#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 4.18 0.17 8.00 0.01 -1.26 -4.84 113.70 119.96 2k3w s SER 4 Ca 0.00 2.46 -0.13 0.00 1.31 0.00 0.00 55.95 59.59 2k3w s SER 4 Cb 0.00 -2.60 0.07 0.00 0.21 0.00 0.00 66.02 63.70 2k3w s SER 4 CO 0.00 -2.28 1.78 0.74 0.41 0.00 0.00 173.24 173.89 2k3w h THR 5 N -0.14 1.19 -0.51 1.44 2.02 -1.99 -1.60 112.91 113.32 2k3w h THR 5 Ca -0.49 -0.48 -0.05 0.00 0.77 0.00 0.00 66.41 66.17 2k3w h THR 5 Cb 1.31 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 68.19 2k3w h THR 5 CO 0.50 0.20 0.13 0.25 0.37 0.00 0.00 175.52 176.97 2k3w h LEU 6 N 0.75 0.76 -0.71 2.58 6.46 -1.91 -1.11 115.31 122.13 2k3w h LEU 6 Ca 0.19 -0.23 0.07 0.00 -0.12 0.00 0.00 57.88 57.79 2k3w h LEU 6 Cb 0.05 -0.20 -0.06 0.00 -0.73 0.00 0.00 40.66 39.72 2k3w h LEU 6 CO -0.03 0.80 0.39 -0.61 -0.62 0.00 0.00 178.44 178.37 2k3w h GLN 7 N 0.70 0.69 -0.69 1.25 5.75 -1.84 0.12 115.11 121.09 2k3w h GLN 7 Ca 0.16 -0.04 -0.04 0.00 -0.15 0.00 0.00 58.65 58.58 2k3w h GLN 7 Cb 0.33 -0.16 -0.03 0.00 1.07 0.00 0.00 27.48 28.69 2k3w h GLN 7 CO 0.00 0.46 0.28 0.87 -2.65 0.00 0.00 178.83 177.79 2k3w h LYS 8 N 0.71 1.02 -0.33 1.69 1.79 -0.98 -0.31 116.57 120.16 2k3w h LYS 8 Ca 0.33 -0.18 0.04 0.00 -2.18 0.00 0.00 60.65 58.66 2k3w h LYS 8 Cb 0.24 -0.17 -0.04 0.00 -1.58 0.00 0.00 32.23 30.68 2k3w h LYS 8 CO -0.20 0.84 0.10 0.00 -1.08 0.00 0.00 179.45 179.11 2k3w h ALA 9 N 1.13 0.38 -0.58 3.86 0.00 0.26 0.63 119.26 124.93 2k3w h ALA 9 Ca 0.23 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 2k3w h ALA 9 Cb 0.20 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2k3w h ALA 9 CO -0.02 -0.30 0.19 0.82 0.00 0.00 0.00 179.25 179.95 2k3w h ILE 10 N 0.24 1.24 -0.20 0.00 2.04 -0.82 -1.10 117.51 118.91 2k3w h ILE 10 Ca 0.15 -0.79 0.01 0.00 1.00 0.00 0.00 64.86 65.24 2k3w h ILE 10 Cb 0.14 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 2k3w h ILE 10 CO -0.17 0.30 0.08 -0.78 0.00 0.00 0.00 178.15 177.58 2k3w h ASP 11 N 0.81 0.12 -0.57 1.72 3.58 -0.31 0.24 116.42 122.02 2k3w h ASP 11 Ca 0.19 0.01 -0.04 0.00 0.42 0.00 0.00 57.03 57.61 2k3w h ASP 11 Cb 0.27 -0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.28 2k3w h ASP 11 CO -0.01 0.10 0.18 -0.07 -2.88 0.00 0.00 179.24 176.56 2k3w h LEU 12 N 0.19 0.83 -0.57 2.28 3.38 -0.73 -2.31 115.31 118.38 2k3w h LEU 12 Ca 0.08 -0.20 -0.11 0.00 0.09 0.00 0.00 57.88 57.74 2k3w h LEU 12 Cb 0.03 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 