#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 4.58 0.18 8.00 0.01 -1.26 -4.81 113.70 120.40 2k3w s SER 4 Ca 0.00 2.57 -0.12 0.00 1.31 0.00 0.00 55.95 59.71 2k3w s SER 4 Cb 0.00 -2.61 0.09 0.00 0.21 0.00 0.00 66.02 63.71 2k3w s SER 4 CO 0.00 -2.02 1.81 0.74 0.41 0.00 0.00 173.24 174.18 2k3w h THR 5 N 0.45 1.18 -0.29 1.44 2.02 -1.98 -0.64 112.91 115.09 2k3w h THR 5 Ca -0.50 -0.43 -0.04 0.00 0.77 0.00 0.00 66.41 66.20 2k3w h THR 5 Cb 1.33 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 68.10 2k3w h THR 5 CO 0.53 0.19 0.01 0.25 0.37 0.00 0.00 175.52 176.87 2k3w h LEU 6 N 0.82 0.50 -0.63 2.58 7.12 -1.91 -1.13 115.31 122.66 2k3w h LEU 6 Ca 0.22 -0.30 0.01 0.00 0.13 0.00 0.00 57.88 57.94 2k3w h LEU 6 Cb -0.00 -0.13 -0.03 0.00 -0.53 0.00 0.00 40.66 39.96 2k3w h LEU 6 CO -0.04 0.67 0.41 -0.61 -0.13 0.00 0.00 178.44 178.75 2k3w h GLN 7 N 0.31 0.80 -0.49 1.25 5.75 -1.87 -1.27 115.11 119.60 2k3w h GLN 7 Ca 0.08 -0.05 -0.06 0.00 -0.15 0.00 0.00 58.65 58.48 2k3w h GLN 7 Cb 0.41 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.76 2k3w h GLN 7 CO 0.01 0.53 0.07 -0.22 -2.65 0.00 0.00 178.83 176.58 2k3w h LYS 8 N 0.83 0.81 -0.67 1.69 3.64 -1.02 -1.18 116.57 120.66 2k3w h LYS 8 Ca 0.24 -0.22 0.06 0.00 -1.27 0.00 0.00 60.65 59.46 2k3w h LYS 8 Cb -0.06 -0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 31.61 2k3w h LYS 8 CO -0.07 0.82 0.37 0.00 -2.27 0.00 0.00 179.45 178.29 2k3w h ALA 9 N 0.96 0.90 -0.62 5.00 0.00 -0.68 -0.29 119.26 124.54 2k3w h ALA 9 Ca 0.15 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 2k3w h ALA 9 Cb 0.40 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 2k3w h ALA 9 CO 0.01 0.04 0.14 0.82 0.00 0.00 0.00 179.25 180.26 2k3w h ILE 10 N 0.68 1.26 -0.38 0.00 2.04 -1.02 -1.60 117.51 118.49 2k3w h ILE 10 Ca 0.30 -0.94 0.00 0.00 1.00 0.00 0.00 64.86 65.22 2k3w h ILE 10 Cb 0.20 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 2k3w h ILE 10 CO -0.19 0.35 0.25 -0.78 0.00 0.00 0.00 178.15 177.78 2k3w h ASP 11 N 0.92 0.43 -0.51 1.72 1.82 -0.01 0.50 116.42 121.29 2k3w h ASP 11 Ca 0.19 -0.01 -0.04 0.00 -0.39 0.00 0.00 57.03 56.78 2k3w h ASP 11 Cb 0.37 -0.11 -0.02 0.00 0.68 0.00 0.00 39.33 40.26 2k3w h ASP 11 CO 0.00 0.31 0.15 -0.07 -1.61 0.00 0.00 179.24 178.03 2k3w h LEU 12 N 0.51 0.75 -0.68 2.28 3.38 -0.91 -2.18 115.31 118.47 2k3w h LEU 12 Ca 0.14 -0.21 -0.11 0.00 0.09 0.00 0.00 57.88 57.79 2k3w h LEU 12 Cb -0.06 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 2k3w h LEU 12 CO -0.03 0.77 -0.11 1.62 0.09 0.00 0.00 178.44 180.77 2k3w h VAL 13 N 0.70 1.26 -0.20 1.22 3.04 -1.11 -0.77 116.25 120.39 2k3w h VAL 13 Ca 0.16 -1.23 0.02 0.00 -1.01 0.00 0.00 66.70 64.64 2k3w h VAL 13 Cb 0.29 1.01 -0.02 0.00 -2.01 0.00 0.00 31.29 30.55 2k3w h VAL 13 CO -0.00 