#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 4.99 0.13 8.00 0.01 -1.26 -4.88 113.70 120.69 2k3w s SER 4 Ca 0.00 1.77 -0.18 0.00 1.31 0.00 0.00 55.95 58.85 2k3w s SER 4 Cb 0.00 -2.52 -0.03 0.00 0.21 0.00 0.00 66.02 63.68 2k3w s SER 4 CO 0.00 -1.71 1.72 0.74 0.41 0.00 0.00 173.24 174.40 2k3w h THR 5 N -0.73 1.14 -0.52 1.44 2.02 -1.99 -1.58 112.91 112.68 2k3w h THR 5 Ca -0.44 -0.38 -0.05 0.00 0.77 0.00 0.00 66.41 66.31 2k3w h THR 5 Cb 1.22 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 68.43 2k3w h THR 5 CO 0.54 0.14 0.12 0.25 0.37 0.00 0.00 175.52 176.94 2k3w h LEU 6 N 0.38 0.79 -0.17 2.58 6.46 -1.93 -1.62 115.31 121.81 2k3w h LEU 6 Ca 0.11 -0.24 0.05 0.00 -0.12 0.00 0.00 57.88 57.68 2k3w h LEU 6 Cb 0.08 -0.21 -0.05 0.00 -0.73 0.00 0.00 40.66 39.75 2k3w h LEU 6 CO -0.02 0.83 -0.15 -0.61 -0.62 0.00 0.00 178.44 177.87 2k3w h GLN 7 N 0.72 -0.16 -1.00 1.25 -0.00 -1.87 0.19 115.11 114.25 2k3w h GLN 7 Ca 0.16 0.01 0.05 0.00 -0.00 0.00 0.00 58.65 58.88 2k3w h GLN 7 Cb 0.35 0.04 -0.06 0.00 0.00 0.00 0.00 27.48 27.80 2k3w h GLN 7 CO 0.00 -0.11 0.65 -0.22 0.00 0.00 0.00 178.83 179.15 2k3w h LYS 8 N -0.16 1.17 -0.31 1.69 3.64 -1.10 0.19 116.57 121.69 2k3w h LYS 8 Ca 0.11 -0.07 0.04 0.00 -1.27 0.00 0.00 60.65 59.46 2k3w h LYS 8 Cb 0.32 -0.26 -0.04 0.00 -0.41 0.00 0.00 32.23 31.84 2k3w h LYS 8 CO -0.27 0.77 0.07 0.00 -2.27 0.00 0.00 179.45 177.76 2k3w h ALA 9 N 1.43 0.33 -0.53 5.00 0.00 -0.03 0.18 119.26 125.64 2k3w h ALA 9 Ca 0.42 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.31 2k3w h ALA 9 Cb 0.10 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2k3w h ALA 9 CO -0.15 -0.34 0.07 0.82 0.00 0.00 0.00 179.25 179.65 2k3w h ILE 10 N 0.19 1.25 -0.35 0.00 2.04 -0.26 -1.15 117.51 119.23 2k3w h ILE 10 Ca 0.14 -0.97 0.01 0.00 1.00 0.00 0.00 64.86 65.04 2k3w h ILE 10 Cb 0.14 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 2k3w h ILE 10 CO -0.18 0.35 0.22 -0.78 0.00 0.00 0.00 178.15 177.76 2k3w h ASP 11 N 0.77 0.37 -0.54 1.72 3.58 0.11 0.18 116.42 122.60 2k3w h ASP 11 Ca 0.16 -0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.55 2k3w h ASP 11 Cb 0.42 -0.08 -0.02 0.00 1.72 0.00 0.00 39.33 41.37 2k3w h ASP 11 CO 0.01 0.27 0.14 -0.07 -2.88 0.00 0.00 179.24 176.71 2k3w h LEU 12 N 0.45 0.81 -0.61 2.28 3.38 -0.53 -2.32 115.31 118.76 2k3w h LEU 12 Ca 0.13 -0.23 -0.12 0.00 0.09 0.00 0.00 57.88 57.76 2k3w h LEU 12 Cb -0.03 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 