#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 5.03 0.18 8.00 0.01 -1.26 -4.85 113.70 120.82 2k3w s SER 4 Ca 0.00 2.29 -0.13 0.00 1.31 0.00 0.00 55.95 59.42 2k3w s SER 4 Cb 0.00 -2.59 0.09 0.00 0.21 0.00 0.00 66.02 63.73 2k3w s SER 4 CO 0.00 -1.69 1.84 0.74 0.41 0.00 0.00 173.24 174.54 2k3w h THR 5 N 0.53 1.16 -0.36 1.44 2.02 -1.99 -0.86 112.91 114.85 2k3w h THR 5 Ca -0.49 -0.31 -0.05 0.00 0.77 0.00 0.00 66.41 66.33 2k3w h THR 5 Cb 1.28 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 67.98 2k3w h THR 5 CO 0.54 0.16 0.05 0.25 0.37 0.00 0.00 175.52 176.88 2k3w h LEU 6 N 0.80 0.58 -0.39 2.58 7.12 -1.92 -0.95 115.31 123.14 2k3w h LEU 6 Ca 0.22 -0.27 0.02 0.00 0.13 0.00 0.00 57.88 57.97 2k3w h LEU 6 Cb -0.07 -0.16 -0.03 0.00 -0.53 0.00 0.00 40.66 39.88 2k3w h LEU 6 CO -0.04 0.71 0.23 -0.61 -0.13 0.00 0.00 178.44 178.59 2k3w h GLN 7 N 0.44 0.46 -0.55 1.25 5.75 -1.86 -1.23 115.11 119.37 2k3w h GLN 7 Ca 0.11 -0.03 -0.04 0.00 -0.15 0.00 0.00 58.65 58.54 2k3w h GLN 7 Cb 0.38 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 28.80 2k3w h GLN 7 CO 0.01 0.30 0.19 -0.22 -2.65 0.00 0.00 178.83 176.46 2k3w h LYS 8 N 0.47 0.84 -0.59 1.69 3.64 -1.06 -1.05 116.57 120.52 2k3w h LYS 8 Ca 0.15 -0.17 0.07 0.00 -1.27 0.00 0.00 60.65 59.44 2k3w h LYS 8 Cb -0.00 -0.13 -0.06 0.00 -0.41 0.00 0.00 32.23 31.63 2k3w h LYS 8 CO -0.07 0.75 0.26 0.00 -2.27 0.00 0.00 179.45 178.12 2k3w h ALA 9 N 1.05 0.76 -0.68 5.00 0.00 -0.67 0.01 119.26 124.73 2k3w h ALA 9 Ca 0.18 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 2k3w h ALA 9 Cb 0.25 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2k3w h ALA 9 CO -0.01 -0.12 0.22 0.82 0.00 0.00 0.00 179.25 180.15 2k3w h ILE 10 N 0.48 1.25 -0.26 0.00 2.04 -0.92 -1.74 117.51 118.36 2k3w h ILE 10 Ca 0.28 -0.86 0.00 0.00 1.00 0.00 0.00 64.86 65.28 2k3w h ILE 10 Cb 0.27 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 36.87 2k3w h ILE 10 CO -0.24 0.33 0.17 -0.78 0.00 0.00 0.00 178.15 177.64 2k3w h ASP 11 N 0.99 0.30 -0.49 1.72 1.82 0.16 0.13 116.42 121.04 2k3w h ASP 11 Ca 0.22 -0.01 -0.03 0.00 -0.39 0.00 0.00 57.03 56.82 2k3w h ASP 11 Cb 0.29 -0.07 -0.02 0.00 0.68 0.00 0.00 39.33 40.21 2k3w h ASP 11 CO -0.01 0.22 0.20 -0.07 -1.61 0.00 0.00 179.24 177.97 2k3w h LEU 12 N 0.36 0.68 -0.65 2.28 3.38 -0.87 -2.22 115.31 118.27 2k3w h LEU 12 Ca 0.10 -0.17 -0.12 0.00 0.09 0.00 0.00 57.88 57.78 2k3w h LEU 12 Cb -0.04 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 