0.43 0.07 0.74 -1.01 0.00 0.00 177.57 177.79 2k3w h THR 14 N 0.81 0.95 -0.66 3.17 2.02 -0.68 -0.86 112.91 117.66 2k3w h THR 14 Ca 0.13 -0.06 -0.03 0.00 0.77 0.00 0.00 66.41 67.23 2k3w h THR 14 Cb 0.64 0.77 -0.03 0.00 -1.74 0.00 0.00 68.15 67.79 2k3w h THR 14 CO 0.04 0.03 0.30 0.50 0.37 0.00 0.00 175.52 176.76 2k3w h LYS 15 N 0.16 0.96 -0.80 6.66 3.64 -1.25 -2.41 116.57 123.53 2k3w h LYS 15 Ca 0.09 -0.15 0.13 0.00 -1.27 0.00 0.00 60.65 59.45 2k3w h LYS 15 Cb 0.06 -0.17 -0.09 0.00 -0.41 0.00 0.00 32.23 31.62 2k3w h LYS 15 CO -0.09 0.78 0.39 0.00 -2.27 0.00 0.00 179.45 178.26 2k3w h ALA 16 N 1.13 1.17 -0.62 5.00 0.00 -0.22 0.25 119.26 125.98 2k3w h ALA 16 Ca 0.22 0.08 -0.09 0.00 0.00 0.00 0.00 54.91 55.13 2k3w h ALA 16 Cb 0.15 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2k3w h ALA 16 CO -0.02 -0.10 0.03 1.79 0.00 0.00 0.00 179.25 180.95 2k3w h THR 17 N 0.59 1.26 -0.65 0.00 1.35 -0.74 -0.86 112.91 113.87 2k3w h THR 17 Ca 0.43 -1.12 -0.05 0.00 -0.55 0.00 0.00 66.41 65.12 2k3w h THR 17 Cb 0.57 0.76 -0.03 0.00 -1.73 0.00 0.00 68.15 67.73 2k3w h THR 17 CO -0.35 0.41 0.19 1.05 -0.25 0.00 0.00 175.52 176.58 2k3w h GLU 18 N 0.98 1.01 -0.61 4.72 4.11 -0.67 -2.15 114.58 121.96 2k3w h GLU 18 Ca 0.18 -0.22 -0.08 0.00 0.07 0.00 0.00 59.36 59.31 2k3w h GLU 18 Cb 0.52 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 2k3w h GLU 18 CO 0.03 0.89 0.08 0.93 0.07 0.00 0.00 179.01 181.01 2k3w h GLU 19 N 0.94 1.00 -0.95 1.06 4.39 -0.76 -1.65 114.58 118.61 2k3w h GLU 19 Ca 0.21 -0.26 0.02 0.00 0.34 0.00 0.00 59.36 59.66 2k3w h GLU 19 Cb 0.31 -0.12 -0.05 0.00 -0.10 0.00 0.00 28.75 28.79 2k3w h GLU 19 CO -0.00 0.94 0.63 0.22 -1.16 0.00 0.00 179.01 179.63 2k3w h ASP 20 N 0.94 1.08 -0.58 1.42 1.82 -0.79 0.48 116.42 120.79 2k3w h ASP 20 Ca 0.19 -0.02 -0.07 0.00 -0.39 0.00 0.00 57.03 56.73 2k3w h ASP 20 Cb 0.43 -0.26 -0.02 0.00 0.68 0.00 0.00 39.33 40.16 2k3w h ASP 20 CO 0.01 0.77 0.08 0.11 -1.61 0.00 0.00 179.24 178.60 2k3w h LYS 21 N 1.27 0.97 -0.04 0.28 1.57 -0.83 -1.68 116.57 118.11 2k3w h LYS 21 Ca 0.36 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 2k3w h LYS 21 Cb -0.10 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.10 2k3w h LYS 21 CO -0.09 0.93 0.00 0.00 -0.57 0.00 0.00 179.45 179.72 2k3w n ALA 22 N -2.44 2.16 -2.03 3.86 0.00 -0.56 -4.78 120.51 116.72 2k3w n ALA 22 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.33 2k3w n ALA 22 Cb 0.29 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.71 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 -0.46 -1.08 -2.77 0.00 4.76 -0.63 -4.93 118.16 113.04 2k3w n LYS 23 Ca 0.00 0.77 -0.42 0.00 -2.87 0.00 0.00 58.31 55.79 2k3w n LYS 23 Cb 0.01 -5.00 0.01 0.00 -1.84 0.00 0.00 35.03 28.21 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 -0.58 6.56 -0.37 4.39 4.13 0.16 -4.80 115.26 124.75 2k3w n ASN 24 Ca -0.16 -3.42 0.03 0.00 1.68 0.00 0.00 54.58 52.71 2k3w n ASN 24 Cb 0.58 -1.28 0.18 0.00 -1.54 0.00 0.00 39.78 37.72 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 5.15 1.20 0.24 3.10 0.05 -1.87 0.55 116.97 125.38 2k3w h TYR 25 Ca 0.33 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 59.13 2k3w h TYR 25 Cb 0.53 -0.39 0.00 0.00 1.01 0.00 0.00 36.73 37.88 2k3w h TYR 25 CO 1.16 0.61 -0.12 0.93 -1.05 0.00 0.00 178.16 179.70 2k3w h GLU 26 N 1.17 -0.31 -0.22 4.88 5.08 -1.95 0.35 114.58 123.58 2k3w h GLU 26 Ca 0.43 0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.77 2k3w h GLU 26 Cb 0.18 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 2k3w h GLU 26 CO -0.18 -0.15 -0.02 1.49 -1.00 0.00 0.00 179.01 179.15 2k3w h GLU 27 N -0.40 0.40 -0.54 2.33 4.57 -1.86 -2.21 114.58 116.87 2k3w h GLU 27 Ca -0.03 -0.14 0.06 0.00 -1.18 0.00 0.00 59.36 58.07 2k3w h GLU 27 Cb 0.30 -0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 28.81 2k3w h GLU 27 CO 0.05 0.61 0.26 0.00 -1.18 0.00 0.00 179.01 178.75 2k3w h ALA 28 N 0.77 0.70 -0.42 2.92 0.00 0.17 -1.30 119.26 122.09 2k3w h ALA 28 Ca 0.06 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.02 2k3w h ALA 28 Cb 0.45 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 2k3w h ALA 28 CO 0.02 -0.11 0.26 1.25 0.00 0.00 0.00 179.25 180.67 2k3w h LEU 29 N 0.49 0.43 -0.67 0.00 5.85 -0.19 0.19 115.31 121.41 2k3w h LEU 29 Ca 0.25 -0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.98 2k3w h LEU 29 Cb 0.20 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.10 2k3w h LEU 29 CO -0.20 0.31 0.44 0.03 -0.34 0.00 0.00 178.44 178.68 2k3w h ARG 30 N 0.52 0.85 -0.57 1.25 3.08 -0.77 -1.45 114.38 117.29 2k3w h ARG 30 Ca 0.16 -0.05 -0.10 0.00 0.07 0.00 0.00 59.98 60.06 2k3w h ARG 30 Cb -0.01 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.83 2k3w h ARG 30 CO -0.06 0.56 -0.05 -0.07 -1.07 0.00 0.00 179.97 179.27 2k3w h LEU 31 N 0.87 1.03 -0.09 3.04 3.38 -0.71 -1.79 115.31 121.03 2k3w h LEU 31 Ca 0.26 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2k3w h LEU 31 Cb -0.05 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.42 2k3w h LEU 31 CO -0.08 1.10 0.06 1.88 0.09 0.00 0.00 178.44 181.49 2k3w h TYR 32 N 0.93 0.11 -0.63 1.13 0.05 -0.05 0.22 116.97 118.73 2k3w h TYR 32 Ca 0.16 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.89 2k3w h TYR 32 Cb 0.61 -0.04 -0.03 0.00 1.01 0.00 0.00 36.73 38.29 2k3w h TYR 32 CO 0.04 0.07 0.21 1.96 -1.05 0.00 0.00 178.16 179.39 2k3w h GLN 33 N 0.12 0.97 0.06 4.88 4.20 -1.23 -1.60 115.11 122.52 2k3w h GLN 33 Ca 0.04 -0.20 -0.00 0.00 0.06 0.00 0.00 58.65 58.54 2k3w h GLN 33 Cb -0.01 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.63 