2k3w h LEU 12 CO -0.05 0.83 -0.17 1.62 0.09 0.00 0.00 178.44 180.76 2k3w h VAL 13 N 0.76 1.27 -0.06 1.22 3.04 -0.97 -0.94 116.25 120.57 2k3w h VAL 13 Ca 0.17 -1.30 0.02 0.00 -1.01 0.00 0.00 66.70 64.58 2k3w h VAL 13 Cb 0.32 1.08 -0.02 0.00 -2.01 0.00 0.00 31.29 30.66 2k3w h VAL 13 CO -0.00 0.45 -0.07 0.74 -1.01 0.00 0.00 177.57 177.68 2k3w h THR 14 N 0.81 0.80 -0.77 3.17 2.02 -0.43 -0.01 112.91 118.50 2k3w h THR 14 Ca 0.12 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.29 2k3w h THR 14 Cb 0.71 0.80 -0.04 0.00 -1.74 0.00 0.00 68.15 67.88 2k3w h THR 14 CO 0.05 0.00 0.43 0.50 0.37 0.00 0.00 175.52 176.88 2k3w h LYS 15 N -0.09 1.07 -0.73 6.66 3.64 -1.33 -2.16 116.57 123.63 2k3w h LYS 15 Ca 0.05 -0.12 0.12 0.00 -1.27 0.00 0.00 60.65 59.43 2k3w h LYS 15 Cb 0.16 -0.21 -0.08 0.00 -0.41 0.00 0.00 32.23 31.69 2k3w h LYS 15 CO -0.12 0.79 0.33 0.00 -2.27 0.00 0.00 179.45 178.18 2k3w h ALA 16 N 1.23 1.02 -0.67 5.00 0.00 -0.04 -0.72 119.26 125.07 2k3w h ALA 16 Ca 0.27 0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.22 2k3w h ALA 16 Cb 0.02 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2k3w h ALA 16 CO -0.05 -0.13 0.23 1.79 0.00 0.00 0.00 179.25 181.10 2k3w h THR 17 N 0.53 1.25 -0.88 0.00 1.35 -0.43 -1.14 112.91 113.58 2k3w h THR 17 Ca 0.38 -0.83 -0.02 0.00 -0.55 0.00 0.00 66.41 65.39 2k3w h THR 17 Cb 0.49 0.52 -0.04 0.00 -1.73 0.00 0.00 68.15 67.39 2k3w h THR 17 CO -0.33 0.32 0.48 1.05 -0.25 0.00 0.00 175.52 176.80 2k3w h GLU 18 N 0.97 1.23 -0.74 4.72 4.11 -0.71 -2.01 114.58 122.16 2k3w h GLU 18 Ca 0.22 -0.15 -0.06 0.00 0.07 0.00 0.00 59.36 59.44 2k3w h GLU 18 Cb 0.27 -0.24 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 2k3w h GLU 18 CO -0.01 0.90 0.22 0.93 0.07 0.00 0.00 179.01 181.12 2k3w h GLU 19 N 1.24 1.16 -0.99 1.06 4.39 -0.71 -1.19 114.58 119.54 2k3w h GLU 19 Ca 0.31 -0.26 0.03 0.00 0.34 0.00 0.00 59.36 59.78 2k3w h GLU 19 Cb 0.03 -0.16 -0.06 0.00 -0.10 0.00 0.00 28.75 28.46 2k3w h GLU 19 CO -0.05 0.99 0.65 0.22 -1.16 0.00 0.00 179.01 179.66 2k3w h ASP 20 N 1.11 1.10 -0.62 1.42 3.58 -0.59 0.59 116.42 123.00 2k3w h ASP 20 Ca 0.24 -0.02 -0.10 0.00 0.42 0.00 0.00 57.03 57.58 2k3w h ASP 20 Cb 0.32 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 41.09 2k3w h ASP 20 CO -0.01 0.76 0.02 0.11 -2.88 0.00 0.00 179.24 177.25 2k3w h LYS 21 N 1.28 1.09 -0.05 0.28 1.57 -0.74 -1.78 116.57 118.22 2k3w h LYS 21 Ca 0.38 -0.34 