#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k3w n SER 4 N 0.00 1.16 -0.15 8.00 7.64 -1.26 -4.76 113.62 124.25 2k3w n SER 4 Ca 0.00 0.63 -0.08 0.00 1.01 0.00 0.00 58.87 60.44 2k3w n SER 4 Cb 0.00 -1.51 0.01 0.00 -1.01 0.00 0.00 64.21 61.70 2k3w n SER 4 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 2k3w h THR 5 N -0.61 1.14 -0.33 0.44 2.02 -1.99 0.36 112.91 113.94 2k3w h THR 5 Ca -0.47 -0.32 -0.10 0.00 0.77 0.00 0.00 66.41 66.29 2k3w h THR 5 Cb 1.31 0.54 -0.01 0.00 -1.74 0.00 0.00 68.15 68.25 2k3w h THR 5 CO 0.47 0.14 -0.17 0.25 0.37 0.00 0.00 175.52 176.59 2k3w h LEU 6 N 0.60 0.73 -0.40 2.58 5.85 -1.91 -1.52 115.31 121.23 2k3w h LEU 6 Ca 0.16 -0.41 0.02 0.00 0.84 0.00 0.00 57.88 58.50 2k3w h LEU 6 Cb -0.00 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.79 2k3w h LEU 6 CO -0.03 0.97 0.22 -0.61 -0.34 0.00 0.00 178.44 178.65 2k3w h GLN 7 N 0.48 0.43 -0.71 1.25 5.75 -1.86 -0.74 115.11 119.70 2k3w h GLN 7 Ca 0.07 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.53 2k3w h GLN 7 Cb 0.70 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 29.12 2k3w h GLN 7 CO 0.05 0.29 0.38 -0.22 -2.65 0.00 0.00 178.83 176.68 2k3w h LYS 8 N 0.44 0.98 -0.79 1.69 1.63 -0.85 -1.19 116.57 118.48 2k3w h LYS 8 Ca 0.17 -0.11 0.02 0.00 -0.85 0.00 0.00 60.65 59.88 2k3w h LYS 8 Cb 0.05 -0.20 -0.04 0.00 -0.60 0.00 0.00 32.23 31.44 2k3w h LYS 8 CO -0.10 0.72 0.51 0.00 -3.45 0.00 0.00 179.45 177.14 2k3w h ALA 9 N 1.44 1.03 -0.60 5.00 0.00 -0.10 -0.05 119.26 125.97 2k3w h ALA 9 Ca 0.25 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.05 2k3w h ALA 9 Cb 0.03 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2k3w h ALA 9 CO -0.04 0.36 0.11 0.82 0.00 0.00 0.00 179.25 180.50 2k3w h ILE 10 N 1.02 1.26 -0.51 0.00 2.04 -0.37 -1.72 117.51 119.24 2k3w h ILE 10 Ca 0.31 -0.97 -0.04 0.00 1.00 0.00 0.00 64.86 65.16 2k3w h ILE 10 Cb -0.04 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 36.74 2k3w h ILE 10 CO -0.09 0.36 0.18 -0.78 0.00 0.00 0.00 178.15 177.81 2k3w h ASP 11 N 0.89 0.72 -0.37 1.72 1.82 -0.52 -0.12 116.42 120.55 2k3w h ASP 11 Ca 0.18 -0.19 -0.03 0.00 -0.39 0.00 0.00 57.03 56.60 2k3w h ASP 11 Cb 0.40 -0.19 -0.02 0.00 0.68 0.00 0.00 39.33 40.21 2k3w h ASP 11 CO 0.01 0.71 0.11 -0.07 -1.61 0.00 0.00 179.24 178.39 2k3w h LEU 12 N 0.68 0.55 -0.82 2.28 3.38 -0.85 -2.33 115.31 118.20 2k3w h LEU 12 Ca 0.17 -0.21 -0.12 0.00 0.09 0.00 0.00 57.88 57.81 2k3w h LEU 12 Cb 0.24 