#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 -1.11 -0.09 8.00 2.88 -1.26 -4.67 113.62 117.37 2k3w n SER 4 Ca 0.00 0.23 -0.09 0.00 -1.33 0.00 0.00 58.87 57.68 2k3w n SER 4 Cb 0.00 -1.29 -0.02 0.00 -0.75 0.00 0.00 64.21 62.15 2k3w n SER 4 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 2k3w h THR 5 N -1.95 1.10 -0.44 2.46 2.02 -1.98 -0.05 112.91 114.07 2k3w h THR 5 Ca -0.47 -0.21 -0.10 0.00 0.77 0.00 0.00 66.41 66.40 2k3w h THR 5 Cb 1.29 0.67 -0.01 0.00 -1.74 0.00 0.00 68.15 68.36 2k3w h THR 5 CO 0.40 0.10 -0.10 0.25 0.37 0.00 0.00 175.52 176.53 2k3w h LEU 6 N 0.42 0.85 -0.67 2.58 5.85 -1.91 -1.28 115.31 121.15 2k3w h LEU 6 Ca 0.11 -0.36 0.04 0.00 0.84 0.00 0.00 57.88 58.51 2k3w h LEU 6 Cb -0.02 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 40.74 2k3w h LEU 6 CO -0.02 1.01 0.40 -0.61 -0.34 0.00 0.00 178.44 178.88 2k3w h GLN 7 N 0.68 0.75 -0.59 1.25 5.75 -1.83 -0.22 115.11 120.89 2k3w h GLN 7 Ca 0.11 -0.05 -0.07 0.00 -0.15 0.00 0.00 58.65 58.50 2k3w h GLN 7 Cb 0.63 -0.17 -0.02 0.00 1.07 0.00 0.00 27.48 28.99 2k3w h GLN 7 CO 0.04 0.50 0.09 -0.22 -2.65 0.00 0.00 178.83 176.59 2k3w h LYS 8 N 0.78 0.95 -0.79 1.69 3.64 -0.84 -1.49 116.57 120.51 2k3w h LYS 8 Ca 0.28 -0.24 0.01 0.00 -1.27 0.00 0.00 60.65 59.43 2k3w h LYS 8 Cb 0.07 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 31.73 2k3w h LYS 8 CO -0.13 0.89 0.52 0.00 -2.27 0.00 0.00 179.45 178.46 2k3w h ALA 9 N 1.19 1.01 -0.58 5.00 0.00 0.08 -0.98 119.26 124.97 2k3w h ALA 9 Ca 0.18 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 2k3w h ALA 9 Cb 0.41 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2k3w h ALA 9 CO 0.01 0.40 0.11 0.82 0.00 0.00 0.00 179.25 180.58 2k3w h ILE 10 N 1.05 1.25 -0.52 0.00 2.04 -0.69 -1.64 117.51 119.01 2k3w h ILE 10 Ca 0.30 -0.96 -0.01 0.00 1.00 0.00 0.00 64.86 65.19 2k3w h ILE 10 Cb -0.10 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 2k3w h ILE 10 CO -0.07 0.35 0.29 -0.78 0.00 0.00 0.00 178.15 177.94 2k3w h ASP 11 N 0.86 0.64 -0.47 1.72 3.58 -0.63 0.24 116.42 122.36 2k3w h ASP 11 Ca 0.18 -0.08 -0.05 0.00 0.42 0.00 0.00 57.03 57.50 2k3w h ASP 11 Cb 0.40 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 41.27 2k3w h ASP 11 CO 0.01 0.54 0.10 -0.07 -2.88 0.00 0.00 179.24 176.94 2k3w h LEU 12 N 0.70 0.72 -0.70 2.28 3.38 -1.02 -2.21 115.31 118.45 2k3w h LEU 12 Ca 0.18 -0.24 -0.12 0.00 0.09 0.00 0.00 57.88 57.80 2k3w h LEU 12 Cb 0.03 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2k3w h LEU 12 CO -0.03 0.77 -0.28 1.62 0.09 0.00 0.00 178.44 180.61 2k3w h VAL 13 N 0.63 1.28 -0.26 1.22 3.04 -1.15 -0.68 116.25 120.33 2k3w h VAL 13 Ca 0.15 -1.40 0.02 0.00 -1.01 0.00 0.00 66.70 64.45 2k3w h VAL 13 Cb 0.34 1.32 -0.02 0.00 -2.01 0.00 0.00 31.29 30.92 2k3w h VAL 13 CO 0.00 0.46 0.13 