2k3w h LEU 12 CO -0.02 0.66 -0.27 1.62 0.09 0.00 0.00 178.44 180.52 2k3w h VAL 13 N 0.66 1.28 -0.04 1.22 3.04 -1.16 -1.08 116.25 120.16 2k3w h VAL 13 Ca 0.17 -1.40 0.02 0.00 -1.01 0.00 0.00 66.70 64.48 2k3w h VAL 13 Cb 0.19 1.28 -0.02 0.00 -2.01 0.00 0.00 31.29 30.72 2k3w h VAL 13 CO -0.01 0.46 -0.08 0.74 -1.01 0.00 0.00 177.57 177.67 2k3w h THR 14 N 0.66 0.78 -0.78 3.17 2.02 -0.47 -0.47 112.91 117.82 2k3w h THR 14 Ca 0.08 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.23 2k3w h THR 14 Cb 0.79 0.78 -0.04 0.00 -1.74 0.00 0.00 68.15 67.94 2k3w h THR 14 CO 0.07 0.00 0.37 0.50 0.37 0.00 0.00 175.52 176.82 2k3w h LYS 15 N -0.12 1.13 -0.80 6.66 3.64 -1.32 -2.15 116.57 123.59 2k3w h LYS 15 Ca 0.05 -0.17 0.15 0.00 -1.27 0.00 0.00 60.65 59.40 2k3w h LYS 15 Cb 0.19 -0.20 -0.09 0.00 -0.41 0.00 0.00 32.23 31.71 2k3w h LYS 15 CO -0.12 0.88 0.37 0.00 -2.27 0.00 0.00 179.45 178.32 2k3w h ALA 16 N 1.19 1.18 -0.59 5.00 0.00 -0.15 0.16 119.26 126.05 2k3w h ALA 16 Ca 0.27 0.10 -0.10 0.00 0.00 0.00 0.00 54.91 55.18 2k3w h ALA 16 Cb 0.13 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2k3w h ALA 16 CO -0.03 -0.15 -0.01 1.79 0.00 0.00 0.00 179.25 180.85 2k3w h THR 17 N 0.53 1.26 -0.67 0.00 1.35 -0.52 -0.77 112.91 114.10 2k3w h THR 17 Ca 0.44 -1.15 -0.06 0.00 -0.55 0.00 0.00 66.41 65.10 2k3w h THR 17 Cb 0.65 0.82 -0.03 0.00 -1.73 0.00 0.00 68.15 67.86 2k3w h THR 17 CO -0.38 0.41 0.19 1.05 -0.25 0.00 0.00 175.52 176.54 2k3w h GLU 18 N 0.94 1.06 -0.69 4.72 4.11 -0.38 -1.99 114.58 122.36 2k3w h GLU 18 Ca 0.17 -0.24 -0.07 0.00 0.07 0.00 0.00 59.36 59.28 2k3w h GLU 18 Cb 0.55 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.63 2k3w h GLU 18 CO 0.03 0.94 0.14 0.93 0.07 0.00 0.00 179.01 181.12 2k3w h GLU 19 N 0.99 1.11 -0.96 1.06 4.39 -0.50 -1.14 114.58 119.53 2k3w h GLU 19 Ca 0.21 -0.28 0.02 0.00 0.34 0.00 0.00 59.36 59.65 2k3w h GLU 19 Cb 0.34 -0.14 -0.05 0.00 -0.10 0.00 0.00 28.75 28.79 2k3w h GLU 19 CO -0.00 0.99 0.64 0.22 -1.16 0.00 0.00 179.01 179.70 2k3w h ASP 20 N 1.05 1.09 -0.62 1.42 1.82 -0.76 0.56 116.42 120.98 2k3w h ASP 20 Ca 0.21 -0.02 -0.09 0.00 -0.39 0.00 0.00 57.03 56.74 2k3w h ASP 20 Cb 0.40 -0.27 -0.02 0.00 0.68 0.00 0.00 39.33 40.12 2k3w h ASP 20 CO 0.01 0.78 0.05 0.11 -1.61 0.00 0.00 179.24 178.58 2k3w h LYS 21 N 1.29 1.07 -0.00 0.28 1.57 -0.81 -1.52 116.57 118.45 2k3w h LYS 21 Ca 0.36 -0.31 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 