#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k3w s SER 4 N 0.00 4.44 0.22 8.00 0.15 -1.26 -4.81 113.70 120.44 2k3w s SER 4 Ca 0.00 2.25 -0.09 0.00 0.70 0.00 0.00 55.95 58.81 2k3w s SER 4 Cb 0.00 -2.58 0.18 0.00 -1.71 0.00 0.00 66.02 61.91 2k3w s SER 4 CO 0.00 -2.09 1.89 0.74 1.20 0.00 0.00 173.24 174.98 2k3w h THR 5 N -0.21 1.21 -0.38 6.45 2.02 -1.97 -0.46 112.91 119.57 2k3w h THR 5 Ca -0.47 -0.39 -0.05 0.00 0.77 0.00 0.00 66.41 66.28 2k3w h THR 5 Cb 1.28 0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.68 2k3w h THR 5 CO 0.51 0.20 0.06 0.25 0.37 0.00 0.00 175.52 176.91 2k3w h LEU 6 N 1.11 0.60 -0.98 2.58 7.12 -1.91 -1.08 115.31 122.76 2k3w h LEU 6 Ca 0.30 -0.26 -0.02 0.00 0.13 0.00 0.00 57.88 58.03 2k3w h LEU 6 Cb -0.13 -0.16 -0.04 0.00 -0.53 0.00 0.00 40.66 39.80 2k3w h LEU 6 CO -0.06 0.71 0.44 -0.61 -0.13 0.00 0.00 178.44 178.79 2k3w h GLN 7 N 0.47 1.16 -0.34 1.25 5.75 -1.82 -1.48 115.11 120.09 2k3w h GLN 7 Ca 0.11 -0.14 -0.07 0.00 -0.15 0.00 0.00 58.65 58.41 2k3w h GLN 7 Cb 0.37 -0.22 -0.01 0.00 1.07 0.00 0.00 27.48 28.68 2k3w h GLN 7 CO 0.01 0.86 -0.05 -0.22 -2.65 0.00 0.00 178.83 176.78 2k3w h LYS 8 N 1.16 0.64 -0.57 1.69 3.11 -0.89 -1.46 116.57 120.25 2k3w h LYS 8 Ca 0.29 -0.23 0.04 0.00 -2.81 0.00 0.00 60.65 57.94 2k3w h LYS 8 Cb 0.05 -0.05 -0.04 0.00 -1.00 0.00 0.00 32.23 31.19 2k3w h LYS 8 CO -0.04 0.78 0.32 0.00 -2.81 0.00 0.00 179.45 177.70 2k3w h ALA 9 N 0.83 0.74 -0.69 5.00 0.00 -0.77 -1.05 119.26 123.32 2k3w h ALA 9 Ca 0.09 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 2k3w h ALA 9 Cb 0.53 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 2k3w h ALA 9 CO 0.03 0.02 0.28 0.82 0.00 0.00 0.00 179.25 180.39 2k3w h ILE 10 N 0.63 1.24 -0.51 0.00 2.04 -1.16 -1.38 117.51 118.37 2k3w h ILE 10 Ca 0.24 -0.77 0.01 0.00 1.00 0.00 0.00 64.86 65.35 2k3w h ILE 10 Cb 0.09 0.45 -0.03 0.00 -0.74 0.00 0.00 36.82 36.60 2k3w h ILE 10 CO -0.13 0.31 0.33 -0.78 0.00 0.00 0.00 178.15 177.87 2k3w h ASP 11 N 0.99 0.57 -0.47 1.72 1.82 -0.38 0.12 116.42 120.78 2k3w h ASP 11 Ca 0.23 -0.01 -0.06 0.00 -0.39 0.00 0.00 57.03 56.80 2k3w h ASP 11 Cb 0.21 -0.14 -0.02 0.00 0.68 0.00 0.00 39.33 40.06 2k3w h ASP 11 CO -0.02 0.41 0.05 -0.07 -1.61 0.00 0.00 179.24 178.00 2k3w h LEU 12 N 0.67 0.78 -0.60 2.28 3.38 -0.94 -2.30 115.31 118.57 2k3w h LEU 12 Ca 0.19 -0.28 -0.12 0.00 0.09 0.00 0.00 57.88 57.76 2k3w h LEU 12 Cb -0.06 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 2k3w h LEU 12 CO -0.05 0.86 -0.17 1.62 0.09 0.00 0.00 178.44 180.79 2k3w h VAL 13 N 0.67 1.27 -0.25 1.22 3.04 -1.05 -0.63 116.25 120.52 2k3w h VAL 13 Ca 0.14 -1.31 0.03 0.00 -1.01 0.00 0.00 66.70 64.54 2k3w h VAL 13 Cb 0.43 1.09 -0.03 0.00 -2.01 0.00 0.00 31.29 30.77 2k3w h VAL 13 CO 0.01 0.45 0.08 0.74 -1.01 0.00 0.00 177.57 177.84 2k3w h THR 14 N 0.81 0.92 -0.63 3.17 2.02 -0.59 -0.43 112.91 118.18 2k3w h THR 14 Ca 0.12 -0.06 -0.04 0.00 0.77 0.00 0.00 66.41 67.19 2k3w h THR 14 Cb 0.72 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 67.83 2k3w h THR 14 CO 0.06 0.03 0.25 0.50 0.37 0.00 0.00 175.52 176.73 2k3w h LYS 15 N 0.19 0.95 -0.79 6.66 3.64 -1.29 -2.42 116.57 123.51 2k3w h LYS 15 Ca 0.11 -0.18 0.13 0.00 -1.27 0.00 0.00 60.65 59.45 2k3w h LYS 15 Cb 0.09 -0.15 -0.09 0.00 -0.41 0.00 0.00 32.23 31.66 2k3w h LYS 15 CO -0.12 0.80 0.37 0.00 -2.27 0.00 0.00 179.45 178.24 2k3w h ALA 16 N 1.10 1.14 -0.63 5.00 0.00 -0.10 0.17 119.26 125.94 2k3w h ALA 16 Ca 0.21 0.09 -0.09 0.00 0.00 0.00 0.00 54.91 55.12 2k3w h ALA 16 Cb 0.22 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 2k3w h ALA 16 CO -0.02 -0.12 0.06 1.79 0.00 0.00 0.00 179.25 180.96 2k3w h THR 17 N 0.56 1.26 -0.73 0.00 1.35 -0.69 -0.85 112.91 113.82 2k3w h THR 17 Ca 0.42 -1.09 -0.05 0.00 -0.55 0.00 0.00 66.41 65.14 2k3w h THR 17 Cb 0.58 0.73 -0.03 0.00 -1.73 0.00 0.00 68.15 67.69 2k3w h THR 17 CO -0.35 0.40 0.25 1.05 -0.25 0.00 0.00 175.52 176.61 2k3w h GLU 18 N 0.98 1.12 -0.56 4.72 4.11 -0.68 -2.17 114.58 122.11 2k3w h GLU 18 Ca 0.19 -0.23 -0.09 0.00 0.07 0.00 0.00 59.36 59.29 2k3w h GLU 18 Cb 0.50 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 2k3w h GLU 18 CO 0.02 0.94 -0.03 0.93 0.07 0.00 0.00 179.01 180.95 2k3w h GLU 19 N 1.07 0.98 -0.95 1.06 4.39 -0.76 -1.72 114.58 118.64 2k3w h GLU 19 Ca 0.24 -0.31 0.03 0.00 0.34 0.00 0.00 59.36 59.66 2k3w h GLU 19 Cb 0.28 -0.09 -0.05 0.00 -0.10 0.00 0.00 28.75 28.78 2k3w h GLU 19 CO -0.01 0.98 0.62 0.22 -1.16 0.00 0.00 179.01 179.66 2k3w h ASP 20 N 0.89 1.05 -0.64 1.42 1.82 -0.76 0.50 116.42 120.70 2k3w h ASP 20 Ca 0.16 -0.01 -0.09 0.00 -0.39 0.00 0.00 57.03 56.70 2k3w h ASP 20 Cb 0.56 -0.25 -0.02 0.00 0.68 0.00 0.00 39.33 40.30 2k3w h ASP 20 CO 0.03 0.73 0.06 0.11 -1.61 0.00 0.00 179.24 178.56 2k3w h LYS 21 N 1.23 1.09 -0.06 0.28 1.57 -0.96 -1.52 116.57 118.20 2k3w h LYS 21 Ca 0.37 -0.32 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2k3w h LYS 21 Cb -0.04 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.16 