0.74 -1.01 0.00 0.00 177.57 177.89 2k3w h THR 14 N 0.59 1.00 -0.57 3.17 2.02 -0.76 -0.85 112.91 117.51 2k3w h THR 14 Ca 0.07 -0.09 -0.05 0.00 0.77 0.00 0.00 66.41 67.11 2k3w h THR 14 Cb 0.78 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 67.87 2k3w h THR 14 CO 0.06 0.05 0.17 0.50 0.37 0.00 0.00 175.52 176.68 2k3w h LYS 15 N 0.27 0.89 -0.84 6.66 3.64 -1.26 -2.47 116.57 123.46 2k3w h LYS 15 Ca 0.10 -0.20 0.14 0.00 -1.27 0.00 0.00 60.65 59.43 2k3w h LYS 15 Cb 0.03 -0.13 -0.09 0.00 -0.41 0.00 0.00 32.23 31.62 2k3w h LYS 15 CO -0.07 0.81 0.43 0.00 -2.27 0.00 0.00 179.45 178.35 2k3w h ALA 16 N 1.04 1.26 -0.41 5.00 0.00 -0.36 0.10 119.26 125.89 2k3w h ALA 16 Ca 0.18 0.09 -0.10 0.00 0.00 0.00 0.00 54.91 55.08 2k3w h ALA 16 Cb 0.29 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2k3w h ALA 16 CO -0.00 -0.09 -0.15 1.79 0.00 0.00 0.00 179.25 180.79 2k3w h THR 17 N 0.61 1.26 -0.57 0.00 1.35 -0.81 0.09 112.91 114.85 2k3w h THR 17 Ca 0.46 -1.23 -0.08 0.00 -0.55 0.00 0.00 66.41 65.01 2k3w h THR 17 Cb 0.64 1.11 -0.02 0.00 -1.73 0.00 0.00 68.15 68.15 2k3w h THR 17 CO -0.36 0.41 0.03 1.05 -0.25 0.00 0.00 175.52 176.40 2k3w h GLU 18 N 0.69 0.99 -0.55 4.72 4.11 -0.52 -2.11 114.58 121.90 2k3w h GLU 18 Ca 0.11 -0.30 -0.11 0.00 0.07 0.00 0.00 59.36 59.13 2k3w h GLU 18 Cb 0.64 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.77 2k3w h GLU 18 CO 0.04 0.97 -0.09 0.93 0.07 0.00 0.00 179.01 180.94 2k3w h GLU 19 N 0.87 1.03 -0.86 1.06 4.39 -0.64 -1.63 114.58 118.80 2k3w h GLU 19 Ca 0.17 -0.37 0.04 0.00 0.34 0.00 0.00 59.36 59.53 2k3w h GLU 19 Cb 0.50 -0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 29.03 2k3w h GLU 19 CO 0.02 1.06 0.55 0.22 -1.16 0.00 0.00 179.01 179.70 2k3w h ASP 20 N 0.91 0.90 -0.59 1.42 3.58 -0.77 0.51 116.42 122.38 2k3w h ASP 20 Ca 0.15 -0.00 -0.09 0.00 0.42 0.00 0.00 57.03 57.51 2k3w h ASP 20 Cb 0.65 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.48 2k3w h ASP 20 CO 0.05 0.62 0.03 0.11 -2.88 0.00 0.00 179.24 177.17 2k3w h LYS 21 N 1.06 1.04 -0.06 0.28 1.57 -1.13 -1.54 116.57 117.79 2k3w h LYS 21 Ca 0.35 -0.30 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2k3w h LYS 21 Cb 0.03 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.23 2k3w h LYS 21 CO -0.12 0.99 0.00 0.00 -0.57 0.00 0.00 179.45 179.75 2k3w n ALA 22 N -2.48 2.14 -1.57 3.86 0.00 -0.45 -4.77 120.51 117.24 2k3w n ALA 22 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.34 2k3w n ALA 22 Cb 0.32 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.73 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 -0.44 -0.97 -2.56 0.00 4.76 -0.58 -4.92 118.16 113.46 2k3w n LYS 23 Ca 0.00 0.91 -0.42 0.00 -2.87 0.00 0.00 58.31 55.93 2k3w n LYS 23 Cb 0.01 -5.02 0.01 0.00 -1.84 0.00 0.00 35.03 28.19 