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2k3w h LEU 12 CO -0.01 0.62 -0.39 1.62 0.09 0.00 0.00 178.44 180.36 2k3w h VAL 13 N 0.45 1.30 -0.22 1.22 3.04 -1.24 -1.49 116.25 119.31 2k3w h VAL 13 Ca 0.12 -1.52 0.01 0.00 -1.01 0.00 0.00 66.70 64.30 2k3w h VAL 13 Cb 0.27 1.59 -0.02 0.00 -2.01 0.00 0.00 31.29 31.13 2k3w h VAL 13 CO -0.00 0.47 0.11 0.74 -1.01 0.00 0.00 177.57 177.87 2k3w h THR 14 N 0.34 0.99 -0.65 3.17 2.02 -0.79 -0.78 112.91 117.22 2k3w h THR 14 Ca 0.03 -0.08 -0.04 0.00 0.77 0.00 0.00 66.41 67.09 2k3w h THR 14 Cb 0.84 0.74 -0.03 0.00 -1.74 0.00 0.00 68.15 67.97 2k3w h THR 14 CO 0.07 0.04 0.24 0.50 0.37 0.00 0.00 175.52 176.74 2k3w h LYS 15 N 0.23 0.98 -0.81 6.66 3.64 -1.30 -2.40 116.57 123.57 2k3w h LYS 15 Ca 0.09 -0.19 0.15 0.00 -1.27 0.00 0.00 60.65 59.43 2k3w h LYS 15 Cb 0.02 -0.15 -0.10 0.00 -0.41 0.00 0.00 32.23 31.60 2k3w h LYS 15 CO -0.06 0.84 0.38 0.00 -2.27 0.00 0.00 179.45 178.34 2k3w h ALA 16 N 1.10 1.20 -0.37 5.00 0.00 -0.40 0.21 119.26 126.00 2k3w h ALA 16 Ca 0.21 0.10 -0.09 0.00 0.00 0.00 0.00 54.91 55.13 2k3w h ALA 16 Cb 0.24 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2k3w h ALA 16 CO -0.01 -0.14 -0.16 1.79 0.00 0.00 0.00 179.25 180.72 2k3w h THR 17 N 0.55 1.26 -0.56 0.00 1.35 -0.72 0.27 112.91 115.05 2k3w h THR 17 Ca 0.45 -1.20 -0.11 0.00 -0.55 0.00 0.00 66.41 65.00 2k3w h THR 17 Cb 0.66 1.15 -0.02 0.00 -1.73 0.00 0.00 68.15 68.21 2k3w h THR 17 CO -0.38 0.40 -0.08 1.05 -0.25 0.00 0.00 175.52 176.25 2k3w h GLU 18 N 0.60 1.05 -0.29 4.72 4.11 -0.40 -1.70 114.58 122.68 2k3w h GLU 18 Ca 0.10 -0.38 -0.13 0.00 0.07 0.00 0.00 59.36 59.02 2k3w h GLU 18 Cb 0.62 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.79 2k3w h GLU 18 CO 0.04 1.08 -0.33 0.93 0.07 0.00 0.00 179.01 180.79 2k3w h GLU 19 N 0.94 0.74 -0.65 1.06 4.39 -0.32 -0.84 114.58 119.90 2k3w h GLU 19 Ca 0.15 -0.41 0.05 0.00 0.34 0.00 0.00 59.36 59.49 2k3w h GLU 19 Cb 0.65 0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 29.28 2k3w h GLU 19 CO 0.05 1.03 0.37 0.22 -1.16 0.00 0.00 179.01 179.51 2k3w h ASP 20 N 0.49 0.56 -0.45 1.42 1.82 -0.35 0.56 116.42 120.47 2k3w h ASP 20 Ca 0.04 0.02 -0.10 0.00 -0.39 0.00 0.00 57.03 56.61 2k3w h ASP 20 Cb 0.91 -0.09 -0.02 0.00 0.68 0.00 0.00 39.33 40.81 2k3w h ASP 20 CO 0.08 0.37 -0.08 0.11 -1.61 0.00 0.00 179.24 178.11 2k3w h LYS 21 N 0.69 0.90 -0.12 0.28 1.57 -1.20 -1.59 116.57 117.11 2k3w h LYS 21 Ca 0.28 -0.30 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2k3w