#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 2.40 -0.12 8.00 7.64 -1.26 -4.86 113.62 125.42 2k3w n SER 4 Ca 0.00 0.91 -0.09 0.00 1.01 0.00 0.00 58.87 60.70 2k3w n SER 4 Cb 0.00 -1.57 -0.01 0.00 -1.01 0.00 0.00 64.21 61.62 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 1.00 1.16 -0.56 0.44 2.02 -1.98 -1.38 112.91 113.62 2k3w h THR 5 Ca -0.51 -0.45 -0.06 0.00 0.77 0.00 0.00 66.41 66.17 2k3w h THR 5 Cb 1.32 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 68.47 2k3w h THR 5 CO 0.55 0.17 0.13 0.25 0.37 0.00 0.00 175.52 176.99 2k3w h LEU 6 N 0.47 0.85 -0.81 2.58 5.85 -1.91 -1.28 115.31 121.07 2k3w h LEU 6 Ca 0.13 -0.24 0.05 0.00 0.84 0.00 0.00 57.88 58.66 2k3w h LEU 6 Cb 0.10 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 40.85 2k3w h LEU 6 CO -0.02 0.87 0.50 -0.61 -0.34 0.00 0.00 178.44 178.84 2k3w h GLN 7 N 0.80 0.91 -0.65 1.25 5.75 -1.87 -0.35 115.11 120.95 2k3w h GLN 7 Ca 0.17 -0.05 -0.06 0.00 -0.15 0.00 0.00 58.65 58.56 2k3w h GLN 7 Cb 0.35 -0.21 -0.03 0.00 1.07 0.00 0.00 27.48 28.67 2k3w h GLN 7 CO 0.00 0.60 0.17 -0.22 -2.65 0.00 0.00 178.83 176.74 2k3w h LYS 8 N 0.94 1.03 -0.85 1.69 1.63 -0.90 -1.17 116.57 118.93 2k3w h LYS 8 Ca 0.34 -0.24 0.02 0.00 -0.85 0.00 0.00 60.65 59.92 2k3w h LYS 8 Cb 0.11 -0.14 -0.05 0.00 -0.60 0.00 0.00 32.23 31.55 2k3w h LYS 8 CO -0.15 0.92 0.56 0.00 -3.45 0.00 0.00 179.45 177.32 2k3w h ALA 9 N 1.07 1.10 -0.39 5.00 0.00 -0.03 -0.67 119.26 125.34 2k3w h ALA 9 Ca 0.21 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 2k3w h ALA 9 Cb 0.34 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2k3w h ALA 9 CO -0.00 0.43 -0.01 0.82 0.00 0.00 0.00 179.25 180.49 2k3w h ILE 10 N 1.11 1.26 -0.24 0.00 2.04 -0.78 -1.36 117.51 119.53 2k3w h ILE 10 Ca 0.33 -1.03 0.02 0.00 1.00 0.00 0.00 64.86 65.19 2k3w h ILE 10 Cb -0.05 1.15 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 2k3w h ILE 10 CO -0.09 0.35 0.09 -0.78 0.00 0.00 0.00 178.15 177.71 2k3w h ASP 11 N 0.52 0.11 -0.54 1.72 3.58 -0.64 0.19 116.42 121.36 2k3w h ASP 11 Ca 0.11 0.02 -0.04 0.00 0.42 0.00 0.00 57.03 57.54 2k3w h ASP 11 Cb 0.49 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.52 2k3w h ASP 11 CO 0.02 0.09 0.19 -0.07 -2.88 0.00 0.00 179.24 176.60 2k3w h LEU 12 N 0.20 0.77 -0.61 2.28 3.38 -1.05 -2.19 115.31 118.10 2k3w h LEU 12 Ca 0.10 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 57.80 2k3w h LEU 12 Cb 0.07 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 2k3w h LEU 12 CO -0.10 0.75 0.05 1.62 0.09 0.00 0.00 178.44 180.85 2k3w h VAL 13 N 0.75 1.26 -0.07 1.22 3.04 -0.97 -0.98 116.25 120.50 2k3w h VAL 13 Ca 0.18 -1.09 0.02 0.00 -1.01 0.00 0.00 66.70 64.80 2k3w h VAL 13 Cb 0.24 0.76 -0.02 0.00 -2.01 0.00 0.00 31.29 30.26 2k3w h VAL 13 CO -0.01 0.40 -0.06 0.74 -1.01 0.00 0.00 177.57 177.63 