2k3w h LYS 21 Cb -0.11 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.08 2k3w h LYS 21 CO -0.09 1.02 0.00 0.00 -0.57 0.00 0.00 179.45 179.81 2k3w n ALA 22 N -2.48 2.19 -2.51 3.86 0.00 -0.48 -4.79 120.51 116.29 2k3w n ALA 22 Ca 0.04 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.32 2k3w n ALA 22 Cb 0.32 -1.00 0.01 0.00 0.00 0.00 0.00 19.45 18.78 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 -0.50 -2.23 -3.08 0.00 4.76 -0.57 -4.94 118.16 111.60 2k3w n LYS 23 Ca 0.00 0.69 -0.40 0.00 -2.87 0.00 0.00 58.31 55.73 2k3w n LYS 23 Cb 0.00 -5.00 -0.01 0.00 -1.84 0.00 0.00 35.03 28.18 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 -1.02 5.91 -0.24 4.39 4.13 0.19 -4.84 115.26 123.77 2k3w n ASN 24 Ca -0.13 -3.43 -0.02 0.00 1.68 0.00 0.00 54.58 52.68 2k3w n ASN 24 Cb 0.61 -1.15 0.09 0.00 -1.54 0.00 0.00 39.78 37.80 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 5.16 0.72 0.24 3.10 0.05 -1.87 0.49 116.97 124.86 2k3w h TYR 25 Ca 0.20 0.02 -0.00 0.00 0.05 0.00 0.00 58.73 59.00 2k3w h TYR 25 Cb 0.62 -0.23 -0.01 0.00 1.01 0.00 0.00 36.73 38.12 2k3w h TYR 25 CO 0.96 0.37 -0.17 0.93 -1.05 0.00 0.00 178.16 179.20 2k3w h GLU 26 N 0.74 -0.40 -0.25 4.88 5.08 -1.96 0.34 114.58 123.02 2k3w h GLU 26 Ca 0.29 0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.63 2k3w h GLU 26 Cb 0.13 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 2k3w h GLU 26 CO -0.16 -0.26 -0.04 1.49 -1.00 0.00 0.00 179.01 179.04 2k3w h GLU 27 N -0.41 0.46 -0.65 2.33 4.57 -1.90 -2.30 114.58 116.68 2k3w h GLU 27 Ca -0.02 -0.17 0.05 0.00 -1.18 0.00 0.00 59.36 58.05 2k3w h GLU 27 Cb 0.36 -0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 28.86 2k3w h GLU 27 CO 0.00 0.67 0.36 0.00 -1.18 0.00 0.00 179.01 178.86 2k3w h ALA 28 N 0.78 0.86 -0.30 2.92 0.00 0.11 -1.16 119.26 122.47 2k3w h ALA 28 Ca 0.07 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2k3w h ALA 28 Cb 0.49 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2k3w h ALA 28 CO 0.02 0.05 0.18 1.25 0.00 0.00 0.00 179.25 180.74 2k3w h LEU 29 N 0.68 0.36 -0.87 0.00 6.46 -0.19 0.65 115.31 122.40 2k3w h LEU 29 Ca 0.29 -0.06 -0.01 0.00 -0.12 0.00 0.00 57.88 57.98 2k3w h LEU 29 Cb 0.16 -0.09 -0.04 0.00 -0.73 0.00 0.00 40.66 39.96 2k3w h LEU 29 CO -0.17 0.32 0.52 -0.09 -0.62 0.00 0.00 178.44 178.40 2k3w h ARG 30 N 0.38 1.18 -0.65 1.25 1.12 -1.00 -1.76 114.38 114.89 2k3w h ARG 30 Ca 0.11 -0.11 -0.08 0.00 -1.11 0.00 0.00 