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 2k3w h LYS 21 Cb -0.04 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.16 2k3w h LYS 21 CO -0.11 1.05 0.00 0.00 -0.57 0.00 0.00 179.45 179.82 2k3w n ALA 22 N -2.48 2.22 -2.29 3.86 0.00 -0.51 -4.79 120.51 116.52 2k3w n ALA 22 Ca 0.03 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.33 2k3w n ALA 22 Cb 0.34 -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 -0.46 -1.22 -3.03 0.00 4.76 -0.67 -4.94 118.16 112.61 2k3w n LYS 23 Ca 0.00 0.71 -0.41 0.00 -2.87 0.00 0.00 58.31 55.74 2k3w n LYS 23 Cb 0.01 -5.02 0.00 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 -0.80 6.19 -0.37 4.39 4.13 0.19 -4.82 115.26 124.17 2k3w n ASN 24 Ca -0.17 -3.44 0.01 0.00 1.68 0.00 0.00 54.58 52.67 2k3w n ASN 24 Cb 0.63 -1.20 0.16 0.00 -1.54 0.00 0.00 39.78 37.84 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 5.22 1.22 0.20 3.10 0.05 -1.87 0.57 116.97 125.45 2k3w h TYR 25 Ca 0.21 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 59.02 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 1.00 0.67 -0.10 0.93 -1.05 0.00 0.00 178.16 179.61 2k3w h GLU 26 N 1.22 -0.26 -0.42 4.88 5.08 -1.95 0.39 114.58 123.53 2k3w h GLU 26 Ca 0.42 0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.73 2k3w h GLU 26 Cb 0.08 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 2k3w h GLU 26 CO -0.15 -0.06 0.01 1.49 -1.00 0.00 0.00 179.01 179.30 2k3w h GLU 27 N -0.42 0.73 -0.66 2.33 4.57 -1.87 -2.31 114.58 116.96 2k3w h GLU 27 Ca -0.03 -0.23 -0.03 0.00 -1.18 0.00 0.00 59.36 57.89 2k3w h GLU 27 Cb 0.32 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.81 2k3w h GLU 27 CO 0.05 0.81 0.29 0.00 -1.18 0.00 0.00 179.01 178.97 2k3w h ALA 28 N 0.90 0.85 -0.23 2.92 0.00 0.21 -2.46 119.26 121.45 2k3w h ALA 28 Ca 0.12 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.88 2k3w h ALA 28 Cb 0.47 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 2k3w h ALA 28 CO 0.02 0.45 0.13 1.25 0.00 0.00 0.00 179.25 181.10 2k3w h LEU 29 N 0.92 0.21 -0.68 0.00 5.85 -0.00 0.12 115.31 121.72 2k3w h LEU 29 Ca 0.22 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.93 2k3w h LEU 29 Cb 0.17 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 2k3w h LEU 29 CO -0.02 0.16 0.39 0.08 -0.34 0.00 0.00 178.44 178.70 2k3w h ARG 30 N 0.27 0.95 -0.66 1.25 0.11 -1.31 -1.68 114.38 113.30 2k3w h ARG 30 Ca 0.09 -0.10 -0.06 0.00 0.10 0.00 0.00 59.98 60.00 2k3w h ARG 30 