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 -0.26 6.40 -0.34 4.39 4.13 0.17 -4.78 115.26 124.96 2k3w n ASN 24 Ca -0.14 -3.31 0.02 0.00 1.68 0.00 0.00 54.58 52.83 2k3w n ASN 24 Cb 0.48 -1.34 0.17 0.00 -1.54 0.00 0.00 39.78 37.55 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 5.21 1.08 0.25 3.10 0.05 -1.86 0.55 116.97 125.35 2k3w h TYR 25 Ca 0.40 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 59.20 2k3w h TYR 25 Cb 0.52 -0.35 0.00 0.00 1.01 0.00 0.00 36.73 37.91 2k3w h TYR 25 CO 1.24 0.53 -0.12 0.93 -1.05 0.00 0.00 178.16 179.69 2k3w h GLU 26 N 1.04 -0.33 -0.20 4.88 5.08 -1.95 0.39 114.58 123.50 2k3w h GLU 26 Ca 0.41 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.76 2k3w h GLU 26 Cb 0.22 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 2k3w h GLU 26 CO -0.19 -0.20 -0.01 1.49 -1.00 0.00 0.00 179.01 179.11 2k3w h GLU 27 N -0.37 0.36 -0.55 2.33 4.57 -1.86 -2.27 114.58 116.78 2k3w h GLU 27 Ca -0.03 -0.12 0.07 0.00 -1.18 0.00 0.00 59.36 58.10 2k3w h GLU 27 Cb 0.28 -0.03 -0.06 0.00 -0.16 0.00 0.00 28.75 28.79 2k3w h GLU 27 CO 0.06 0.57 0.24 0.00 -1.18 0.00 0.00 179.01 178.69 2k3w h ALA 28 N 0.78 0.71 -0.34 2.92 0.00 0.19 -1.34 119.26 122.18 2k3w h ALA 28 Ca 0.06 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.04 2k3w h ALA 28 Cb 0.41 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 2k3w h ALA 28 CO 0.01 -0.14 0.18 1.25 0.00 0.00 0.00 179.25 180.55 2k3w h LEU 29 N 0.45 0.27 -0.65 0.00 5.85 -0.09 0.22 115.31 121.36 2k3w h LEU 29 Ca 0.26 0.01 0.04 0.00 0.84 0.00 0.00 57.88 59.03 2k3w h LEU 29 Cb 0.25 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 2k3w h LEU 29 CO -0.23 0.20 0.39 0.03 -0.34 0.00 0.00 178.44 178.49 2k3w h ARG 30 N 0.37 0.74 -0.62 1.25 3.08 -0.79 -1.29 114.38 117.11 2k3w h ARG 30 Ca 0.14 -0.04 -0.10 0.00 0.07 0.00 0.00 59.98 60.05 2k3w h ARG 30 Cb 0.03 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 29.90 2k3w h ARG 30 CO -0.08 0.49 0.02 -0.07 -1.07 0.00 0.00 179.97 179.25 2k3w h LEU 31 N 0.76 1.07 -0.04 3.04 3.38 -0.68 -1.94 115.31 120.90 2k3w h LEU 31 Ca 0.27 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2k3w h LEU 31 Cb 0.07 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 40.52 2k3w h LEU 31 CO -0.13 1.10 0.01 1.88 0.09 0.00 0.00 178.44 181.39 2k3w h TYR 32 N 1.00 0.01 -0.53 1.13 0.05 0.12 0.20 116.97 118.95 2k3w h TYR 32 Ca 0.18 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.93 2k3w h TYR 32 Cb 0.55 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.26 2k3w h TYR 32 CO 0.04 0.00 0.23 1.96 -1.05 0.00 0.00 178.16 179.34 2k3w h GLN 33 N 0.02 0.78 0.14 4.88 4.20 -1.21 -1.65 115.11 122.27 2k3w h GLN 33 Ca 0.02 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.59 2k3w h GLN 33 Cb 0.01 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.66 