2k3w h LYS 21 CO -0.11 1.03 0.00 0.00 -0.57 0.00 0.00 179.45 179.80 2k3w n ALA 22 N -2.47 2.14 -1.69 3.86 0.00 -0.54 -4.77 120.51 117.03 2k3w n ALA 22 Ca 0.04 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.33 2k3w n ALA 22 Cb 0.32 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.72 2k3w n ALA 22 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2k3w n LYS 23 N -0.43 -1.04 -2.57 0.00 4.76 -0.57 -4.92 118.16 113.40 2k3w n LYS 23 Ca 0.00 0.90 -0.42 0.00 -2.87 0.00 0.00 58.31 55.92 2k3w n LYS 23 Cb 0.02 -5.07 0.01 0.00 -1.84 0.00 0.00 35.03 28.15 2k3w n LYS 23 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2k3w n ASN 24 N -0.43 6.18 -0.33 4.39 4.13 0.16 -4.78 115.26 124.58 2k3w n ASN 24 Ca -0.15 -3.29 0.00 0.00 1.68 0.00 0.00 54.58 52.82 2k3w n ASN 24 Cb 0.52 -1.36 0.14 0.00 -1.54 0.00 0.00 39.78 37.54 2k3w n ASN 24 CO 0.00 0.00 0.00 1.88 0.28 0.00 0.00 177.26 179.42 2k3w h TYR 25 N 5.33 1.07 0.32 3.10 0.05 -1.86 0.55 116.97 125.52 2k3w h TYR 25 Ca 0.37 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 59.17 2k3w h TYR 25 Cb 0.55 -0.35 0.00 0.00 1.01 0.00 0.00 36.73 37.94 2k3w h TYR 25 CO 1.22 0.58 -0.15 0.93 -1.05 0.00 0.00 178.16 179.68 2k3w h GLU 26 N 1.08 -0.41 -0.28 4.88 5.08 -1.95 0.40 114.58 123.38 2k3w h GLU 26 Ca 0.38 0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.73 2k3w h GLU 26 Cb 0.09 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 2k3w h GLU 26 CO -0.15 -0.26 0.03 1.49 -1.00 0.00 0.00 179.01 179.12 2k3w h GLU 27 N -0.44 0.47 -0.54 2.33 4.57 -1.87 -2.19 114.58 116.91 2k3w h GLU 27 Ca -0.04 -0.13 0.05 0.00 -1.18 0.00 0.00 59.36 58.05 2k3w h GLU 27 Cb 0.34 -0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 28.83 2k3w h GLU 27 CO 0.07 0.60 0.27 0.00 -1.18 0.00 0.00 179.01 178.77 2k3w h ALA 28 N 0.85 0.69 -0.40 2.92 0.00 0.20 -1.48 119.26 122.04 2k3w h ALA 28 Ca 0.08 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.04 2k3w h ALA 28 Cb 0.37 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2k3w h ALA 28 CO 0.01 -0.08 0.23 1.25 0.00 0.00 0.00 179.25 180.66 2k3w h LEU 29 N 0.52 0.37 -0.74 0.00 5.85 -0.04 0.17 115.31 121.44 2k3w h LEU 29 Ca 0.24 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.99 2k3w h LEU 29 Cb 0.16 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.07 2k3w h LEU 29 CO -0.17 0.27 0.47 0.03 -0.34 0.00 0.00 178.44 178.70 2k3w h ARG 30 N 0.47 0.91 -0.51 1.25 3.08 -0.82 -1.43 114.38 117.33 2k3w h ARG 30 Ca 0.16 -0.05 -0.11 0.00 