#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 4.32 0.19 8.00 0.15 -1.26 -4.82 113.70 120.28 2k3w s SER 4 Ca 0.00 2.13 -0.11 0.00 0.70 0.00 0.00 55.95 58.67 2k3w s SER 4 Cb 0.00 -2.56 0.12 0.00 -1.71 0.00 0.00 66.02 61.86 2k3w s SER 4 CO 0.00 -2.17 1.82 0.74 1.20 0.00 0.00 173.24 174.83 2k3w h THR 5 N -0.59 1.20 -0.40 6.45 2.02 -1.99 -0.76 112.91 118.84 2k3w h THR 5 Ca -0.46 -0.48 -0.05 0.00 0.77 0.00 0.00 66.41 66.19 2k3w h THR 5 Cb 1.27 0.30 -0.02 0.00 -1.74 0.00 0.00 68.15 67.96 2k3w h THR 5 CO 0.50 0.22 0.04 0.25 0.37 0.00 0.00 175.52 176.90 2k3w h LEU 6 N 0.92 0.65 -0.46 2.58 7.12 -1.92 -0.83 115.31 123.38 2k3w h LEU 6 Ca 0.24 -0.28 -0.00 0.00 0.13 0.00 0.00 57.88 57.97 2k3w h LEU 6 Cb 0.00 -0.17 -0.02 0.00 -0.53 0.00 0.00 40.66 39.94 2k3w h LEU 6 CO -0.04 0.77 0.27 -0.61 -0.13 0.00 0.00 178.44 178.70 2k3w h GLN 7 N 0.52 0.63 -0.55 1.25 5.75 -1.85 -1.28 115.11 119.58 2k3w h GLN 7 Ca 0.12 -0.06 -0.04 0.00 -0.15 0.00 0.00 58.65 58.52 2k3w h GLN 7 Cb 0.40 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 28.80 2k3w h GLN 7 CO 0.01 0.47 0.17 -0.22 -2.65 0.00 0.00 178.83 176.61 2k3w h LYS 8 N 0.61 0.85 -0.67 1.69 3.64 -1.03 -1.45 116.57 120.20 2k3w h LYS 8 Ca 0.16 -0.18 0.06 0.00 -1.27 0.00 0.00 60.65 59.42 2k3w h LYS 8 Cb 0.01 -0.12 -0.06 0.00 -0.41 0.00 0.00 32.23 31.65 2k3w h LYS 8 CO -0.03 0.77 0.38 0.00 -2.27 0.00 0.00 179.45 178.30 2k3w h ALA 9 N 1.04 0.90 -0.68 5.00 0.00 -0.76 -0.44 119.26 124.32 2k3w h ALA 9 Ca 0.18 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 2k3w h ALA 9 Cb 0.28 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2k3w h ALA 9 CO -0.01 0.05 0.30 0.82 0.00 0.00 0.00 179.25 180.41 2k3w h ILE 10 N 0.69 1.24 -0.36 0.00 2.04 -0.91 -2.07 117.51 118.14 2k3w h ILE 10 Ca 0.30 -0.70 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 2k3w h ILE 10 Cb 0.19 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 36.69 2k3w h ILE 10 CO -0.18 0.28 0.20 -0.78 0.00 0.00 0.00 178.15 177.67 2k3w h ASP 11 N 0.95 0.45 -0.42 1.72 3.58 -0.22 0.50 116.42 122.98 2k3w h ASP 11 Ca 0.23 -0.08 -0.02 0.00 0.42 0.00 0.00 57.03 57.57 2k3w h ASP 11 Cb 0.17 -0.11 -0.02 0.00 1.72 0.00 0.00 39.33 41.09 2k3w h ASP 11 CO -0.02 0.40 0.18 -0.07 -2.88 0.00 0.00 179.24 176.85 2k3w h LEU 12 N 0.46 0.57 -0.71 2.28 3.38 -0.92 -2.04 115.31 118.32 2k3w h LEU 12 Ca 0.13 -0.15 -0.13 0.00 0.09 0.00 0.00 57.88 57.81 2k3w h LEU 12 Cb 0.05 