.23 0.86 -0.13 8.23 -2.85 -1.26 -4.90 119.74 116.45 1vgl s LYS 58 Ca 0.32 -0.20 0.01 0.00 -1.00 0.00 0.00 55.97 55.10 1vgl s LYS 58 Cb -0.10 0.39 0.02 0.00 -2.06 0.00 0.00 37.83 36.08 1vgl s LYS 58 CO 0.25 -0.28 -0.15 0.42 0.10 0.00 0.00 175.35 175.70 1vgl s ILE 59 N -1.88 1.56 0.30 3.79 1.01 -1.26 -4.68 121.20 120.03 1vgl s ILE 59 Ca -0.09 -0.65 0.08 0.00 0.00 0.00 0.00 60.65 59.99 1vgl s ILE 59 Cb -0.02 -1.45 -0.04 0.00 0.01 0.00 0.00 42.46 40.96 1vgl s ILE 59 CO 0.02 0.46 0.18 -0.76 0.00 0.00 0.00 174.94 174.83 1vgl s LEU 60 N 1.27 3.53 0.39 2.97 1.43 -0.07 -4.86 118.68 123.34 1vgl s LEU 60 Ca 0.00 -0.50 -0.26 0.00 -1.03 0.00 0.00 54.13 52.34 1vgl s LEU 60 Cb -0.14 -2.07 -0.09 0.00 0.03 0.00 0.00 46.19 43.92 1vgl s LEU 60 CO -0.07 -0.17 1.26 0.00 0.23 0.00 0.00 176.35 177.60 1vgl s ALA 61 N -2.28 3.28 0.07 4.21 0.00 -1.26 -1.04 121.76 124.74 1vgl s ALA 61 Ca 0.36 1.15 -0.23 0.00 0.00 0.00 0.00 51.96 53.24 1vgl s ALA 61 Cb -0.06 -3.45 -0.16 0.00 0.00 0.00 0.00 23.12 19.45 1vgl s ALA 61 CO 0.24 -0.68 1.65 1.15 0.00 0.00 0.00 175.76 178.11 1vgl h THR 62 N 2.56 1.08 -0.82 0.00 2.02 -1.93 -3.32 112.91 112.50 1vgl h THR 62 Ca -0.49 -0.23 0.20 0.00 0.77 0.00 0.00 66.41 66.66 1vgl h THR 62 Cb 1.24 1.22 -0.14 0.00 -1.74 0.00 0.00 68.15 68.73 1vgl h THR 62 CO 0.63 0.06 0.09 -0.65 0.37 0.00 0.00 175.52 176.02 1vgl h PRO 63 N -0.09 0.13 0.00 6.66 0.11 -1.98 0.18 132.00 137.02 1vgl h PRO 63 Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 1vgl h PRO 63 Cb 0.10 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.18 1vgl h PRO 63 CO -0.00 0.09 0.00 0.00 -0.21 0.00 0.00 178.00 177.88 1vgl h LEU 65 N 0.00 0.60 -1.94 0.00 5.85 -1.67 -2.70 115.31 115.46 1vgl h LEU 65 Ca 0.00 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.76 1vgl h LEU 65 Cb 0.00 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 40.91 1vgl h LEU 65 CO 0.00 0.41 0.38 0.00 -0.34 0.00 0.00 178.44 178.89 1vgl h ALA 66 N 1.30 1.53 0.00 1.25 0.00 -0.79 -0.26 119.26 122.29 1vgl h ALA 66 Ca 0.27 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 1vgl h ALA 66 Cb 0.07 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1vgl h ALA 66 CO -0.13 -0.43 -0.00 0.87 0.00 0.00 0.00 179.25 179.56 1vgl h LYS 67 N 0.00 0.00 -0.09 0.00 1.57 -1.57 -2.91 116.57 113.57 1vgl h LYS 67 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1vgl h LYS 67 Cb 0.80 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.11 1vgl h LYS 67 CO -0.00 0.00 0.00 1.33 -0.57 0.00 0.00 179.45 180.21 1vgl n VAL 68 N -3.10 0.10 -2.69 0.50 0.24 -0.11 -4.94 118.33 108.33 1vgl n VAL 68 Ca 0.00 -0.38 -0.25 0.00 -2.04 0.00 0.00 64.34 61.68 1vgl n VAL 68 Cb 0.29 0.76 