0.07 0.00 0.00 59.98 60.04 2k3w h ARG 30 Cb 0.02 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 29.84 2k3w h ARG 30 CO -0.08 0.60 -0.13 -0.07 -1.07 0.00 0.00 179.97 179.23 2k3w h LEU 31 N 0.94 0.96 -0.05 3.04 3.38 -0.74 -1.97 115.31 120.87 2k3w h LEU 31 Ca 0.29 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2k3w h LEU 31 Cb -0.03 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.46 2k3w h LEU 31 CO -0.09 1.09 0.03 1.88 0.09 0.00 0.00 178.44 181.44 2k3w h TYR 32 N 0.85 0.06 -0.61 1.13 0.05 -0.01 0.22 116.97 118.66 2k3w h TYR 32 Ca 0.13 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.88 2k3w h TYR 32 Cb 0.68 -0.02 -0.03 0.00 1.01 0.00 0.00 36.73 38.37 2k3w h TYR 32 CO 0.04 0.04 0.25 1.96 -1.05 0.00 0.00 178.16 179.41 2k3w h GLN 33 N 0.07 0.91 0.03 4.88 4.20 -1.24 -1.64 115.11 122.31 2k3w h GLN 33 Ca 0.02 -0.16 -0.00 0.00 0.06 0.00 0.00 58.65 58.57 2k3w h GLN 33 Cb -0.01 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.62 2k3w h GLN 33 CO -0.00 0.77 -0.01 0.45 -0.67 0.00 0.00 178.83 179.36 2k3w h HIS 34 N 0.85 -0.03 -0.53 2.96 3.86 -1.10 -2.05 115.15 119.11 2k3w h HIS 34 Ca 0.20 -0.00 0.08 0.00 -1.16 0.00 0.00 60.37 59.50 2k3w h HIS 34 Cb 0.19 0.01 -0.07 0.00 1.06 0.00 0.00 27.41 28.61 2k3w h HIS 34 CO 0.01 0.14 0.15 0.00 0.86 0.00 0.00 177.93 179.10 2k3w h ALA 35 N 0.76 0.63 -0.66 2.45 0.00 -0.44 -0.87 119.26 121.14 2k3w h ALA 35 Ca -0.00 0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.05 2k3w h ALA 35 Cb 0.19 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.02 2k3w h ALA 35 CO 0.01 -0.25 0.38 0.28 0.00 0.00 0.00 179.25 179.66 2k3w h VAL 36 N 0.31 1.00 -0.34 0.00 2.07 -1.16 -0.61 116.25 117.52 2k3w h VAL 36 Ca 0.26 -0.24 0.06 0.00 0.82 0.00 0.00 66.70 67.60 2k3w h VAL 36 Cb 0.33 0.23 -0.06 0.00 -1.52 0.00 0.00 31.29 30.27 2k3w h VAL 36 CO -0.30 0.13 -0.02 -0.08 0.02 0.00 0.00 177.57 177.32 2k3w h GLU 37 N 0.71 0.07 -0.70 1.57 4.81 -0.44 0.21 114.58 120.82 2k3w h GLU 37 Ca 0.29 -0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.48 2k3w h GLU 37 Cb 0.14 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.47 2k3w h GLU 37 CO -0.16 0.05 0.29 1.88 -0.73 0.00 0.00 179.01 180.34 2k3w h TYR 38 N 0.08 1.03 0.00 0.92 -1.99 -0.71 -0.28 116.97 116.02 2k3w h TYR 38 Ca 0.17 -0.06 -0.00 0.00 2.00 0.00 0.00 58.73 60.83 2k3w h TYR 38 Cb 0.23 -0.31 0.00 0.00 2.00 0.00 0.00 36.73 38.65 2k3w h TYR 38 CO -0.25 0.78 -0.00 0.74 -0.00 0.00 0.00 178.16 179.42 2k3w h PHE 39 N 1.00 -0.00 -0.73 4.88 0.04 0.06 0.12 116.94 122.33 2k3w h PHE 39 Ca 0.24 -0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.97 2k3w h PHE 39 Cb 0.17 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.29 2k3w h PHE 39 CO 0.01 0.07 0.29 -0.07 -0.60 0.00 0.00 178.31 178.02 2k3w h LEU 40 N -0.07 1.00 -1.34 1.54 3.38 -0.80 -2.02 115.31 117.00 2k3w h LEU 40 Ca -0.00 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 57.73 2k3w h LEU 40 Cb 0.07 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 2k3w h LEU 40 CO 0.00 0.90 -0.29 -0.74 0.09 0.00 0.00 178.44 178.39 2k3w h HIS 41 N 1.04 0.06 -0.07 1.13 2.76 -0.79 -2.98 115.15 116.30 2k3w h HIS 41 Ca 0.24 -0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.37 2k3w h HIS 41 Cb 0.21 -0.02 -0.00 0.00 1.55 0.00 0.00 27.41 29.15 2k3w h HIS 41 CO 0.02 0.35 -0.07 0.00 -1.30 0.00 0.00 177.93 176.93 2k3w h ALA 42 N 1.65 0.10 -0.18 5.26 0.00 -0.06 -0.04 119.26 125.99 2k3w h ALA 42 Ca 0.01 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.65 2k3w h ALA 42 Cb 0.55 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2k3w h ALA 42 CO 0.04 -0.10 0.12 -0.84 0.00 0.00 0.00 179.25 178.47 2k3w h ILE 43 N -0.27 1.01 0.16 0.00 3.07 -1.34 1.26 117.51 121.41 2k3w h ILE 43 Ca 0.01 -0.06 -0.30 0.00 1.55 0.00 0.00 64.86 66.05 2k3w h ILE 43 Cb 0.57 0.81 0.01 0.00 -0.27 0.00 0.00 36.82 37.94 2k3w h ILE 43 CO 0.02 0.03 -1.50 0.11 -1.05 0.00 0.00 178.15 175.76 2k3w h LYS 44 N 0.18 0.34 0.00 0.16 1.57 -1.47 -3.37 116.57 113.98 2k3w h LYS 44 Ca 0.07 -0.58 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 2k3w h LYS 44 Cb 0.06 0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.59 2k3w h LYS 44 CO -0.01 1.28 -0.72 1.88 -0.57 0.00 0.00 179.45 181.31 2k3w h TYR 45 N -0.10 0.00 0.00 -1.35 -1.99 -0.75 -3.45 116.97 109.32 2k3w h TYR 45 Ca -0.30 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.43 2k3w h TYR 45 Cb 1.93 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.66 2k3w h TYR 45 CO 0.12 0.00 0.00 0.39 -0.00 0.00 0.00 178.16 178.67 2k3w n GLU 46 N -2.49 0.00 0.00 4.88 -0.58 0.43 -5.04 120.64 117.84 2k3w n GLU 46 Ca 0.02 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.76 2k3w n GLU 46 Cb 0.50 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.37 2k3w n GLU 46 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2k3w n ALA 47 N -3.00 0.00 -1.34 0.62 0.00 -1.26 -5.02 120.51 110.51 2k3w n ALA 47 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.06 2k3w n ALA 47 