2k3w h GLN 33 CO -0.02 0.67 -0.07 0.45 -0.67 0.00 0.00 178.83 179.19 2k3w h HIS 34 N 0.71 -0.17 -0.61 2.96 3.86 -1.12 -1.96 115.15 118.82 2k3w h HIS 34 Ca 0.18 -0.00 0.10 0.00 -1.16 0.00 0.00 60.37 59.49 2k3w h HIS 34 Cb 0.17 0.06 -0.08 0.00 1.06 0.00 0.00 27.41 28.62 2k3w h HIS 34 CO 0.00 -0.00 0.19 0.00 0.86 0.00 0.00 177.93 178.98 2k3w h ALA 35 N 0.53 0.76 -0.64 2.45 0.00 -0.49 -0.32 119.26 121.55 2k3w h ALA 35 Ca -0.02 0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.03 2k3w h ALA 35 Cb 0.25 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 2k3w h ALA 35 CO 0.03 -0.24 0.39 0.28 0.00 0.00 0.00 179.25 179.72 2k3w h VAL 36 N 0.35 1.06 -0.34 0.00 2.07 -1.13 -0.68 116.25 117.58 2k3w h VAL 36 Ca 0.31 -0.26 0.07 0.00 0.82 0.00 0.00 66.70 67.64 2k3w h VAL 36 Cb 0.42 0.23 -0.06 0.00 -1.52 0.00 0.00 31.29 30.36 2k3w h VAL 36 CO -0.34 0.14 -0.05 -0.08 0.02 0.00 0.00 177.57 177.25 2k3w h GLU 37 N 0.76 0.03 -0.74 1.57 4.81 -0.29 0.40 114.58 121.12 2k3w h GLU 37 Ca 0.27 -0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.45 2k3w h GLU 37 Cb 0.06 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.39 2k3w h GLU 37 CO -0.12 0.02 0.30 1.88 -0.73 0.00 0.00 179.01 180.36 2k3w h TYR 38 N 0.03 1.11 0.07 0.92 0.05 -0.76 0.40 116.97 118.79 2k3w h TYR 38 Ca 0.17 -0.07 -0.00 0.00 0.05 0.00 0.00 58.73 58.87 2k3w h TYR 38 Cb 0.24 -0.33 0.00 0.00 1.01 0.00 0.00 36.73 37.65 2k3w h TYR 38 CO -0.29 0.84 -0.03 0.74 -1.05 0.00 0.00 178.16 178.37 2k3w h PHE 39 N 1.07 -0.08 -0.60 4.88 0.04 -0.11 0.15 116.94 122.28 2k3w h PHE 39 Ca 0.25 -0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.99 2k3w h PHE 39 Cb 0.20 0.03 -0.03 0.00 2.20 0.00 0.00 35.95 38.35 2k3w h PHE 39 CO 0.02 -0.01 0.27 -0.07 -0.60 0.00 0.00 178.31 177.92 2k3w h LEU 40 N -0.14 0.81 -1.65 1.54 3.38 -0.75 -1.87 115.31 116.63 2k3w h LEU 40 Ca -0.01 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.77 2k3w h LEU 40 Cb 0.11 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2k3w h LEU 40 CO 0.02 0.73 -0.20 -0.74 0.09 0.00 0.00 178.44 178.34 2k3w h HIS 41 N 0.83 0.00 -0.08 1.13 2.76 -0.68 -2.85 115.15 116.26 2k3w h HIS 41 Ca 0.20 0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.34 2k3w h HIS 41 Cb 0.15 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.11 2k3w h HIS 41 CO 0.00 0.20 -0.10 0.00 -1.30 0.00 0.00 177.93 176.74 2k3w h ALA 42 N 1.80 0.11 -0.16 5.26 0.00 0.10 -0.72 119.26 125.66 2k3w h ALA 42 Ca -0.00 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 2k3w h ALA 42 Cb 0.38 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2k3w h ALA 42 CO 0.03 -0.04 -0.04 -0.84 0.00 0.00 0.00 179.25 178.35 2k3w h ILE 43 N -0.25 1.13 0.13 0.00 3.07 -1.27 0.46 117.51 120.78 2k3w h ILE 43 Ca 0.01 -0.54 -0.24 0.00 1.55 0.00 