2k3w h THR 14 N 0.96 0.82 -0.86 3.17 2.02 -0.41 -1.07 112.91 117.54 2k3w h THR 14 Ca 0.18 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.37 2k3w h THR 14 Cb 0.50 0.82 -0.04 0.00 -1.74 0.00 0.00 68.15 67.69 2k3w h THR 14 CO 0.02 0.00 0.57 0.50 0.37 0.00 0.00 175.52 176.98 2k3w h LYS 15 N -0.07 1.13 -0.69 6.66 1.63 -1.26 -2.03 116.57 121.93 2k3w h LYS 15 Ca 0.05 -0.07 0.12 0.00 -0.85 0.00 0.00 60.65 59.90 2k3w h LYS 15 Cb 0.14 -0.25 -0.09 0.00 -0.60 0.00 0.00 32.23 31.43 2k3w h LYS 15 CO -0.12 0.75 0.26 0.00 -3.45 0.00 0.00 179.45 176.89 2k3w h ALA 16 N 1.31 0.93 -0.65 5.00 0.00 -0.23 -0.04 119.26 125.58 2k3w h ALA 16 Ca 0.31 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.29 2k3w h ALA 16 Cb -0.13 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 2k3w h ALA 16 CO -0.07 -0.21 0.26 1.79 0.00 0.00 0.00 179.25 181.02 2k3w h THR 17 N 0.42 1.24 -0.78 0.00 1.35 -0.53 -0.82 112.91 113.79 2k3w h THR 17 Ca 0.37 -0.74 -0.04 0.00 -0.55 0.00 0.00 66.41 65.44 2k3w h THR 17 Cb 0.51 0.51 -0.03 0.00 -1.73 0.00 0.00 68.15 67.41 2k3w h THR 17 CO -0.37 0.29 0.32 1.05 -0.25 0.00 0.00 175.52 176.57 2k3w h GLU 18 N 0.91 1.15 -0.56 4.72 4.11 -0.75 -1.88 114.58 122.27 2k3w h GLU 18 Ca 0.22 -0.20 -0.10 0.00 0.07 0.00 0.00 59.36 59.35 2k3w h GLU 18 Cb 0.21 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 2k3w h GLU 18 CO -0.02 0.92 -0.06 0.93 0.07 0.00 0.00 179.01 180.85 2k3w h GLU 19 N 1.12 1.02 -0.81 1.06 4.39 -0.67 -1.76 114.58 118.94 2k3w h GLU 19 Ca 0.26 -0.35 0.01 0.00 0.34 0.00 0.00 59.36 59.62 2k3w h GLU 19 Cb 0.19 -0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 28.72 2k3w h GLU 19 CO -0.02 1.04 0.53 0.22 -1.16 0.00 0.00 179.01 179.61 2k3w h ASP 20 N 0.92 0.93 -0.59 1.42 3.58 -0.68 0.58 116.42 122.58 2k3w h ASP 20 Ca 0.15 -0.03 -0.10 0.00 0.42 0.00 0.00 57.03 57.48 2k3w h ASP 20 Cb 0.61 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 41.41 2k3w h ASP 20 CO 0.04 0.68 -0.02 0.11 -2.88 0.00 0.00 179.24 177.16 2k3w h LYS 21 N 1.10 1.06 0.00 0.28 1.57 -0.93 -1.76 116.57 117.89 2k3w h LYS 21 Ca 0.30 -0.35 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2k3w h LYS 21 Cb -0.12 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.10 2k3w h LYS 21 CO -0.06 1.05 0.00 0.00 -0.57 0.00 0.00 179.45 179.87 2k3w n ALA 22 N -2.49 2.30 -2.19 3.86 0.00 -0.61 -4.81 120.51 116.58 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 -1.05 -0.01 0.00 0.00 0.00 0.00 19.45 18.75 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 -0.56 -0.99 -2.98 0.00 4.76 -0.66 -4.94 118.16 112.79 2k3w n LYS 23 Ca 0.02 0.62 -0.43 0.00 -2.87 0.00 0.00 58.31 55.66 2k3w n LYS 23 Cb 0.01 -4.81 0.01 0.00 -1.84 0.00 0.00 35.03 28.40 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 -0.36 6.48 -0.35 4.39 4.13 0.19 -4.81 115.26 124.92 