#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 0.28 -0.04 8.00 7.64 -1.26 -4.75 113.62 123.49 2k3w n SER 4 Ca 0.00 0.60 -0.11 0.00 1.01 0.00 0.00 58.87 60.37 2k3w n SER 4 Cb 0.00 -1.41 -0.04 0.00 -1.01 0.00 0.00 64.21 61.75 2k3w n SER 4 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 2k3w h THR 5 N -0.63 1.09 -0.47 0.44 2.02 -1.97 -0.37 112.91 113.02 2k3w h THR 5 Ca -0.46 -0.23 -0.09 0.00 0.77 0.00 0.00 66.41 66.40 2k3w h THR 5 Cb 1.32 0.93 -0.02 0.00 -1.74 0.00 0.00 68.15 68.64 2k3w h THR 5 CO 0.45 0.08 -0.04 0.25 0.37 0.00 0.00 175.52 176.63 2k3w h LEU 6 N 0.19 0.86 -0.58 2.58 6.46 -1.91 -1.40 115.31 121.50 2k3w h LEU 6 Ca 0.06 -0.33 0.05 0.00 -0.12 0.00 0.00 57.88 57.54 2k3w h LEU 6 Cb 0.05 -0.23 -0.05 0.00 -0.73 0.00 0.00 40.66 39.70 2k3w h LEU 6 CO -0.01 0.98 0.31 -0.61 -0.62 0.00 0.00 178.44 178.49 2k3w h GLN 7 N 0.71 0.57 -0.72 1.25 5.75 -1.86 -0.18 115.11 120.63 2k3w h GLN 7 Ca 0.13 -0.03 -0.05 0.00 -0.15 0.00 0.00 58.65 58.55 2k3w h GLN 7 Cb 0.56 -0.13 -0.03 0.00 1.07 0.00 0.00 27.48 28.95 2k3w h GLN 7 CO 0.03 0.38 0.25 -0.22 -2.65 0.00 0.00 178.83 176.63 2k3w h LYS 8 N 0.59 1.10 -0.72 1.69 1.63 -0.87 -0.91 116.57 119.08 2k3w h LYS 8 Ca 0.26 -0.21 0.02 0.00 -0.85 0.00 0.00 60.65 59.87 2k3w h LYS 8 Cb 0.15 -0.17 -0.04 0.00 -0.60 0.00 0.00 32.23 31.57 2k3w h LYS 8 CO -0.17 0.91 0.46 0.00 -3.45 0.00 0.00 179.45 177.21 2k3w h ALA 9 N 1.21 0.92 -0.56 5.00 0.00 0.04 -0.65 119.26 125.23 2k3w h ALA 9 Ca 0.24 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.03 2k3w h ALA 9 Cb 0.25 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2k3w h ALA 9 CO -0.01 0.28 0.02 0.82 0.00 0.00 0.00 179.25 180.36 2k3w h ILE 10 N 0.92 1.26 -0.40 0.00 2.04 -0.65 -1.31 117.51 119.38 2k3w h ILE 10 Ca 0.28 -1.08 -0.00 0.00 1.00 0.00 0.00 64.86 65.05 2k3w h ILE 10 Cb -0.04 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 2k3w h ILE 10 CO -0.08 0.39 0.24 -0.78 0.00 0.00 0.00 178.15 177.91 2k3w h ASP 11 N 0.85 0.47 -0.49 1.72 3.58 -0.49 0.13 116.42 122.19 2k3w h ASP 11 Ca 0.16 -0.05 -0.05 0.00 0.42 0.00 0.00 57.03 57.51 2k3w h ASP 11 Cb 0.51 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.42 2k3w h ASP 11 CO 0.02 0.38 0.12 -0.07 -2.88 0.00 0.00 179.24 176.82 2k3w h LEU 12 N 0.52 0.75 -0.61 2.28 3.38 -1.00 -2.05 115.31 118.58 2k3w h LEU 12 Ca 0.14 -0.23 -0.11 0.00 0.09 0.00 0.00 57.88 57.77 