59.98 58.78 2k3w h ARG 30 Cb 0.03 -0.25 -0.03 0.00 -0.01 0.00 0.00 29.97 29.71 2k3w h ARG 30 CO -0.02 0.84 0.09 -0.07 -3.11 0.00 0.00 179.97 177.69 2k3w h LEU 31 N 1.20 1.06 -0.37 3.80 3.38 -0.76 -1.93 115.31 121.68 2k3w h LEU 31 Ca 0.31 -0.27 0.01 0.00 0.09 0.00 0.00 57.88 58.02 2k3w h LEU 31 Cb -0.04 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.41 2k3w h LEU 31 CO -0.06 1.06 0.23 1.88 0.09 0.00 0.00 178.44 181.65 2k3w h TYR 32 N 1.01 0.44 -0.59 1.13 0.05 -0.22 0.16 116.97 118.95 2k3w h TYR 32 Ca 0.20 0.01 -0.04 0.00 0.05 0.00 0.00 58.73 58.95 2k3w h TYR 32 Cb 0.47 -0.15 -0.03 0.00 1.01 0.00 0.00 36.73 38.04 2k3w h TYR 32 CO 0.03 0.27 0.21 1.96 -1.05 0.00 0.00 178.16 179.58 2k3w h GLN 33 N 0.47 0.90 0.14 4.88 4.20 -1.21 -1.40 115.11 123.10 2k3w h GLN 33 Ca 0.14 -0.18 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 2k3w h GLN 33 Cb -0.03 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.61 2k3w h GLN 33 CO -0.04 0.79 -0.07 0.45 -0.67 0.00 0.00 178.83 179.29 2k3w h HIS 34 N 0.83 -0.18 -0.64 2.96 3.86 -0.96 -2.02 115.15 119.00 2k3w h HIS 34 Ca 0.19 -0.00 0.08 0.00 -1.16 0.00 0.00 60.37 59.48 2k3w h HIS 34 Cb 0.25 0.06 -0.06 0.00 1.06 0.00 0.00 27.41 28.72 2k3w h HIS 34 CO 0.01 0.06 0.30 0.00 0.86 0.00 0.00 177.93 179.16 2k3w h ALA 35 N 0.43 0.85 -0.68 2.45 0.00 -0.63 -0.98 119.26 120.69 2k3w h ALA 35 Ca -0.02 0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.97 2k3w h ALA 35 Cb 0.32 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 2k3w h ALA 35 CO 0.03 -0.08 0.42 0.28 0.00 0.00 0.00 179.25 179.90 2k3w h VAL 36 N 0.54 1.08 -0.33 0.00 2.07 -1.15 -0.96 116.25 117.49 2k3w h VAL 36 Ca 0.31 -0.28 0.06 0.00 0.82 0.00 0.00 66.70 67.61 2k3w h VAL 36 Cb 0.30 0.19 -0.06 0.00 -1.52 0.00 0.00 31.29 30.20 2k3w h VAL 36 CO -0.25 0.15 -0.04 -0.08 0.02 0.00 0.00 177.57 177.37 2k3w h GLU 37 N 0.82 0.04 -0.77 1.57 4.22 -0.43 -0.08 114.58 119.95 2k3w h GLU 37 Ca 0.28 -0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.68 2k3w h GLU 37 Cb 0.04 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.24 2k3w h GLU 37 CO -0.11 0.03 0.36 1.88 -2.18 0.00 0.00 179.01 178.98 2k3w h TYR 38 N 0.04 1.11 -0.07 0.92 0.05 -0.83 -0.45 116.97 117.74 2k3w h TYR 38 Ca 0.16 -0.05 -0.00 0.00 0.05 0.00 0.00 58.73 58.89 2k3w h TYR 38 Cb 0.23 -0.34 -0.00 0.00 1.01 0.00 0.00 36.73 37.63 2k3w h TYR 38 CO -0.27 0.81 0.04 0.74 -1.05 0.00 0.00 178.16 178.43 2k3w h PHE 39 N 1.10 0.10 -0.77 