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2k3w h LEU 12 CO -0.02 0.56 -0.45 1.62 0.09 0.00 0.00 178.44 180.24 2k3w h VAL 13 N 0.53 1.32 -0.10 1.22 3.04 -1.29 -1.39 116.25 119.59 2k3w h VAL 13 Ca 0.14 -1.64 0.02 0.00 -1.01 0.00 0.00 66.70 64.21 2k3w h VAL 13 Cb 0.17 1.67 -0.02 0.00 -2.01 0.00 0.00 31.29 31.10 2k3w h VAL 13 CO -0.01 0.51 -0.02 0.74 -1.01 0.00 0.00 177.57 177.77 2k3w h THR 14 N 0.36 0.91 -0.76 3.17 2.02 -0.62 -0.43 112.91 117.55 2k3w h THR 14 Ca 0.02 -0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.16 2k3w h THR 14 Cb 0.94 0.90 -0.03 0.00 -1.74 0.00 0.00 68.15 68.21 2k3w h THR 14 CO 0.08 0.00 0.32 0.50 0.37 0.00 0.00 175.52 176.79 2k3w h LYS 15 N 0.01 1.14 -0.81 6.66 3.64 -1.29 -2.26 116.57 123.65 2k3w h LYS 15 Ca 0.05 -0.20 0.13 0.00 -1.27 0.00 0.00 60.65 59.36 2k3w h LYS 15 Cb 0.07 -0.19 -0.09 0.00 -0.41 0.00 0.00 32.23 31.61 2k3w h LYS 15 CO -0.10 0.92 0.40 0.00 -2.27 0.00 0.00 179.45 178.40 2k3w h ALA 16 N 1.16 1.18 -0.46 5.00 0.00 -0.27 0.13 119.26 126.00 2k3w h ALA 16 Ca 0.26 0.08 -0.09 0.00 0.00 0.00 0.00 54.91 55.16 2k3w h ALA 16 Cb 0.20 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2k3w h ALA 16 CO -0.02 -0.09 -0.07 1.79 0.00 0.00 0.00 179.25 180.86 2k3w h THR 17 N 0.60 1.25 -0.58 0.00 1.35 -0.56 0.58 112.91 115.56 2k3w h THR 17 Ca 0.43 -1.12 -0.08 0.00 -0.55 0.00 0.00 66.41 65.09 2k3w h THR 17 Cb 0.57 0.97 -0.02 0.00 -1.73 0.00 0.00 68.15 67.94 2k3w h THR 17 CO -0.34 0.39 0.07 1.05 -0.25 0.00 0.00 175.52 176.43 2k3w h GLU 18 N 0.74 0.98 -0.55 4.72 4.11 -0.52 -1.90 114.58 122.17 2k3w h GLU 18 Ca 0.13 -0.28 -0.08 0.00 0.07 0.00 0.00 59.36 59.20 2k3w h GLU 18 Cb 0.55 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 2k3w h GLU 18 CO 0.03 0.95 0.02 0.93 0.07 0.00 0.00 179.01 181.01 2k3w h GLU 19 N 0.88 0.96 -0.87 1.06 4.39 -0.46 -0.97 114.58 119.56 2k3w h GLU 19 Ca 0.17 -0.29 0.03 0.00 0.34 0.00 0.00 59.36 59.61 2k3w h GLU 19 Cb 0.46 -0.09 -0.05 0.00 -0.10 0.00 0.00 28.75 28.97 2k3w h GLU 19 CO 0.02 0.96 0.56 0.22 -1.16 0.00 0.00 179.01 179.60 2k3w h ASP 20 N 0.84 0.93 -0.52 1.42 1.82 -0.66 0.46 116.42 120.71 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 0.51 -0.21 -0.02 0.00 0.68 0.00 0.00 39.33 40.29 2k3w h ASP 20 CO 0.02 0.63 -0.03 0.11 -1.61 0.00 0.00 179.24 178.37 2k3w h LYS 21 N 1.08 0.97 -0.25 0.28 1.57 -1.00 -1.86 116.57 117.37 2k3w h LYS 21 Ca 0.35 -0.31 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2k3w