h LYS 21 Cb 0.14 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.37 2k3w h LYS 21 CO -0.16 0.94 0.00 0.00 -0.57 0.00 0.00 179.45 179.66 2k3w n ALA 22 N -2.49 2.08 -1.65 3.86 0.00 -0.33 -4.76 120.51 117.22 2k3w n ALA 22 Ca 0.02 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.31 2k3w n ALA 22 Cb 0.37 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.77 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 -0.37 -1.06 -2.74 0.00 4.76 -0.60 -4.91 118.16 113.24 2k3w n LYS 23 Ca 0.00 0.94 -0.43 0.00 -2.87 0.00 0.00 58.31 55.95 2k3w n LYS 23 Cb 0.03 -5.11 0.01 0.00 -1.84 0.00 0.00 35.03 28.12 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 -0.49 6.01 -0.18 4.39 4.13 0.18 -4.81 115.26 124.49 2k3w n ASN 24 Ca -0.15 -3.31 -0.02 0.00 1.68 0.00 0.00 54.58 52.77 2k3w n ASN 24 Cb 0.52 -1.34 0.08 0.00 -1.54 0.00 0.00 39.78 37.50 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 5.49 0.42 0.35 3.10 0.05 -1.86 0.40 116.97 124.93 2k3w h TYR 25 Ca 0.28 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 59.08 2k3w h TYR 25 Cb 0.61 -0.11 -0.00 0.00 1.01 0.00 0.00 36.73 38.24 2k3w h TYR 25 CO 1.12 0.15 -0.21 0.93 -1.05 0.00 0.00 178.16 179.10 2k3w h GLU 26 N 0.44 -0.52 -0.27 4.88 5.08 -1.95 0.17 114.58 122.41 2k3w h GLU 26 Ca 0.27 0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.64 2k3w h GLU 26 Cb 0.26 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 2k3w h GLU 26 CO -0.24 -0.34 0.09 1.49 -1.00 0.00 0.00 179.01 179.01 2k3w h GLU 27 N -0.53 0.42 -0.63 2.33 4.57 -1.89 -2.34 114.58 116.51 2k3w h GLU 27 Ca -0.04 -0.09 0.07 0.00 -1.18 0.00 0.00 59.36 58.12 2k3w h GLU 27 Cb 0.44 -0.06 -0.06 0.00 -0.16 0.00 0.00 28.75 28.91 2k3w h GLU 27 CO 0.04 0.48 0.32 0.00 -1.18 0.00 0.00 179.01 178.67 2k3w h ALA 28 N 0.92 0.84 -0.36 2.92 0.00 -0.08 -1.59 119.26 121.92 2k3w h ALA 28 Ca 0.09 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.05 2k3w h ALA 28 Cb 0.24 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2k3w h ALA 28 CO -0.00 -0.05 0.21 1.25 0.00 0.00 0.00 179.25 180.66 2k3w h LEU 29 N 0.58 0.34 -0.74 0.00 6.46 -0.41 0.17 115.31 121.71 2k3w h LEU 29 Ca 0.30 0.00 0.03 0.00 -0.12 0.00 0.00 57.88 58.09 2k3w h LEU 29 Cb 0.26 -0.07 -0.05 0.00 -0.73 0.00 0.00 40.66 40.07 2k3w h LEU 29 CO -0.22 0.25 0.46 0.03 -0.62 0.00 0.00 178.44 178.34 2k3w h ARG 30 N 0.43 0.87 -0.55 1.25 3.08 -0.86 -1.11 114.38 117.49 2k3w h ARG 30 Ca 0.14 -0.05 -0.10 0.00 