0.00 64.86 65.64 2k3w h ILE 43 Cb 0.63 1.06 0.01 0.00 -0.27 0.00 0.00 36.82 38.25 2k3w h ILE 43 CO 0.02 0.17 -1.19 0.11 -1.05 0.00 0.00 178.15 176.22 2k3w h LYS 44 N 0.23 0.27 0.00 0.16 1.57 -1.49 -3.37 116.57 113.94 2k3w h LYS 44 Ca 0.05 -0.46 0.00 0.00 -1.87 0.00 0.00 60.65 58.38 2k3w h LYS 44 Cb 0.23 0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.71 2k3w h LYS 44 CO 0.01 1.22 -0.55 1.88 -0.57 0.00 0.00 179.45 181.43 2k3w h TYR 45 N -0.33 0.00 0.00 -1.35 -1.99 -1.08 -3.45 116.97 108.77 2k3w h TYR 45 Ca -0.24 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.49 2k3w h TYR 45 Cb 1.72 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.45 2k3w h TYR 45 CO 0.15 0.00 0.00 0.39 -0.00 0.00 0.00 178.16 178.70 2k3w n GLU 46 N -2.69 0.00 0.00 4.88 4.71 0.16 -5.05 120.64 122.66 2k3w n GLU 46 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.17 2k3w n GLU 46 Cb 0.52 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.95 2k3w n GLU 46 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2k3w n ALA 47 N -3.00 0.00 -1.00 0.62 0.00 -1.26 -5.03 120.51 110.84 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 -0.93 -4.02 0.00 8.25 -1.26 -5.00 115.22 112.25 2k3w n HIS 48 Ca 0.00 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.24 2k3w n HIS 48 Cb 0.00 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.08 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 -2.12 6.03 0.34 0.41 0.01 -1.26 -4.93 113.70 112.18 2k3w s SER 49 Ca 0.00 -0.04 0.12 0.00 1.31 0.00 0.00 55.95 57.34 2k3w s SER 49 Cb 0.00 -1.70 0.92 0.00 0.21 0.00 0.00 66.02 65.46 2k3w s SER 49 CO 0.00 -0.05 1.76 -0.78 0.41 0.00 0.00 173.24 174.58 2k3w h ASP 50 N 1.35 0.62 -0.78 2.44 1.82 -1.99 0.59 116.42 120.47 2k3w h ASP 50 Ca -0.51 0.11 -0.05 0.00 -0.39 0.00 0.00 57.03 56.19 2k3w h ASP 50 Cb 1.23 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 41.21 2k3w h ASP 50 CO 0.61 0.15 0.30 0.11 -1.61 0.00 0.00 179.24 178.80 2k3w h LYS 51 N 0.57 1.17 0.47 0.28 1.57 -2.00 -1.64 116.57 116.99 2k3w h LYS 51 Ca 0.60 -0.22 -0.02 0.00 -1.87 0.00 0.00 60.65 59.14 2k3w h LYS 51 Cb 1.22 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 33.35 2k3w h LYS 51 CO -0.38 0.96 -0.22 0.00 -0.57 0.00 0.00 179.45 179.24 2k3w h ALA 52 N 1.16 -0.63 -0.31 3.86 0.00 -0.28 -2.58 119.26 120.48 2k3w h ALA 52 Ca 0.26 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 55.04 2k3w h ALA 52 Cb 0.24 0.24 -0.08 0.00 0.00 0.00 0.00 17.79 18.19 2k3w h ALA 52 CO -0.02 -0.72 -0.40 0.87 0.00 0.00 0.00 179.25 178.98 2k3w h LYS 53 N -0.90 -0.35 -0.91 0.00 6.56 -0.93 0.88 116.57 120.92 2k3w h LYS 53 Ca -0.06 0.02 0.15 0.00 -1.06 0.00 0.00 60.65 59.70 2k3w h LYS 53 Cb 0.58 0.08 -0.09 0.00 -0.57 0.00 0.00 32.23 32.23 2k3w h LYS 53 CO 0.11 -0.23 0.51 1.05 -2.06 