2k3w h GLN 33 CO -0.01 0.84 -0.03 0.45 -0.67 0.00 0.00 178.83 179.41 2k3w h HIS 34 N 0.90 -0.08 -0.56 2.96 3.86 -1.04 -1.85 115.15 119.34 2k3w h HIS 34 Ca 0.20 -0.00 0.08 0.00 -1.16 0.00 0.00 60.37 59.49 2k3w h HIS 34 Cb 0.27 0.03 -0.06 0.00 1.06 0.00 0.00 27.41 28.70 2k3w h HIS 34 CO 0.02 0.10 0.21 0.00 0.86 0.00 0.00 177.93 179.12 2k3w h ALA 35 N 0.67 0.70 -0.62 2.45 0.00 -0.46 -1.02 119.26 120.98 2k3w h ALA 35 Ca -0.01 0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.01 2k3w h ALA 35 Cb 0.22 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 2k3w h ALA 35 CO 0.01 -0.19 0.36 0.28 0.00 0.00 0.00 179.25 179.72 2k3w h VAL 36 N 0.39 1.03 -0.35 0.00 2.07 -1.15 -0.59 116.25 117.65 2k3w h VAL 36 Ca 0.27 -0.24 0.07 0.00 0.82 0.00 0.00 66.70 67.62 2k3w h VAL 36 Cb 0.31 0.27 -0.06 0.00 -1.52 0.00 0.00 31.29 30.28 2k3w h VAL 36 CO -0.27 0.13 -0.03 -0.08 0.02 0.00 0.00 177.57 177.34 2k3w h GLU 37 N 0.70 0.06 -0.66 1.57 4.57 -0.35 -0.37 114.58 120.11 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 0.09 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.63 2k3w h GLU 37 CO -0.13 0.04 0.26 1.88 -1.18 0.00 0.00 179.01 179.87 2k3w h TYR 38 N 0.06 0.98 -0.08 0.92 0.05 -0.71 -0.51 116.97 117.69 2k3w h TYR 38 Ca 0.17 -0.06 -0.00 0.00 0.05 0.00 0.00 58.73 58.89 2k3w h TYR 38 Cb 0.24 -0.30 -0.00 0.00 1.01 0.00 0.00 36.73 37.68 2k3w h TYR 38 CO -0.27 0.76 0.05 0.74 -1.05 0.00 0.00 178.16 178.38 2k3w h PHE 39 N 0.95 0.10 -0.76 4.88 0.04 0.01 0.18 116.94 122.34 2k3w h PHE 39 Ca 0.22 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.95 2k3w h PHE 39 Cb 0.19 -0.03 -0.03 0.00 2.20 0.00 0.00 35.95 38.28 2k3w h PHE 39 CO 0.01 0.09 0.29 -0.07 -0.60 0.00 0.00 178.31 178.04 2k3w h LEU 40 N 0.08 1.06 -1.45 1.54 3.38 -0.87 -1.47 115.31 117.58 2k3w h LEU 40 Ca 0.03 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.77 2k3w h LEU 40 Cb 0.02 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 2k3w h LEU 40 CO -0.01 0.95 -0.25 -0.74 0.09 0.00 0.00 178.44 178.48 2k3w h HIS 41 N 1.11 0.00 -0.05 1.13 2.76 -0.70 -2.28 115.15 117.12 2k3w h HIS 41 Ca 0.25 0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.37 2k3w h HIS 41 Cb 0.23 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.19 2k3w h HIS 41 CO 0.02 0.25 -0.19 0.00 -1.30 0.00 0.00 177.93 176.72 2k3w h ALA 42 N 1.75 0.10 -0.15 5.26 0.00 0.39 -0.45 119.26 126.15 2k3w h ALA 42 Ca -0.00 -0.39 -0.09 0.00 0.00 0.00 0.00 54.91 54.43 2k3w h ALA 42 Cb 0.57 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2k3w h ALA 42 CO 0.03 0.05 -0.29 -0.84 0.00 0.00 0.00 179.25 178.20 2k3w h ILE 43 N -0.31 1.26 0.05 0.00 3.07 -1.31 0.28 117.51 120.56 2k3w h ILE 43 Ca -0.01 -1.25 -0.13 0.00 1.55 0.00 0.00 64.86 65.02 2k3w h ILE 43 Cb 0.82 1.47 -0.00 0.00 -0.27 0.00 0.00 36.82 38.84 2k3w h ILE 43 CO 0.04 0.38 -0.64 0.11 -1.05 0.00 0.00 178.15 177.00 2k3w h LYS 44 N 0.26 0.11 0.00 0.16 1.57 -1.45 -3.38 116.57 113.84 2k3w h LYS 44 Ca 0.04 -0.18 -0.12 0.00 -1.87 0.00 0.00 60.65 58.51 2k3w h LYS 44 Cb 0.66 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.02 2k3w h LYS 44 CO 0.05 1.09 -0.67 1.88 -0.57 0.00 0.00 179.45 181.23 2k3w h TYR 45 N -0.74 0.00 0.00 -1.35 -1.99 -1.14 -3.44 116.97 108.31 2k3w h TYR 45 Ca -0.14 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.59 2k3w h TYR 45 Cb 1.32 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.05 2k3w h TYR 45 CO 0.20 0.57 0.00 0.39 -0.00 0.00 0.00 178.16 179.32 2k3w n GLU 46 N -3.20 0.00 0.00 4.88 -0.58 0.09 -5.05 120.64 116.78 2k3w n GLU 46 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2k3w n GLU 46 Cb 0.77 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.64 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 -1.16 0.62 0.00 -1.26 -5.03 120.51 110.68 2k3w n ALA 47 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2k3w n ALA 47 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 -0.27 -3.24 0.00 8.25 -1.26 -5.10 115.22 113.60 2k3w n HIS 48 Ca 0.00 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.27 2k3w n HIS 48 Cb 0.00 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.10 2k3w n HIS 48 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2k3w s SER 49 N -1.00 5.40 0.32 0.41 0.15 -1.26 -4.93 113.70 112.78 2k3w s SER 49 Ca 0.00 -0.56 0.01 0.00 0.70 0.00 0.00 55.95 56.09 2k3w s SER 49 Cb 0.00 -0.61 0.54 0.00 -1.71 0.00 0.00 66.02 64.24 2k3w s SER 49 CO 0.00 -0.72 1.96 0.44 1.20 0.00 0.00 173.24 176.11 2k3w h ASP 50 N 0.80 0.78 -0.26 5.45 3.32 -1.98 0.78 116.42 125.30 2k3w h ASP 50 Ca -0.40 -0.05 -0.03 0.00 0.02 0.00 0.00 57.03 56.57 2k3w h ASP 50 Cb 1.27 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.62 2k3w h ASP 50 CO 0.50 0.62 0.05 0.11 -1.72 0.00 0.00 179.24 178.80 2k3w h LYS 51 N 0.90 0.43 0.38 3.56 6.56 -1.99 -0.95 116.57 125.46 2k3w h LYS 51 Ca 0.23 -0.11 -0.02 0.00 -1.06 0.00 0.00 60.65 59.69 2k3w h LYS 51 Cb -0.01 -0.05 0.00 0.00 -0.57 0.00 0.00 32.23 31.60 2k3w h LYS 51 CO -0.04 0.54 -0.18 0.00 -2.06 0.00 0.00 179.45 177.71 2k3w h ALA 52 N 0.87 -0.52 -0.44 3.86 0.00 -1.82 -1.91 119.26 119.30 2k3w h ALA 52 Ca 0.08 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 54.95 2k3w h ALA 52 Cb 0.32 0.20 -0.09 0.00 0.00 0.00 0.00 17.79 18.22 2k3w h ALA 52 CO 0.00 -0.75 -0.16 0.87 0.00 0.00 0.00 179.25 179.21 2k3w h LYS 53 N -0.59 -0.07 -0.92 0.00 6.56 -0.81 0.29 116.57 121.04 2k3w h LYS 53 Ca -0.05 0.00 0.14 0.00 -1.06 0.00 0.00 60.65 59.68 2k3w h LYS 53 Cb 0.44 0.01 -0.09 0.00 -0.57 0.00 0.00 32.23 32.03 2k3w h LYS 53 CO 0.09 -0.04 