4.88 0.04 -0.11 -0.04 116.94 122.13 2k3w h PHE 39 Ca 0.26 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 61.00 2k3w h PHE 39 Cb 0.13 -0.03 -0.03 0.00 2.20 0.00 0.00 35.95 38.21 2k3w h PHE 39 CO 0.01 0.10 0.34 -0.07 -0.60 0.00 0.00 178.31 178.10 2k3w h LEU 40 N 0.07 1.03 -1.49 1.54 3.38 -0.83 -1.62 115.31 117.39 2k3w h LEU 40 Ca 0.03 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 2k3w h LEU 40 Cb 0.03 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 2k3w h LEU 40 CO -0.01 0.89 0.02 -0.74 0.09 0.00 0.00 178.44 178.70 2k3w h HIS 41 N 1.10 0.35 -0.16 1.13 2.76 -0.69 -2.68 115.15 116.95 2k3w h HIS 41 Ca 0.26 -0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.38 2k3w h HIS 41 Cb 0.16 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.01 2k3w h HIS 41 CO 0.01 0.34 -0.02 0.00 -1.30 0.00 0.00 177.93 176.96 2k3w h ALA 42 N 1.69 0.22 -0.38 5.26 0.00 -0.03 0.53 119.26 126.55 2k3w h ALA 42 Ca 0.08 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 2k3w h ALA 42 Cb 0.20 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2k3w h ALA 42 CO 0.00 -0.04 0.10 -0.84 0.00 0.00 0.00 179.25 178.48 2k3w h ILE 43 N 0.02 1.17 0.09 0.00 3.07 -1.25 2.15 117.51 122.76 2k3w h ILE 43 Ca 0.04 -0.58 -0.21 0.00 1.55 0.00 0.00 64.86 65.67 2k3w h ILE 43 Cb 0.44 0.77 0.00 0.00 -0.27 0.00 0.00 36.82 37.76 2k3w h ILE 43 CO 0.01 0.21 -1.04 0.11 -1.05 0.00 0.00 178.15 176.40 2k3w h LYS 44 N 0.54 0.19 0.00 0.16 1.57 -1.36 -3.38 116.57 114.29 2k3w h LYS 44 Ca 0.13 -0.33 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 2k3w h LYS 44 Cb 0.19 0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.62 2k3w h LYS 44 CO -0.01 1.16 -0.92 0.66 -0.57 0.00 0.00 179.45 179.77 2k3w n TYR 45 N -4.13 0.21 -4.61 -1.35 4.02 0.19 -4.90 117.16 106.58 2k3w n TYR 45 Ca -0.21 0.06 -0.26 0.00 -0.01 0.00 0.00 57.90 57.48 2k3w n TYR 45 Cb 0.79 -0.37 -0.14 0.00 -0.02 0.00 0.00 39.34 39.60 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 -3.14 1.42 0.25 -0.72 0.41 0.73 -4.99 118.70 112.66 2k3w s GLU 46 Ca 0.05 -1.04 -0.08 0.00 -0.41 0.00 0.00 54.97 53.50 2k3w s GLU 46 Cb 0.15 -1.60 -0.06 0.00 -1.78 0.00 0.00 34.13 30.83 2k3w s GLU 46 CO 0.79 0.40 0.54 0.00 -0.49 0.00 0.00 175.26 176.50 2k3w s ALA 47 N -0.88 3.60 0.16 5.21 0.00 -1.26 -4.04 121.76 124.55 2k3w s ALA 47 Ca 0.09 -0.39 -0.07 0.00 0.00 0.00 0.00 51.96 51.59 2k3w s ALA 47 Cb -0.09 -2.37 0.03 0.00 0.00 0.00 0.00 23.12 20.68 2k3w s ALA 47 