Cb -0.00 -0.19 -0.03 0.00 1.11 0.00 0.00 29.97 30.86 2k3w h ARG 30 CO -0.04 0.70 0.17 -0.07 0.10 0.00 0.00 179.97 180.82 2k3w h LEU 31 N 0.94 0.98 -0.31 0.08 3.38 -1.10 -1.79 115.31 117.48 2k3w h LEU 31 Ca 0.24 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 58.03 2k3w h LEU 31 Cb 0.02 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 2k3w h LEU 31 CO -0.04 0.94 0.19 1.88 0.09 0.00 0.00 178.44 181.49 2k3w h TYR 32 N 0.99 0.35 -0.73 1.13 0.05 -0.09 0.16 116.97 118.82 2k3w h TYR 32 Ca 0.21 0.01 -0.04 0.00 0.05 0.00 0.00 58.73 58.96 2k3w h TYR 32 Cb 0.34 -0.11 -0.03 0.00 1.01 0.00 0.00 36.73 37.93 2k3w h TYR 32 CO 0.02 0.21 0.30 1.96 -1.05 0.00 0.00 178.16 179.60 2k3w h GLN 33 N 0.38 1.09 0.05 4.88 4.20 -1.10 -1.94 115.11 122.68 2k3w h GLN 33 Ca 0.12 -0.20 -0.00 0.00 0.06 0.00 0.00 58.65 58.63 2k3w h GLN 33 Cb -0.01 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 27.59 2k3w h GLN 33 CO -0.05 0.89 -0.03 0.45 -0.67 0.00 0.00 178.83 179.43 2k3w h HIS 34 N 1.05 -0.07 -0.53 2.96 3.86 -0.85 -2.07 115.15 119.50 2k3w h HIS 34 Ca 0.24 -0.00 0.10 0.00 -1.16 0.00 0.00 60.37 59.56 2k3w h HIS 34 Cb 0.21 0.02 -0.09 0.00 1.06 0.00 0.00 27.41 28.61 2k3w h HIS 34 CO 0.02 0.17 0.01 0.00 0.86 0.00 0.00 177.93 178.98 2k3w h ALA 35 N 0.64 0.52 -0.67 2.45 0.00 -0.56 -0.12 119.26 121.52 2k3w h ALA 35 Ca -0.01 0.15 0.05 0.00 0.00 0.00 0.00 54.91 55.10 2k3w h ALA 35 Cb 0.26 0.26 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 2k3w h ALA 35 CO 0.01 -0.38 0.40 0.28 0.00 0.00 0.00 179.25 179.56 2k3w h VAL 36 N 0.13 1.02 -0.31 0.00 2.07 -1.23 -0.60 116.25 117.33 2k3w h VAL 36 Ca 0.27 -0.26 0.06 0.00 0.82 0.00 0.00 66.70 67.59 2k3w h VAL 36 Cb 0.42 0.21 -0.05 0.00 -1.52 0.00 0.00 31.29 30.34 2k3w h VAL 36 CO -0.44 0.14 -0.03 -0.08 0.02 0.00 0.00 177.57 177.18 2k3w h GLU 37 N 0.75 0.06 -0.63 1.57 4.57 -0.32 0.14 114.58 120.72 2k3w h GLU 37 Ca 0.29 -0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.40 2k3w h GLU 37 Cb 0.11 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.66 2k3w h GLU 37 CO -0.15 0.04 0.15 1.88 -1.18 0.00 0.00 179.01 179.75 2k3w h TYR 38 N 0.06 1.04 -0.07 0.92 0.05 -0.77 -0.76 116.97 117.43 2k3w h TYR 38 Ca 0.15 -0.11 -0.00 0.00 0.05 0.00 0.00 58.73 58.82 2k3w h TYR 38 Cb 0.21 -0.30 -0.00 0.00 1.01 0.00 0.00 36.73 37.65 2k3w h TYR 38 CO -0.25 0.85 0.04 0.74 -1.05 0.00 0.00 178.16 178.49 2k3w h PHE 39 N 0.95 0.10 -0.80 4.88 0.04 -0.27 0.45 116.94 122.29 