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.49 2k3w n ALA 47 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2k3w n HIS 48 N 0.00 -1.32 -0.48 0.00 8.25 -1.26 -4.91 115.22 115.50 2k3w n HIS 48 Ca 0.00 0.39 -0.29 0.00 -0.26 0.00 0.00 57.72 57.57 2k3w n HIS 48 Cb 0.00 -1.87 0.26 0.00 1.12 0.00 0.00 29.99 29.50 2k3w n HIS 48 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2k3w n SER 49 N 0.74 -1.93 0.01 0.41 7.64 -1.26 -4.63 113.62 114.61 2k3w n SER 49 Ca 0.10 -0.20 0.01 0.00 1.01 0.00 0.00 58.87 59.79 2k3w n SER 49 Cb 0.49 -1.22 0.33 0.00 -1.01 0.00 0.00 64.21 62.80 2k3w n SER 49 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 2k3w h ASP 50 N -2.70 0.45 -0.29 6.43 3.32 -1.99 -0.84 116.42 120.81 2k3w h ASP 50 Ca -0.62 -0.07 -0.02 0.00 0.02 0.00 0.00 57.03 56.33 2k3w h ASP 50 Cb 1.34 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.76 2k3w h ASP 50 CO 0.48 0.51 0.10 0.11 -1.72 0.00 0.00 179.24 178.72 2k3w h LYS 51 N 0.48 0.44 -0.16 3.56 1.57 -2.00 -1.55 116.57 118.91 2k3w h LYS 51 Ca 0.11 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2k3w h LYS 51 Cb 0.28 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 2k3w h LYS 51 CO 0.01 0.49 0.06 0.00 -0.57 0.00 0.00 179.45 179.43 2k3w h ALA 52 N 0.93 0.21 -0.45 3.86 0.00 -1.80 -2.44 119.26 119.57 2k3w h ALA 52 Ca 0.09 -0.11 0.09 0.00 0.00 0.00 0.00 54.91 54.98 2k3w h ALA 52 Cb 0.23 -0.06 -0.09 0.00 0.00 0.00 0.00 17.79 17.87 2k3w h ALA 52 CO -0.00 -0.19 -0.13 0.87 0.00 0.00 0.00 179.25 179.80 2k3w h LYS 53 N 0.10 -0.02 -0.99 0.00 6.56 -1.02 0.17 116.57 121.36 2k3w h LYS 53 Ca 0.05 0.00 0.13 0.00 -1.06 0.00 0.00 60.65 59.77 2k3w h LYS 53 Cb 0.19 0.00 -0.08 0.00 -0.57 0.00 0.00 32.23 31.77 2k3w h LYS 53 CO -0.00 -0.01 0.63 1.49 -2.06 0.00 0.00 179.45 179.49 2k3w h GLU 54 N -0.02 0.93 -0.62 3.15 4.22 -1.07 0.10 114.58 121.26 2k3w h GLU 54 Ca 0.22 -0.06 -0.00 0.00 0.08 0.00 0.00 59.36 59.60 2k3w h GLU 54 Cb 0.35 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 2k3w h GLU 54 CO -0.47 0.61 0.38 1.03 -2.18 0.00 0.00 179.01 178.38 2k3w h SER 55 N 0.96 0.75 -0.32 1.04 0.87 -0.22 -0.12 113.55 116.50 2k3w h SER 55 Ca 0.50 -0.06 -0.05 0.00 -1.23 0.00 0.00 61.79 60.94 2k3w h SER 55 Cb 0.53 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.29 2k3w h SER 55 CO -0.27 0.59 -0.01 0.40 -0.53 0.00 0.00 176.83 177.01 2k3w h ILE 56 N 0.85 1.26 0.79 2.23 1.08 0.19 -1.41 117.51 122.50 2k3w h ILE 56 Ca 0.22 -0.98 -0.04 0.00 -0.39 0.00 0.00 64.86 