0.02 0.00 -1.47 0.00 0.00 33.84 33.45 1vgl n VAL 68 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1vgl s LEU 69 N -1.86 3.44 0.82 1.34 1.43 -1.10 -5.05 118.68 117.71 1vgl s LEU 69 Ca 0.34 0.47 -0.13 0.00 -1.03 0.00 0.00 54.13 53.78 1vgl s LEU 69 Cb 0.20 -3.33 0.07 0.00 0.03 0.00 0.00 46.19 43.16 1vgl s LEU 69 CO 0.31 -0.89 1.05 -2.65 0.23 0.00 0.00 176.35 174.40 1vgl n PRO 70 N -2.33 0.11 -0.10 1.29 -0.02 -1.26 -4.73 135.00 127.96 1vgl n PRO 70 Ca 0.03 0.11 -0.06 0.00 -2.02 0.00 0.00 63.50 61.56 1vgl n PRO 70 Cb 0.58 -2.31 0.01 0.00 -0.02 0.00 0.00 33.50 31.76 1vgl n PRO 70 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1vgl h PRO 71 N -0.97 0.23 0.00 0.52 0.11 -1.96 -1.84 132.00 128.09 1vgl h PRO 71 Ca -0.46 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 1vgl h PRO 71 Cb 1.30 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 1vgl h PRO 71 CO 0.44 0.15 -0.04 -1.00 -0.21 0.00 0.00 178.00 177.35 1vgl h PRO 72 N 0.24 0.00 -0.20 1.05 0.13 -2.00 -1.62 132.00 129.60 1vgl h PRO 72 Ca 0.16 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 65.12 1vgl h PRO 72 Cb 0.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.28 1vgl h PRO 72 CO -0.18 0.04 -0.55 0.28 -0.23 0.00 0.00 178.00 177.36 1vgl h VAL 73 N 0.00 1.31 -0.21 1.56 2.07 -1.75 -2.60 116.25 116.63 1vgl h VAL 73 Ca -0.00 -1.78 -0.01 0.00 0.82 0.00 0.00 66.70 65.73 1vgl h VAL 73 Cb 0.07 1.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 1vgl h VAL 73 CO 0.01 0.56 0.09 0.03 0.02 0.00 0.00 177.57 178.27 1vgl h ARG 74 N 0.43 0.28 0.13 1.57 3.08 -0.53 -1.47 114.38 117.87 1vgl h ARG 74 Ca -0.01 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 1vgl h ARG 74 Cb 1.17 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.16 1vgl h ARG 74 CO 0.12 0.24 -0.06 0.00 -1.07 0.00 0.00 179.97 179.19 1vgl h ARG 75 N 0.29 -0.17 -0.26 0.04 3.08 -1.21 -1.18 114.38 114.98 1vgl h ARG 75 Ca 0.07 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.14 1vgl h ARG 75 Cb 0.05 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 1vgl h ARG 75 CO -0.01 0.21 0.16 0.82 -1.07 0.00 0.00 179.97 180.08 1vgl h ILE 76 N -0.57 1.08 -0.92 2.04 2.04 -1.25 -1.82 117.51 118.11 1vgl h ILE 76 Ca -0.02 -0.18 0.09 0.00 1.00 0.00 0.00 64.86 65.74 1vgl h ILE 76 Cb 0.45 0.75 -0.06 0.00 -0.74 0.00 0.00 36.82 37.21 1vgl h ILE 76 CO 0.03 0.08 0.59 0.40 0.00 0.00 0.00 178.15 179.25 1vgl h ILE 77 N 0.33 1.01 -0.50 -0.67 2.04 -1.34 -0.03 117.51 118.34 1vgl h ILE 77 Ca 0.09 -0.33 -0.07 0.00 1.00 0.00 0.00 64.86 65.55 1vgl h ILE 77 Cb -0.01 -0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.00 1vgl h ILE 77 CO -0.02 0.18 0.02 1.23 0.00 0.00 0.00 178.15 