2k3w n ASN 24 Ca -0.15 -3.43 0.02 0.00 1.68 0.00 0.00 54.58 52.70 2k3w n ASN 24 Cb 0.60 -1.27 0.16 0.00 -1.54 0.00 0.00 39.78 37.74 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 5.37 1.13 0.39 3.10 0.05 -1.88 0.52 116.97 125.66 2k3w h TYR 25 Ca 0.21 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 59.01 2k3w h TYR 25 Cb 0.60 -0.37 0.00 0.00 1.01 0.00 0.00 36.73 37.97 2k3w h TYR 25 CO 1.03 0.59 -0.19 0.93 -1.05 0.00 0.00 178.16 179.47 2k3w h GLU 26 N 1.11 -0.51 -0.32 4.88 5.08 -1.95 0.34 114.58 123.23 2k3w h GLU 26 Ca 0.41 0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.77 2k3w h GLU 26 Cb 0.16 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2k3w h GLU 26 CO -0.17 -0.30 0.06 1.49 -1.00 0.00 0.00 179.01 179.09 2k3w h GLU 27 N -0.59 0.52 -0.65 2.33 4.57 -1.87 -2.27 114.58 116.61 2k3w h GLU 27 Ca -0.05 -0.14 0.03 0.00 -1.18 0.00 0.00 59.36 58.02 2k3w h GLU 27 Cb 0.44 -0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 28.93 2k3w h GLU 27 CO 0.09 0.60 0.40 0.00 -1.18 0.00 0.00 179.01 178.92 2k3w h ALA 28 N 0.89 0.85 -0.49 2.92 0.00 0.11 -1.71 119.26 121.84 2k3w h ALA 28 Ca 0.10 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.01 2k3w h ALA 28 Cb 0.33 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 2k3w h ALA 28 CO 0.00 0.15 0.30 1.25 0.00 0.00 0.00 179.25 180.96 2k3w h LEU 29 N 0.78 0.50 -0.77 0.00 5.85 -0.13 0.18 115.31 121.72 2k3w h LEU 29 Ca 0.26 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.97 2k3w h LEU 29 Cb 0.03 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 40.91 2k3w h LEU 29 CO -0.11 0.36 0.46 0.03 -0.34 0.00 0.00 178.44 178.84 2k3w h ARG 30 N 0.61 1.05 -0.44 1.25 3.08 -0.92 -1.60 114.38 117.40 2k3w h ARG 30 Ca 0.19 -0.10 -0.13 0.00 0.07 0.00 0.00 59.98 60.01 2k3w h ARG 30 Cb -0.02 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 29.80 2k3w h ARG 30 CO -0.07 0.75 -0.25 -0.07 -1.07 0.00 0.00 179.97 179.26 2k3w h LEU 31 N 1.06 0.96 -0.10 3.04 3.38 -0.82 -2.03 115.31 120.79 2k3w h LEU 31 Ca 0.28 -0.37 0.01 0.00 0.09 0.00 0.00 57.88 57.88 2k3w h LEU 31 Cb -0.03 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 2k3w h LEU 31 CO -0.05 1.15 0.05 1.88 0.09 0.00 0.00 178.44 181.55 2k3w h TYR 32 N 0.80 0.09 -0.79 1.13 0.05 -0.20 0.28 116.97 118.33 2k3w h TYR 32 Ca 0.10 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.84 2k3w h TYR 32 Cb 0.81 -0.03 -0.04 0.00 1.01 0.00 0.00 36.73 38.49 2k3w h TYR 32 CO 0.05 0.05 0.33 1.96 -1.05 0.00 0.00 178.16 179.50 2k3w h GLN 33 N 0.11 1.17 0.01 4.88 4.20 -1.27 -2.01 115.11 122.21 2k3w h GLN 33 Ca 0.04 -0.20 -0.00 0.00 0.06 0.00 0.00 58.65 58.55 2k3w h GLN 33 Cb 0.01 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 27.59 2k3w h GLN 33 CO -0.03 0.94 -0.01 0.45 -0.67 0.00 0.00 178.83 179.51 2k3w h HIS 34 N 1.14 -0.02 -0.46 2.96 3.86 -1.00 -2.21 115.15 119.42 2k3w h HIS 34 Ca 0.27 -0.00 0.09 0.00 -1.16 0.00 0.00 60.37 59.57 2k3w h HIS 34 Cb 0.19 0.01 -0.08 0.00 1.06 0.00 0.00 27.41 28.59 2k3w h HIS 34 CO 0.02 0.25 -0.05 0.00 0.86 0.00 0.00 177.93 179.01 2k3w h ALA 35 N 0.69 0.38 -0.74 2.45 0.00 -0.30 -0.67 119.26 121.08 2k3w h ALA 35 Ca -0.00 0.15 0.05 0.00 0.00 0.00 0.00 54.91 55.11 2k3w h ALA 35 Cb 0.28 0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 2k3w h ALA 35 CO 0.00 -0.41 0.44 0.28 0.00 0.00 0.00 179.25 179.56 2k3w h VAL 36 N 0.06 1.03 -0.25 0.00 2.07 -1.30 -0.72 116.25 117.14 2k3w h VAL 36 Ca 0.23 -0.28 0.05 0.00 0.82 0.00 0.00 66.70 67.51 2k3w h VAL 36 Cb 0.35 0.13 -0.05 0.00 -1.52 0.00 0.00 31.29 30.20 2k3w h VAL 36 CO -0.42 0.15 -0.07 -0.08 0.02 0.00 0.00 177.57 177.17 2k3w h GLU 37 N 0.83 -0.01 -0.59 1.57 4.57 -0.49 0.21 114.58 120.66 2k3w h GLU 37 Ca 0.32 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.44 2k3w h GLU 37 Cb 0.13 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.69 2k3w h GLU 37 CO -0.16 -0.01 0.14 1.88 -1.18 0.00 0.00 179.01 179.68 2k3w h TYR 38 N -0.01 0.96 -0.05 0.92 -1.99 -0.89 -1.31 116.97 114.58 2k3w h TYR 38 Ca 0.12 -0.10 0.00 0.00 2.00 0.00 0.00 58.73 60.75 2k3w h TYR 38 Cb 0.20 -0.28 -0.00 0.00 2.00 0.00 0.00 36.73 38.65 2k3w h TYR 38 CO -0.26 0.80 0.03 0.74 -0.00 0.00 0.00 178.16 179.47 2k3w h PHE 39 N 0.88 0.07 -0.50 4.88 0.04 -0.25 0.12 116.94 122.18 2k3w h PHE 39 Ca 0.19 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.92 2k3w h PHE 39 Cb 0.33 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.43 2k3w h PHE 39 CO 0.02 0.07 0.16 -0.07 -0.60 0.00 0.00 178.31 177.89 2k3w h LEU 40 N 0.05 0.68 -1.06 1.54 3.38 -0.81 -1.56 115.31 117.53 2k3w h LEU 40 Ca 0.02 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 57.82 2k3w h LEU 40 Cb 0.02 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2k3w h LEU 40 CO -0.00 0.65 -0.36 -0.74 0.09 0.00 0.00 178.44 178.07 2k3w h HIS 41 N 0.72 0.00 -0.07 1.13 2.76 -0.75 -2.34 115.15 116.60 2k3w h HIS 41 Ca 0.17 0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.30 2k3w h HIS 41 Cb 0.21 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.17 2k3w h HIS 41 CO 0.01 0.36 -0.12 0.00 -1.30 0.00 0.00 177.93 176.88 2k3w h ALA 42 N 1.64 0.10 -0.11 5.26 0.00 0.23 0.14 119.26 126.53 2k3w h ALA 42 Ca -0.00 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.48 2k3w h ALA 42 Cb 0.82 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 2k3w h ALA 42 CO 0.05 -0.02 -0.37 -0.84 0.00 0.00 0.00 179.25 178.06 2k3w h ILE 43 N -0.28 1.29 0.00 0.00 3.07 -1.44 0.54 117.51 120.69 2k3w h ILE 43 Ca 0.00 -1.42 -0.03 0.00 1.55 0.00 0.00 64.86 64.97 2k3w h ILE 43 Cb 0.68 1.62 -0.00 0.00 -0.27 0.00 0.00 36.82 38.85 2k3w h ILE 43 CO 0.03 0.42 -0.15 0.11 -1.05 