63.68 2k3w h ILE 56 Cb -0.02 1.27 0.01 0.00 -3.07 0.00 0.00 36.82 35.01 2k3w h ILE 56 CO -0.04 0.32 -0.39 0.03 -0.69 0.00 0.00 178.15 177.37 2k3w h ARG 57 N 0.36 -1.04 -0.44 2.37 3.08 -0.65 0.77 114.38 118.83 2k3w h ARG 57 Ca 0.09 0.07 0.09 0.00 0.07 0.00 0.00 59.98 60.30 2k3w h ARG 57 Cb 0.46 0.24 -0.08 0.00 0.08 0.00 0.00 29.97 30.67 2k3w h ARG 57 CO 0.02 -0.69 -0.09 0.00 -1.07 0.00 0.00 179.97 178.13 2k3w h ALA 58 N -0.87 0.31 -0.70 0.04 0.00 -1.05 -0.61 119.26 116.38 2k3w h ALA 58 Ca -0.11 0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 2k3w h ALA 58 Cb 0.83 0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.91 2k3w h ALA 58 CO 0.17 -0.44 0.18 0.87 0.00 0.00 0.00 179.25 180.03 2k3w h LYS 59 N 0.02 1.12 -0.73 0.00 1.79 -1.10 -2.50 116.57 115.17 2k3w h LYS 59 Ca 0.21 -0.27 0.10 0.00 -2.18 0.00 0.00 60.65 58.52 2k3w h LYS 59 Cb 0.32 -0.15 -0.08 0.00 -1.58 0.00 0.00 32.23 30.75 2k3w h LYS 59 CO -0.44 0.98 0.35 0.00 -1.08 0.00 0.00 179.45 179.27 2k3w h VAL 61 N 0.58 1.26 -0.08 0.00 3.04 -0.94 -1.08 116.25 119.03 2k3w h VAL 61 Ca 0.37 -1.23 -0.03 0.00 -1.01 0.00 0.00 66.70 64.80 2k3w h VAL 61 Cb 0.43 1.63 -0.00 0.00 -2.01 0.00 0.00 31.29 31.33 2k3w h VAL 61 CO -0.30 0.36 -0.07 1.56 -1.01 0.00 0.00 177.57 178.11 2k3w h GLN 62 N 0.04 0.20 -0.12 4.17 4.20 -0.31 -0.68 115.11 122.61 2k3w h GLN 62 Ca 0.00 -0.10 -0.00 0.00 0.06 0.00 0.00 58.65 58.61 2k3w h GLN 62 Cb 0.64 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.41 2k3w h GLN 62 CO 0.05 0.61 0.06 1.88 -0.67 0.00 0.00 178.83 180.76 2k3w h TYR 63 N -0.22 0.17 -0.15 2.96 0.05 -0.65 -2.12 116.97 117.01 2k3w h TYR 63 Ca 0.01 -0.01 0.01 0.00 0.05 0.00 0.00 58.73 58.80 2k3w h TYR 63 Cb 0.57 -0.05 -0.01 0.00 1.01 0.00 0.00 36.73 38.25 2k3w h TYR 63 CO 0.09 0.20 0.07 -0.07 -1.05 0.00 0.00 178.16 177.40 2k3w h LEU 64 N 0.08 0.10 -0.75 3.88 3.38 -1.23 -0.82 115.31 119.96 2k3w h LEU 64 Ca 0.04 0.01 0.16 0.00 0.09 0.00 0.00 57.88 58.18 2k3w h LEU 64 Cb 0.09 -0.01 -0.11 0.00 0.09 0.00 0.00 40.66 40.73 2k3w h LEU 64 CO -0.01 0.08 0.22 -0.78 0.09 0.00 0.00 178.44 178.05 2k3w h ASP 65 N 0.16 0.11 -0.51 -0.43 3.58 -0.92 0.49 116.42 118.89 2k3w h ASP 65 Ca 0.06 0.14 -0.01 0.00 0.42 0.00 0.00 57.03 57.64 2k3w h ASP 65 Cb 0.02 0.16 -0.02 0.00 1.72 0.00 0.00 39.33 41.20 2k3w h ASP 65 CO -0.05 0.00 0.28 0.03 -2.88 0.00 0.00 179.24 176.63 2k3w h ARG 66 N 0.32 0.71 -0.47 0.28 2.47 -0.73 -1.80 114.38 115.16 2k3w h ARG 66 Ca 0.42 -0.08 -0.01 0.00 -1.26 0.00 0.00 