179.56 1vgl h GLY 78 N 0.97 0.90 1.95 5.37 0.00 -0.50 -2.01 103.07 109.74 1vgl h GLY 78 Ca 0.41 -0.59 -0.15 0.00 0.00 0.00 0.00 47.33 47.00 1vgl h GLY 78 CO -0.17 0.55 -0.71 -1.80 0.00 0.00 0.00 176.54 174.40 1vgl h ASP 79 N 0.78 0.06 -0.22 0.19 1.82 -0.47 -0.98 116.42 117.61 1vgl h ASP 79 Ca 0.15 -0.04 -0.06 0.00 -0.39 0.00 0.00 57.03 56.69 1vgl h ASP 79 Cb 0.44 -0.02 -0.01 0.00 0.68 0.00 0.00 39.33 40.43 1vgl h ASP 79 CO 0.02 0.75 -0.09 -0.07 -1.61 0.00 0.00 179.24 178.24 1vgl h LEU 80 N 0.03 0.45 0.00 2.28 3.38 -0.55 0.82 115.31 121.72 1vgl h LEU 80 Ca -0.01 -0.40 -0.08 0.00 0.09 0.00 0.00 57.88 57.47 1vgl h LEU 80 Cb 1.26 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 1vgl h LEU 80 CO 0.10 0.76 -0.45 0.77 0.09 0.00 0.00 178.44 179.70 1vgl h SER 81 N 0.15 0.00 0.25 -0.43 4.64 -1.44 0.33 113.55 117.06 1vgl h SER 81 Ca 0.05 -0.82 -0.01 0.00 -0.47 0.00 0.00 61.79 60.54 1vgl h SER 81 Cb 0.58 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 1vgl h SER 81 CO 0.03 1.17 -0.12 0.78 -0.87 0.00 0.00 176.83 177.82 1vgl h ASN 82 N -1.00 -0.29 0.00 4.97 -0.26 -1.31 -3.06 115.58 114.63 1vgl h ASN 82 Ca -0.12 -0.24 -0.03 0.00 -0.56 0.00 0.00 56.30 55.34 1vgl h ASN 82 Cb 1.11 0.07 -0.00 0.00 -1.06 0.00 0.00 38.32 38.44 1vgl h ASN 82 CO -0.08 0.15 -0.26 -0.09 -1.06 0.00 0.00 177.43 176.09 1vgl h ARG 83 N -0.81 0.00 0.01 0.81 2.43 -1.40 -3.39 114.38 112.04 1vgl h ARG 83 Ca -0.03 0.00 -0.21 0.00 -0.81 0.00 0.00 59.98 58.93 1vgl h ARG 83 Cb 0.51 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.04 1vgl h ARG 83 CO 0.06 0.47 -0.97 0.93 -1.51 0.00 0.00 179.97 178.95 1vgl h GLU 84 N -1.00 0.05 -5.30 0.20 4.39 -0.94 -3.48 114.58 108.49 1vgl h GLU 84 Ca -0.05 -0.07 -0.32 0.00 0.34 0.00 0.00 59.36 59.26 1vgl h GLU 84 Cb 0.59 0.02 0.14 0.00 -0.10 0.00 0.00 28.75 29.41 1vgl h GLU 84 CO -0.03 0.97 -0.66 1.63 -1.16 0.00 0.00 179.01 179.76 1vgl n LYS 85 N -3.45 -6.39 -0.00 2.33 4.76 0.11 -4.91 118.16 110.60 1vgl n LYS 85 Ca -0.01 0.75 0.06 0.00 -2.87 0.00 0.00 58.31 56.24 1vgl n LYS 85 Cb 0.90 -5.53 -0.08 0.00 -1.84 0.00 0.00 35.03 28.48 1vgl n LYS 85 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 1vgl n VAL 86 N -4.15 0.00 -3.08 -0.18 0.24 -0.70 -4.95 118.33 105.50 1vgl n VAL 86 Ca -0.16 -0.25 -0.41 0.00 -2.04 0.00 0.00 64.34 61.47 1vgl n VAL 86 Cb 0.62 0.61 -0.06 0.00 -1.47 0.00 0.00 33.84 33.53 1vgl n VAL 86 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1vgl s LEU 87 N -3.23 4.17 -0.12 1.34 2.96 -1.23 -1.07 118.68 121.50 1vgl s LEU 87 Ca 0.00 0.38 -0.11 0.00 -0.22 0.00 0.00 54.13 54.18 1vgl s LEU 87 Cb 0.09 -2.85 -0.10 0.00 0.50 0.00 0.00 46.19 43.83 1vgl s LEU 87 CO 0.52 -0.54 0.27 