#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dbb n ARG 5 N 0.00 0.00 -1.62 0.03 0.63 -1.26 -5.14 116.66 109.31 2dbb n ARG 5 Ca 0.00 0.00 -0.56 0.00 -0.92 0.00 0.00 57.85 56.37 2dbb n ARG 5 Cb 0.00 0.00 -0.07 0.00 0.45 0.00 0.00 32.46 32.84 2dbb n ARG 5 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29 2dbb n LYS 6 N -0.71 0.86 -3.74 -0.14 3.00 -1.26 -4.98 118.16 111.20 2dbb n LYS 6 Ca 0.00 0.31 -0.13 0.00 -0.00 0.00 0.00 58.31 58.50 2dbb n LYS 6 Cb 0.00 -1.93 -0.11 0.00 0.00 0.00 0.00 35.03 32.99 2dbb n LYS 6 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 2dbb s LEU 7 N 1.38 0.49 0.20 3.14 2.96 -1.26 -5.14 118.68 120.45 2dbb s LEU 7 Ca 0.91 0.75 -0.21 0.00 -0.22 0.00 0.00 54.13 55.36 2dbb s LEU 7 Cb -1.08 1.25 -0.13 0.00 0.50 0.00 0.00 46.19 46.73 2dbb s LEU 7 CO 0.56 -0.14 0.33 -0.67 -1.32 0.00 0.00 176.35 175.11 2dbb n ASP 8 N 3.14 -1.33 -0.31 3.68 2.03 -1.26 -4.71 116.55 117.79 2dbb n ASP 8 Ca -0.15 0.84 -0.01 0.00 0.52 0.00 0.00 54.79 55.99 2dbb n ASP 8 Cb 0.57 -0.75 0.16 0.00 -0.72 0.00 0.00 41.12 40.38 2dbb n ASP 8 CO 0.00 0.00 0.00 -0.09 -1.92 0.00 0.00 177.20 175.19 2dbb h ARG 9 N 0.66 1.20 -0.10 -0.67 2.43 -2.00 -2.30 114.38 113.59 2dbb h ARG 9 Ca -0.24 -0.08 -0.16 0.00 -0.81 0.00 0.00 59.98 58.69 2dbb h ARG 9 Cb 1.15 -0.27 -0.01 0.00 -0.42 0.00 0.00 29.97 30.43 2dbb h ARG 9 CO 0.44 0.80 -0.63 0.28 -1.51 0.00 0.00 179.97 179.35 2dbb h VAL 10 N 1.23 1.37 -0.78 0.20 2.07 -2.00 -2.74 116.25 115.60 2dbb h VAL 10 Ca 0.33 -1.98 -0.05 0.00 0.82 0.00 0.00 66.70 65.82 2dbb h VAL 10 Cb -0.12 1.97 -0.03 0.00 -1.52 0.00 0.00 31.29 31.59 2dbb h VAL 10 CO -0.07 0.60 0.28 0.44 0.02 0.00 0.00 177.57 178.84 2dbb h ASP 11 N 0.27 1.10 -0.55 0.57 3.32 -1.79 -1.32 116.42 118.02 2dbb h ASP 11 Ca -0.01 -0.19 -0.08 0.00 0.02 0.00 0.00 57.03 56.77 2dbb h ASP 11 Cb 1.16 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 40.41 2dbb h ASP 11 CO 0.11 0.99 0.04 -0.03 -1.72 0.00 0.00 179.24 178.62 2dbb h MET 12 N 1.14 0.94 -0.58 3.56 4.05 -1.35 -0.96 114.93 121.74 2dbb h MET 12 Ca 0.26 -0.28 -0.01 0.00 -0.28 0.00 0.00 59.70 59.39 2dbb h MET 12 Cb 0.26 -0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 30.93 2dbb h MET 12 CO -0.02 0.94 0.34 1.96 0.23 0.00 0.00 176.91 180.36 2dbb h GLN 13 N 0.82 0.79 -0.75 0.39 4.20 -1.22 0.15 115.11 119.50 2dbb h GLN 13 Ca 0.16 -0.08 0.04 0.00 0.06 0.00 0.00 58.65 58.83 2dbb h GLN 13 Cb 0.49 -0.16 -0.05 0.00 0.30 0.00 0.00 27.48 28.06 2dbb h GLN 13 CO 0.02 0.59 0.47 1.25 -0.67 0.00 0.00 178.83 180.48 2dbb h LEU 14 N 0.78 0.75 -0.33 1.46 5.85 -0.97 0.12 115.31 122.97 2dbb h LEU 14 Ca 0.21 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.90 2dbb h LEU 14 Cb 0.01 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 2dbb h LEU 14 CO -0.04 0.51 0.07 0.58 -0.34 0.00 0.00 178.44 179.22 2dbb h VAL 15 N 0.89 1.23 -0.55 1.05 2.07 -0.52 -0.71 116.25 119.71 2dbb h VAL 15 Ca 0.31 -0.77 0.03 0.00 0.82 0.00 0.00 66.70 67.10 2dbb h VAL 15 Cb 0.07 1.10 -0.04 0.00 -1.52 0.00 0.00 31.29 30.89 2dbb h VAL 15 CO -0.13 0.26 0.31 0.11 0.02 0.00 0.00 177.57 178.14 2dbb h LYS 16 N 0.38 0.60 -0.05 1.57 1.79 -0.23 -1.95 116.57 118.67 2dbb h LYS 16 Ca 0.10 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.53 2dbb h LYS 16 Cb 0.31 -0.13 -0.00 0.00 -1.58 0.00 0.00 32.23 30.83 2dbb h LYS 16 CO 0.00 0.40 -0.00 0.82 -1.08 0.00 0.00 179.45 179.58 2dbb h ILE 17 N 0.62 1.26 0.00 1.86 2.04 -0.61 -3.06 117.51 119.62 2dbb h ILE 17 Ca 0.23 -0.81 -0.00 0.00 1.00 0.00 0.00 64.86 65.27 2dbb h ILE 17 Cb 0.06 1.71 -0.00 0.00 -0.74 0.00 0.00 36.82 37.85 2dbb h ILE 17 CO -0.12 0.22 -0.02 -0.07 0.00 0.00 0.00 178.15 178.16 2dbb h LEU 18 N -0.21 0.00 -0.89 1.44 3.38 -1.02 -0.75 115.31 117.26 2dbb h LEU 18 Ca 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 2dbb h LEU 18 Cb 0.36 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 2dbb h LEU 18 CO 0.00 0.02 -0.00 0.77 0.09 0.00 0.00 178.44 179.33 2dbb h SER 19 N 0.00 0.00 0.16 -0.43 4.64 -1.25 -2.09 113.55 114.58 2dbb h SER 19 Ca -0.00 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 60.97 2dbb h SER 19 Cb 0.07 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.10 2dbb h SER 19 CO 0.00 0.00 -2.17 -0.62 -0.87 0.00 0.00 176.83 173.18 2dbb n GLU 20 N -3.09 0.67 -3.25 4.77 -0.58 -0.36 -4.80 120.64 113.99 2dbb n GLU 20 Ca 0.02 0.12 -0.12 0.00 -0.42 0.00 0.00 57.16 56.76 2dbb n GLU 20 Cb 0.39 -1.62 -0.05 0.00 -0.57 0.00 0.00 31.44 29.60 2dbb n GLU 20 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 2dbb s ASN 21 N -5.88 0.23 0.00 1.62 3.84 -0.73 -5.01 114.94 109.01 2dbb s ASN 21 Ca -0.12 -1.57 0.17 0.00 0.21 0.00 0.00 52.86 51.55 2dbb s ASN 21 Cb 0.07 0.96 0.94 0.00 -0.55 0.00 0.00 41.25 42.67 2dbb s ASN 21 CO 0.80 -0.20 1.44 -1.54 -2.79 0.00 0.00 177.10 174.81 2dbb n SER 22 N 3.97 0.00 -1.11 -4.21 3.41 -0.79 -2.89 113.62 112.00 2dbb n SER 22 Ca 0.14 -0.31 0.11 0.00 -0.26 0.00 0.00 58.87 58.55 2dbb n SER 22 Cb 0.49 -0.11 0.21 0.00 -0.26 0.00 0.00 64.21 64.55 2dbb n SER 22 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2dbb n ARG 23 N -1.11 2.46 -1.89 4.33 