0.07 0.00 0.00 59.98 60.04 2k3w h ARG 30 Cb 0.00 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 29.84 2k3w h ARG 30 CO -0.06 0.58 -0.04 -0.07 -1.07 0.00 0.00 179.97 179.30 2k3w h LEU 31 N 0.90 0.99 -0.05 3.04 3.38 -0.75 -2.00 115.31 120.82 2k3w h LEU 31 Ca 0.30 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2k3w h LEU 31 Cb 0.03 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 2k3w h LEU 31 CO -0.12 1.08 0.03 1.88 0.09 0.00 0.00 178.44 181.41 2k3w h TYR 32 N 0.88 0.06 -0.44 1.13 0.05 -0.03 0.95 116.97 119.57 2k3w h TYR 32 Ca 0.15 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.93 2k3w h TYR 32 Cb 0.60 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.30 2k3w h TYR 32 CO 0.04 0.04 0.27 1.96 -1.05 0.00 0.00 178.16 179.42 2k3w h GLN 33 N 0.07 0.60 -0.07 4.88 4.20 -1.18 -1.57 115.11 122.04 2k3w h GLN 33 Ca 0.02 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.68 2k3w h GLN 33 Cb -0.00 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 27.65 2k3w h GLN 33 CO -0.01 0.44 0.05 0.45 -0.67 0.00 0.00 178.83 179.09 2k3w h HIS 34 N 0.59 0.09 -0.38 2.96 3.86 -1.10 -1.82 115.15 119.35 2k3w h HIS 34 Ca 0.16 0.00 0.07 0.00 -1.16 0.00 0.00 60.37 59.44 2k3w h HIS 34 Cb -0.01 -0.03 -0.07 0.00 1.06 0.00 0.00 27.41 28.37 2k3w h HIS 34 CO -0.03 0.06 -0.06 0.00 0.86 0.00 0.00 177.93 178.75 2k3w h ALA 35 N 1.02 0.28 -0.55 2.45 0.00 -0.56 -1.45 119.26 120.45 2k3w h ALA 35 Ca 0.03 0.14 0.06 0.00 0.00 0.00 0.00 54.91 55.13 2k3w h ALA 35 Cb -0.01 0.26 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 2k3w h ALA 35 CO -0.01 -0.44 0.25 0.28 0.00 0.00 0.00 179.25 179.34 2k3w h VAL 36 N 0.03 0.90 -0.26 0.00 2.07 -0.99 0.13 116.25 118.13 2k3w h VAL 36 Ca 0.18 -0.17 0.05 0.00 0.82 0.00 0.00 66.70 67.58 2k3w h VAL 36 Cb 0.27 0.37 -0.04 0.00 -1.52 0.00 0.00 31.29 30.37 2k3w h VAL 36 CO -0.36 0.09 -0.02 -0.08 0.02 0.00 0.00 177.57 177.21 2k3w h GLU 37 N 0.48 0.05 -0.75 1.57 4.57 -0.44 0.16 114.58 120.22 2k3w h GLU 37 Ca 0.25 -0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 58.38 2k3w h GLU 37 Cb 0.21 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.76 2k3w h GLU 37 CO -0.20 0.03 0.26 1.88 -1.18 0.00 0.00 179.01 179.80 2k3w h TYR 38 N 0.05 1.19 0.04 0.92 -1.99 -0.64 0.16 116.97 116.70 2k3w h TYR 38 Ca 0.12 -0.11 -0.00 0.00 2.00 0.00 0.00 58.73 60.74 2k3w h TYR 38 Cb 0.17 -0.35 0.00 0.00 2.00 0.00 0.00 36.73 38.55 2k3w h TYR 38 CO -0.22 0.92 -0.02 0.74 -0.00 0.00 