0.00 0.00 178.15 177.51 2k3w h LYS 44 N 0.19 0.00 0.00 0.16 1.57 -1.43 -3.37 116.57 113.70 2k3w h LYS 44 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2k3w h LYS 44 Cb 0.75 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.06 2k3w h LYS 44 CO 0.06 0.88 -0.31 0.66 -0.57 0.00 0.00 179.45 180.16 2k3w n TYR 45 N -4.61 0.63 -4.48 -1.35 4.02 0.50 -4.87 117.16 107.00 2k3w n TYR 45 Ca -0.11 0.18 -0.24 0.00 -0.01 0.00 0.00 57.90 57.72 2k3w n TYR 45 Cb 0.45 -0.73 -0.10 0.00 -0.02 0.00 0.00 39.34 38.93 2k3w n TYR 45 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 2k3w s GLU 46 N -3.11 1.68 0.09 -0.72 0.41 0.19 -5.02 118.70 112.21 2k3w s GLU 46 Ca 0.09 -1.85 0.05 0.00 -0.41 0.00 0.00 54.97 52.85 2k3w s GLU 46 Cb 0.14 -1.45 -0.04 0.00 -1.78 0.00 0.00 34.13 31.00 2k3w s GLU 46 CO 0.65 0.11 0.00 0.00 -0.49 0.00 0.00 175.26 175.54 2k3w s ALA 47 N -2.79 3.31 0.29 5.21 0.00 -1.26 -4.36 121.76 122.15 2k3w s ALA 47 Ca 0.31 -1.11 -0.12 0.00 0.00 0.00 0.00 51.96 51.03 2k3w s ALA 47 Cb 0.02 -1.20 0.05 0.00 0.00 0.00 0.00 23.12 21.99 2k3w s ALA 47 CO 0.14 0.70 0.64 0.72 0.00 0.00 0.00 175.76 177.96 2k3w n HIS 48 N 0.55 -1.96 -1.86 0.00 8.25 -1.26 -5.04 115.22 113.90 2k3w n HIS 48 Ca -0.11 -1.39 -0.30 0.00 -0.26 0.00 0.00 57.72 55.67 2k3w n HIS 48 Cb 0.52 0.69 0.16 0.00 1.12 0.00 0.00 29.99 32.48 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 -2.64 3.48 -0.01 0.41 0.01 -1.26 -4.86 113.70 108.83 2k3w s SER 49 Ca 0.13 0.48 -0.23 0.00 1.31 0.00 0.00 55.95 57.64 2k3w s SER 49 Cb -0.04 -0.70 -0.15 0.00 0.21 0.00 0.00 66.02 65.33 2k3w s SER 49 CO 0.09 -2.52 1.09 -2.24 0.41 0.00 0.00 173.24 170.06 2k3w h ASP 50 N -1.49 -0.36 -0.25 2.44 2.03 -2.02 -1.40 116.42 115.36 2k3w h ASP 50 Ca -0.45 -0.18 0.07 0.00 -0.73 0.00 0.00 57.03 55.74 2k3w h ASP 50 Cb 1.27 0.09 -0.01 0.00 -0.83 0.00 0.00 39.33 39.86 2k3w h ASP 50 CO 0.48 0.05 0.22 0.11 -1.03 0.00 0.00 179.24 179.07 2k3w h LYS 51 N -0.86 0.00 0.31 4.15 1.57 -1.98 -0.22 116.57 119.54 2k3w h LYS 51 Ca -0.04 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 2k3w h LYS 51 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.84 2k3w h LYS 51 CO 0.07 0.00 -0.15 0.00 -0.57 0.00 0.00 179.45 178.80 2k3w h ALA 52 N 1.80 -0.42 -0.34 3.86 0.00 -1.88 -1.08 119.26 121.20 2k3w h ALA 52 Ca 0.12 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.88 2k3w h ALA 52 Cb 0.56 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 2k3w h ALA 52 CO -0.00 -0.54 0.09 0.87 0.00 0.00 0.00 179.25 179.68 2k3w h LYS 53 N -0.83 0.22 -0.73 0.00 6.56 -0.31 -0.50 116.57 120.98 2k3w h LYS 53 Ca -0.04 -0.01 0.08 0.00 -1.06 0.00 0.00 60.65 59.61 2k3w h LYS 53 Cb 0.52 -0.05 -0.05 0.00 -0.57 0.00 0.00 32.23 32.08 2k3w h LYS 53 CO 0.07 0.14 0.48 0.93 -2.06 0.00 0.00 179.45 179.02 2k3w h GLU 54 N 0.22 0.69 -0.54 