2k3w h PHE 39 Ca 0.20 -0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.93 2k3w h PHE 39 Cb 0.34 -0.03 -0.04 0.00 2.20 0.00 0.00 35.95 38.43 2k3w h PHE 39 CO 0.02 0.15 0.34 -0.07 -0.60 0.00 0.00 178.31 178.15 2k3w h LEU 40 N 0.02 1.09 -1.22 1.54 3.38 -0.86 -1.78 115.31 117.49 2k3w h LEU 40 Ca 0.03 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 2k3w h LEU 40 Cb 0.08 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 2k3w h LEU 40 CO -0.00 0.95 0.03 -0.74 0.09 0.00 0.00 178.44 178.77 2k3w h HIS 41 N 1.16 0.58 -0.22 1.13 2.76 -0.81 -2.76 115.15 117.00 2k3w h HIS 41 Ca 0.27 -0.05 -0.03 0.00 -2.20 0.00 0.00 60.37 58.36 2k3w h HIS 41 Cb 0.19 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 28.97 2k3w h HIS 41 CO 0.02 0.55 0.03 0.00 -1.30 0.00 0.00 177.93 177.22 2k3w h ALA 42 N 1.49 0.29 -0.25 5.26 0.00 -0.05 0.54 119.26 126.54 2k3w h ALA 42 Ca 0.12 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2k3w h ALA 42 Cb 0.30 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2k3w h ALA 42 CO 0.01 -0.03 0.02 -0.84 0.00 0.00 0.00 179.25 178.41 2k3w h ILE 43 N 0.15 1.15 0.11 0.00 3.07 -1.31 2.17 117.51 122.85 2k3w h ILE 43 Ca 0.06 -0.55 -0.23 0.00 1.55 0.00 0.00 64.86 65.69 2k3w h ILE 43 Cb 0.34 0.93 0.00 0.00 -0.27 0.00 0.00 36.82 37.82 2k3w h ILE 43 CO 0.01 0.19 -1.13 0.11 -1.05 0.00 0.00 178.15 176.27 2k3w h LYS 44 N 0.37 0.22 0.00 0.16 1.57 -1.29 -3.38 116.57 114.23 2k3w h LYS 44 Ca 0.09 -0.38 0.00 0.00 -1.87 0.00 0.00 60.65 58.48 2k3w h LYS 44 Cb 0.21 0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.66 2k3w h LYS 44 CO 0.00 1.18 -0.92 0.66 -0.57 0.00 0.00 179.45 179.81 2k3w n TYR 45 N -4.07 0.41 -5.17 -1.35 4.02 0.19 -4.86 117.16 106.33 2k3w n TYR 45 Ca -0.21 0.12 -0.30 0.00 -0.01 0.00 0.00 57.90 57.49 2k3w n TYR 45 Cb 0.83 -0.55 -0.16 0.00 -0.02 0.00 0.00 39.34 39.44 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 -3.21 2.35 0.16 -0.72 0.41 0.73 -5.00 118.70 113.43 2k3w s GLU 46 Ca 0.04 -0.84 -0.24 0.00 -0.41 0.00 0.00 54.97 53.52 2k3w s GLU 46 Cb 0.14 -2.01 -0.08 0.00 -1.78 0.00 0.00 34.13 30.39 2k3w s GLU 46 CO 0.78 0.36 0.76 0.00 -0.49 0.00 0.00 175.26 176.66 2k3w s ALA 47 N -0.14 3.46 0.04 5.21 0.00 -1.26 -4.04 121.76 125.03 2k3w s ALA 47 Ca -0.03 0.32 -0.27 0.00 0.00 0.00 0.00 51.96 51.98 2k3w s ALA 47 Cb -0.13 -2.92 0.07 0.00 0.00 0.00 0.00 23.12 20.14 2k3w s ALA 47 CO 0.03 0.30 0.65 -1.01 0.00 0.00 0.00 175.76 175.73 2k3w s