2k3w h LEU 12 CO -0.07 0.81 -0.07 1.62 0.09 0.00 0.00 178.44 180.83 2k3w h VAL 13 N 0.80 1.27 -0.02 1.22 3.04 -0.96 -0.86 116.25 120.73 2k3w h VAL 13 Ca 0.18 -1.23 0.02 0.00 -1.01 0.00 0.00 66.70 64.67 2k3w h VAL 13 Cb 0.28 0.90 -0.03 0.00 -2.01 0.00 0.00 31.29 30.43 2k3w h VAL 13 CO -0.01 0.44 -0.12 0.74 -1.01 0.00 0.00 177.57 177.61 2k3w h THR 14 N 0.94 0.68 -0.80 3.17 2.02 -0.29 -0.50 112.91 118.13 2k3w h THR 14 Ca 0.15 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.33 2k3w h THR 14 Cb 0.64 0.68 -0.04 0.00 -1.74 0.00 0.00 68.15 67.69 2k3w h THR 14 CO 0.04 0.00 0.47 0.50 0.37 0.00 0.00 175.52 176.90 2k3w h LYS 15 N -0.20 1.09 -0.78 6.66 3.64 -1.34 -2.06 116.57 123.59 2k3w h LYS 15 Ca 0.05 -0.10 0.14 0.00 -1.27 0.00 0.00 60.65 59.47 2k3w h LYS 15 Cb 0.27 -0.22 -0.09 0.00 -0.41 0.00 0.00 32.23 31.77 2k3w h LYS 15 CO -0.14 0.77 0.33 0.00 -2.27 0.00 0.00 179.45 178.15 2k3w h ALA 16 N 1.25 1.12 -0.69 5.00 0.00 -0.04 0.62 119.26 126.51 2k3w h ALA 16 Ca 0.28 0.11 -0.07 0.00 0.00 0.00 0.00 54.91 55.23 2k3w h ALA 16 Cb -0.03 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2k3w h ALA 16 CO -0.05 -0.18 0.14 1.79 0.00 0.00 0.00 179.25 180.94 2k3w h THR 17 N 0.48 1.26 -0.71 0.00 1.35 -0.46 -0.53 112.91 114.32 2k3w h THR 17 Ca 0.43 -1.01 -0.05 0.00 -0.55 0.00 0.00 66.41 65.23 2k3w h THR 17 Cb 0.64 0.58 -0.03 0.00 -1.73 0.00 0.00 68.15 67.61 2k3w h THR 17 CO -0.39 0.38 0.25 1.05 -0.25 0.00 0.00 175.52 176.56 2k3w h GLU 18 N 1.05 1.07 -0.49 4.72 4.11 -0.50 -1.84 114.58 122.70 2k3w h GLU 18 Ca 0.21 -0.20 -0.12 0.00 0.07 0.00 0.00 59.36 59.32 2k3w h GLU 18 Cb 0.41 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 2k3w h GLU 18 CO 0.01 0.89 -0.16 0.93 0.07 0.00 0.00 179.01 180.75 2k3w h GLU 19 N 1.04 0.96 -0.88 1.06 4.39 -0.55 -1.41 114.58 119.19 2k3w h GLU 19 Ca 0.23 -0.39 0.03 0.00 0.34 0.00 0.00 59.36 59.58 2k3w h GLU 19 Cb 0.24 -0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 28.80 2k3w h GLU 19 CO -0.01 1.06 0.57 0.22 -1.16 0.00 0.00 179.01 179.69 2k3w h ASP 20 N 0.82 0.96 -0.56 1.42 1.82 -0.71 0.71 116.42 120.88 2k3w h ASP 20 Ca 0.12 -0.01 -0.10 0.00 -0.39 0.00 0.00 57.03 56.65 2k3w h ASP 20 Cb 0.73 -0.22 -0.02 0.00 0.68 0.00 0.00 39.33 40.50 2k3w h ASP 20 CO 0.06 0.66 -0.03 0.11 -1.61 0.00 0.00 179.24 178.43 2k3w h LYS 21 N 1.12 1.02 0.00 0.28 1.57 -1.10 -1.59 116.57 117.87 2k3w h LYS 21 Ca 0.35 -0.33 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2k3w