1.74 -1.26 -4.97 116.66 115.96 2dbb n ARG 23 Ca 0.11 -2.27 -0.42 0.00 -0.77 0.00 0.00 57.85 54.50 2dbb n ARG 23 Cb 0.09 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.01 2dbb n ARG 23 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2dbb s LEU 24 N -1.35 4.37 0.74 0.55 1.43 -1.14 -4.97 118.68 118.31 2dbb s LEU 24 Ca 0.37 2.67 -0.11 0.00 -1.03 0.00 0.00 54.13 56.03 2dbb s LEU 24 Cb 0.22 -3.59 0.04 0.00 0.03 0.00 0.00 46.19 42.88 2dbb s LEU 24 CO 0.30 -0.86 1.09 0.42 0.23 0.00 0.00 176.35 177.53 2dbb s THR 25 N 1.21 3.37 0.44 5.49 -4.23 -1.26 -4.80 115.64 115.86 2dbb s THR 25 Ca 0.71 0.48 0.13 0.00 -1.18 0.00 0.00 61.69 61.84 2dbb s THR 25 Cb -0.45 -3.00 0.31 0.00 1.34 0.00 0.00 72.50 70.71 2dbb s THR 25 CO 0.31 -0.54 2.00 1.88 -0.54 0.00 0.00 174.62 177.73 2dbb h TYR 26 N -0.84 0.42 -0.00 3.99 0.05 -1.93 -0.87 116.97 117.78 2dbb h TYR 26 Ca -0.44 0.01 -0.00 0.00 0.05 0.00 0.00 58.73 58.35 2dbb h TYR 26 Cb 1.23 -0.14 -0.00 0.00 1.01 0.00 0.00 36.73 38.83 2dbb h TYR 26 CO 0.58 0.22 0.00 -0.09 -1.05 0.00 0.00 178.16 177.81 2dbb h ARG 27 N 0.41 0.01 -0.70 4.88 2.43 -1.91 0.19 114.38 119.68 2dbb h ARG 27 Ca 0.24 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.41 2dbb h ARG 27 Cb 0.41 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.92 2dbb h ARG 27 CO -0.06 0.21 0.44 0.93 -1.51 0.00 0.00 179.97 179.97 2dbb h GLU 28 N -0.19 0.95 -0.47 0.20 5.08 -1.70 -0.70 114.58 117.74 2dbb h GLU 28 Ca 0.00 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 2dbb h GLU 28 Cb 0.20 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2dbb h GLU 28 CO -0.00 0.66 0.23 -0.07 -1.00 0.00 0.00 179.01 178.83 2dbb h LEU 29 N 0.96 0.61 -1.00 1.33 3.38 -1.02 -0.86 115.31 118.71 2dbb h LEU 29 Ca 0.25 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2dbb h LEU 29 Cb -0.06 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.49 2dbb h LEU 29 CO -0.05 0.56 0.63 0.00 0.09 0.00 0.00 178.44 179.67 2dbb h ALA 30 N 1.08 1.26 -0.30 1.53 0.00 -0.14 -0.30 119.26 122.39 2dbb h ALA 30 Ca 0.16 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2dbb h ALA 30 Cb 0.10 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2dbb h ALA 30 CO -0.02 0.66 0.02 -0.44 0.00 0.00 0.00 179.25 179.47 2dbb h ASP 31 N 1.34 0.51 -0.62 0.00 3.32 -0.77 0.91 116.42 121.12 2dbb h ASP 31 Ca 0.36 -0.29 -0.05 0.00 0.02 0.00 0.00 57.03 57.06 2dbb h ASP 31 Cb -0.12 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.27 2dbb h ASP 31 CO -0.07 0.68 0.20 0.40 -1.72 0.00 0.00 179.24 178.72 2dbb h ILE 32 N 0.33 1.24 -0.56 0.35 2.04 -0.82 -3.00 117.51 117.09 2dbb h ILE 32 Ca 0.09 -0.84 0.00 0.00 1.00 0.00 0.00 64.86 65.11 2dbb h ILE 32 Cb 0.40 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 37.02 2dbb h ILE 32 CO 0.01 0.32 0.00 0.18 0.00 0.00 0.00 178.15 178.67 2dbb n LEU 33 N -4.27 3.24 -3.76 1.44 4.77 -0.15 -4.98 117.00 113.30 2dbb n LEU 33 Ca 0.05 -1.58 -0.31 0.00 -0.03 0.00 0.00 56.01 54.14 2dbb n LEU 33 Cb 0.22 -0.37 0.03 0.00 -2.33 0.00 0.00 43.42 40.96 2dbb n LEU 33 CO 0.41 0.79 -0.11 -3.20 -1.33 0.00 0.00 177.39 173.94 2dbb n ASN 34 N 1.29 -4.03 -1.12 -1.43 5.15 0.17 -4.98 115.26 110.31 2dbb n ASN 34 Ca 0.20 -1.03 -0.01 0.00 -0.60 0.00 0.00 54.58 53.15 2dbb n ASN 34 Cb 0.52 -3.23 -0.00 0.00 -0.53 0.00 0.00 39.78 36.54 2dbb n ASN 34 CO 0.00 0.00 0.00 1.07 1.40 0.00 0.00 177.26 179.73 2dbb n THR 35 N -4.29 0.00 -3.68 -0.44 5.66 -0.37 -5.05 114.28 106.12 2dbb n THR 35 Ca -0.15 -0.11 -0.24 0.00 -3.05 0.00 0.00 64.05 60.50 2dbb n THR 35 Cb 0.61 0.07 -0.02 0.00 -1.55 0.00 0.00 70.33 69.44 2dbb n THR 35 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2dbb s THR 36 N -2.38 5.19 0.23 1.09 -4.23 -1.26 -4.47 115.64 109.80 2dbb s THR 36 Ca 0.02 -0.63 -0.05 0.00 -1.18 0.00 0.00 61.69 59.85 2dbb s THR 36 Cb -0.00 -3.83 0.13 0.00 1.34 0.00 0.00 72.50 70.14 2dbb s THR 36 CO 0.01 -0.37 1.75 -0.09 -0.54 0.00 0.00 174.62 175.39 2dbb h ARG 37 N 1.25 1.00 -0.37 3.99 2.43 -1.92 -1.86 114.38 118.91 2dbb h ARG 37 Ca -0.50 -0.24 0.00 0.00 -0.81 0.00 0.00 59.98 58.44 2dbb h ARG 37 Cb 1.22 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.61 2dbb h ARG 37 CO 0.63 0.90 0.24 1.96 -1.51 0.00 0.00 179.97 182.19 2dbb h GLN 38 N 0.95 0.49 -0.41 0.20 7.50 -1.94 0.46 115.11 122.36 2dbb h GLN 38 Ca 0.20 -0.03 -0.06 0.00 0.50 0.00 0.00 58.65 59.25 2dbb h GLN 38 Cb 0.37 -0.11 -0.02 0.00 0.05 0.00 0.00 27.48 27.77 2dbb h GLN 38 CO 0.00 0.34 -0.00 0.00 -1.50 0.00 0.00 178.83 177.67 2dbb h ARG 39 N 0.49 0.65 -0.57 1.46 3.08 -1.90 -1.27 114.38 116.32 2dbb h ARG 39 Ca 0.13 -0.16 -0.10 0.00 0.07 0.00 0.00 59.98 59.93 2dbb h ARG 39 Cb -0.04 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 29.90 2dbb h ARG 39 CO -0.03 0.67 -0.02 0.82 -1.07 0.00 0.00 179.97 180.34 2dbb h ILE 40 N 0.62 1.27 -0.01 2.04 1.08 -0.82 -1.06 117.51 120.63 2dbb h ILE 40 Ca 0.13 -1.17 0.01 0.00 -0.39 0.00 0.00 64.86 63.43 2dbb h ILE 40 Cb 0.39 0.87 -0.01 0.00 -3.07 0.00 0.00 36.82 35.00 2dbb h ILE 40 CO 0.01 0.42 -0.03 0.00 -0.69 0.00 0.00 178.15 177.87 2dbb h ALA 41 N 0.96 -0.02 -0.67 1.87 0.00 -0.29 -0.87 119.26 120.24 2dbb