3.15 5.08 -1.10 0.77 114.58 122.86 2k3w h GLU 54 Ca 0.16 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.42 2k3w h GLU 54 Cb 0.15 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 2k3w h GLU 54 CO -0.18 0.46 0.13 0.77 -1.00 0.00 0.00 179.01 179.19 2k3w h SER 55 N 0.71 0.81 -0.18 1.42 0.02 0.24 -0.12 113.55 116.45 2k3w h SER 55 Ca 0.33 -0.23 -0.05 0.00 -0.84 0.00 0.00 61.79 61.00 2k3w h SER 55 Cb 0.35 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 62.67 2k3w h SER 55 CO -0.11 0.83 -0.08 0.40 -1.14 0.00 0.00 176.83 176.72 2k3w h ILE 56 N 0.75 1.31 0.89 3.27 1.08 -0.17 -1.18 117.51 123.46 2k3w h ILE 56 Ca 0.17 -1.12 -0.04 0.00 -0.39 0.00 0.00 64.86 63.47 2k3w h ILE 56 Cb 0.33 1.68 0.01 0.00 -3.07 0.00 0.00 36.82 35.77 2k3w h ILE 56 CO 0.00 0.33 -0.43 0.03 -0.69 0.00 0.00 178.15 177.40 2k3w h ARG 57 N 0.05 -1.15 -0.34 2.37 3.08 -0.83 0.70 114.38 118.26 2k3w h ARG 57 Ca 0.04 0.08 0.07 0.00 0.07 0.00 0.00 59.98 60.24 2k3w h ARG 57 Cb 0.56 0.26 -0.07 0.00 0.08 0.00 0.00 29.97 30.80 2k3w h ARG 57 CO 0.02 -0.77 -0.13 0.00 -1.07 0.00 0.00 179.97 178.03 2k3w h ALA 58 N -1.10 0.16 -0.63 0.04 0.00 -1.09 -1.11 119.26 115.53 2k3w h ALA 58 Ca -0.12 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2k3w h ALA 58 Cb 0.92 0.34 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 2k3w h ALA 58 CO 0.20 -0.51 0.30 0.87 0.00 0.00 0.00 179.25 180.12 2k3w h LYS 59 N -0.07 0.91 -0.98 0.00 1.79 -1.13 -2.16 116.57 114.94 2k3w h LYS 59 Ca 0.17 -0.13 0.15 0.00 -2.18 0.00 0.00 60.65 58.66 2k3w h LYS 59 Cb 0.33 -0.16 -0.10 0.00 -1.58 0.00 0.00 32.23 30.72 2k3w h LYS 59 CO -0.39 0.73 0.59 0.00 -1.08 0.00 0.00 179.45 179.30 2k3w h VAL 61 N 0.84 1.18 -0.45 0.00 2.07 -0.63 0.21 116.25 119.47 2k3w h VAL 61 Ca 0.53 -0.56 0.06 0.00 0.82 0.00 0.00 66.70 67.54 2k3w h VAL 61 Cb 0.68 1.25 -0.05 0.00 -1.52 0.00 0.00 31.29 31.65 2k3w h VAL 61 CO -0.33 0.17 0.17 1.56 0.02 0.00 0.00 177.57 179.16 2k3w h GLN 62 N 0.09 0.33 0.06 1.57 4.20 -0.48 0.43 115.11 121.32 2k3w h GLN 62 Ca 0.05 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.74 2k3w h GLN 62 Cb 0.22 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.93 2k3w h GLN 62 CO -0.00 0.22 -0.03 1.88 -0.67 0.00 0.00 178.83 180.23 2k3w h TYR 63 N 0.34 -0.08 -0.15 2.96 0.05 -0.74 -2.02 116.97 117.33 2k3w h TYR 63 Ca 0.21 -0.00 0.01 0.00 0.05 0.00 0.00 58.73 59.00 2k3w h TYR 63 Cb 0.20 0.03 -0.01 0.00 1.01 0.00 0.00 36.73 37.96 2k3w h TYR 63 CO -0.15 0.08 0.08 -0.07 -1.05 0.00 0.00 178.16 177.05 2k3w h LEU 64 N -0.23 0.13 -0.64 3.88 3.38 -0.58 -1.04 115.31 120.22 2k3w h LEU 64 Ca -0.01 0.00 0.12 0.00 0.09 0.00 0.00 57.88 58.09 2k3w h LEU 64 Cb 0.20 -0.02 -0.09 0.00 0.09 0.00 0.00 40.66 40.83 2k3w h LEU 64 CO 0.01 0.10 0.14 -0.78 0.09 0.00 0.00 178.44 178.00 2k3w h ASP 65 N 0.17 0.01 -0.49 -0.43 3.58 -0.07 0.43 116.42 119.62 2k3w h ASP 65 Ca 0.06 0.12 0.01 0.00 0.42 0.00 0.00 57.03 57.64 2k3w h ASP 65 Cb 0.00 0.16 -0.03 0.00 1.72 0.00 0.00 39.33 41.19 2k3w h ASP 65 CO -0.03 0.00 0.32 0.03 -2.88 0.00 0.00 179.24 176.68 2k3w h ARG 66 N 0.27 0.63 -0.93 0.28 2.47 -0.88 -1.73 114.38 114.49 2k3w h ARG 66 Ca 0.34 -0.04 -0.00 0.00 -1.26 0.00 0.00 59.98 59.02 2k3w h ARG 66 Cb 0.52 -0.14 -0.05 0.00 -1.65 0.00 0.00 29.97 28.66 2k3w h ARG 66 CO -0.43 0.41 0.56 0.00 0.56 0.00 0.00 179.97 181.08 2k3w h ALA 67 N 1.19 1.24 0.50 0.04 0.00 0.47 -0.15 119.26 122.55 2k3w h ALA 67 Ca 0.18 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2k3w h ALA 67 Cb -0.06 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.36 2k3w h ALA 67 CO -0.05 0.66 -0.25 0.93 0.00 0.00 0.00 179.25 180.54 2k3w h GLU 68 N 1.29 -0.66 -0.66 0.00 4.39 0.41 -0.62 114.58 118.73 2k3w h GLU 68 Ca 0.33 0.04 -0.02 0.00 0.34 0.00 0.00 59.36 60.06 2k3w h GLU 68 Cb -0.06 0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 28.71 2k3w h GLU 68 CO -0.06 -0.44 0.33 1.57 -1.16 0.00 0.00 179.01 179.25 2k3w h LYS 69 N -0.68 0.92 -0.11 2.33 2.10 -1.19 0.26 116.57 120.19 2k3w h LYS 69 Ca -0.07 -0.11 0.01 0.00 -2.00 0.00 0.00 60.65 58.48 2k3w h LYS 69 Cb 0.53 -0.18 -0.01 0.00 -0.90 0.00 0.00 32.23 31.67 2k3w h LYS 69 CO 0.11 0.70 0.04 -0.07 -2.00 0.00 0.00 179.45 178.22 2k3w h LEU 70 N 0.92 0.05 -0.99 7.07 3.38 -0.73 -1.34 115.31 123.68 2k3w h LEU 70 Ca 0.23 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.17 2k3w h LEU 70 Cb 0.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2k3w h LEU 70 CO -0.03 0.05 -0.20 0.50 0.09 0.00 0.00 178.44 178.84 2k3w h LYS 71 N 0.10 0.00 0.49 1.13 3.64 -0.76 -2.15 116.57 119.02 2k3w h LYS 71 Ca 0.05 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.40 2k3w h LYS 71 Cb 0.02 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.85 2k3w h LYS 71 CO -0.05 0.20 -0.24 0.22 -2.27 0.00 0.00 179.45 177.31 2k3w h ASP 72 N 0.00 -0.56 1.05 4.20 3.58 0.61 -2.10 116.42 123.20 2k3w h ASP 72 Ca -0.00 -0.07 -0.16 0.00 0.42 0.00 0.00 57.03 57.21 2k3w h ASP 72 Cb 0.79 0.15 -0.02 0.00 1.72 0.00 0.00 39.33 41.96 2k3w h ASP 72 CO 0.03 -0.21 -0.77 0.10 -2.88 0.00 0.00 179.24 175.50 2k3w h TYR 73 N -0.95 0.00 -0.06 0.28 -0.00 -1.47 -3.25 116.97 111.52 2k3w h TYR 73 Ca -0.07 0.00 -0.00 0.00 0.00 0.00 0.00 58.73 58.66 2k3w h TYR 73 Cb 0.60 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.33 2k3w h TYR 73 CO 0.01 0.77 0.04 -0.07 -0.00 0.00 0.00 178.16 178.90 2k3w h LEU 74 N 0.00 0.07 0.00 0.10 3.38 -1.43 -3.52 115.31 113.91 2k3w h LEU 74 Ca -0.01 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2k3w h LEU 74 Cb 1.50 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.23 2k3w h LEU 74 CO 0.10 0.09 0.00 -1.14 0.09 0.00 0.00 178.44 177.58