h LYS 21 Cb -0.01 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.21 2k3w h LYS 21 CO -0.11 1.02 0.00 0.00 -0.57 0.00 0.00 179.45 179.79 2k3w n ALA 22 N -2.49 2.18 -2.18 3.86 0.00 -0.53 -4.79 120.51 116.57 2k3w n ALA 22 Ca 0.03 -0.02 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 2k3w n ALA 22 Cb 0.36 -1.06 -0.01 0.00 0.00 0.00 0.00 19.45 18.74 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 -0.58 -0.97 -3.02 0.00 4.76 -0.60 -4.94 118.16 112.80 2k3w n LYS 23 Ca 0.03 0.62 -0.41 0.00 -2.87 0.00 0.00 58.31 55.67 2k3w n LYS 23 Cb 0.01 -4.79 0.00 0.00 -1.84 0.00 0.00 35.03 28.41 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 -0.32 6.22 -0.37 4.39 4.13 0.24 -4.82 115.26 124.72 2k3w n ASN 24 Ca -0.14 -3.44 0.02 0.00 1.68 0.00 0.00 54.58 52.70 2k3w n ASN 24 Cb 0.60 -1.20 0.17 0.00 -1.54 0.00 0.00 39.78 37.81 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 5.21 1.21 0.37 3.10 0.05 -1.87 0.48 116.97 125.53 2k3w h TYR 25 Ca 0.22 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 59.01 2k3w h TYR 25 Cb 0.60 -0.40 0.00 0.00 1.01 0.00 0.00 36.73 37.94 2k3w h TYR 25 CO 1.01 0.64 -0.18 0.93 -1.05 0.00 0.00 178.16 179.51 2k3w h GLU 26 N 1.20 -0.48 -0.37 4.88 4.39 -1.95 0.41 114.58 122.65 2k3w h GLU 26 Ca 0.43 0.03 -0.03 0.00 0.34 0.00 0.00 59.36 60.13 2k3w h GLU 26 Cb 0.14 0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.88 2k3w h GLU 26 CO -0.16 -0.25 0.12 1.49 -1.16 0.00 0.00 179.01 179.05 2k3w h GLU 27 N -0.62 0.57 -0.68 2.33 4.57 -1.88 -1.90 114.58 116.97 2k3w h GLU 27 Ca -0.05 -0.12 0.03 0.00 -1.18 0.00 0.00 59.36 58.03 2k3w h GLU 27 Cb 0.46 -0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 28.92 2k3w h GLU 27 CO 0.08 0.58 0.43 0.00 -1.18 0.00 0.00 179.01 178.92 2k3w h ALA 28 N 0.97 0.88 -0.44 2.92 0.00 0.01 -1.64 119.26 121.96 2k3w h ALA 28 Ca 0.12 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.01 2k3w h ALA 28 Cb 0.24 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2k3w h ALA 28 CO -0.00 0.21 0.28 1.25 0.00 0.00 0.00 179.25 180.98 2k3w h LEU 29 N 0.84 0.49 -0.64 0.00 5.85 0.11 0.20 115.31 122.17 2k3w h LEU 29 Ca 0.27 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.98 2k3w h LEU 29 Cb -0.00 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 2k3w h LEU 29 CO -0.10 0.35 0.41 0.03 -0.34 0.00 0.00 178.44 178.80 2k3w h ARG 30 N 0.58 0.85 -0.48 1.25 3.08 -0.88 -1.62 114.38 117.15 2k3w h ARG 30 Ca 0.16 -0.06 -0.11 0.00 0.07 0.00 0.00 59.98 60.04 2k3w h ARG 30 Cb -0.05 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.79 2k3w h ARG 30 CO -0.04 0.57 -0.15 -0.07 -1.07 0.00 0.00 179.97 179.21 2k3w h LEU 31 N 0.87 0.93 -0.26 3.04 3.38 -0.90 -2.09 115.31 120.29 2k3w h LEU 31 Ca 0.23 -0.32 0.01 0.00 0.09 0.00 0.00 57.88 57.90 2k3w h LEU 31 Cb -0.08 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.40 2k3w h LEU 31 CO -0.05 1.07 0.14 1.88 0.09 0.00 0.00 178.44 181.58 2k3w h TYR 32 N 0.82 0.27 -0.77 1.13 0.05 -0.12 0.28 116.97 118.64 2k3w h TYR 32 Ca 0.12 0.01 -0.05 0.00 0.05 0.00 0.00 58.73 58.86 2k3w h TYR 32 Cb 0.69 -0.08 -0.03 0.00 1.01 0.00 0.00 36.73 38.32 2k3w h TYR 32 CO 0.04 0.16 0.29 1.96 -1.05 0.00 0.00 178.16 179.56 2k3w h GLN 33 N 0.30 1.16 0.06 4.88 4.20 -1.23 -1.98 115.11 122.50 2k3w h GLN 33 Ca 0.10 -0.22 -0.00 0.00 0.06 0.00 0.00 58.65 58.59 2k3w h GLN 33 Cb 0.01 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 27.60 2k3w h GLN 33 CO -0.05 0.96 -0.03 0.45 -0.67 0.00 0.00 178.83 179.48 2k3w h HIS 34 N 1.12 -0.08 -0.49 2.96 3.86 -0.89 -2.19 115.15 119.45 2k3w h HIS 34 Ca 0.25 -0.00 0.10 0.00 -1.16 0.00 0.00 60.37 59.56 2k3w h HIS 34 Cb 0.24 0.03 -0.09 0.00 1.06 0.00 0.00 27.41 28.65 2k3w h HIS 34 CO 0.02 0.20 -0.06 0.00 0.86 0.00 0.00 177.93 178.95 2k3w h ALA 35 N 0.55 0.40 -0.72 2.45 0.00 -0.32 -0.25 119.26 121.38 2k3w h ALA 35 Ca -0.01 0.17 0.06 0.00 0.00 0.00 0.00 54.91 55.13 2k3w h ALA 35 Cb 0.31 0.31 -0.05 0.00 0.00 0.00 0.00 17.79 18.36 2k3w h ALA 35 CO 0.01 -0.42 0.42 0.28 0.00 0.00 0.00 179.25 179.55 2k3w h VAL 36 N 0.05 1.00 -0.32 0.00 2.07 -1.29 -0.70 116.25 117.07 2k3w h VAL 36 Ca 0.24 -0.27 0.06 0.00 0.82 0.00 0.00 66.70 67.55 2k3w h VAL 36 Cb 0.37 0.15 -0.05 0.00 -1.52 0.00 0.00 31.29 30.24 2k3w h VAL 36 CO -0.46 0.14 -0.00 -0.08 0.02 0.00 0.00 177.57 177.19 2k3w h GLU 37 N 0.78 0.09 -0.63 1.57 4.22 -0.41 -0.11 114.58 120.09 2k3w h GLU 37 Ca 0.32 -0.01 -0.07 0.00 0.08 0.00 0.00 59.36 59.69 2k3w h GLU 37 Cb 0.16 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 2k3w h GLU 37 CO -0.17 0.06 0.14 1.88 -2.18 0.00 0.00 179.01 178.73 2k3w h TYR 38 N 0.09 1.05 -0.14 0.92 -1.99 -0.76 -1.35 116.97 114.79 2k3w h TYR 38 Ca 0.15 -0.12 -0.00 0.00 2.00 0.00 0.00 58.73 60.76 2k3w h TYR 38 Cb 0.21 -0.30 -0.01 0.00 2.00 0.00 0.00 36.73 38.63 2k3w h TYR 38 CO -0.23 0.87 0.09 0.74 -0.00 0.00 0.00 178.16 179.63 2k3w h PHE 39 N 0.95 0.19 -0.62 4.88 