h ALA 41 Ca 0.16 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2dbb h ALA 41 Cb 0.58 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 2dbb h ALA 41 CO 0.03 -0.52 0.39 0.00 0.00 0.00 0.00 179.25 179.16 2dbb h ARG 42 N -0.04 0.92 0.00 0.00 3.08 -1.12 -0.96 114.38 116.25 2dbb h ARG 42 Ca 0.01 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 59.97 2dbb h ARG 42 Cb 0.06 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 29.92 2dbb h ARG 42 CO -0.03 0.66 -0.00 0.00 -1.07 0.00 0.00 179.97 179.53 2dbb h ARG 43 N 0.91 -0.00 -0.71 0.04 3.08 -0.90 -0.73 114.38 116.06 2dbb h ARG 43 Ca 0.24 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.27 2dbb h ARG 43 Cb -0.01 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.01 2dbb h ARG 43 CO -0.04 0.06 0.36 0.82 -1.07 0.00 0.00 179.97 180.10 2dbb h ILE 44 N -0.07 1.22 -0.65 2.04 2.04 -1.05 -0.99 117.51 120.05 2dbb h ILE 44 Ca -0.00 -0.61 -0.06 0.00 1.00 0.00 0.00 64.86 65.20 2dbb h ILE 44 Cb 0.07 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 36.42 2dbb h ILE 44 CO 0.00 0.26 0.19 -0.78 0.00 0.00 0.00 178.15 177.82 2dbb h ASP 45 N 1.00 0.97 -0.45 1.72 1.82 -0.87 -1.45 116.42 119.16 2dbb h ASP 45 Ca 0.25 -0.22 -0.08 0.00 -0.39 0.00 0.00 57.03 56.59 2dbb h ASP 45 Cb 0.08 -0.25 -0.02 0.00 0.68 0.00 0.00 39.33 39.82 2dbb h ASP 45 CO -0.03 0.93 -0.04 0.50 -1.61 0.00 0.00 179.24 178.98 2dbb h LYS 46 N 0.95 0.82 -0.99 0.28 1.63 -0.67 -0.78 116.57 117.82 2dbb h LYS 46 Ca 0.21 -0.29 0.04 0.00 -0.85 0.00 0.00 60.65 59.76 2dbb h LYS 46 Cb 0.32 -0.06 -0.06 0.00 -0.60 0.00 0.00 32.23 31.83 2dbb h LYS 46 CO -0.00 0.91 0.65 -0.07 -3.45 0.00 0.00 179.45 177.48 2dbb h LEU 47 N 0.66 1.07 -0.27 5.20 3.38 -0.89 0.39 115.31 124.86 2dbb h LEU 47 Ca 0.12 -0.01 -0.18 0.00 0.09 0.00 0.00 57.88 57.90 2dbb h LEU 47 Cb 0.56 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2dbb h LEU 47 CO 0.03 0.73 -0.54 0.11 0.09 0.00 0.00 178.44 178.86 2dbb h LYS 48 N 1.24 0.84 -0.82 1.13 1.57 -1.04 -0.30 116.57 119.18 2dbb h LYS 48 Ca 0.40 -0.55 -0.03 0.00 -1.87 0.00 0.00 60.65 58.60 2dbb h LYS 48 Cb 0.01 0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.36 2dbb h LYS 48 CO -0.13 1.18 0.39 -0.22 -0.57 0.00 0.00 179.45 180.09 2dbb h LYS 49 N 0.60 1.18 -0.01 3.15 3.64 -0.54 -2.09 116.57 122.52 2dbb h LYS 49 Ca 0.01 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.21 2dbb h LYS 49 Cb 1.15 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.76 2dbb h LYS 49 CO 0.12 0.91 0.00 1.28 -2.27 0.00 0.00 179.45 179.49 2dbb n LEU 50 N -4.30 0.12 0.00 5.20 4.77 0.07 -4.89 117.00 117.97 2dbb n LEU 50 Ca 0.08 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 2dbb n LEU 50 Cb 0.14 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 2dbb n LEU 50 CO 0.40 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 2dbb n GLY 51 N 0.95 0.35 0.25 -0.72 0.00 -0.79 -4.88 105.19 100.35 2dbb n GLY 51 Ca 0.20 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.12 2dbb n GLY 51 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2dbb h ILE 52 N 0.00 1.27 -3.63 -0.61 2.04 -1.30 -3.35 117.51 111.92 2dbb h ILE 52 Ca 0.00 -1.13 -0.70 0.00 1.00 0.00 0.00 64.86 64.03 2dbb h ILE 52 Cb 0.33 1.07 -0.27 0.00 -0.74 0.00 0.00 36.82 37.22 2dbb h ILE 52 CO 0.00 0.39 -0.57 -0.63 0.00 0.00 0.00 178.15 177.35 2dbb s ILE 53 N -4.91 4.15 -0.07 -0.67 1.01 -1.09 -4.96 121.20 114.66 2dbb s ILE 53 Ca -0.12 -0.98 0.14 0.00 0.00 0.00 0.00 60.65 59.69 2dbb s ILE 53 Cb 0.11 -3.32 -0.17 0.00 0.01 0.00 0.00 42.46 39.08 2dbb s ILE 53 CO 0.82 -0.19 0.80 0.03 0.00 0.00 0.00 174.94 176.41 2dbb h ARG 54 N 8.32 0.00 -2.25 2.79 3.08 -1.90 -3.40 114.38 121.01 2dbb h ARG 54 Ca -0.25 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.75 2dbb h ARG 54 Cb 1.09 0.00 -0.18 0.00 0.08 0.00 0.00 29.97 30.97 2dbb h ARG 54 CO 0.63 0.43 0.17 0.21 -1.07 0.00 0.00 179.97 180.34 2dbb s LYS 55 N -2.77 1.09 -0.35 0.04 2.20 -1.26 -5.11 119.74 113.58 2dbb s LYS 55 Ca -0.03 0.09 -0.05 0.00 -0.36 0.00 0.00 55.97 55.62 2dbb s LYS 55 Cb 0.08 0.51 0.06 0.00 -1.51 0.00 0.00 37.83 36.98 2dbb s LYS 55 CO 0.82 -0.37 0.12 -0.06 -0.36 0.00 0.00 175.35 175.49 2dbb s PHE 56 N -1.73 3.33 0.00 4.03 0.08 -1.26 -5.07 117.98 117.36 2dbb s PHE 56 Ca -0.09 -1.75 0.00 0.00 0.12 0.00 0.00 56.93 55.21 2dbb s PHE 56 Cb -0.00 -2.52 0.00 0.00 -0.57 0.00 0.00 43.02 39.92 2dbb s PHE 56 CO 0.05 -0.81 0.00 -2.37 -0.10 0.00 0.00 175.22 171.99 2dbb n THR 57 N 4.74 0.00 -4.22 0.64 5.66 -1.26 -5.18 114.28 114.66 2dbb n THR 57 Ca -0.10 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.77 2dbb n THR 57 Cb 0.43 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.11 2dbb n THR 57 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 2dbb s ILE 58 N -0.85 0.95 -0.34 1.09 -4.36 -1.26 -4.93 121.20 111.51 2dbb s ILE 58 Ca 0.00 -2.01 -0.06 0.00 -0.26 0.00 0.00 60.65 58.33 2dbb s ILE 58 Cb 0.00 -1.78 0.04 0.00 1.25 0.00 0.00 42.46 41.97 2dbb s ILE 58 CO 0.00 -0.80 0.09 -0.63 0.24 0.00 0.00 174.94 173.85 2dbb s ILE 59 N -3.46 3.64 0.46 8.37 1.01 -1.26 -5.10 121.20 124.86 2dbb s ILE 59 Ca 0.15 -1.21 0.08 