59.98 59.05 2k3w h ARG 66 Cb 0.71 -0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.86 2k3w h ARG 66 CO -0.48 0.54 0.24 0.00 0.56 0.00 0.00 179.97 180.84 2k3w h ALA 67 N 1.12 1.54 0.39 0.04 0.00 0.10 -0.63 119.26 121.82 2k3w h ALA 67 Ca 0.18 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2k3w h ALA 67 Cb 0.04 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.64 2k3w h ALA 67 CO -0.03 0.38 -0.19 0.93 0.00 0.00 0.00 179.25 180.34 2k3w h GLU 68 N 0.66 -0.51 -0.64 0.00 5.08 0.52 -1.16 114.58 118.52 2k3w h GLU 68 Ca 0.17 0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.54 2k3w h GLU 68 Cb 0.05 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.38 2k3w h GLU 68 CO -0.03 -0.22 0.32 1.57 -1.00 0.00 0.00 179.01 179.65 2k3w h LYS 69 N -0.77 0.90 -0.08 2.33 2.10 -1.21 0.28 116.57 120.12 2k3w h LYS 69 Ca -0.05 -0.11 -0.00 0.00 -2.00 0.00 0.00 60.65 58.48 2k3w h LYS 69 Cb 0.52 -0.17 -0.00 0.00 -0.90 0.00 0.00 32.23 31.68 2k3w h LYS 69 CO 0.09 0.69 0.05 -0.07 -2.00 0.00 0.00 179.45 178.21 2k3w h LEU 70 N 0.90 0.10 -1.27 7.07 3.38 -1.02 -1.48 115.31 122.98 2k3w h LEU 70 Ca 0.22 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.12 2k3w h LEU 70 Cb 0.08 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 2k3w h LEU 70 CO -0.03 0.11 -0.13 0.50 0.09 0.00 0.00 178.44 178.98 2k3w h LYS 71 N 0.07 0.00 0.44 1.13 3.64 -0.90 -2.08 116.57 118.87 2k3w h LYS 71 Ca 0.03 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 2k3w h LYS 71 Cb 0.03 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 2k3w h LYS 71 CO -0.01 0.13 -0.21 0.22 -2.27 0.00 0.00 179.45 177.31 2k3w h ASP 72 N 0.00 -0.50 0.80 4.20 3.58 0.57 -1.70 116.42 123.38 2k3w h ASP 72 Ca -0.00 -0.10 -0.17 0.00 0.42 0.00 0.00 57.03 57.18 2k3w h ASP 72 Cb 0.64 0.13 -0.02 0.00 1.72 0.00 0.00 39.33 41.79 2k3w h ASP 72 CO 0.02 -0.10 -0.81 0.10 -2.88 0.00 0.00 179.24 175.57 2k3w h TYR 73 N -0.98 0.00 -0.22 0.28 -0.00 -1.48 -3.17 116.97 111.41 2k3w h TYR 73 Ca -0.06 -0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.67 2k3w h TYR 73 Cb 0.56 -0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.28 2k3w h TYR 73 CO 0.02 0.81 0.14 -0.07 -0.00 0.00 0.00 178.16 179.06 2k3w h LEU 74 N 0.00 0.25 0.00 0.10 3.38 -1.44 -3.52 115.31 114.08 2k3w h LEU 74 Ca -0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2k3w h LEU 74 Cb 1.43 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.11 2k3w h LEU 74 CO 0.10 0.19 0.00 -1.14 0.09 0.00 0.00 178.44 177.68