0.04 -0.32 0.34 116.94 122.40 2k3w h PHE 39 Ca 0.20 -0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.92 2k3w h PHE 39 Cb 0.37 -0.06 -0.03 0.00 2.20 0.00 0.00 35.95 38.42 2k3w h PHE 39 CO 0.03 0.16 0.20 -0.07 -0.60 0.00 0.00 178.31 178.03 2k3w h LEU 40 N 0.16 0.87 -1.16 1.54 3.38 -0.89 -1.85 115.31 117.36 2k3w h LEU 40 Ca 0.05 -0.14 -0.08 0.00 0.09 0.00 0.00 57.88 57.79 2k3w h LEU 40 Cb 0.03 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 2k3w h LEU 40 CO -0.01 0.81 -0.35 -0.74 0.09 0.00 0.00 178.44 178.24 2k3w h HIS 41 N 0.91 0.13 -0.14 1.13 2.76 -0.84 -2.29 115.15 116.82 2k3w h HIS 41 Ca 0.21 -0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.31 2k3w h HIS 41 Cb 0.25 -0.03 -0.00 0.00 1.55 0.00 0.00 27.41 29.17 2k3w h HIS 41 CO 0.02 0.46 -0.06 0.00 -1.30 0.00 0.00 177.93 177.05 2k3w h ALA 42 N 1.54 0.20 -0.19 5.26 0.00 -0.12 0.47 119.26 126.42 2k3w h ALA 42 Ca 0.01 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 2k3w h ALA 42 Cb 0.68 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2k3w h ALA 42 CO 0.05 -0.01 -0.21 -0.84 0.00 0.00 0.00 179.25 178.24 2k3w h ILE 43 N -0.04 1.24 0.00 0.00 3.07 -1.38 1.05 117.51 121.45 2k3w h ILE 43 Ca 0.03 -1.09 -0.06 0.00 1.55 0.00 0.00 64.86 65.29 2k3w h ILE 43 Cb 0.53 1.33 -0.01 0.00 -0.27 0.00 0.00 36.82 38.40 2k3w h ILE 43 CO 0.02 0.34 -0.32 0.11 -1.05 0.00 0.00 178.15 177.25 2k3w h LYS 44 N 0.31 0.01 0.00 0.16 1.57 -1.34 -3.37 116.57 113.91 2k3w h LYS 44 Ca 0.05 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2k3w h LYS 44 Cb 0.55 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.87 2k3w h LYS 44 CO 0.04 1.01 -0.51 1.88 -0.57 0.00 0.00 179.45 181.30 2k3w h TYR 45 N -0.98 0.00 -3.94 -1.35 -1.99 -0.08 -3.46 116.97 105.18 2k3w h TYR 45 Ca -0.09 0.00 -0.67 0.00 2.00 0.00 0.00 58.73 59.97 2k3w h TYR 45 Cb 1.09 0.00 -0.22 0.00 2.00 0.00 0.00 36.73 39.60 2k3w h TYR 45 CO 0.23 0.00 -0.86 -1.21 -0.00 0.00 0.00 178.16 176.32 2k3w s GLU 46 N -3.18 1.38 -0.02 4.88 2.02 0.36 -5.01 118.70 119.13 2k3w s GLU 46 Ca 0.06 -1.31 -0.12 0.00 0.02 0.00 0.00 54.97 53.62 2k3w s GLU 46 Cb 0.12 -1.83 -0.05 0.00 0.10 0.00 0.00 34.13 32.46 2k3w s GLU 46 CO 0.70 0.44 0.33 0.00 0.02 0.00 0.00 175.26 176.75 2k3w s ALA 47 N -1.06 3.76 0.06 5.21 0.00 -1.26 -4.19 121.76 124.28 2k3w s ALA 47 Ca 0.13 -0.36 -0.26 0.00 0.00 0.00 0.00 51.96 51.47 2k3w s ALA 47 Cb -0.10 -2.25 0.07 0.00 0.00 0.00 0.00 23.12 20.84 2k3w s ALA 47 CO 0.06 