0.00 0.00 0.00 0.00 60.65 59.67 2dbb s ILE 59 Cb 0.04 -3.09 0.03 0.00 0.01 0.00 0.00 42.46 39.45 2dbb s ILE 59 CO -0.02 -0.19 0.61 -2.16 0.00 0.00 0.00 174.94 173.18 2dbb s PRO 60 N 1.37 2.68 -0.62 2.79 0.04 -1.26 -5.03 135.00 134.97 2dbb s PRO 60 Ca -0.02 -1.36 -0.17 0.00 0.04 0.00 0.00 61.00 59.48 2dbb s PRO 60 Cb -0.20 -2.70 0.13 0.00 0.04 0.00 0.00 34.50 31.77 2dbb s PRO 60 CO 0.02 -0.41 0.66 0.34 0.04 0.00 0.00 177.00 177.65 2dbb s ASP 61 N -4.41 6.27 0.54 6.66 -1.08 -1.26 -4.92 116.67 118.48 2dbb s ASP 61 Ca 0.56 -1.73 0.20 0.00 -0.52 0.00 0.00 52.55 51.06 2dbb s ASP 61 Cb -0.08 -2.26 1.44 0.00 -1.46 0.00 0.00 42.92 40.55 2dbb s ASP 61 CO 0.34 -0.96 2.18 0.16 0.52 0.00 0.00 175.17 177.41 2dbb h ILE 62 N 5.78 0.85 -0.31 4.11 3.07 -1.96 -2.19 117.51 126.86 2dbb h ILE 62 Ca -0.23 -0.01 -0.03 0.00 1.55 0.00 0.00 64.86 66.15 2dbb h ILE 62 Cb 1.08 1.00 -0.01 0.00 -0.27 0.00 0.00 36.82 38.62 2dbb h ILE 62 CO 1.04 0.00 0.09 -0.78 -1.05 0.00 0.00 178.15 177.45 2dbb h ASP 63 N 0.00 0.46 0.50 2.16 3.58 -1.91 0.80 116.42 122.00 2dbb h ASP 63 Ca -0.00 -0.21 -0.00 0.00 0.42 0.00 0.00 57.03 57.23 2dbb h ASP 63 Cb 0.00 -0.12 -0.00 0.00 1.72 0.00 0.00 39.33 40.93 2dbb h ASP 63 CO 0.00 0.55 -0.02 0.11 -2.88 0.00 0.00 179.24 177.00 2dbb h LYS 64 N 0.34 0.00 -0.00 0.28 1.57 -1.72 -0.59 116.57 116.45 2dbb h LYS 64 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 2dbb h LYS 64 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 2dbb h LYS 64 CO -0.00 0.02 -0.23 1.28 -0.57 0.00 0.00 179.45 179.95 2dbb n LEU 65 N -3.19 0.69 0.00 2.94 4.77 -0.84 -4.93 117.00 116.44 2dbb n LEU 65 Ca -0.01 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 2dbb n LEU 65 Cb 0.20 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 2dbb n LEU 65 CO 0.25 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 2dbb n GLY 66 N 1.36 0.92 3.59 -0.72 0.00 -0.23 -5.04 105.19 105.06 2dbb n GLY 66 Ca 0.11 -0.51 -0.27 0.00 0.00 0.00 0.00 46.02 45.36 2dbb n GLY 66 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2dbb s TYR 67 N -2.00 2.29 -0.01 1.61 2.02 0.21 -1.24 117.35 120.24 2dbb s TYR 67 Ca 0.00 -0.79 -0.12 0.00 -0.37 0.00 0.00 57.07 55.79 2dbb s TYR 67 Cb 0.00 -1.62 0.01 0.00 -0.40 0.00 0.00 41.96 39.95 2dbb s TYR 67 CO 0.00 0.30 0.24 0.00 -1.57 0.00 0.00 175.55 174.52 2dbb s MET 68 N -3.77 0.59 0.31 -0.62 0.23 -0.05 -3.69 119.30 112.29 2dbb s MET 68 Ca 0.32 -0.27 -0.02 0.00 -1.03 0.00 0.00 55.69 54.70 2dbb s MET 68 Cb 0.09 0.26 -0.04 0.00 -1.53 0.00 0.00 34.83 33.60 2dbb s MET 68 CO 0.16 -0.15 0.54 0.71 -2.03 0.00 0.00 175.02 174.24 2dbb s TYR 69 N -1.33 3.49 -0.04 3.16 2.02 -1.26 -0.66 117.35 122.74 2dbb s TYR 69 Ca -0.14 0.46 -0.03 0.00 -0.37 0.00 0.00 57.07 56.99 2dbb s TYR 69 Cb -0.06 -1.97 0.02 0.00 -0.40 0.00 0.00 41.96 39.54 2dbb s TYR 69 CO 0.03 0.16 0.10 0.00 -1.57 0.00 0.00 175.55 174.27 2dbb s ALA 70 N -2.19 -0.23 -0.13 3.71 0.00 -0.81 -0.65 121.76 121.46 2dbb s ALA 70 Ca 0.41 0.34 -0.01 0.00 0.00 0.00 0.00 51.96 52.71 2dbb s ALA 70 Cb -0.10 -0.21 -0.02 0.00 0.00 0.00 0.00 23.12 22.79 2dbb s ALA 70 CO 0.33 -0.07 -0.11 0.42 0.00 0.00 0.00 175.76 176.33 2dbb s ILE 71 N 0.28 3.20 -0.22 0.00 -1.09 0.44 -0.84 121.20 122.97 2dbb s ILE 71 Ca -0.02 -0.61 -0.04 0.00 -2.23 0.00 0.00 60.65 57.75 2dbb s ILE 71 Cb -0.03 -2.36 -0.01 0.00 -1.58 0.00 0.00 42.46 38.49 2dbb s ILE 71 CO -0.01 0.52 -0.04 -0.69 -1.23 0.00 0.00 174.94 173.49 2dbb s VAL 72 N 0.33 3.42 -0.26 2.92 1.01 1.00 0.01 120.40 128.83 2dbb s VAL 72 Ca -0.10 -0.48 -0.10 0.00 0.00 0.00 0.00 61.98 61.31 2dbb s VAL 72 Cb -0.16 -2.56 -0.04 0.00 0.00 0.00 0.00 36.38 33.62 2dbb s VAL 72 CO 0.05 0.42 0.14 -0.76 0.00 0.00 0.00 175.10 174.95 2dbb s LEU 73 N 1.48 3.85 -0.05 3.92 1.43 0.55 -0.80 118.68 129.06 2dbb s LEU 73 Ca 0.06 -0.04 0.06 0.00 -1.03 0.00 0.00 54.13 53.18 2dbb s LEU 73 Cb -0.14 -2.05 -0.01 0.00 0.03 0.00 0.00 46.19 44.02 2dbb s LEU 73 CO -0.03 -0.01 -0.25 -0.63 0.23 0.00 0.00 176.35 175.66 2dbb s ILE 74 N 1.50 2.02 -0.24 -0.59 1.01 0.82 -0.74 121.20 124.98 2dbb s ILE 74 Ca 0.07 -1.05 -0.01 0.00 0.00 0.00 0.00 60.65 59.66 2dbb s ILE 74 Cb -0.15 -1.71 0.03 0.00 0.01 0.00 0.00 42.46 40.64 2dbb s ILE 74 CO 0.07 0.56 -0.09 -0.75 0.00 0.00 0.00 174.94 174.73 2dbb s LYS 75 N -0.19 2.82 0.47 2.79 2.47 0.33 -1.25 119.74 127.18 2dbb s LYS 75 Ca -0.03 -0.98 -0.09 0.00 -1.56 0.00 0.00 55.97 53.32 2dbb s LYS 75 Cb -0.13 -2.90 -0.05 0.00 -1.46 0.00 0.00 37.83 33.28 2dbb s LYS 75 CO 0.03 -0.38 0.82 -1.12 0.16 0.00 0.00 175.35 174.87 2dbb s SER 76 N 1.30 6.38 0.02 1.43 0.01 -1.26 -0.96 113.70 120.61 2dbb s SER 76 Ca 0.00 1.10 0.06 0.00 1.31 0.00 0.00 55.95 58.43 2dbb s SER 76 Cb -0.16 -2.32 -0.24 0.00 0.21 0.00 0.00 66.02 63.51 2dbb s SER 76 CO -0.06 -0.54 0.89 0.11 0.41 0.00 0.00 173.24 174.05 2dbb h LYS 77 N 0.61 0.07 -3.09 12.44 1.57 -1.91 -3.43 116.57 122.82 2dbb h LYS 77 Ca -0.47 -0.13 -0.09 0.00 -1.87 0.00 0.00 60.65 58.10 2dbb h LYS 77 Cb 1.19 0.05 -0.17 0.00 0.08 0.00 0.00 32.23 33.38 2dbb h LYS 77 CO 0.63 0.84 -0.17 0.14 -0.57 0.00 0.00 179.45 180.31 2dbb s VAL 78 N -2.64 0.06 0.15 0.50 -7.23 -1.26 -5.07 120.40 104.91 2dbb s VAL 78 Ca -0.05 -0.52 -0.18 0.00 -1.81 0.00 0.00 61.98 59.42 2dbb s VAL 78 Cb 0.08 -0.90 0.04 0.00 0.56 0.00 0.00 36.38 36.16 2dbb s VAL 78 CO 0.83 -0.29 1.69 -0.65 -0.31 0.00 0.00 175.10 176.37 2dbb h PRO 79 N 3.21 0.02 -0.97 4.82 0.11 -2.00 -1.67 132.00 135.52 2dbb h PRO 79 Ca -0.31 -0.00 0.22 0.00 0.11 0.00 0.00 66.00 66.02 2dbb h PRO 79 Cb 1.20 -0.01 -0.08 0.00 0.11 0.00 0.00 31.00 32.22 2dbb h PRO 79 CO 0.44 0.02 0.63 1.03 -0.21 0.00 0.00 178.00 179.90 2dbb h SER 80 N 0.03 0.51 -0.09 -2.05 0.87 -2.00 0.19 113.55 111.01 2dbb h SER 80 Ca 0.15 0.07 -0.20 0.00 -1.23 0.00 0.00 61.79 60.58 2dbb h SER 80 Cb 0.23 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.17 2dbb h SER 80 CO -0.31 0.17 -0.68 0.44 -0.53 0.00 0.00 176.83 175.92 2dbb h ASP 81 N 0.49 0.83 0.45 6.23 3.32 -1.71 -2.77 116.42 123.25 2dbb h ASP 81 Ca 0.53 -0.50 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 2dbb h ASP 81 Cb 1.21 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.51 2dbb h ASP 81 CO -0.26 1.28 -0.29 0.00 -1.72 0.00 0.00 179.24 178.25 2dbb h ALA 82 N 0.72 -0.71 -0.83 3.45 0.00 -0.12 0.40 119.26 122.17 2dbb h ALA 82 Ca -0.02 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 54.81 2dbb h ALA 82 Cb 1.28 0.36 -0.05 0.00 0.00 0.00 0.00 17.79 19.38 2dbb h ALA 82 CO 0.14 -0.92 0.55 -0.44 0.00 0.00 0.00 179.25 178.58 2dbb h ASP 83 N -0.71 0.84 -0.37 0.00 3.32 -1.35 0.01 116.42 118.15 2dbb h ASP 83 Ca -0.05 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.88 2dbb h ASP 83 Cb 0.59 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 2dbb h ASP 83 CO 0.04 0.55 -0.23 0.50 -1.72 0.00 0.00 179.24 178.38 2dbb h LYS 84 N 0.96 0.81 -0.34 3.56 3.64 -1.23 -1.16 116.57 122.81 2dbb h LYS 84 Ca 0.35 -0.38 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2dbb h LYS 84 Cb 0.16 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 2dbb h LYS 84 CO -0.12 1.01 0.22 0.28 -2.27 0.00 0.00 179.45 178.57 2dbb h VAL 85 N 0.61 1.10 -0.84 2.00 2.07 -0.11 -0.03 116.25 121.05 2dbb h VAL 85 Ca 0.08 -0.21 0.02 0.00 0.82 0.00 0.00 66.70 67.40 2dbb h VAL 85 Cb 0.80 0.63 -0.04 0.00 -1.52 0.00 0.00 31.29 31.15 2dbb h VAL 85 CO 0.07 0.10 0.55 0.40 0.02 0.00 0.00 177.57 178.70 2dbb h ILE 86 N 0.45 1.18 0.00 4.57 2.04 -0.85 -0.32 117.51 124.59 2dbb h ILE 86 Ca 0.12 -0.38 -0.11 0.00 1.00 0.00 0.00 64.86 65.49 2dbb h ILE 86 Cb -0.02 -0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 36.03 2dbb h ILE 86 CO -0.02 0.20 -0.54 0.77 0.00 0.00 0.00 178.15 178.56 2dbb h SER 87 N 1.10 0.00 -0.33 1.72 4.64 -0.95 -0.79 113.55 118.93 2dbb h SER 87 Ca 0.32 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.49 2dbb h SER 87 Cb -0.08 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.01 2dbb h SER 87 CO -0.09 0.54 -0.35 -0.33 -0.87 0.00 0.00 176.83 175.73 2dbb h GLU 88 N 0.00 0.88 0.00 4.77 4.39 0.03 -3.34 114.58 121.31 2dbb h GLU 88 Ca -0.01 -0.44 0.00 0.00 0.34 0.00 0.00 59.36 59.26 2dbb h GLU 88 Cb 1.07 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.73 2dbb h GLU 88 CO 0.07 1.08 -1.82 0.44 -1.16 0.00 0.00 179.01 177.63 2dbb n ILE 89 N -4.06 0.02 0.30 3.13 -5.35 -0.23 -4.48 119.36 108.69 2dbb n ILE 89 Ca -0.02 -0.42 0.18 0.00 -0.27 0.00 0.00 62.75 62.22 2dbb n ILE 89 Cb 0.52 0.14 1.01 0.00 -1.74 0.00 0.00 39.64 39.58 2dbb n ILE 89 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 2dbb h SER 90 N 0.00 0.00 0.39 7.28 0.02 -1.26 -1.59 113.55 118.39 2dbb h SER 90 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2dbb h SER 90 Cb 0.92 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.46 2dbb h SER 90 CO 0.00 0.00 -0.52 0.47 -1.14 0.00 0.00 176.83 175.64 2dbb n ASP 91 N -3.50 0.68 -4.71 3.07 8.00 -1.26 -4.88 116.55 113.93 2dbb n ASP 91 Ca -0.02 -0.47 -0.42 0.00 0.71 0.00 0.00 54.79 54.59 2dbb n ASP 91 Cb 0.13 0.33 -0.03 0.00 -0.02 0.00 0.00 41.12 41.53 2dbb n ASP 91 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2dbb s ILE 92 N -2.91 3.31 0.25 0.53 1.01 -0.60 -4.92 121.20 117.86 2dbb s ILE 92 Ca 0.13 0.91 -0.06 0.00 0.00 0.00 0.00 60.65 61.63 2dbb s ILE 92 Cb 0.18 -3.58 0.22 0.00 0.01 0.00 0.00 42.46 39.28 2dbb s ILE 92 CO 0.69 0.06 1.88 -0.08 0.00 0.00 0.00 174.94 177.49 2dbb h GLU 93 N 6.99 1.23 -0.01 2.79 4.22 -1.90 -2.62 114.58 125.29 2dbb h GLU 93 Ca -0.42 -0.13 0.00 0.00 0.08 0.00 0.00 59.36 58.89 2dbb h GLU 93 Cb 1.21 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 30.21 2dbb h GLU 93 CO 0.87 0.89 0.00 2.48 -2.18 0.00 0.00 179.01 181.07 2dbb n TYR 94 N -4.34 0.01 -3.09 0.92 0.18 -1.26 -4.58 117.16 105.00 2dbb n TYR 94 Ca 0.10 -0.01 -0.43 0.00 1.88 0.00 0.00 57.90 59.44 2dbb n TYR 94 Cb 0.08 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 38.98 2dbb n TYR 94 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 2dbb s VAL 95 N -1.99 4.80 0.03 -3.48 1.01 -0.99 -0.77 120.40 119.01 2dbb s VAL 95 Ca 0.41 0.00 0.06 0.00 0.00 0.00 0.00 61.98 62.45 2dbb s VAL 95 Cb 0.20 -4.26 -0.24 0.00 0.00 0.00 0.00 36.38 32.08 2dbb s VAL 95 CO 0.33 -0.69 0.95 0.11 0.00 0.00 0.00 175.10 175.79 2dbb h LYS 96 N 8.94 0.07 -3.00 2.72 