HIS 48 N -1.17 -0.60 1.08 0.00 3.76 -1.26 -5.07 115.29 112.02 2k3w s HIS 48 Ca 0.36 0.76 -0.13 0.00 -0.15 0.00 0.00 55.06 55.90 2k3w s HIS 48 Cb -0.22 0.48 0.19 0.00 1.11 0.00 0.00 32.58 34.14 2k3w s HIS 48 CO 0.25 -0.72 0.77 0.43 -0.85 0.00 0.00 174.74 174.63 2k3w n SER 49 N 0.32 -1.44 0.13 1.40 7.64 -1.26 -4.66 113.62 115.75 2k3w n SER 49 Ca -0.18 0.04 -0.14 0.00 1.01 0.00 0.00 58.87 59.60 2k3w n SER 49 Cb 0.61 -1.24 -0.07 0.00 -1.01 0.00 0.00 64.21 62.49 2k3w n SER 49 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 2k3w h ASP 50 N -2.26 -0.25 -0.92 6.43 3.58 -2.02 -1.50 116.42 119.48 2k3w h ASP 50 Ca -0.54 0.01 0.20 0.00 0.42 0.00 0.00 57.03 57.13 2k3w h ASP 50 Cb 1.32 0.07 -0.07 0.00 1.72 0.00 0.00 39.33 42.37 2k3w h ASP 50 CO 0.43 -0.17 0.60 0.07 -2.88 0.00 0.00 179.24 177.29 2k3w h LYS 51 N -0.28 0.44 0.29 0.28 2.10 -1.99 0.11 116.57 117.53 2k3w h LYS 51 Ca -0.02 -0.03 -0.01 0.00 -2.00 0.00 0.00 60.65 58.59 2k3w h LYS 51 Cb 0.22 -0.10 0.00 0.00 -0.90 0.00 0.00 32.23 31.45 2k3w h LYS 51 CO 0.03 0.29 -0.14 0.00 -2.00 0.00 0.00 179.45 177.63 2k3w h ALA 52 N 1.61 -0.40 -0.33 0.07 0.00 -1.70 -1.42 119.26 117.10 2k3w h ALA 52 Ca 0.48 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 55.30 2k3w h ALA 52 Cb 1.14 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 19.03 2k3w h ALA 52 CO -0.20 -0.60 -0.04 0.87 0.00 0.00 0.00 179.25 179.27 2k3w h LYS 53 N -0.63 0.04 -0.99 0.00 6.56 0.02 0.47 116.57 122.05 2k3w h LYS 53 Ca -0.04 -0.00 0.13 0.00 -1.06 0.00 0.00 60.65 59.68 2k3w h LYS 53 Cb 0.45 -0.01 -0.09 0.00 -0.57 0.00 0.00 32.23 32.01 2k3w h LYS 53 CO 0.07 0.03 0.62 0.93 -2.06 0.00 0.00 179.45 179.04 2k3w h GLU 54 N 0.04 0.90 -0.55 3.15 5.08 -0.84 0.38 114.58 122.75 2k3w h GLU 54 Ca 0.16 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.44 2k3w h GLU 54 Cb 0.23 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 2k3w h GLU 54 CO -0.30 0.60 0.23 1.03 -1.00 0.00 0.00 179.01 179.56 2k3w h SER 55 N 0.93 0.74 -0.25 1.42 0.87 0.19 0.18 113.55 117.63 2k3w h SER 55 Ca 0.50 -0.16 -0.08 0.00 -1.23 0.00 0.00 61.79 60.82 2k3w h SER 55 Cb 0.57 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.33 2k3w h SER 55 CO -0.27 0.70 -0.15 0.40 -0.53 0.00 0.00 176.83 176.98 2k3w h ILE 56 N 0.74 1.30 -0.57 2.23 1.08 0.38 -0.15 117.51 122.53 2k3w h ILE 56 Ca 0.18 -1.26 -0.06 0.00 -0.39 0.00 0.00 64.86 63.34 2k3w h ILE 56 Cb 0.18 1.57 -0.03 0.00 -3.07 0.00 0.00 36.82 