0.53 0.61 -1.01 0.00 0.00 0.00 175.76 175.95 2k3w s HIS 48 N -1.10 -0.56 1.10 0.00 3.76 -1.26 -5.06 115.29 112.17 2k3w s HIS 48 Ca 0.22 0.63 -0.14 0.00 -0.15 0.00 0.00 55.06 55.63 2k3w s HIS 48 Cb -0.15 0.46 0.20 0.00 1.11 0.00 0.00 32.58 34.20 2k3w s HIS 48 CO 0.11 -0.73 0.70 0.43 -0.85 0.00 0.00 174.74 174.40 2k3w n SER 49 N 0.22 -1.66 0.14 1.40 7.64 -1.26 -4.67 113.62 115.42 2k3w n SER 49 Ca -0.18 -0.02 -0.14 0.00 1.01 0.00 0.00 58.87 59.54 2k3w n SER 49 Cb 0.61 -1.20 -0.08 0.00 -1.01 0.00 0.00 64.21 62.53 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 -2.30 -0.24 -0.86 6.43 3.32 -2.02 -1.74 116.42 119.00 2k3w h ASP 50 Ca -0.55 -0.05 0.20 0.00 0.02 0.00 0.00 57.03 56.65 2k3w h ASP 50 Cb 1.33 0.06 -0.06 0.00 0.22 0.00 0.00 39.33 40.88 2k3w h ASP 50 CO 0.43 -0.10 0.58 0.07 -1.72 0.00 0.00 179.24 178.50 2k3w h LYS 51 N -0.36 0.32 0.36 3.56 2.10 -1.99 0.34 116.57 120.90 2k3w h LYS 51 Ca -0.03 -0.02 -0.02 0.00 -2.00 0.00 0.00 60.65 58.58 2k3w h LYS 51 Cb 0.28 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 31.54 2k3w h LYS 51 CO 0.05 0.21 -0.17 0.00 -2.00 0.00 0.00 179.45 177.54 2k3w h ALA 52 N 1.61 -0.48 -0.32 0.07 0.00 -1.73 -1.38 119.26 117.04 2k3w h ALA 52 Ca 0.44 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 55.24 2k3w h ALA 52 Cb 1.20 0.19 -0.06 0.00 0.00 0.00 0.00 17.79 19.12 2k3w h ALA 52 CO -0.14 -0.64 -0.07 0.87 0.00 0.00 0.00 179.25 179.27 2k3w h LYS 53 N -0.74 0.01 -0.97 0.00 6.56 -0.22 0.19 116.57 121.41 2k3w h LYS 53 Ca -0.05 -0.00 0.11 0.00 -1.06 0.00 0.00 60.65 59.65 2k3w h LYS 53 Cb 0.51 -0.00 -0.08 0.00 -0.57 0.00 0.00 32.23 32.09 2k3w h LYS 53 CO 0.08 0.01 0.62 0.93 -2.06 0.00 0.00 179.45 179.02 2k3w h GLU 54 N 0.01 0.92 -0.49 3.15 3.07 -1.00 0.31 114.58 120.55 2k3w h GLU 54 Ca 0.15 -0.06 -0.02 0.00 -0.50 0.00 0.00 59.36 58.94 2k3w h GLU 54 Cb 0.23 -0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 27.91 2k3w h GLU 54 CO -0.32 0.61 0.24 1.03 -1.40 0.00 0.00 179.01 179.17 2k3w h SER 55 N 0.95 0.63 -0.26 1.42 0.87 0.17 0.16 113.55 117.48 2k3w h SER 55 Ca 0.47 -0.12 -0.06 0.00 -1.23 0.00 0.00 61.79 60.85 2k3w h SER 55 Cb 0.48 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.27 2k3w h SER 55 CO -0.23 0.57 -0.08 0.40 -0.53 0.00 0.00 176.83 176.97 2k3w h ILE 56 N 0.64 1.29 -0.57 2.23 1.08 0.16 -0.66 117.51 121.68 2k3w h ILE 56 Ca 0.17 -1.10 -0.03 0.00 -0.39 0.00 0.00 64.86 63.50 2k3w h ILE 56 Cb 0.11 1.47 -0.03 0.00 -3.07 0.00 