1.79 -1.11 -3.46 116.57 122.52 2dbb h LYS 96 Ca -0.26 -0.12 -0.11 0.00 -2.18 0.00 0.00 60.65 57.97 2dbb h LYS 96 Cb 1.09 0.05 -0.20 0.00 -1.58 0.00 0.00 32.23 31.59 2dbb h LYS 96 CO 0.93 0.86 -0.25 -1.54 -1.08 0.00 0.00 179.45 178.37 2dbb s SER 97 N -6.58 -0.21 -0.05 0.86 1.04 -1.18 -4.97 113.70 102.61 2dbb s SER 97 Ca -0.04 0.10 -0.02 0.00 0.48 0.00 0.00 55.95 56.47 2dbb s SER 97 Cb 0.08 0.32 0.04 0.00 0.10 0.00 0.00 66.02 66.56 2dbb s SER 97 CO 0.83 -0.47 0.11 -0.69 0.98 0.00 0.00 173.24 174.00 2dbb s VAL 98 N -1.40 -0.10 0.03 5.02 1.01 -1.26 -1.68 120.40 122.02 2dbb s VAL 98 Ca -0.13 0.26 0.01 0.00 0.00 0.00 0.00 61.98 62.11 2dbb s VAL 98 Cb -0.05 -0.20 -0.02 0.00 0.00 0.00 0.00 36.38 36.12 2dbb s VAL 98 CO 0.04 0.11 -0.05 -1.61 0.00 0.00 0.00 175.10 173.59 2dbb s GLU 99 N 1.49 0.37 -0.11 2.72 2.02 -0.39 -5.00 118.70 119.81 2dbb s GLU 99 Ca -0.05 -0.62 -0.04 0.00 0.02 0.00 0.00 54.97 54.29 2dbb s GLU 99 Cb -0.12 -0.05 -0.04 0.00 0.10 0.00 0.00 34.13 34.02 2dbb s GLU 99 CO -0.05 -0.01 0.04 0.15 0.02 0.00 0.00 175.26 175.41 2dbb s LYS 100 N -1.39 3.22 0.24 1.61 1.02 -1.26 -1.14 119.74 122.04 2dbb s LYS 100 Ca -0.13 -0.34 0.01 0.00 0.02 0.00 0.00 55.97 55.53 2dbb s LYS 100 Cb -0.09 -2.93 -0.04 0.00 -0.52 0.00 0.00 37.83 34.24 2dbb s LYS 100 CO -0.00 0.66 0.13 0.20 -0.92 0.00 0.00 175.35 175.41 2dbb s GLY 101 N -0.73 1.67 -0.26 -3.33 0.00 0.52 -4.97 107.32 100.22 2dbb s GLY 101 Ca 0.12 -1.78 -0.02 0.00 0.00 0.00 0.00 44.72 43.03 2dbb s GLY 101 CO 0.02 -1.49 -0.04 0.14 0.00 0.00 0.00 173.10 171.73 2dbb s VAL 102 N -3.92 3.03 -5.00 1.40 1.01 -1.26 -4.36 120.40 111.30 2dbb s VAL 102 Ca 0.38 -0.98 0.00 0.00 0.00 0.00 0.00 61.98 61.38 2dbb s VAL 102 Cb 0.07 -2.55 0.00 0.00 0.00 0.00 0.00 36.38 33.90 2dbb s VAL 102 CO 0.14 0.18 0.00 0.61 0.00 0.00 0.00 175.10 176.03 2dbb n GLY 103 N 4.70 -0.10 0.30 4.51 0.00 -1.26 -4.94 105.19 108.41 2dbb n GLY 103 Ca -0.16 -1.22 0.13 0.00 0.00 0.00 0.00 46.02 44.76 2dbb n GLY 103 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2dbb h ARG 104 N 0.00 0.00 -4.72 1.61 2.43 -1.99 -3.40 114.38 108.31 2dbb h ARG 104 Ca 0.00 0.00 -0.51 0.00 -0.81 0.00 0.00 59.98 58.66 2dbb h ARG 104 Cb 0.00 0.00 -0.32 0.00 -0.42 0.00 0.00 29.97 29.23 2dbb h ARG 104 CO 0.00 0.00 -0.81 0.71 -1.51 0.00 0.00 179.97 178.36 2dbb s TYR 105 N -4.98 1.42 -0.84 2.20 2.02 -1.26 -4.75 117.35 111.16 2dbb s TYR 105 Ca -0.05 -0.47 0.23 0.00 -0.37 0.00 0.00 57.07 56.42 2dbb s TYR 105 Cb 0.17 -1.02 0.18 0.00 -0.40 0.00 0.00 41.96 40.90 2dbb s TYR 105 CO 0.67 -0.22 1.17 0.27 -1.57 0.00 0.00 175.55 175.86 2dbb n ASN 106 N 3.57 0.65 -3.94 2.29 6.94 -0.38 -4.46 115.26 119.93 2dbb n ASN 106 Ca -0.21 -0.37 -0.23 0.00 -0.02 0.00 0.00 54.58 53.75 2dbb n ASN 106 Cb 0.52 0.59 -0.17 0.00 -2.36 0.00 0.00 39.78 38.37 2dbb n ASN 106 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2dbb s ILE 107 N -3.08 0.84 -0.14 1.53 1.01 -0.68 -0.36 121.20 120.32 2dbb s ILE 107 Ca 0.08 -0.27 0.02 0.00 0.00 0.00 0.00 60.65 60.47 2dbb s ILE 107 Cb 0.16 -0.82 0.01 0.00 0.01 0.00 0.00 42.46 41.82 2dbb s ILE 107 CO 0.77 0.30 -0.19 -0.63 0.00 0.00 0.00 174.94 175.19 2dbb s ILE 108 N 1.01 1.89 -0.02 2.92 -1.09 -0.29 -0.13 121.20 125.48 2dbb s ILE 108 Ca -0.09 -0.86 0.05 0.00 -2.23 0.00 0.00 60.65 57.52 2dbb s ILE 108 Cb -0.14 -1.70 -0.01 0.00 -1.58 0.00 0.00 42.46 39.03 2dbb s ILE 108 CO -0.00 0.52 -0.19 -0.69 -1.23 0.00 0.00 174.94 173.35 2dbb s VAL 109 N 1.03 1.48 -0.12 2.92 1.01 0.02 -1.26 120.40 125.48 2dbb s VAL 109 Ca -0.03 -0.79 -0.00 0.00 0.00 0.00 0.00 61.98 61.16 2dbb s VAL 109 Cb -0.15 -1.24 -0.02 0.00 0.00 0.00 0.00 36.38 34.97 2dbb s VAL 109 CO -0.05 0.42 -0.11 -0.60 0.00 0.00 0.00 175.10 174.76 2dbb s ARG 110 N -0.33 3.30 0.03 2.72 3.52 -0.68 -0.00 118.95 127.51 2dbb s ARG 110 Ca 0.05 -0.64 0.08 0.00 -0.13 0.00 0.00 55.73 55.09 2dbb s ARG 110 Cb -0.08 -2.66 -0.03 0.00 -1.56 0.00 0.00 34.95 30.61 2dbb s ARG 110 CO 0.00 0.31 -0.22 -0.51 -0.81 0.00 0.00 175.30 174.07 2dbb s LEU 111 N 0.12 2.38 -0.30 -0.88 1.43 -0.02 -0.62 118.68 120.80 2dbb s LEU 111 Ca -0.05 -0.49 -0.09 0.00 -1.03 0.00 0.00 54.13 52.48 2dbb s LEU 111 Cb -0.14 -1.41 -0.01 0.00 0.03 0.00 0.00 46.19 44.66 2dbb s LEU 111 CO 0.04 0.27 0.13 -0.22 0.23 0.00 0.00 176.35 176.80 2dbb s LEU 112 N -1.24 3.96 0.33 1.79 2.96 0.05 -1.93 118.68 124.59 2dbb s LEU 112 Ca 0.13 -0.44 0.10 0.00 -0.22 0.00 0.00 54.13 53.69 2dbb s LEU 112 Cb -0.10 -1.99 -0.06 0.00 0.50 0.00 0.00 46.19 44.54 2dbb s LEU 112 CO 0.03 -0.16 -0.09 -0.76 -1.32 0.00 0.00 176.35 174.05 2dbb s LEU 113 N 1.62 2.77 0.40 -0.68 1.43 0.16 -4.83 118.68 119.55 2dbb s LEU 113 Ca 0.05 -1.10 -0.25 0.00 -1.03 0.00 0.00 54.13 51.80 2dbb s LEU 113 Cb -0.17 -1.12 -0.09 0.00 0.03 0.00 0.00 46.19 44.85 2dbb s LEU 113 CO 0.06 -0.15 1.18 -2.84 0.23 0.00 0.00 176.35 174.82 2dbb s PRO 114 N -3.61 4.07 0.55 1.29 0.02 -1.26 -0.87 135.00 135.18 2dbb s PRO 114 Ca 0.32 1.86 0.29 0.00 0.02 0.00 0.00 61.00 63.50 2dbb s PRO 114 Cb 0.00 -2.70 1.61 0.00 0.02 0.00 0.00 34.50 33.43 2dbb s PRO 114 CO 0.17 -0.31 2.14 -0.22 -0.33 0.00 0.00 177.00 178.44 2dbb h LYS 115 