0.00 0.00 179.45 178.82 2k3w h GLU 54 N -0.37 0.70 -0.71 3.15 4.11 -1.36 0.31 114.58 120.41 2k3w h GLU 54 Ca 0.12 -0.04 -0.01 0.00 0.07 0.00 0.00 59.36 59.50 2k3w h GLU 54 Cb 0.59 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.64 2k3w h GLU 54 CO -0.50 0.46 0.39 1.03 0.07 0.00 0.00 179.01 180.46 2k3w h SER 55 N 0.72 0.90 -0.32 3.06 0.87 -0.50 -1.08 113.55 117.20 2k3w h SER 55 Ca 0.49 -0.10 -0.06 0.00 -1.23 0.00 0.00 61.79 60.89 2k3w h SER 55 Cb 0.67 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.40 2k3w h SER 55 CO -0.35 0.74 -0.04 0.40 -0.53 0.00 0.00 176.83 177.05 2k3w h ILE 56 N 0.98 1.27 0.85 2.23 1.08 0.15 -1.75 117.51 122.32 2k3w h ILE 56 Ca 0.25 -1.04 -0.04 0.00 -0.39 0.00 0.00 64.86 63.64 2k3w h ILE 56 Cb 0.04 1.31 0.01 0.00 -3.07 0.00 0.00 36.82 35.11 2k3w h ILE 56 CO -0.04 0.34 -0.41 0.03 -0.69 0.00 0.00 178.15 177.38 2k3w h ARG 57 N 0.37 -1.10 -0.33 2.37 3.08 -0.33 0.70 114.38 119.14 2k3w h ARG 57 Ca 0.09 0.08 0.07 0.00 0.07 0.00 0.00 59.98 60.28 2k3w h ARG 57 Cb 0.51 0.25 -0.07 0.00 0.08 0.00 0.00 29.97 30.73 2k3w h ARG 57 CO 0.02 -0.73 -0.17 0.00 -1.07 0.00 0.00 179.97 178.02 2k3w h ALA 58 N -0.99 0.08 -0.70 0.04 0.00 -1.25 -1.04 119.26 115.41 2k3w h ALA 58 Ca -0.12 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2k3w h ALA 58 Cb 0.88 0.41 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 2k3w h ALA 58 CO 0.19 -0.56 0.34 0.87 0.00 0.00 0.00 179.25 180.10 2k3w h LYS 59 N -0.12 1.00 -0.99 0.00 1.79 -1.22 -1.99 116.57 115.04 2k3w h LYS 59 Ca 0.17 -0.14 0.16 0.00 -2.18 0.00 0.00 60.65 58.66 2k3w h LYS 59 Cb 0.38 -0.18 -0.10 0.00 -1.58 0.00 0.00 32.23 30.75 2k3w h LYS 59 CO -0.41 0.78 0.60 0.00 -1.08 0.00 0.00 179.45 179.34 2k3w h VAL 61 N 0.83 1.22 -0.47 0.00 2.07 -0.55 -0.54 116.25 118.81 2k3w h VAL 61 Ca 0.54 -0.71 0.08 0.00 0.82 0.00 0.00 66.70 67.43 2k3w h VAL 61 Cb 0.74 1.49 -0.06 0.00 -1.52 0.00 0.00 31.29 31.93 2k3w h VAL 61 CO -0.34 0.20 0.11 1.56 0.02 0.00 0.00 177.57 179.12 2k3w h GLN 62 N -0.06 0.24 -0.07 1.57 4.20 -0.44 0.52 115.11 121.08 2k3w h GLN 62 Ca 0.03 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 2k3w h GLN 62 Cb 0.30 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.03 2k3w h GLN 62 CO 0.00 0.16 0.03 1.88 -0.67 0.00 0.00 178.83 180.23 2k3w h TYR 63 N 0.25 0.10 -0.13 2.96 0.05 -0.85 -2.11 116.97 117.24 2k3w h TYR 63 Ca 0.23 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 59.01 2k3w h TYR 63 Cb 0.29 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 38.00 2k3w h TYR 63 CO -0.21 0.19 0.08 -0.07 -1.05 0.00 0.00 178.16 177.11 2k3w h LEU 64 N -0.03 0.14 -0.76 3.88 3.38 -0.42 -0.96 115.31 120.54 2k3w h LEU 64 Ca 0.02 -0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.14 2k3w h LEU 64 Cb 0.13 -0.03 -0.10 0.00 0.09 0.00 0.00 