0.00 178.16 179.59 2k3w h PHE 39 N 1.11 -0.04 -0.61 4.88 0.04 -0.02 0.15 116.94 122.45 2k3w h PHE 39 Ca 0.25 -0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.98 2k3w h PHE 39 Cb 0.28 0.01 -0.03 0.00 2.20 0.00 0.00 35.95 38.41 2k3w h PHE 39 CO 0.02 0.05 0.25 -0.07 -0.60 0.00 0.00 178.31 177.96 2k3w h LEU 40 N -0.13 0.83 -1.71 1.54 3.38 -0.55 -1.83 115.31 116.84 2k3w h LEU 40 Ca -0.00 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 2k3w h LEU 40 Cb 0.11 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2k3w h LEU 40 CO 0.01 0.77 -0.18 -0.74 0.09 0.00 0.00 178.44 178.39 2k3w h HIS 41 N 0.84 0.00 -0.05 1.13 2.76 -0.45 -2.98 115.15 116.41 2k3w h HIS 41 Ca 0.20 0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.30 2k3w h HIS 41 Cb 0.20 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.16 2k3w h HIS 41 CO 0.01 0.18 -0.24 0.00 -1.30 0.00 0.00 177.93 176.58 2k3w h ALA 42 N 1.82 0.09 -0.07 5.26 0.00 0.11 -0.65 119.26 125.81 2k3w h ALA 42 Ca -0.00 -0.42 0.02 0.00 0.00 0.00 0.00 54.91 54.51 2k3w h ALA 42 Cb 0.36 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 2k3w h ALA 42 CO 0.02 0.10 0.05 -0.84 0.00 0.00 0.00 179.25 178.58 2k3w h ILE 43 N -0.30 0.91 0.18 0.00 3.07 -1.27 3.29 117.51 123.40 2k3w h ILE 43 Ca -0.02 0.00 -0.31 0.00 1.55 0.00 0.00 64.86 66.08 2k3w h ILE 43 Cb 0.90 0.96 0.01 0.00 -0.27 0.00 0.00 36.82 38.43 2k3w h ILE 43 CO 0.05 0.00 -1.51 0.11 -1.05 0.00 0.00 178.15 175.75 2k3w h LYS 44 N 0.00 0.38 0.00 0.16 1.57 -1.51 -3.07 116.57 114.10 2k3w h LYS 44 Ca 0.03 -0.65 0.00 0.00 -1.87 0.00 0.00 60.65 58.16 2k3w h LYS 44 Cb 0.14 0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.69 2k3w h LYS 44 CO -0.00 1.31 -0.91 0.66 -0.57 0.00 0.00 179.45 179.94 2k3w n TYR 45 N -3.76 0.07 -1.89 -1.35 4.02 -0.26 -4.18 117.16 109.81 2k3w n TYR 45 Ca -0.22 0.02 -0.02 0.00 -0.01 0.00 0.00 57.90 57.67 2k3w n TYR 45 Cb 1.01 -0.20 0.13 0.00 -0.02 0.00 0.00 39.34 40.26 2k3w n TYR 45 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 2k3w n GLU 46 N -1.65 1.86 0.00 -0.72 -0.58 1.09 -5.01 120.64 115.63 2k3w n GLU 46 Ca 0.04 -3.34 0.00 0.00 -0.42 0.00 0.00 57.16 53.43 2k3w n GLU 46 Cb 0.37 -1.55 0.00 0.00 -0.57 0.00 0.00 31.44 29.68 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 -0.77 0.00 -1.00 0.62 0.00 -1.16 -4.75 120.51 113.44 2k3w n ALA 47 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.66 2k3w n ALA 47 Cb 0.82 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.27 