0.53 0.93 -2.06 0.00 0.00 179.45 178.89 2k3w h GLU 54 N -0.07 0.77 -0.56 3.15 5.08 -1.02 0.40 114.58 122.33 2k3w h GLU 54 Ca 0.21 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.51 2k3w h GLU 54 Cb 0.40 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 2k3w h GLU 54 CO -0.49 0.51 0.27 1.03 -1.00 0.00 0.00 179.01 179.32 2k3w h SER 55 N 0.79 0.73 -0.23 1.42 0.87 0.31 0.01 113.55 117.46 2k3w h SER 55 Ca 0.48 -0.13 -0.05 0.00 -1.23 0.00 0.00 61.79 60.86 2k3w h SER 55 Cb 0.59 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.35 2k3w h SER 55 CO -0.31 0.66 -0.06 0.40 -0.53 0.00 0.00 176.83 176.98 2k3w h ILE 56 N 0.75 1.29 0.76 2.23 1.08 0.10 -1.27 117.51 122.45 2k3w h ILE 56 Ca 0.19 -1.07 -0.04 0.00 -0.39 0.00 0.00 64.86 63.55 2k3w h ILE 56 Cb 0.12 1.52 0.01 0.00 -3.07 0.00 0.00 36.82 35.39 2k3w h ILE 56 CO -0.02 0.33 -0.36 0.03 -0.69 0.00 0.00 178.15 177.43 2k3w h ARG 57 N 0.18 -0.98 -0.32 2.37 3.08 -0.21 0.71 114.38 119.22 2k3w h ARG 57 Ca 0.06 0.07 0.07 0.00 0.07 0.00 0.00 59.98 60.25 2k3w h ARG 57 Cb 0.53 0.22 -0.07 0.00 0.08 0.00 0.00 29.97 30.73 2k3w h ARG 57 CO 0.02 -0.64 -0.18 0.00 -1.07 0.00 0.00 179.97 178.10 2k3w h ALA 58 N -0.90 0.05 -0.71 0.04 0.00 -1.05 -1.00 119.26 115.68 2k3w h ALA 58 Ca -0.10 0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2k3w h ALA 58 Cb 0.80 0.42 -0.03 0.00 0.00 0.00 0.00 17.79 18.98 2k3w h ALA 58 CO 0.17 -0.57 0.33 0.87 0.00 0.00 0.00 179.25 180.05 2k3w h LYS 59 N -0.14 1.04 -0.95 0.00 1.79 -1.16 -1.89 116.57 115.25 2k3w h LYS 59 Ca 0.17 -0.16 0.20 0.00 -2.18 0.00 0.00 60.65 58.67 2k3w h LYS 59 Cb 0.39 -0.18 -0.08 0.00 -1.58 0.00 0.00 32.23 30.78 2k3w h LYS 59 CO -0.41 0.82 0.61 0.00 -1.08 0.00 0.00 179.45 179.40 2k3w h VAL 61 N 0.57 1.28 -0.29 0.00 2.07 -0.51 -0.45 116.25 118.91 2k3w h VAL 61 Ca 0.51 -0.99 0.06 0.00 0.82 0.00 0.00 66.70 67.11 2k3w h VAL 61 Cb 1.05 1.52 -0.06 0.00 -1.52 0.00 0.00 31.29 32.28 2k3w h VAL 61 CO -0.26 0.30 -0.08 1.56 0.02 0.00 0.00 177.57 179.12 2k3w h GLN 62 N 0.11 -0.01 -0.11 1.57 4.20 0.08 0.53 115.11 121.48 2k3w h GLN 62 Ca 0.05 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.76 2k3w h GLN 62 Cb 0.47 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.24 2k3w h GLN 62 CO 0.02 -0.00 0.05 1.88 -0.67 0.00 0.00 178.83 180.10 2k3w h TYR 63 N -0.01 0.17 -0.24 2.96 0.05 -0.90 -2.22 116.97 116.78 2k3w h TYR 63 Ca 0.14 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.91 2k3w h TYR 63 Cb 0.22 -0.05 -0.01 0.00 1.01 0.00 0.00 36.73 37.90 2k3w h TYR 63 CO -0.28 0.26 0.16 -0.07 -1.05 0.00 0.00 178.16 177.17 2k3w h LEU 64 N 0.03 0.28 -0.73 3.88 3.38 -0.60 -0.85 115.31 120.70 2k3w h LEU 64 Ca 0.04 -0.01 0.13 0.00 0.09 0.00 0.00 57.88 58.13 2k3w h LEU 64 Cb 0.16 -0.07 -0.09 0.00 0.09 0.00 0.00 40.66 40.75 