0.00 36.82 35.30 2k3w h ILE 56 CO -0.02 0.35 0.23 0.03 -0.69 0.00 0.00 178.15 178.04 2k3w h ARG 57 N 0.25 0.82 0.03 2.37 3.08 -0.31 0.71 114.38 121.35 2k3w h ARG 57 Ca 0.06 -0.12 -0.00 0.00 0.07 0.00 0.00 59.98 59.99 2k3w h ARG 57 Cb 0.55 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.46 2k3w h ARG 57 CO 0.03 0.68 -0.02 0.00 -1.07 0.00 0.00 179.97 179.59 2k3w h ALA 58 N 1.44 -0.05 -0.37 0.04 0.00 -0.55 -2.46 119.26 117.31 2k3w h ALA 58 Ca 0.19 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 2k3w h ALA 58 Cb 0.16 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2k3w h ALA 58 CO -0.02 -0.27 -0.16 0.87 0.00 0.00 0.00 179.25 179.67 2k3w h LYS 59 N -0.56 0.69 -0.11 0.00 1.79 -0.98 -2.44 116.57 114.96 2k3w h LYS 59 Ca -0.00 -0.24 0.03 0.00 -2.18 0.00 0.00 60.65 58.25 2k3w h LYS 59 Cb 0.52 -0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 31.08 2k3w h LYS 59 CO 0.01 0.81 -0.08 0.00 -1.08 0.00 0.00 179.45 179.11 2k3w h VAL 61 N -0.09 1.01 -0.11 0.00 3.04 -1.31 -0.73 116.25 118.05 2k3w h VAL 61 Ca 0.07 -0.53 -0.07 0.00 -1.01 0.00 0.00 66.70 65.16 2k3w h VAL 61 Cb 0.19 1.29 -0.00 0.00 -2.01 0.00 0.00 31.29 30.77 2k3w h VAL 61 CO -0.17 0.15 -0.19 1.56 -1.01 0.00 0.00 177.57 177.91 2k3w h GLN 62 N 0.00 0.33 -0.15 4.17 4.20 -0.68 -1.38 115.11 121.59 2k3w h GLN 62 Ca -0.00 -0.20 -0.01 0.00 0.06 0.00 0.00 58.65 58.50 2k3w h GLN 62 Cb 0.28 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 2k3w h GLN 62 CO 0.02 0.79 0.07 1.88 -0.67 0.00 0.00 178.83 180.91 2k3w h TYR 63 N -0.10 0.22 -0.02 2.96 0.05 -0.13 -2.15 116.97 117.81 2k3w h TYR 63 Ca 0.01 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.77 2k3w h TYR 63 Cb 0.77 -0.07 -0.00 0.00 1.01 0.00 0.00 36.73 38.44 2k3w h TYR 63 CO 0.10 0.28 0.01 -0.07 -1.05 0.00 0.00 178.16 177.43 2k3w h LEU 64 N 0.10 0.02 -0.72 3.88 3.38 -1.20 -0.79 115.31 119.99 2k3w h LEU 64 Ca 0.05 -0.02 0.15 0.00 0.09 0.00 0.00 57.88 58.16 2k3w h LEU 64 Cb 0.15 -0.00 -0.11 0.00 0.09 0.00 0.00 40.66 40.79 2k3w h LEU 64 CO -0.01 0.03 0.18 -0.78 0.09 0.00 0.00 178.44 177.96 2k3w h ASP 65 N 0.01 0.03 -0.55 -0.43 3.58 -1.14 0.53 116.42 118.45 2k3w h ASP 65 Ca 0.01 0.14 -0.01 0.00 0.42 0.00 0.00 57.03 57.59 2k3w h ASP 65 Cb 0.02 0.18 -0.03 0.00 1.72 0.00 0.00 39.33 41.22 2k3w h ASP 65 CO -0.00 -0.02 0.32 0.03 -2.88 0.00 0.00 179.24 176.69 2k3w h ARG 66 N 0.28 0.76 -0.61 0.28 2.47 -0.91 -1.67 114.38 114.98 2k3w h ARG 66 Ca 0.40 -0.08 -0.02 