N 2.68 0.00 -6.29 5.54 3.64 -1.42 -3.37 116.57 117.35 2dbb h LYS 115 Ca -0.49 0.00 -0.54 0.00 -1.27 0.00 0.00 60.65 58.35 2dbb h LYS 115 Cb 1.23 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.05 2dbb h LYS 115 CO 0.63 0.08 1.11 0.34 -2.27 0.00 0.00 179.45 179.34 2dbb s ASP 116 N -6.08 6.62 0.27 4.20 3.68 -1.26 -4.91 116.67 119.19 2dbb s ASP 116 Ca -0.03 2.34 0.01 0.00 2.13 0.00 0.00 52.55 56.99 2dbb s ASP 116 Cb 0.13 -2.53 0.57 0.00 -1.45 0.00 0.00 42.92 39.64 2dbb s ASP 116 CO 0.56 -0.95 1.77 0.40 0.13 0.00 0.00 175.17 177.09 2dbb h ILE 117 N 5.55 0.75 -0.25 4.11 1.08 -1.98 0.42 117.51 127.19 2dbb h ILE 117 Ca -0.42 -0.24 -0.20 0.00 -0.39 0.00 0.00 64.86 63.62 2dbb h ILE 117 Cb 1.19 -0.01 0.00 0.00 -3.07 0.00 0.00 36.82 34.93 2dbb h ILE 117 CO 0.95 0.13 -0.61 0.11 -0.69 0.00 0.00 178.15 178.04 2dbb h LYS 118 N 0.70 0.84 -0.30 2.37 1.79 -1.95 -0.90 116.57 119.13 2dbb h LYS 118 Ca 0.49 -0.57 -0.15 0.00 -2.18 0.00 0.00 60.65 58.23 2dbb h LYS 118 Cb 0.68 0.08 -0.00 0.00 -1.58 0.00 0.00 32.23 31.41 2dbb h LYS 118 CO -0.35 1.20 -0.41 -0.44 -1.08 0.00 0.00 179.45 178.37 2dbb h ASP 119 N 0.63 0.87 -0.26 0.86 3.32 -1.78 -2.15 116.42 117.91 2dbb h ASP 119 Ca -0.00 -0.50 0.00 0.00 0.02 0.00 0.00 57.03 56.55 2dbb h ASP 119 Cb 1.22 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.51 2dbb h ASP 119 CO 0.13 1.20 0.17 0.00 -1.72 0.00 0.00 179.24 179.02 2dbb h ALA 120 N 0.70 0.33 -0.54 3.45 0.00 -0.14 -0.91 119.26 122.15 2dbb h ALA 120 Ca 0.03 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 2dbb h ALA 120 Cb 1.00 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 2dbb h ALA 120 CO 0.10 -0.20 0.05 1.05 0.00 0.00 0.00 179.25 180.24 2dbb h GLU 121 N 0.35 0.89 -0.45 0.00 4.11 -1.15 -0.08 114.58 118.24 2dbb h GLU 121 Ca 0.10 -0.23 -0.03 0.00 0.07 0.00 0.00 59.36 59.27 2dbb h GLU 121 Cb -0.03 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 2dbb h GLU 121 CO -0.03 0.85 0.16 -0.91 0.07 0.00 0.00 179.01 179.15 2dbb h ASN 122 N 0.83 0.64 -0.44 3.06 -0.26 -1.11 -1.60 115.58 116.71 2dbb h ASN 122 Ca 0.17 -0.19 -0.07 0.00 -0.56 0.00 0.00 56.30 55.65 2dbb h ASN 122 Cb 0.42 -0.17 -0.02 0.00 -1.06 0.00 0.00 38.32 37.49 2dbb h ASN 122 CO 0.01 0.66 0.03 0.25 -1.06 0.00 0.00 177.43 177.32 2dbb h LEU 123 N 0.59 0.79 -0.51 1.61 5.85 -0.79 -1.63 115.31 121.22 2dbb h LEU 123 Ca 0.15 -0.19 -0.07 0.00 0.84 0.00 0.00 57.88 58.62 2dbb h LEU 123 Cb 0.23 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 2dbb h LEU 123 CO -0.01 0.84 0.06 0.40 -0.34 0.00 0.00 178.44 179.39 2dbb h ILE 124 N 0.78 1.26 -0.74 4.05 2.04 -0.75 -1.15 117.51 123.00 2dbb h ILE 124 Ca 0.15 -0.99 -0.02 0.00 1.00 0.00 0.00 64.86 65.01 2dbb h ILE 124 Cb 0.43 0.89 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 2dbb h ILE 124 CO 0.02 0.35 0.40 0.28 0.00 0.00 0.00 178.15 179.19 2dbb h SER 125 N 0.74 0.92 -0.35 1.72 0.02 -1.01 0.50 113.55 116.10 2dbb h SER 125 Ca 0.15 -0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 2dbb h SER 125 Cb 0.44 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.73 2dbb h SER 125 CO 0.02 0.76 0.17 -0.33 -1.14 0.00 0.00 176.83 176.31 2dbb h GLU 126 N 1.02 0.49 -0.32 3.45 5.08 -1.01 -2.26 114.58 121.03 2dbb h GLU 126 Ca 0.26 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.55 2dbb h GLU 126 Cb 0.05 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 2dbb h GLU 126 CO -0.04 0.44 0.20 0.35 -1.00 0.00 0.00 179.01 178.95 2dbb h PHE 127 N 0.43 0.41 -0.07 4.33 3.57 -0.76 -2.80 116.94 122.04 2dbb h PHE 127 Ca 0.12 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 2dbb h PHE 127 Cb 0.10 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 38.70 2dbb h PHE 127 CO -0.02 0.29 0.01 -0.07 -2.23 0.00 0.00 178.31 176.29 2dbb h LEU 128 N 0.41 0.08 -2.17 0.59 3.38 -0.73 -1.04 115.31 115.84 2dbb h LEU 128 Ca 0.11 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 2dbb h LEU 128 Cb -0.01 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 2dbb h LEU 128 CO -0.02 0.10 -0.01 1.56 0.09 0.00 0.00 178.44 180.15 2dbb h GLN 129 N 0.10 0.00 0.00 1.13 4.20 -1.13 0.59 115.11 120.00 2dbb h GLN 129 Ca 0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 2dbb h GLN 129 Cb 0.05 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.83 2dbb h GLN 129 CO -0.00 0.01 0.00 0.54 -0.67 0.00 0.00 178.83 178.71 2dbb n ARG 130 N -4.24 0.35 -3.47 1.46 1.74 -0.39 -4.58 116.66 107.53 2dbb n ARG 130 Ca -0.03 0.03 -0.43 0.00 -0.77 0.00 0.00 57.85 56.65 2dbb n ARG 130 Cb 0.10 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 29.95 2dbb n ARG 130 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2dbb s ILE 131 N -2.62 4.78 0.22 0.55 1.01 0.20 -4.92 121.20 120.41 2dbb s ILE 131 Ca 0.25 -1.31 0.09 0.00 0.00 0.00 0.00 60.65 59.68 2dbb s ILE 131 Cb 0.18 -3.93 -0.04 0.00 0.01 0.00 0.00 42.46 38.68 2dbb s ILE 131 CO 0.43 -0.61 -0.06 -0.54 0.00 0.00 0.00 174.94 174.16 2dbb s LYS 132 N 1.53 2.15 -1.14 2.79 3.01 -1.26 -4.72 119.74 122.10 2dbb s LYS 132 Ca 0.04 -1.35 -0.06 0.00 -1.01 0.00 0.00 55.97 53.59 2dbb s LYS 132 Cb -0.25 -2.15 0.01 0.00 -1.01 0.00 0.00 37.83 34.43 