CO 0.03 0.42 0.38 0.72 0.00 0.00 0.00 175.76 177.31 2k3w n HIS 48 N -0.41 -1.47 -2.00 0.00 8.25 -1.26 -5.03 115.22 113.30 2k3w n HIS 48 Ca -0.00 -0.78 -0.28 0.00 -0.26 0.00 0.00 57.72 56.39 2k3w n HIS 48 Cb 0.53 0.39 0.11 0.00 1.12 0.00 0.00 29.99 32.14 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 -1.97 4.17 -0.00 0.41 0.01 -1.26 -4.88 113.70 110.18 2k3w s SER 49 Ca 0.08 0.52 -0.25 0.00 1.31 0.00 0.00 55.95 57.61 2k3w s SER 49 Cb -0.02 -0.91 -0.19 0.00 0.21 0.00 0.00 66.02 65.11 2k3w s SER 49 CO 0.05 -2.07 1.32 0.44 0.41 0.00 0.00 173.24 173.38 2k3w h ASP 50 N -1.11 0.08 0.42 2.44 3.32 -2.02 -0.91 116.42 118.64 2k3w h ASP 50 Ca -0.45 -0.45 -0.03 0.00 0.02 0.00 0.00 57.03 56.12 2k3w h ASP 50 Cb 1.30 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 40.82 2k3w h ASP 50 CO 0.56 0.51 -0.14 0.07 -1.72 0.00 0.00 179.24 178.52 2k3w h LYS 51 N -0.35 0.00 -0.01 3.56 2.10 -1.99 -1.81 116.57 118.07 2k3w h LYS 51 Ca 0.01 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2k3w h LYS 51 Cb 0.48 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.81 2k3w h LYS 51 CO 0.01 0.14 -0.01 0.00 -2.00 0.00 0.00 179.45 177.59 2k3w h ALA 52 N 1.86 0.01 -0.30 0.07 0.00 -1.88 -1.16 119.26 117.85 2k3w h ALA 52 Ca -0.00 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.69 2k3w h ALA 52 Cb 0.39 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 2k3w h ALA 52 CO 0.02 -0.24 0.12 0.87 0.00 0.00 0.00 179.25 180.02 2k3w h LYS 53 N -0.45 0.26 -0.36 0.00 6.56 -0.65 -0.65 116.57 121.29 2k3w h LYS 53 Ca 0.00 -0.02 -0.00 0.00 -1.06 0.00 0.00 60.65 59.57 2k3w h LYS 53 Cb 0.49 -0.06 -0.02 0.00 -0.57 0.00 0.00 32.23 32.07 2k3w h LYS 53 CO 0.00 0.17 0.22 0.93 -2.06 0.00 0.00 179.45 178.71 2k3w h GLU 54 N 0.27 0.48 -0.60 3.15 5.08 -1.36 -1.02 114.58 120.58 2k3w h GLU 54 Ca 0.13 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.41 2k3w h GLU 54 Cb 0.08 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 2k3w h GLU 54 CO -0.12 0.34 0.20 1.03 -1.00 0.00 0.00 179.01 179.46 2k3w h SER 55 N 0.50 0.87 -0.20 1.42 0.87 0.15 -0.63 113.55 116.53 2k3w h SER 55 Ca 0.13 -0.20 -0.05 0.00 -1.23 0.00 0.00 61.79 60.44 2k3w h SER 55 Cb -0.02 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.71 2k3w h SER 55 CO -0.02 0.83 -0.08 0.40 -0.53 0.00 0.00 176.83 177.42 2k3w h ILE 56 N 0.85 1.30 0.80 2.23 1.08 -0.27 -1.16 117.51 122.35 2k3w h ILE 56 Ca 0.20 -1.12 -0.04 0.00 -0.39 0.00 0.00 64.86 63.50 2k3w