h LYS 21 Cb 0.01 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.24 2k3w h LYS 21 CO -0.12 0.97 0.00 0.00 -0.57 0.00 0.00 179.45 179.73 2k3w n ALA 22 N -2.48 2.12 -2.34 3.86 0.00 -0.40 -4.77 120.51 116.50 2k3w n ALA 22 Ca 0.03 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.30 2k3w n ALA 22 Cb 0.35 -1.00 -0.01 0.00 0.00 0.00 0.00 19.45 18.79 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 -0.26 -1.42 -3.05 0.00 4.76 -0.70 -4.93 118.16 112.56 2k3w n LYS 23 Ca 0.00 0.78 -0.40 0.00 -2.87 0.00 0.00 58.31 55.82 2k3w n LYS 23 Cb 0.06 -5.18 -0.01 0.00 -1.84 0.00 0.00 35.03 28.06 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 -1.11 5.99 -0.19 4.39 4.13 0.15 -4.84 115.26 123.77 2k3w n ASN 24 Ca -0.19 -3.45 -0.03 0.00 1.68 0.00 0.00 54.58 52.59 2k3w n ASN 24 Cb 0.64 -1.14 0.07 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 5.06 0.54 0.36 3.10 0.05 -1.86 0.33 116.97 124.55 2k3w h TYR 25 Ca 0.22 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 59.01 2k3w h TYR 25 Cb 0.60 -0.16 0.00 0.00 1.01 0.00 0.00 36.73 38.18 2k3w h TYR 25 CO 0.98 0.25 -0.17 0.93 -1.05 0.00 0.00 178.16 179.10 2k3w h GLU 26 N 0.56 -0.47 -0.38 4.88 5.08 -1.95 0.14 114.58 122.43 2k3w h GLU 26 Ca 0.25 0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.62 2k3w h GLU 26 Cb 0.17 0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 2k3w h GLU 26 CO -0.18 -0.29 0.15 1.49 -1.00 0.00 0.00 179.01 179.19 2k3w h GLU 27 N -0.52 0.57 -0.81 2.33 4.81 -1.90 -2.25 114.58 116.81 2k3w h GLU 27 Ca -0.05 -0.10 0.06 0.00 -0.13 0.00 0.00 59.36 59.13 2k3w h GLU 27 Cb 0.40 -0.09 -0.06 0.00 0.63 0.00 0.00 28.75 29.62 2k3w h GLU 27 CO 0.08 0.54 0.50 0.00 -0.73 0.00 0.00 179.01 179.40 2k3w h ALA 28 N 1.00 1.10 -0.34 2.92 0.00 -0.25 -1.76 119.26 121.93 2k3w h ALA 28 Ca 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2k3w h ALA 28 Cb 0.19 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2k3w h ALA 28 CO -0.01 0.24 0.22 1.25 0.00 0.00 0.00 179.25 180.95 2k3w h LEU 29 N 0.92 0.38 -0.59 0.00 6.46 -0.34 0.21 115.31 122.34 2k3w h LEU 29 Ca 0.35 -0.01 0.02 0.00 -0.12 0.00 0.00 57.88 58.12 2k3w h LEU 29 Cb 0.14 -0.09 -0.04 0.00 -0.73 0.00 0.00 40.66 39.94 2k3w h LEU 29 CO -0.16 0.27 0.37 0.03 -0.62 0.00 0.00 178.44 178.33 2k3w h ARG 30 N 0.45 0.72 -0.63 1.25 -0.00 -0.86 -1.38 114.38 113.93 2k3w h ARG 30 Ca 0.12 -0.04 -0.07 0.00 -0.50 0.00 0.00 59.98 59.49 2k3w h ARG 30 Cb -0.05 -0.16 -0.02 0.00 0.00 0.00 0.00 29.97 29.74 2k3w h ARG 30 CO -0.03 0.48 0.11 -0.07 0.00 0.00 0.00 179.97 180.46 2k3w h LEU 31 N 0.74 0.99 -0.19 3.04 3.38 -0.85 -1.85 115.31 120.58 2k3w h LEU 31 Ca 0.23 -0.26 0.01 0.00 0.09 0.00 0.00 57.88 57.95 2k3w h LEU 31 Cb -0.01 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 2k3w h LEU 31 CO -0.08 1.00 0.11 1.88 0.09 0.00 0.00 178.44 181.43 2k3w h TYR 32 N 0.95 0.20 -0.47 1.13 0.05 -0.06 0.42 116.97 119.19 2k3w h TYR 32 Ca 0.19 0.01 -0.03 0.00 0.05 0.00 0.00 58.73 58.95 2k3w h TYR 32 Cb 0.42 -0.07 -0.02 0.00 1.01 0.00 0.00 36.73 38.08 2k3w h TYR 32 CO 0.03 0.12 0.18 1.96 -1.05 0.00 0.00 178.16 179.41 2k3w h GLN 33 N 0.23 0.70 -0.06 4.88 4.20 -1.18 -1.79 115.11 122.09 2k3w h GLN 33 Ca 0.07 -0.13 -0.00 0.00 0.06 0.00 0.00 58.65 58.65 2k3w h GLN 33 Cb -0.01 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 27.66 2k3w h GLN 33 CO -0.03 0.64 0.04 0.45 -0.67 0.00 0.00 178.83 179.25 2k3w h HIS 34 N 0.61 0.08 -0.60 2.96 3.86 -1.10 -1.97 115.15 118.99 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 0.20 -0.03 -0.06 0.00 1.06 0.00 0.00 27.41 28.59 2k3w h HIS 34 CO 0.00 0.09 0.28 0.00 0.86 0.00 0.00 177.93 179.16 2k3w h ALA 35 N 0.98 0.79 -0.61 2.45 0.00 -0.79 -1.38 119.26 120.71 2k3w h ALA 35 Ca 0.02 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.02 2k3w h ALA 35 Cb 0.03 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 2k3w h ALA 35 CO -0.00 -0.10 0.35 0.28 0.00 0.00 0.00 179.25 179.78 2k3w h VAL 36 N 0.51 1.01 -0.31 0.00 2.07 -1.02 0.09 116.25 118.59 2k3w h VAL 36 Ca 0.29 -0.23 0.06 0.00 0.82 0.00 0.00 66.70 67.64 2k3w h VAL 36 Cb 0.27 0.28 -0.05 0.00 -1.52 0.00 0.00 31.29 30.27 2k3w h VAL 36 CO -0.24 0.12 -0.02 -0.08 0.02 0.00 0.00 177.57 177.38 2k3w h GLU 37 N 0.67 0.07 -0.80 1.57 4.57 -0.51 0.52 114.58 120.68 2k3w h GLU 37 Ca 0.26 -0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.40 2k3w h GLU 37 Cb 0.11 -0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 28.65 2k3w h GLU 37 CO -0.15 0.04 0.34 1.88 -1.18 0.00 0.00 179.01 179.95 2k3w h TYR 38 N 0.07 1.19 -0.01 0.92 0.05 -0.75 0.50 116.97 118.93 2k3w h TYR 38 Ca 0.15 -0.08 -0.00 0.00 0.05 0.00 0.00 58.73 58.85 2k3w h TYR 38 Cb 0.21 -0.36 -0.00 0.00 1.01 0.00 0.00 36.73 37.59 2k3w h TYR 38 CO -0.24 0.89 0.00 0.74 -1.05 0.00 0.00 178.16 178.50 2k3w h PHE 39 N 1.15 0.01 -0.70 4.88 0.04 -0.08 0.11 116.94 122.35 2k3w h PHE 39 Ca 0.27 -0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.99 2k3w h PHE 39 Cb 0.18 -0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.30 2k3w h PHE 39 CO 0.02 0.07 0.26 -0.07 -0.60 0.00 0.00 178.31 177.99 2k3w h LEU 40 N -0.05 0.98 -1.10 1.54 3.38 -0.76 -2.06 115.31 117.25 2k3w h LEU 40 Ca 0.00 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.75 2k3w h LEU 40 Cb 0.06 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 2k3w h LEU 40 CO -0.00 0.90 0.24 -0.74 0.09 0.00 0.00 178.44 178.94 2k3w h HIS 41 N 1.01 0.89 -0.24 1.13 2.76 -0.61 -2.34 115.15 117.74 2k3w h HIS 41 Ca 0.23 -0.05 -0.03 0.00 -2.20 0.00 0.00 60.37 58.32 2k3w h HIS 41 Cb 0.24 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 28.92 2k3w h HIS 41 CO 0.02 0.68 0.04 0.00 -1.30 0.00 0.00 177.93 177.37 2k3w h ALA 42 N 1.40 0.32 -0.36 5.26 0.00 -0.10 0.98 119.26 126.76 2k3w h ALA 42 Ca 0.21 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 2k3w h ALA 42 Cb 0.17 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2k3w h ALA 42 CO -0.02 0.00 0.02 -0.84 0.00 0.00 0.00 179.25 178.41 2k3w h ILE 43 N 0.21 1.20 0.07 0.00 3.07 -1.28 1.50 117.51 122.28 2k3w h ILE 43 Ca 0.07 -0.78 -0.18 0.00 1.55 0.00 0.00 64.86 65.53 2k3w h ILE 43 Cb 0.33 0.91 -0.00 0.00 -0.27 0.00 0.00 36.82 37.78 2k3w h ILE 43 CO 0.00 0.27 -0.88 0.11 -1.05 0.00 0.00 178.15 176.60 2k3w h LYS 44 N 0.54 0.14 0.00 0.16 1.57 -1.21 -3.39 116.57 114.38 2k3w h LYS 44 Ca 0.12 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 2k3w h LYS 44 Cb 0.32 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.72 2k3w h LYS 44 CO 0.01 1.12 -1.07 0.66 -0.57 0.00 0.00 179.45 179.60 2k3w n TYR 45 N -4.25 0.70 -5.09 -1.35 4.02 0.34 -4.85 117.16 106.69 2k3w n TYR 45 Ca -0.20 0.20 -0.32 0.00 -0.01 0.00 0.00 57.90 57.57 2k3w n TYR 45 Cb 0.73 -0.79 -0.16 0.00 -0.02 0.00 0.00 39.34 39.10 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 -3.33 3.12 0.37 -0.72 0.41 0.51 -4.99 118.70 114.07 2k3w s GLU 46 Ca 0.00 -0.82 -0.26 0.00 -0.41 0.00 0.00 54.97 53.48 2k3w s GLU 46 Cb 0.11 -2.39 -0.09 0.00 -1.78 0.00 0.00 34.13 29.98 2k3w s GLU 46 CO 0.80 0.21 1.08 0.00 -0.49 0.00 0.00 175.26 176.85 2k3w s ALA 47 N 0.30 3.18 0.00 5.21 0.00 -1.26 -3.97 121.76 125.22 2k3w s ALA 47 Ca -0.16 0.79 0.00 0.00 0.00 0.00 0.00 51.96 52.60 2k3w s ALA 47 Cb -0.17 -3.30 0.00 0.00 0.00 0.00 0.00 23.12 19.65 2k3w s ALA 47 CO 0.08 -0.25 0.00 0.72 0.00 0.00 0.00 175.76 176.31 2k3w n HIS 