0.40 -1.32 0.00 0.00 176.35 175.68 1vgl h ILE 88 N 5.60 0.66 -0.94 6.68 2.04 -1.43 -3.44 117.51 126.68 1vgl h ILE 88 Ca -0.26 -1.50 0.00 0.00 1.00 0.00 0.00 64.86 64.10 1vgl h ILE 88 Cb 1.11 1.25 0.00 0.00 -0.74 0.00 0.00 36.82 38.44 1vgl h ILE 88 CO 0.83 0.22 0.00 0.61 0.00 0.00 0.00 178.15 179.81 1vgl n GLY 89 N 1.71 1.07 2.66 5.37 0.00 -1.20 -4.68 105.19 110.13 1vgl n GLY 89 Ca -0.04 -0.78 -0.11 0.00 0.00 0.00 0.00 46.02 45.09 1vgl n GLY 89 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1vgl n LEU 90 N 0.00 0.00 -3.45 0.99 -0.00 -0.21 -1.08 117.00 113.26 1vgl n LEU 90 Ca 0.00 -2.18 -0.14 0.00 -0.00 0.00 0.00 56.01 53.70 1vgl n LEU 90 Cb 0.00 2.14 -0.03 0.00 -0.00 0.00 0.00 43.42 45.53 1vgl n LEU 90 CO 0.00 -0.53 0.41 -0.62 -0.00 0.00 0.00 177.39 176.65 1vgl s ASP 91 N -2.67 -0.59 -0.18 1.45 2.15 -0.18 -0.89 116.67 115.76 1vgl s ASP 91 Ca 0.21 0.19 -0.01 0.00 0.43 0.00 0.00 52.55 53.36 1vgl s ASP 91 Cb -0.01 0.58 0.05 0.00 -0.30 0.00 0.00 42.92 43.24 1vgl s ASP 91 CO 0.15 -0.87 -0.01 -0.22 -0.17 0.00 0.00 175.17 174.05 1vgl s LEU 92 N -2.34 1.44 -0.05 -1.34 2.96 -1.26 -0.09 118.68 118.00 1vgl s LEU 92 Ca -0.02 -0.74 0.02 0.00 -0.22 0.00 0.00 54.13 53.17 1vgl s LEU 92 Cb -0.01 -0.75 0.01 0.00 0.50 0.00 0.00 46.19 45.94 1vgl s LEU 92 CO -0.07 -0.25 -0.12 -0.76 -1.32 0.00 0.00 176.35 173.84 1vgl s LEU 93 N 1.74 1.68 -0.01 -0.68 1.43 -0.62 -4.93 118.68 117.29 1vgl s LEU 93 Ca -0.01 -0.27 -0.30 0.00 -1.03 0.00 0.00 54.13 52.52 1vgl s LEU 93 Cb -0.16 -0.76 -0.03 0.00 0.03 0.00 0.00 46.19 45.26 1vgl s LEU 93 CO -0.07 0.05 1.07 -0.47 0.23 0.00 0.00 176.35 177.16 1vgl s TYR 94 N 0.50 3.50 0.09 0.29 6.14 -1.26 -0.22 117.35 126.39 1vgl s TYR 94 Ca -0.11 1.50 -0.25 0.00 0.64 0.00 0.00 57.07 58.85 1vgl s TYR 94 Cb -0.14 -3.26 0.08 0.00 0.42 0.00 0.00 41.96 39.07 1vgl s TYR 94 CO 0.03 -0.58 0.70 -1.83 0.64 0.00 0.00 175.55 174.51 1vgl s GLU 95 N 1.39 1.11 -0.06 4.97 -1.05 -0.20 -4.95 118.70 119.92 1vgl s GLU 95 Ca 0.54 -0.35 -0.30 0.00 -0.15 0.00 0.00 54.97 54.71 1vgl s GLU 95 Cb -0.23 0.51 -0.03 0.00 -0.44 0.00 0.00 34.13 33.95 1vgl s GLU 95 CO 0.26 -0.47 1.10 -2.00 0.95 0.00 0.00 175.26 175.09 1vgl s GLU 96 N -3.29 4.41 -0.28 -4.83 2.12 -1.26 -1.81 118.70 113.75 1vgl s GLU 96 Ca 0.01 1.55 -0.02 0.00 0.36 0.00 0.00 54.97 56.87 1vgl s GLU 96 Cb -0.01 -3.52 0.04 0.00 0.26 0.00 0.00 34.13 30.90 1vgl s GLU 96 CO -0.10 -0.34 -0.02 0.42 -0.54 0.00 0.00 175.26 174.68 1vgl s ILE 97 N 1.91 2.99 0.00 -3.70 -1.09 0.19 -4.82 121.20 116.68 1vgl s ILE 97 Ca 0.53 -1.19 0.00 0.00 -2.23 0.00 0.00 60.65 57.76 1vgl s ILE 97 Cb -0.22 -2.62 0.00 0.00 -1.58 0.00 0.00 42.46 38.04 1vgl s ILE 97 CO 0.22 0.04 0.00 0.61 -1.23 0.00 0.00 174.94 174.58 1vgl n GLY 98 N 4.66 0.00 1.71 6.18 0.00 -1.26 -1.03 105.19 115.44 1vgl n GLY 98 Ca -0.15 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.91 1vgl n GLY 98 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1vgl n ASP 99 N -0.00 4.87 -4.71 1.61 5.75 -1.26 -4.61 116.55 118.20 1vgl n ASP 99 Ca 0.00 -2.84 -0.23 0.00 -0.01 0.00 0.00 54.79 51.71 1vgl n ASP 99 Cb 0.00 -0.67 -0.06 0.00 -1.03 0.00 0.00 41.12 39.36 1vgl n ASP 99 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 1vgl s GLN 100 N -2.51 2.51 0.53 0.11 -0.21 -1.26 -5.12 119.66 113.71 1vgl s GLN 100 Ca 0.46 -1.30 -0.00 0.00 0.02 0.00 0.00 55.36 54.54 1vgl s GLN 100 Cb 0.36 -2.30 0.02 0.00 1.00 0.00 0.00 33.01 32.09 1vgl s GLN 100 CO 0.13 0.37 0.76 0.00 -2.12 0.00 0.00 175.29 174.43 1vgl s ALA 101 N -2.26 3.75 -0.05 6.09 0.00 -1.26 -4.97 121.76 123.06 1vgl s ALA 101 Ca 0.32 -1.16 -0.00 0.00 0.00 0.00 0.00 51.96 51.12 1vgl s ALA 101 Cb -0.07 -2.17 0.03 0.00 0.00 0.00 0.00 23.12 20.91 1vgl s ALA 101 CO 0.22 -0.66 -0.00 -1.21 0.00 0.00 0.00 175.76 174.10 1vgl s GLU 102 N -4.74 0.46 -0.05 0.00 2.02 -1.26 -3.57 118.70 111.56 1vgl s GLU 102 Ca 0.54 0.08 -0.30 0.00 0.02 0.00 0.00 54.97 55.31 1vgl s GLU 102 Cb -0.10 -0.70 0.09 0.00 0.10 0.00 0.00 34.13 33.52 1vgl s GLU 102 CO 0.39 -0.19 0.77 0.16 0.02 0.00 0.00 175.26 176.41 1vgl s ASP 103 N 1.39 -0.55 0.03 -0.19 1.47 -1.09 -5.02 116.67 112.71 1vgl s ASP 103 Ca -0.04 0.50 0.00 0.00 1.18 0.00 0.00 52.55 54.19 1vgl s ASP 103 Cb -0.13 0.47 0.00 0.00 -0.34 0.00 0.00 42.92 42.92 1vgl s ASP 103 CO -0.02 -0.59 0.49 -0.90 0.68 0.00 0.00 175.17 174.83 1vgl n ASP 104 N 0.62 0.00 -1.41 2.11 3.85 -1.26 -0.27 116.55 120.19 1vgl n ASP 104 Ca -0.16 0.02 -0.07 0.00 -0.71 0.00 0.00 54.79 53.87 1vgl n ASP 104 Cb 0.59 0.00 0.21 0.00 -1.35 0.00 0.00 41.12 40.56 1vgl n ASP 104 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 1vgl n LEU 105 N -1.00 4.78 0.00 -2.12 4.77 -1.26 -4.37 117.00 117.80 1vgl n LEU 105 Ca 0.00 -3.63 0.00 0.00 -0.03 0.00 0.00 56.01 52.35 1vgl n LEU 105 Cb 0.49 -0.68 0.00 0.00 -2.33 0.00 0.00 43.42 40.90 1vgl n LEU 105 CO 0.00 1.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.80 1vgl n GLY 106 N -1.00 -0.48 3.92 -0.72 0.00 0.62 -4.34 105.19 103.18 1vgl n GLY 106 Ca 0.38 -1.41 -0.27 0.00 0.00 0.00 0.00 46.02 44.72 1vgl n GLY 106 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vgl s LEU 107 N 0.00 3.99 0.00 0.99 1.43 0.15 -2.66 118.68 122.58 1vgl s LEU 107 Ca 0.00 0.66 0.24 0.00 -1.03 0.00 0.00 54.13 54.00 1vgl s LEU 107 Cb 0.00 -3.50 0.24 0.00 0.03 0.00 0.00 46.19 42.96 1vgl s LEU 107 CO 0.00 -0.27 1.29 -0.62 0.23 0.00 0.00 176.35 176.98