2k3w h LEU 64 CO -0.00 0.21 0.28 -0.78 0.09 0.00 0.00 178.44 178.24 2k3w h ASP 65 N 0.32 0.26 -0.57 -0.43 3.58 0.17 0.41 116.42 120.16 2k3w h ASP 65 Ca 0.09 0.10 -0.01 0.00 0.42 0.00 0.00 57.03 57.63 2k3w h ASP 65 Cb -0.03 0.08 -0.03 0.00 1.72 0.00 0.00 39.33 41.08 2k3w h ASP 65 CO -0.02 0.11 0.30 0.03 -2.88 0.00 0.00 179.24 176.78 2k3w h ARG 66 N 0.43 0.81 -0.59 0.28 2.47 -0.85 -1.68 114.38 115.26 2k3w h ARG 66 Ca 0.39 -0.10 -0.02 0.00 -1.26 0.00 0.00 59.98 58.99 2k3w h ARG 66 Cb 0.58 -0.15 -0.03 0.00 -1.65 0.00 0.00 29.97 28.71 2k3w h ARG 66 CO -0.39 0.63 0.29 0.00 0.56 0.00 0.00 179.97 181.07 2k3w h ALA 67 N 1.13 1.40 0.41 0.04 0.00 0.75 -0.73 119.26 122.26 2k3w h ALA 67 Ca 0.20 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2k3w h ALA 67 Cb 0.07 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2k3w h ALA 67 CO -0.03 0.48 -0.20 0.93 0.00 0.00 0.00 179.25 180.43 2k3w h GLU 68 N 0.83 -0.53 -0.58 0.00 5.08 0.34 -1.14 114.58 118.58 2k3w h GLU 68 Ca 0.21 0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.58 2k3w h GLU 68 Cb 0.08 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 2k3w h GLU 68 CO -0.03 -0.26 0.27 1.57 -1.00 0.00 0.00 179.01 179.56 2k3w h LYS 69 N -0.73 0.82 -0.11 2.33 2.10 -1.21 0.26 116.57 120.02 2k3w h LYS 69 Ca -0.06 -0.11 -0.00 0.00 -2.00 0.00 0.00 60.65 58.49 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 0.09 0.64 0.06 -0.07 -2.00 0.00 0.00 179.45 178.18 2k3w h LEU 70 N 0.82 0.13 -1.18 7.07 3.38 -0.99 -1.77 115.31 122.76 2k3w h LEU 70 Ca 0.20 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.07 2k3w h LEU 70 Cb 0.10 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2k3w h LEU 70 CO -0.03 0.15 -0.21 0.50 0.09 0.00 0.00 178.44 178.95 2k3w h LYS 71 N 0.10 0.00 0.41 1.13 3.64 -0.90 -2.03 116.57 118.92 2k3w h LYS 71 Ca 0.04 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.40 2k3w h LYS 71 Cb 0.05 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 2k3w h LYS 71 CO -0.01 0.21 -0.20 0.22 -2.27 0.00 0.00 179.45 177.41 2k3w h ASP 72 N 0.00 -0.47 1.00 4.20 1.82 0.34 -1.80 116.42 121.51 2k3w h ASP 72 Ca -0.00 -0.11 -0.16 0.00 -0.39 0.00 0.00 57.03 56.36 2k3w h ASP 72 Cb 0.71 0.12 -0.02 0.00 0.68 0.00 0.00 39.33 40.82 2k3w h ASP 72 CO 0.03 -0.11 -0.78 0.10 -1.61 0.00 0.00 179.24 176.87 2k3w h TYR 73 N -0.88 0.00 -0.11 0.28 -0.00 -1.47 -3.23 116.97 111.56 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 0.01 0.78 0.07 -0.07 -0.00 0.00 0.00 178.16 178.95 2k3w h LEU 74 N 0.00 0.12 0.00 0.10 3.38 -1.41 -3.52 115.31 113.98 2k3w h LEU 74 Ca -0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2k3w h LEU 74 Cb 1.49 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.21 2k3w h LEU 74 CO 0.10 0.09 0.00 -1.14 0.09 0.00 0.00 178.44 177.58