0.00 -1.26 0.00 0.00 59.98 59.02 2k3w h ARG 66 Cb 0.67 -0.15 -0.03 0.00 -1.65 0.00 0.00 29.97 28.81 2k3w h ARG 66 CO -0.49 0.57 0.30 0.00 0.56 0.00 0.00 179.97 180.91 2k3w h ALA 67 N 1.15 1.38 0.48 0.04 0.00 0.10 -0.69 119.26 121.72 2k3w h ALA 67 Ca 0.20 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2k3w h ALA 67 Cb 0.02 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.56 2k3w h ALA 67 CO -0.03 0.49 -0.23 0.93 0.00 0.00 0.00 179.25 180.41 2k3w h GLU 68 N 0.85 -0.62 -0.66 0.00 5.08 0.58 -1.20 114.58 118.62 2k3w h GLU 68 Ca 0.21 0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.60 2k3w h GLU 68 Cb 0.08 0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 2k3w h GLU 68 CO -0.03 -0.34 0.36 1.57 -1.00 0.00 0.00 179.01 179.58 2k3w h LYS 69 N -0.80 0.91 -0.20 2.33 2.10 -1.23 0.24 116.57 119.92 2k3w h LYS 69 Ca -0.07 -0.10 0.00 0.00 -2.00 0.00 0.00 60.65 58.49 2k3w h LYS 69 Cb 0.56 -0.18 -0.01 0.00 -0.90 0.00 0.00 32.23 31.70 2k3w h LYS 69 CO 0.11 0.67 0.13 -0.07 -2.00 0.00 0.00 179.45 178.29 2k3w h LEU 70 N 0.92 0.23 -1.00 7.07 3.38 -0.99 -1.31 115.31 123.61 2k3w h LEU 70 Ca 0.23 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.16 2k3w h LEU 70 Cb 0.02 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2k3w h LEU 70 CO -0.04 0.18 -0.18 0.50 0.09 0.00 0.00 178.44 178.99 2k3w h LYS 71 N 0.27 0.00 0.45 1.13 3.64 -0.83 -2.18 116.57 119.06 2k3w h LYS 71 Ca 0.07 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 2k3w h LYS 71 Cb -0.03 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 2k3w h LYS 71 CO -0.02 0.18 -0.22 0.22 -2.27 0.00 0.00 179.45 177.35 2k3w h ASP 72 N 0.00 -0.51 0.90 4.20 3.58 0.60 -1.75 116.42 123.43 2k3w h ASP 72 Ca -0.00 -0.10 -0.16 0.00 0.42 0.00 0.00 57.03 57.19 2k3w h ASP 72 Cb 0.77 0.13 -0.02 0.00 1.72 0.00 0.00 39.33 41.93 2k3w h ASP 72 CO 0.02 -0.14 -0.78 0.10 -2.88 0.00 0.00 179.24 175.57 2k3w h TYR 73 N -0.94 0.00 -0.29 0.28 -0.00 -1.48 -3.19 116.97 111.35 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 0.57 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.29 2k3w h TYR 73 CO 0.01 0.78 0.17 -0.07 -0.00 0.00 0.00 178.16 179.05 2k3w h LEU 74 N 0.00 0.35 0.00 0.10 3.38 -1.44 -3.52 115.31 114.18 2k3w h LEU 74 Ca -0.01 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2k3w h LEU 74 Cb 1.43 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.10 2k3w h LEU 74 CO 0.10 0.30 0.00 -1.14 0.09 0.00 0.00 178.44 177.80