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 0.00 -4.03 0.00 8.25 -1.26 -5.06 115.22 113.12 2k3w n HIS 48 Ca 0.00 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.19 2k3w n HIS 48 Cb 0.00 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.06 2k3w n HIS 48 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2k3w s SER 49 N -1.03 5.83 0.33 0.41 0.01 -1.26 -4.94 113.70 113.05 2k3w s SER 49 Ca 0.00 -0.01 0.11 0.00 1.31 0.00 0.00 55.95 57.37 2k3w s SER 49 Cb 0.00 -1.62 0.94 0.00 0.21 0.00 0.00 66.02 65.55 2k3w s SER 49 CO 0.00 0.07 1.73 0.44 0.41 0.00 0.00 173.24 175.90 2k3w h ASP 50 N 2.39 0.63 -0.58 2.44 3.32 -1.99 0.51 116.42 123.13 2k3w h ASP 50 Ca -0.48 0.13 -0.05 0.00 0.02 0.00 0.00 57.03 56.65 2k3w h ASP 50 Cb 1.19 0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.75 2k3w h ASP 50 CO 0.66 0.09 0.17 0.11 -1.72 0.00 0.00 179.24 178.55 2k3w h LYS 51 N 0.54 0.91 0.50 3.56 1.57 -2.00 -2.07 116.57 119.58 2k3w h LYS 51 Ca 0.64 -0.20 -0.02 0.00 -1.87 0.00 0.00 60.65 59.20 2k3w h LYS 51 Cb 1.30 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.49 2k3w h LYS 51 CO -0.45 0.82 -0.24 0.00 -0.57 0.00 0.00 179.45 179.02 2k3w h ALA 52 N 1.05 -0.67 -0.47 3.86 0.00 -0.47 -2.05 119.26 120.52 2k3w h ALA 52 Ca 0.19 -0.18 0.09 0.00 0.00 0.00 0.00 54.91 55.01 2k3w h ALA 52 Cb 0.30 0.26 -0.10 0.00 0.00 0.00 0.00 17.79 18.25 2k3w h ALA 52 CO -0.00 -0.79 -0.27 0.87 0.00 0.00 0.00 179.25 179.05 2k3w h LYS 53 N -0.84 -0.17 -0.91 0.00 6.56 -0.95 0.50 116.57 120.78 2k3w h LYS 53 Ca -0.07 0.01 0.15 0.00 -1.06 0.00 0.00 60.65 59.68 2k3w h LYS 53 Cb 0.58 0.04 -0.09 0.00 -0.57 0.00 0.00 32.23 32.18 2k3w h LYS 53 CO 0.11 -0.11 0.51 0.93 -2.06 0.00 0.00 179.45 178.83 2k3w h GLU 54 N -0.17 0.71 -0.48 3.15 5.08 -1.32 0.63 114.58 122.18 2k3w h GLU 54 Ca 0.21 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.50 2k3w h GLU 54 Cb 0.51 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 2k3w h GLU 54 CO -0.57 0.47 0.19 1.03 -1.00 0.00 0.00 179.01 179.13 2k3w h SER 55 N 0.73 0.66 -0.26 1.42 0.87 0.60 -0.16 113.55 117.40 2k3w h SER 55 Ca 0.49 -0.17 -0.08 0.00 -1.23 0.00 0.00 61.79 60.80 2k3w h SER 55 Cb 0.66 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.44 2k3w h SER 55 CO -0.34 0.65 -0.14 0.40 -0.53 0.00 0.00 176.83 176.87 2k3w h ILE 56 N 0.63 1.30 -0.74 2.23 1.08 0.18 -1.23 117.51 120.95 2k3w h ILE 56 Ca 0.16 -1.23 -0.03 0.00 -0.39 0.00 0.00 64.86 63.37 2k3w