40.66 40.75 2k3w h LEU 64 CO -0.00 0.10 0.26 -0.78 0.09 0.00 0.00 178.44 178.11 2k3w h ASP 65 N 0.17 0.18 -0.51 -0.43 1.82 0.14 0.43 116.42 118.23 2k3w h ASP 65 Ca 0.05 0.13 -0.01 0.00 -0.39 0.00 0.00 57.03 56.80 2k3w h ASP 65 Cb -0.02 0.13 -0.02 0.00 0.68 0.00 0.00 39.33 40.10 2k3w h ASP 65 CO -0.02 0.04 0.27 0.03 -1.61 0.00 0.00 179.24 177.95 2k3w h ARG 66 N 0.37 0.71 -0.45 0.28 2.47 -0.83 -1.88 114.38 115.06 2k3w h ARG 66 Ca 0.43 -0.09 -0.01 0.00 -1.26 0.00 0.00 59.98 59.04 2k3w h ARG 66 Cb 0.69 -0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.85 2k3w h ARG 66 CO -0.45 0.57 0.23 0.00 0.56 0.00 0.00 179.97 180.88 2k3w h ALA 67 N 1.11 1.57 0.38 0.04 0.00 0.88 -0.74 119.26 122.50 2k3w h ALA 67 Ca 0.18 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2k3w h ALA 67 Cb 0.07 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2k3w h ALA 67 CO -0.03 0.36 -0.18 0.93 0.00 0.00 0.00 179.25 180.33 2k3w h GLU 68 N 0.62 -0.49 -0.52 0.00 5.08 0.38 -1.28 114.58 118.36 2k3w h GLU 68 Ca 0.16 0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.52 2k3w h GLU 68 Cb 0.04 0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.38 2k3w h GLU 68 CO -0.02 -0.21 0.18 1.57 -1.00 0.00 0.00 179.01 179.53 2k3w h LYS 69 N -0.75 0.76 -0.09 2.33 2.10 -1.23 0.25 116.57 119.95 2k3w h LYS 69 Ca -0.05 -0.12 -0.00 0.00 -2.00 0.00 0.00 60.65 58.47 2k3w h LYS 69 Cb 0.51 -0.13 -0.00 0.00 -0.90 0.00 0.00 32.23 31.71 2k3w h LYS 69 CO 0.09 0.65 0.05 -0.07 -2.00 0.00 0.00 179.45 178.16 2k3w h LEU 70 N 0.75 0.10 -1.21 7.07 3.38 -1.04 -1.62 115.31 122.74 2k3w h LEU 70 Ca 0.18 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 2k3w h LEU 70 Cb 0.19 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 2k3w h LEU 70 CO -0.01 0.13 -0.13 0.50 0.09 0.00 0.00 178.44 179.02 2k3w h LYS 71 N 0.07 0.00 0.43 1.13 3.64 -0.95 -2.01 116.57 118.87 2k3w h LYS 71 Ca 0.03 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 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 0.13 -0.21 0.22 -2.27 0.00 0.00 179.45 177.31 2k3w h ASP 72 N 0.00 -0.49 0.95 4.20 1.82 0.42 -1.46 116.42 121.87 2k3w h ASP 72 Ca -0.00 -0.10 -0.16 0.00 -0.39 0.00 0.00 57.03 56.37 2k3w h ASP 72 Cb 0.66 0.13 -0.02 0.00 0.68 0.00 0.00 39.33 40.77 2k3w h ASP 72 CO 0.02 -0.09 -0.78 0.10 -1.61 0.00 0.00 179.24 176.88 2k3w h TYR 73 N -0.98 0.00 -0.16 0.28 -0.00 -1.47 -3.19 116.97 111.44 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 0.02 0.78 0.09 -0.07 -0.00 0.00 0.00 178.16 178.98 2k3w h LEU 74 N 0.00 0.20 0.00 0.10 3.38 -1.43 -3.52 115.31 114.05 2k3w h LEU 74 Ca -0.01 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2k3w h LEU 74 Cb 1.46 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.16 2k3w h LEU 74 CO 0.10 0.22 0.00 -1.14 0.09 0.00 0.00 178.44 177.72