48 N 0.28 -0.72 -3.64 0.00 8.25 -1.26 -5.04 115.22 113.09 2k3w n HIS 48 Ca 0.03 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.14 2k3w n HIS 48 Cb 0.48 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.53 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 -0.79 6.61 0.36 0.41 0.01 -1.26 -4.96 113.70 114.09 2k3w s SER 49 Ca 0.00 0.73 0.17 0.00 1.31 0.00 0.00 55.95 58.16 2k3w s SER 49 Cb 0.00 -2.16 1.13 0.00 0.21 0.00 0.00 66.02 65.20 2k3w s SER 49 CO 0.00 0.26 1.68 0.44 0.41 0.00 0.00 173.24 176.03 2k3w h ASP 50 N 4.16 0.48 -0.70 2.44 3.32 -2.02 1.43 116.42 125.54 2k3w h ASP 50 Ca -0.51 0.16 -0.04 0.00 0.02 0.00 0.00 57.03 56.66 2k3w h ASP 50 Cb 1.20 0.10 -0.03 0.00 0.22 0.00 0.00 39.33 40.83 2k3w h ASP 50 CO 0.64 -0.08 0.27 0.11 -1.72 0.00 0.00 179.24 178.46 2k3w h LYS 51 N 0.32 1.07 0.45 3.56 1.57 -2.00 -2.15 116.57 119.40 2k3w h LYS 51 Ca 0.72 -0.19 -0.02 0.00 -1.87 0.00 0.00 60.65 59.28 2k3w h LYS 51 Cb 1.75 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.89 2k3w h LYS 51 CO -0.51 0.88 -0.22 0.00 -0.57 0.00 0.00 179.45 179.03 2k3w h ALA 52 N 1.25 -0.61 -0.41 3.86 0.00 0.16 -1.79 119.26 121.71 2k3w h ALA 52 Ca 0.24 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 55.07 2k3w h ALA 52 Cb 0.22 0.24 -0.09 0.00 0.00 0.00 0.00 17.79 18.16 2k3w h ALA 52 CO -0.02 -0.79 -0.28 0.87 0.00 0.00 0.00 179.25 179.03 2k3w h LYS 53 N -0.71 -0.20 -0.88 0.00 6.56 -1.13 0.49 116.57 120.70 2k3w h LYS 53 Ca -0.06 0.01 0.15 0.00 -1.06 0.00 0.00 60.65 59.69 2k3w h LYS 53 Cb 0.52 0.04 -0.09 0.00 -0.57 0.00 0.00 32.23 32.13 2k3w h LYS 53 CO 0.10 -0.13 0.48 0.93 -2.06 0.00 0.00 179.45 178.77 2k3w h GLU 54 N -0.20 0.66 -0.54 3.15 3.07 -1.30 0.54 114.58 119.96 2k3w h GLU 54 Ca 0.19 -0.04 -0.02 0.00 -0.50 0.00 0.00 59.36 58.99 2k3w h GLU 54 Cb 0.51 -0.15 -0.02 0.00 -0.84 0.00 0.00 28.75 28.24 2k3w h GLU 54 CO -0.53 0.44 0.26 1.03 -1.40 0.00 0.00 179.01 178.80 2k3w h SER 55 N 0.68 0.70 -0.28 1.42 0.87 0.71 -0.39 113.55 117.27 2k3w h SER 55 Ca 0.48 -0.13 -0.07 0.00 -1.23 0.00 0.00 61.79 60.84 2k3w h SER 55 Cb 0.67 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.44 2k3w h SER 55 CO -0.35 0.64 -0.10 0.40 -0.53 0.00 0.00 176.83 176.89 2k3w h ILE 56 N 0.72 1.29 -0.87 2.23 1.08 0.20 -1.40 117.51 120.76 2k3w h ILE 56 Ca 0.18 -1.15 -0.02 0.00 -0.39 0.00 0.00 64.86 63.48 2k3w h ILE 56 Cb 0.12 1.47 -0.04 0.00 -3.07 0.00 0.00 36.82 35.30 2k3w h ILE 56 CO -0.02 0.36 