h ILE 56 Cb 0.20 1.54 -0.03 0.00 -3.07 0.00 0.00 36.82 35.45 2k3w h ILE 56 CO -0.01 0.39 0.36 0.03 -0.69 0.00 0.00 178.15 178.23 2k3w h ARG 57 N 0.29 1.06 -0.06 2.37 3.08 0.23 0.64 114.38 121.99 2k3w h ARG 57 Ca 0.06 -0.14 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 2k3w h ARG 57 Cb 0.65 -0.20 -0.00 0.00 0.08 0.00 0.00 29.97 30.50 2k3w h ARG 57 CO 0.04 0.81 -0.03 0.00 -1.07 0.00 0.00 179.97 179.72 2k3w h ALA 58 N 1.34 0.08 -0.42 0.04 0.00 -0.93 -2.42 119.26 116.96 2k3w h ALA 58 Ca 0.26 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 2k3w h ALA 58 Cb 0.10 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2k3w h ALA 58 CO -0.03 -0.16 -0.13 0.87 0.00 0.00 0.00 179.25 179.79 2k3w h LYS 59 N -0.27 0.75 -0.11 0.00 1.79 -1.01 -2.37 116.57 115.35 2k3w h LYS 59 Ca 0.01 -0.26 0.04 0.00 -2.18 0.00 0.00 60.65 58.26 2k3w h LYS 59 Cb 0.48 -0.06 -0.04 0.00 -1.58 0.00 0.00 32.23 31.03 2k3w h LYS 59 CO 0.01 0.85 -0.12 0.00 -1.08 0.00 0.00 179.45 179.11 2k3w h VAL 61 N -0.15 1.06 -0.15 0.00 3.04 -1.31 -1.54 116.25 117.20 2k3w h VAL 61 Ca 0.08 -0.62 -0.05 0.00 -1.01 0.00 0.00 66.70 65.10 2k3w h VAL 61 Cb 0.27 1.34 -0.00 0.00 -2.01 0.00 0.00 31.29 30.89 2k3w h VAL 61 CO -0.20 0.17 -0.12 1.56 -1.01 0.00 0.00 177.57 177.97 2k3w h GLN 62 N 0.00 0.34 -0.08 4.17 4.20 -0.60 -0.93 115.11 122.21 2k3w h GLN 62 Ca -0.00 -0.17 -0.00 0.00 0.06 0.00 0.00 58.65 58.54 2k3w h GLN 62 Cb 0.33 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.10 2k3w h GLN 62 CO 0.02 0.70 0.04 1.88 -0.67 0.00 0.00 178.83 180.81 2k3w h TYR 63 N -0.02 0.12 0.08 2.96 0.05 -0.32 -1.86 116.97 117.99 2k3w h TYR 63 Ca 0.03 -0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.80 2k3w h TYR 63 Cb 0.63 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 38.33 2k3w h TYR 63 CO 0.08 0.18 -0.04 -0.07 -1.05 0.00 0.00 178.16 177.26 2k3w h LEU 64 N 0.03 -0.09 -0.94 3.88 3.38 -1.33 0.10 115.31 120.34 2k3w h LEU 64 Ca 0.03 -0.01 0.22 0.00 0.09 0.00 0.00 57.88 58.21 2k3w h LEU 64 Cb 0.10 0.02 -0.12 0.00 0.09 0.00 0.00 40.66 40.75 2k3w h LEU 64 CO -0.00 -0.05 0.50 -0.78 0.09 0.00 0.00 178.44 178.19 2k3w h ASP 65 N -0.11 0.54 -0.17 -0.43 1.82 -1.02 0.52 116.42 117.56 2k3w h ASP 65 Ca -0.01 0.14 -0.05 0.00 -0.39 0.00 0.00 57.03 56.72 2k3w h ASP 65 Cb 0.09 0.06 -0.00 0.00 0.68 0.00 0.00 39.33 40.16 2k3w h ASP 65 CO 0.02 0.09 -0.07 0.03 -1.61 0.00 0.00 179.24 177.70 2k3w h ARG 66 N 0.53 0.35 -0.88 0.28 2.47 -0.59 -2.80 114.38 