h ILE 56 Cb 0.27 1.62 0.01 0.00 -3.07 0.00 0.00 36.82 35.64 2k3w h ILE 56 CO -0.01 0.34 -0.39 0.03 -0.69 0.00 0.00 178.15 177.44 2k3w h ARG 57 N 0.12 -1.04 -0.31 2.37 3.08 -1.13 0.76 114.38 118.23 2k3w h ARG 57 Ca 0.05 0.07 0.06 0.00 0.07 0.00 0.00 59.98 60.23 2k3w h ARG 57 Cb 0.56 0.24 -0.06 0.00 0.08 0.00 0.00 29.97 30.78 2k3w h ARG 57 CO 0.03 -0.69 -0.10 0.00 -1.07 0.00 0.00 179.97 178.13 2k3w h ALA 58 N -0.88 0.16 -0.62 0.04 0.00 -1.18 -1.21 119.26 115.58 2k3w h ALA 58 Ca -0.11 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2k3w h ALA 58 Cb 0.83 0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 2k3w h ALA 58 CO 0.18 -0.49 0.30 0.87 0.00 0.00 0.00 179.25 180.11 2k3w h LYS 59 N -0.04 0.88 -1.00 0.00 1.79 -1.11 -1.95 116.57 115.14 2k3w h LYS 59 Ca 0.15 -0.13 0.16 0.00 -2.18 0.00 0.00 60.65 58.66 2k3w h LYS 59 Cb 0.27 -0.16 -0.10 0.00 -1.58 0.00 0.00 32.23 30.67 2k3w h LYS 59 CO -0.34 0.70 0.62 0.00 -1.08 0.00 0.00 179.45 179.36 2k3w h VAL 61 N 0.85 1.21 -0.47 0.00 2.07 -0.52 -0.14 116.25 119.26 2k3w h VAL 61 Ca 0.54 -0.67 0.06 0.00 0.82 0.00 0.00 66.70 67.45 2k3w h VAL 61 Cb 0.73 1.34 -0.05 0.00 -1.52 0.00 0.00 31.29 31.80 2k3w h VAL 61 CO -0.33 0.20 0.19 1.56 0.02 0.00 0.00 177.57 179.21 2k3w h GLN 62 N 0.06 0.36 0.04 1.57 4.20 -0.39 0.46 115.11 121.41 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 0.28 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.98 2k3w h GLN 62 CO 0.00 0.24 -0.02 1.88 -0.67 0.00 0.00 178.83 180.26 2k3w h TYR 63 N 0.38 -0.05 -0.22 2.96 0.05 -0.73 -1.86 116.97 117.49 2k3w h TYR 63 Ca 0.22 -0.00 -0.00 0.00 0.05 0.00 0.00 58.73 59.00 2k3w h TYR 63 Cb 0.20 0.02 -0.01 0.00 1.01 0.00 0.00 36.73 37.94 2k3w h TYR 63 CO -0.14 0.12 0.14 -0.07 -1.05 0.00 0.00 178.16 177.15 2k3w h LEU 64 N -0.22 0.26 -0.69 3.88 3.38 -0.65 -1.19 115.31 120.08 2k3w h LEU 64 Ca -0.01 -0.04 0.12 0.00 0.09 0.00 0.00 57.88 58.05 2k3w h LEU 64 Cb 0.20 -0.07 -0.09 0.00 0.09 0.00 0.00 40.66 40.79 2k3w h LEU 64 CO 0.01 0.22 0.26 -0.78 0.09 0.00 0.00 178.44 178.24 2k3w h ASP 65 N 0.28 0.24 -0.55 -0.43 1.82 -0.00 0.42 116.42 118.19 2k3w h ASP 65 Ca 0.08 0.10 0.00 0.00 -0.39 0.00 0.00 57.03 56.82 2k3w h ASP 65 Cb 0.00 0.08 -0.03 0.00 0.68 0.00 0.00 39.33 40.07 2k3w h ASP 65 CO -0.02 0.11 0.35 0.03 -1.61 0.00 0.00 179.24 178.11 2k3w h ARG 66 N 0.42 0.74 -0.47 0.28 2.47 -0.85 -1.33 114.38 115.64 2k3w h ARG 66 Ca 0.37 -0.05 -0.04 0.00 -1.26 0.00 0.00 59.98 59.00 2k3w