0.46 0.03 -0.69 0.00 0.00 178.15 178.30 2k3w h ARG 57 N 0.30 1.22 -0.00 2.37 3.08 0.07 0.71 114.38 122.13 2k3w h ARG 57 Ca 0.07 -0.15 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 2k3w h ARG 57 Cb 0.59 -0.23 -0.00 0.00 0.08 0.00 0.00 29.97 30.41 2k3w h ARG 57 CO 0.03 0.90 -0.00 0.00 -1.07 0.00 0.00 179.97 179.83 2k3w h ALA 58 N 1.25 0.01 -0.36 0.04 0.00 -1.00 -2.22 119.26 116.98 2k3w h ALA 58 Ca 0.30 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 2k3w h ALA 58 Cb 0.05 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2k3w h ALA 58 CO -0.05 -0.31 -0.16 0.87 0.00 0.00 0.00 179.25 179.61 2k3w h LYS 59 N -0.36 0.67 -0.14 0.00 1.79 -1.10 -2.38 116.57 115.05 2k3w h LYS 59 Ca 0.00 -0.23 0.04 0.00 -2.18 0.00 0.00 60.65 58.28 2k3w h LYS 59 Cb 0.37 -0.05 -0.04 0.00 -1.58 0.00 0.00 32.23 30.93 2k3w h LYS 59 CO 0.00 0.79 -0.09 0.00 -1.08 0.00 0.00 179.45 179.07 2k3w h VAL 61 N -0.09 1.12 -0.17 0.00 3.04 -1.25 -1.34 116.25 117.56 2k3w h VAL 61 Ca 0.08 -0.68 -0.07 0.00 -1.01 0.00 0.00 66.70 65.02 2k3w h VAL 61 Cb 0.22 1.37 -0.00 0.00 -2.01 0.00 0.00 31.29 30.86 2k3w h VAL 61 CO -0.19 0.19 -0.16 1.56 -1.01 0.00 0.00 177.57 177.96 2k3w h GLN 62 N 0.00 0.41 -0.11 4.17 4.20 -0.63 -1.12 115.11 122.03 2k3w h GLN 62 Ca -0.00 -0.21 -0.00 0.00 0.06 0.00 0.00 58.65 58.49 2k3w h GLN 62 Cb 0.36 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 2k3w h GLN 62 CO 0.03 0.78 0.06 1.88 -0.67 0.00 0.00 178.83 180.90 2k3w h TYR 63 N 0.06 0.16 -0.05 2.96 0.05 -0.29 -1.87 116.97 117.99 2k3w h TYR 63 Ca 0.03 -0.01 -0.00 0.00 0.05 0.00 0.00 58.73 58.80 2k3w h TYR 63 Cb 0.70 -0.05 -0.00 0.00 1.01 0.00 0.00 36.73 38.39 2k3w h TYR 63 CO 0.08 0.21 0.03 -0.07 -1.05 0.00 0.00 178.16 177.36 2k3w h LEU 64 N 0.06 0.06 -0.75 3.88 3.38 -1.29 -0.67 115.31 119.99 2k3w h LEU 64 Ca 0.04 -0.04 0.15 0.00 0.09 0.00 0.00 57.88 58.12 2k3w h LEU 64 Cb 0.11 -0.01 -0.10 0.00 0.09 0.00 0.00 40.66 40.74 2k3w h LEU 64 CO -0.01 0.08 0.24 -0.78 0.09 0.00 0.00 178.44 178.07 2k3w h ASP 65 N 0.03 0.15 -0.43 -0.43 3.58 -1.05 0.39 116.42 118.66 2k3w h ASP 65 Ca 0.02 0.13 -0.01 0.00 0.42 0.00 0.00 57.03 57.59 2k3w h ASP 65 Cb 0.03 0.14 -0.02 0.00 1.72 0.00 0.00 39.33 41.20 2k3w h ASP 65 CO -0.00 0.03 0.23 0.03 -2.88 0.00 0.00 179.24 176.65 2k3w h ARG 66 N 0.35 0.61 -0.15 0.28 2.47 -0.85 -1.58 114.38 115.51 2k3w h ARG 66 Ca 0.42 -0.07 -0.02 0.00 -1.26 0.00 0.00 59.98 59.04 2k3w h ARG 66 Cb 0.69 -0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 28.88 2k3w h ARG 66 CO -0.46 0.49 -0.02 0.00 0.56 0.00 0.00 179.97 180.54 2k3w h ALA 67 N 1.09 1.70 0.28 0.04 0.00 0.93 -1.19 119.26 122.11 2k3w h ALA 67 Ca 0.15 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2k3w h ALA 67 Cb 0.06 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2k3w h ALA 67 CO -0.02 0.23 -0.14 0.93 0.00 0.00 0.00 179.25 180.25 2k3w h GLU 68 N 0.21 -0.36 -0.53 0.00 5.08 0.34 -2.00 114.58 117.31 2k3w h GLU 68 Ca 0.05 0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 2k3w h GLU 68 Cb 0.18 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 2k3w h GLU 68 CO 0.00 -0.02 0.30 1.57 -1.00 0.00 0.00 179.01 179.86 2k3w h LYS 69 N -0.81 0.73 -0.26 2.33 2.10 -1.21 0.13 116.57 119.59 2k3w h LYS 69 Ca -0.04 -0.07 0.00 0.00 -2.00 0.00 0.00 60.65 58.55 2k3w h LYS 69 Cb 0.51 -0.15 -0.01 0.00 -0.90 0.00 0.00 32.23 31.68 2k3w h LYS 69 CO 0.06 0.53 0.17 -0.07 -2.00 0.00 0.00 179.45 178.14 2k3w h LEU 70 N 0.74 0.29 -1.20 7.07 3.38 -1.18 -1.31 115.31 123.09 2k3w h LEU 70 Ca 0.19 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.12 2k3w h LEU 70 Cb 0.01 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 2k3w h LEU 70 CO -0.03 0.21 -0.16 0.50 0.09 0.00 0.00 178.44 179.05 2k3w h LYS 71 N 0.34 0.00 0.40 1.13 3.64 -0.81 -1.94 116.57 119.33 2k3w h LYS 71 Ca 0.09 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.45 2k3w h LYS 71 Cb -0.04 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 2k3w h LYS 71 CO -0.02 0.16 -0.19 0.22 -2.27 0.00 0.00 179.45 177.35 2k3w h ASP 72 N 0.00 -0.45 0.80 4.20 3.58 0.36 -2.13 116.42 122.78 2k3w h ASP 72 Ca -0.00 -0.12 -0.17 0.00 0.42 0.00 0.00 57.03 57.15 2k3w h ASP 72 Cb 0.68 0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.82 2k3w h ASP 72 CO 0.02 -0.05 -0.83 0.10 -2.88 0.00 0.00 179.24 175.61 2k3w h TYR 73 N -0.95 0.03 -0.24 0.28 -0.00 -1.47 -3.20 116.97 111.42 2k3w h TYR 73 Ca -0.05 -0.02 0.02 0.00 0.00 0.00 0.00 58.73 58.68 2k3w h TYR 73 Cb 0.55 -0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.25 2k3w h TYR 73 CO 0.02 0.84 0.11 -0.07 -0.00 0.00 0.00 178.16 179.06 2k3w h LEU 74 N 0.01 0.16 0.00 0.10 3.38 -1.41 -3.52 115.31 114.03 2k3w h LEU 74 Ca -0.01 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2k3w h LEU 74 Cb 1.46 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.19 2k3w h LEU 74 CO 0.11 0.12 0.00 -1.14 0.09 0.00 0.00 178.44 177.62