35.47 2k3w h ILE 56 CO -0.02 0.39 0.13 0.03 -0.69 0.00 0.00 178.15 177.99 2k3w h ARG 57 N 0.27 0.88 -0.06 2.37 3.08 -0.22 0.67 114.38 121.37 2k3w h ARG 57 Ca 0.05 -0.19 -0.03 0.00 0.07 0.00 0.00 59.98 59.88 2k3w h ARG 57 Cb 0.67 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.59 2k3w h ARG 57 CO 0.04 0.80 -0.08 0.00 -1.07 0.00 0.00 179.97 179.66 2k3w h ALA 58 N 1.29 0.09 -0.35 0.04 0.00 -0.55 -2.46 119.26 117.34 2k3w h ALA 58 Ca 0.18 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 2k3w h ALA 58 Cb 0.32 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2k3w h ALA 58 CO 0.00 -0.08 -0.26 0.87 0.00 0.00 0.00 179.25 179.78 2k3w h LYS 59 N -0.29 0.71 -0.21 0.00 1.79 -0.88 -2.44 116.57 115.25 2k3w h LYS 59 Ca 0.01 -0.29 0.04 0.00 -2.18 0.00 0.00 60.65 58.23 2k3w h LYS 59 Cb 0.60 -0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 31.18 2k3w h LYS 59 CO 0.02 0.89 -0.07 0.00 -1.08 0.00 0.00 179.45 179.21 2k3w h VAL 61 N -0.03 1.12 -0.11 0.00 3.04 -1.33 -1.03 116.25 117.93 2k3w h VAL 61 Ca 0.10 -0.64 -0.04 0.00 -1.01 0.00 0.00 66.70 65.12 2k3w h VAL 61 Cb 0.18 1.35 -0.00 0.00 -2.01 0.00 0.00 31.29 30.81 2k3w h VAL 61 CO -0.23 0.18 -0.09 1.56 -1.01 0.00 0.00 177.57 177.99 2k3w h GLN 62 N 0.00 0.25 -0.16 4.17 4.20 -0.59 -1.34 115.11 121.64 2k3w h GLN 62 Ca -0.00 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 58.58 2k3w h GLN 62 Cb 0.33 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 2k3w h GLN 62 CO 0.02 0.64 0.08 1.88 -0.67 0.00 0.00 178.83 180.79 2k3w h TYR 63 N -0.15 0.23 -0.10 2.96 0.05 -0.26 -2.15 116.97 117.56 2k3w h TYR 63 Ca 0.02 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.79 2k3w h TYR 63 Cb 0.59 -0.07 -0.00 0.00 1.01 0.00 0.00 36.73 38.25 2k3w h TYR 63 CO 0.08 0.26 0.06 -0.07 -1.05 0.00 0.00 178.16 177.44 2k3w h LEU 64 N 0.14 0.11 -0.74 3.88 3.38 -1.24 -0.93 115.31 119.92 2k3w h LEU 64 Ca 0.06 -0.01 0.16 0.00 0.09 0.00 0.00 57.88 58.17 2k3w h LEU 64 Cb 0.11 -0.03 -0.11 0.00 0.09 0.00 0.00 40.66 40.73 2k3w h LEU 64 CO -0.01 0.09 0.21 -0.78 0.09 0.00 0.00 178.44 178.04 2k3w h ASP 65 N 0.13 0.07 -0.51 -0.43 1.82 -1.07 0.43 116.42 116.85 2k3w h ASP 65 Ca 0.04 0.14 -0.00 0.00 -0.39 0.00 0.00 57.03 56.81 2k3w h ASP 65 Cb -0.01 0.17 -0.02 0.00 0.68 0.00 0.00 39.33 40.15 2k3w h ASP 65 CO -0.01 -0.01 0.30 0.03 -1.61 0.00 0.00 179.24 177.95 2k3w h ARG 66 N 0.30 0.70 -0.59 0.28 2.47 -0.82 -1.72 114.38 115.00 2k3w h ARG 66 Ca 0.42 -0.07 -0.01 0.00 -1.26 0.00 0.00 59.98 59.06 2k3w h ARG 66 Cb 0.70 -0.15 -0.03 0.00 -1.65 0.00 0.00 29.97 28.84 2k3w h ARG 66 CO -0.49 0.52 0.31 0.00 0.56 0.00 0.00 179.97 180.87 2k3w h ALA 67 N 1.14 1.44 0.37 0.04 0.00 0.88 -0.78 119.26 122.36 2k3w h ALA 67 Ca 0.18 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2k3w h ALA 67 Cb 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.55 2k3w h ALA 67 CO -0.03 0.46 -0.18 0.93 0.00 0.00 0.00 179.25 180.42 2k3w h GLU 68 N 0.82 -0.48 -0.60 0.00 5.08 0.34 -1.26 114.58 118.47 2k3w h GLU 68 Ca 0.21 0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.59 2k3w h GLU 68 Cb 0.04 0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 2k3w h GLU 68 CO -0.03 -0.20 0.34 1.57 -1.00 0.00 0.00 179.01 179.68 2k3w h LYS 69 N -0.73 0.82 -0.18 2.33 2.10 -1.21 0.25 116.57 119.95 2k3w h LYS 69 Ca -0.05 -0.08 0.00 0.00 -2.00 0.00 0.00 60.65 58.52 2k3w h LYS 69 Cb 0.50 -0.17 -0.01 0.00 -0.90 0.00 0.00 32.23 31.66 2k3w h LYS 69 CO 0.08 0.60 0.11 -0.07 -2.00 0.00 0.00 179.45 178.17 2k3w h LEU 70 N 0.83 0.21 -1.19 7.07 3.38 -0.99 -1.26 115.31 123.37 2k3w h LEU 70 Ca 0.22 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 58.10 2k3w h LEU 70 Cb 0.01 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2k3w h LEU 70 CO -0.04 0.18 -0.27 0.50 0.09 0.00 0.00 178.44 178.91 2k3w h LYS 71 N 0.22 0.00 0.45 1.13 3.64 -0.80 -1.75 116.57 119.45 2k3w h LYS 71 Ca 0.06 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.42 2k3w h LYS 71 Cb 0.01 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 2k3w h LYS 71 CO -0.01 0.27 -0.21 0.22 -2.27 0.00 0.00 179.45 177.44 2k3w h ASP 72 N 0.00 -0.51 0.96 4.20 1.82 0.66 -1.64 116.42 121.91 2k3w h ASP 72 Ca -0.00 -0.09 -0.18 0.00 -0.39 0.00 0.00 57.03 56.36 2k3w h ASP 72 Cb 0.73 0.13 -0.03 0.00 0.68 0.00 0.00 39.33 40.84 2k3w h ASP 72 CO 0.03 -0.17 -0.87 0.10 -1.61 0.00 0.00 179.24 176.73 2k3w h TYR 73 N -0.88 0.00 -0.16 0.28 -0.00 -1.49 -3.24 116.97 111.48 2k3w h TYR 73 Ca -0.06 0.00 0.01 0.00 0.00 0.00 0.00 58.73 58.68 2k3w h TYR 73 Cb 0.57 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.28 2k3w h TYR 73 CO 0.01 0.87 0.08 -0.07 -0.00 0.00 0.00 178.16 179.04 2k3w h LEU 74 N 0.00 0.12 0.00 0.10 3.38 -1.33 -3.52 115.31 114.06 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 1.58 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.31 2k3w h LEU 74 CO 0.11 0.09 0.00 -1.14 0.09 0.00 0.00 178.44 177.60