h ARG 66 Cb 0.52 -0.16 -0.02 0.00 -1.65 0.00 0.00 29.97 28.65 2k3w h ARG 66 CO -0.37 0.50 0.14 0.00 0.56 0.00 0.00 179.97 180.81 2k3w h ALA 67 N 1.19 1.38 0.37 0.04 0.00 0.48 -0.95 119.26 121.77 2k3w h ALA 67 Ca 0.20 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2k3w h ALA 67 Cb -0.06 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.54 2k3w h ALA 67 CO -0.04 0.46 -0.18 0.93 0.00 0.00 0.00 179.25 180.42 2k3w h GLU 68 N 0.67 -0.47 -0.44 0.00 4.39 0.54 -1.69 114.58 117.58 2k3w h GLU 68 Ca 0.16 0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.87 2k3w h GLU 68 Cb 0.20 0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.94 2k3w h GLU 68 CO -0.01 -0.19 0.21 1.57 -1.16 0.00 0.00 179.01 179.43 2k3w h LYS 69 N -0.72 0.61 -0.26 2.33 2.10 -1.19 0.61 116.57 120.06 2k3w h LYS 69 Ca -0.05 -0.07 0.01 0.00 -2.00 0.00 0.00 60.65 58.54 2k3w h LYS 69 Cb 0.50 -0.12 -0.02 0.00 -0.90 0.00 0.00 32.23 31.69 2k3w h LYS 69 CO 0.08 0.48 0.16 -0.07 -2.00 0.00 0.00 179.45 178.10 2k3w h LEU 70 N 0.61 0.27 -1.29 7.07 3.38 -1.00 -1.12 115.31 123.24 2k3w h LEU 70 Ca 0.15 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.07 2k3w h LEU 70 Cb 0.07 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2k3w h LEU 70 CO -0.02 0.20 -0.27 0.50 0.09 0.00 0.00 178.44 178.94 2k3w h LYS 71 N 0.33 0.00 0.39 1.13 3.64 -0.77 -1.77 116.57 119.51 2k3w h LYS 71 Ca 0.10 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.46 2k3w h LYS 71 Cb -0.02 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 2k3w h LYS 71 CO -0.03 0.27 -0.19 0.22 -2.27 0.00 0.00 179.45 177.45 2k3w h ASP 72 N 0.00 -0.44 0.85 4.20 3.58 0.35 -2.09 116.42 122.88 2k3w h ASP 72 Ca -0.00 -0.13 -0.19 0.00 0.42 0.00 0.00 57.03 57.13 2k3w h ASP 72 Cb 0.68 0.11 -0.02 0.00 1.72 0.00 0.00 39.33 41.82 2k3w h ASP 72 CO 0.03 -0.09 -0.91 0.10 -2.88 0.00 0.00 179.24 175.50 2k3w h TYR 73 N -0.84 0.05 -0.24 0.28 -0.00 -1.46 -3.24 116.97 111.52 2k3w h TYR 73 Ca -0.05 -0.03 0.02 0.00 0.00 0.00 0.00 58.73 58.67 2k3w h TYR 73 Cb 0.54 -0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.24 2k3w h TYR 73 CO 0.02 0.92 0.09 -0.07 -0.00 0.00 0.00 178.16 179.11 2k3w h LEU 74 N 0.01 0.12 0.00 0.10 3.38 -1.36 -3.52 115.31 114.04 2k3w h LEU 74 Ca -0.02 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2k3w h LEU 74 Cb 1.59 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.34 2k3w h LEU 74 CO 0.12 0.10 0.00 -1.14 0.09 0.00 0.00 178.44 177.61