113.74 2k3w h ARG 66 Ca 0.59 -0.15 -0.02 0.00 -1.26 0.00 0.00 59.98 59.14 2k3w h ARG 66 Cb 1.07 -0.01 -0.04 0.00 -1.65 0.00 0.00 29.97 29.34 2k3w h ARG 66 CO -0.48 0.65 0.49 0.00 0.56 0.00 0.00 179.97 181.19 2k3w h ALA 67 N 0.69 1.12 -0.17 0.04 0.00 0.19 -1.95 119.26 119.19 2k3w h ALA 67 Ca 0.04 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2k3w h ALA 67 Cb 0.53 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2k3w h ALA 67 CO 0.02 0.62 0.04 1.05 0.00 0.00 0.00 179.25 180.98 2k3w h GLU 68 N 1.22 0.27 -0.30 0.00 -0.00 -0.15 -1.89 114.58 113.72 2k3w h GLU 68 Ca 0.31 -0.07 -0.03 0.00 -0.00 0.00 0.00 59.36 59.57 2k3w h GLU 68 Cb 0.02 -0.03 -0.02 0.00 -0.00 0.00 0.00 28.75 28.72 2k3w h GLU 68 CO -0.05 0.42 0.04 1.57 -0.00 0.00 0.00 179.01 180.98 2k3w h LYS 69 N 0.07 0.45 -0.44 1.06 2.10 -1.37 0.13 116.57 118.57 2k3w h LYS 69 Ca 0.05 -0.08 -0.01 0.00 -2.00 0.00 0.00 60.65 58.61 2k3w h LYS 69 Cb 0.27 -0.08 -0.02 0.00 -0.90 0.00 0.00 32.23 31.51 2k3w h LYS 69 CO 0.00 0.45 0.23 -0.07 -2.00 0.00 0.00 179.45 178.06 2k3w h LEU 70 N 0.44 0.56 -1.20 7.07 3.38 -1.06 -0.97 115.31 123.53 2k3w h LEU 70 Ca 0.10 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 2k3w h LEU 70 Cb 0.23 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2k3w h LEU 70 CO 0.00 0.50 -0.19 0.50 0.09 0.00 0.00 178.44 179.33 2k3w h LYS 71 N 0.57 0.00 0.46 1.13 3.64 -0.69 -1.91 116.57 119.77 2k3w h LYS 71 Ca 0.15 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.51 2k3w h LYS 71 Cb 0.07 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 2k3w h LYS 71 CO -0.02 0.19 -0.22 0.22 -2.27 0.00 0.00 179.45 177.35 2k3w h ASP 72 N 0.00 -0.52 0.80 4.20 1.82 0.60 -1.64 116.42 121.68 2k3w h ASP 72 Ca -0.00 -0.09 -0.17 0.00 -0.39 0.00 0.00 57.03 56.38 2k3w h ASP 72 Cb 0.70 0.13 -0.02 0.00 0.68 0.00 0.00 39.33 40.82 2k3w h ASP 72 CO 0.03 -0.14 -0.79 0.10 -1.61 0.00 0.00 179.24 176.82 2k3w h TYR 73 N -0.98 0.00 -0.22 0.28 -0.00 -1.51 -3.20 116.97 111.34 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 0.58 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.30 2k3w h TYR 73 CO 0.02 0.79 0.13 -0.07 -0.00 0.00 0.00 178.16 179.03 2k3w h LEU 74 N 0.00 0.26 0.00 0.10 3.38 -1.39 -3.52 115.31 114.14 2k3w h LEU 74 Ca -0.01 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2k3w h LEU 74 Cb 1.41 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.09 2k3w h LEU 74 CO 0.10 0.24 0.00 -1.14 0.09 0.00 0.00 178.44 177.73