2dbb s LYS 132 CO 0.04 0.40 0.79 0.09 0.51 0.00 0.00 175.35 177.18 2dbb n ASN 133 N -0.38 -5.42 -4.61 2.83 5.03 -1.26 -4.96 115.26 106.49 2dbb n ASN 133 Ca -0.09 -0.36 -0.34 0.00 0.87 0.00 0.00 54.58 54.66 2dbb n ASN 133 Cb 0.57 -4.11 -0.11 0.00 -1.02 0.00 0.00 39.78 35.12 2dbb n ASN 133 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2dbb s ALA 134 N -3.19 3.13 0.06 5.41 0.00 -1.26 -3.40 121.76 122.51 2dbb s ALA 134 Ca 0.39 -0.83 -0.13 0.00 0.00 0.00 0.00 51.96 51.39 2dbb s ALA 134 Cb -0.17 -1.44 -0.29 0.00 0.00 0.00 0.00 23.12 21.22 2dbb s ALA 134 CO 0.49 0.48 1.10 1.49 0.00 0.00 0.00 175.76 179.32 2dbb h GLU 135 N 5.61 0.56 -3.23 0.00 4.57 -1.32 -3.46 114.58 117.31 2dbb h GLU 135 Ca -0.45 -0.79 -0.20 0.00 -1.18 0.00 0.00 59.36 56.75 2dbb h GLU 135 Cb 1.19 0.27 -0.28 0.00 -0.16 0.00 0.00 28.75 29.76 2dbb h GLU 135 CO 0.56 1.36 -0.52 -0.80 -1.18 0.00 0.00 179.01 178.44 2dbb s ASN 136 N -7.41 -0.19 -0.07 1.04 0.01 -1.11 -5.01 114.94 102.20 2dbb s ASN 136 Ca -0.08 0.39 -0.01 0.00 -0.71 0.00 0.00 52.86 52.45 2dbb s ASN 136 Cb 0.06 0.35 0.03 0.00 0.41 0.00 0.00 41.25 42.09 2dbb s ASN 136 CO 0.93 -0.10 -0.03 -0.69 -1.51 0.00 0.00 177.10 175.70 2dbb s VAL 137 N 0.52 0.56 -0.13 1.60 1.01 -1.26 -0.52 120.40 122.19 2dbb s VAL 137 Ca -0.04 -0.03 0.03 0.00 0.00 0.00 0.00 61.98 61.94 2dbb s VAL 137 Cb -0.05 -0.66 0.01 0.00 0.00 0.00 0.00 36.38 35.68 2dbb s VAL 137 CO -0.03 0.28 -0.22 -1.61 0.00 0.00 0.00 175.10 173.53 2dbb s GLU 138 N 1.66 3.06 -0.22 2.72 0.41 0.08 -4.97 118.70 121.44 2dbb s GLU 138 Ca 0.01 -0.85 -0.06 0.00 -0.41 0.00 0.00 54.97 53.66 2dbb s GLU 138 Cb -0.13 -2.42 -0.03 0.00 -1.78 0.00 0.00 34.13 29.77 2dbb s GLU 138 CO -0.05 0.05 0.04 0.08 -0.49 0.00 0.00 175.26 174.89 2dbb s VAL 139 N 0.67 4.25 -0.25 2.63 1.01 -1.26 -0.33 120.40 127.11 2dbb s VAL 139 Ca -0.10 -0.21 -0.04 0.00 0.00 0.00 0.00 61.98 61.63 2dbb s VAL 139 Cb -0.16 -2.95 0.01 0.00 0.00 0.00 0.00 36.38 33.28 2dbb s VAL 139 CO 0.01 0.40 -0.00 -0.63 0.00 0.00 0.00 175.10 174.88 2dbb s ILE 140 N 1.14 3.46 -0.02 2.22 -1.09 0.10 -4.96 121.20 122.05 2dbb s ILE 140 Ca 0.04 -0.70 -0.27 0.00 -2.23 0.00 0.00 60.65 57.48 2dbb s ILE 140 Cb -0.14 -2.70 -0.03 0.00 -1.58 0.00 0.00 42.46 38.00 2dbb s ILE 140 CO 0.02 0.24 0.87 -0.76 -1.23 0.00 0.00 174.94 174.08 2dbb s LEU 141 N 1.45 4.36 -0.47 2.97 1.43 -1.26 -0.42 118.68 126.73 2dbb s LEU 141 Ca 0.03 1.48 -0.21 0.00 -1.03 0.00 0.00 54.13 54.40 2dbb s LEU 141 Cb -0.16 -3.37 0.03 0.00 0.03 0.00 0.00 46.19 42.72 2dbb s LEU 141 CO -0.01 -0.19 0.71 -0.63 0.23 0.00 0.00 176.35 176.46 2dbb s ILE 142 N 0.86 4.74 -0.15 -0.59 -1.09 0.18 -4.89 121.20 120.25 2dbb s ILE 142 Ca 0.46 0.09 0.16 0.00 -2.23 0.00 0.00 60.65 59.13 2dbb s ILE 142 Cb -0.20 -4.30 0.01 0.00 -1.58 0.00 0.00 42.46 36.40 2dbb s ILE 142 CO 0.24 -0.73 1.28 0.77 -1.23 0.00 0.00 174.94 175.27 2dbb h SER 143 N 8.98 0.00 -3.54 3.58 4.64 -1.95 -3.38 113.55 121.88 2dbb h SER 143 Ca -0.26 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 60.93 2dbb h SER 143 Cb 1.09 0.00 -0.26 0.00 -0.31 0.00 0.00 62.40 62.92 2dbb h SER 143 CO 0.95 0.50 -0.31 -1.61 -0.87 0.00 0.00 176.83 175.49 2dbb s GLU 144 N -2.97 0.39 -0.36 4.77 2.02 -1.26 -5.11 118.70 116.18 2dbb s GLU 144 Ca 0.02 0.63 -0.10 0.00 0.02 0.00 0.00 54.97 55.55 2dbb s GLU 144 Cb 0.08 0.07 0.03 0.00 0.10 0.00 0.00 34.13 34.41 2dbb s GLU 144 CO 0.76 -0.11 0.18 0.08 0.02 0.00 0.00 175.26 176.19 2dbb s VAL 145 N 0.82 4.37 -0.12 2.63 1.01 -1.26 -4.95 120.40 122.90 2dbb s VAL 145 Ca -0.05 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.03 2dbb s VAL 145 Cb -0.06 -3.44 -0.24 0.00 0.00 0.00 0.00 36.38 32.64 2dbb s VAL 145 CO -0.06 -0.20 0.37 0.54 0.00 0.00 0.00 175.10 175.75 2dbb n ARG 146 N 4.95 0.71 -3.85 2.72 5.12 -1.26 -4.94 116.66 120.11 2dbb n ARG 146 Ca -0.12 0.25 -0.12 0.00 -1.93 0.00 0.00 57.85 55.93 2dbb n ARG 146 Cb 0.46 -1.70 -0.13 0.00 -1.16 0.00 0.00 32.46 29.93 2dbb n ARG 146 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 2dbb s LYS 147 N -2.56 0.15 -0.28 5.56 2.20 -1.26 -5.14 119.74 118.41 2dbb s LYS 147 Ca -0.19 0.07 0.00 0.00 -0.36 0.00 0.00 55.97 55.49 2dbb s LYS 147 Cb 0.07 0.07 0.17 0.00 -1.51 0.00 0.00 37.83 36.63 2dbb s LYS 147 CO 0.77 -0.02 0.50 0.12 -0.36 0.00 0.00 175.35 176.36 2dbb s PHE 148 N -0.11 -1.32 0.13 4.03 5.36 -1.26 -5.15 117.98 119.66 2dbb s PHE 148 Ca -0.02 1.08 0.00 0.00 -0.96 0.00 0.00 56.93 57.04 2dbb s PHE 148 Cb -0.02 0.23 -0.04 0.00 -0.34 0.00 0.00 43.02 42.85 2dbb s PHE 148 CO 0.00 -0.89 0.02 -1.21 -1.46 0.00 0.00 175.22 171.68 2dbb s GLU 149 N 2.70 0.94 -0.23 10.12 2.02 -1.26 -5.08 118.70 127.92 2dbb s GLU 149 Ca 0.14 -1.44 -0.12 0.00 0.02 0.00 0.00 54.97 53.58 2dbb s GLU 149 Cb -0.14 0.05 -0.18 0.00 0.10 0.00 0.00 34.13 33.97 2dbb s GLU 149 CO -0.22 -0.19 -0.03 -0.89 0.02 0.00 0.00 175.26 173.95 2dbb n ILE 150 N -0.11 1.57 -1.07 -1.63 2.08 -1.26 -5.26 119.36 113.68 2dbb n ILE 150 Ca -0.07 -0.36 0.00 0.00 0.56 0.00 0.00 62.75 62.87 2dbb n ILE 150 Cb 0.63 -1.82 0.00 0.00 -0.75 0.00 0.00 39.64 37.70 2dbb n ILE 150 CO 0.00 0.00 0.00 -0.38 0.56 0.00 0.00 176.55 176.73