2k3w h LEU 12 Cb -0.00 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 2k3w h LEU 12 CO -0.03 0.79 -0.07 1.62 0.09 0.00 0.00 178.44 180.84 2k3w h VAL 13 N 0.68 1.27 -0.27 1.22 3.04 -1.02 -1.29 116.25 119.87 2k3w h VAL 13 Ca 0.15 -1.22 0.02 0.00 -1.01 0.00 0.00 66.70 64.64 2k3w h VAL 13 Cb 0.33 0.92 -0.02 0.00 -2.01 0.00 0.00 31.29 30.51 2k3w h VAL 13 CO 0.00 0.44 0.12 0.74 -1.01 0.00 0.00 177.57 177.86 2k3w h THR 14 N 0.91 0.98 -0.67 3.17 2.02 -0.57 -1.15 112.91 117.59 2k3w h THR 14 Ca 0.15 -0.09 -0.04 0.00 0.77 0.00 0.00 66.41 67.20 2k3w h THR 14 Cb 0.63 0.69 -0.03 0.00 -1.74 0.00 0.00 68.15 67.70 2k3w h THR 14 CO 0.04 0.05 0.25 0.50 0.37 0.00 0.00 175.52 176.73 2k3w h LYS 15 N 0.26 1.00 -0.73 6.66 3.64 -1.21 -2.23 116.57 123.95 2k3w h LYS 15 Ca 0.11 -0.18 0.10 0.00 -1.27 0.00 0.00 60.65 59.42 2k3w h LYS 15 Cb 0.05 -0.16 -0.08 0.00 -0.41 0.00 0.00 32.23 31.63 2k3w h LYS 15 CO -0.09 0.83 0.35 0.00 -2.27 0.00 0.00 179.45 178.27 2k3w h ALA 16 N 1.30 1.01 -0.68 5.00 0.00 -0.07 -0.02 119.26 125.80 2k3w h ALA 16 Ca 0.22 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.14 2k3w h ALA 16 Cb 0.22 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2k3w h ALA 16 CO -0.02 -0.07 0.21 1.79 0.00 0.00 0.00 179.25 181.16 2k3w h THR 17 N 0.58 1.25 -0.67 0.00 1.35 -0.71 0.21 112.91 114.93 2k3w h THR 17 Ca 0.37 -0.87 -0.08 0.00 -0.55 0.00 0.00 66.41 65.28 2k3w h THR 17 Cb 0.42 0.50 -0.03 0.00 -1.73 0.00 0.00 68.15 67.32 2k3w h THR 17 CO -0.29 0.34 0.10 1.05 -0.25 0.00 0.00 175.52 176.47 2k3w h GLU 18 N 1.01 1.10 -0.33 4.72 4.11 -0.83 -2.09 114.58 122.28 2k3w h GLU 18 Ca 0.22 -0.29 -0.11 0.00 0.07 0.00 0.00 59.36 59.25 2k3w h GLU 18 Cb 0.29 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 2k3w h GLU 18 CO -0.01 1.01 -0.22 0.93 0.07 0.00 0.00 179.01 180.79 2k3w h GLU 19 N 1.03 0.73 -0.82 1.06 4.39 -0.53 -1.71 114.58 118.74 2k3w h GLU 19 Ca 0.20 -0.35 0.08 0.00 0.34 0.00 0.00 59.36 59.63 2k3w h GLU 19 Cb 0.44 -0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 29.02 2k3w h GLU 19 CO 0.01 0.96 0.48 0.22 -1.16 0.00 0.00 179.01 179.53 2k3w h ASP 20 N 0.50 0.72 -0.66 1.42 3.58 -0.42 0.43 116.42 121.99 2k3w h ASP 20 Ca 0.07 0.03 -0.08 0.00 0.42 0.00 0.00 57.03 57.47 2k3w h ASP 20 Cb 0.77 -0.11 -0.03 0.00 1.72 0.00 0.00 39.33 41.69 2k3w h ASP 20 CO 0.06 0.44 0.10 0.11 -2.88 0.00 0.00 179.24 177.07 2k3w h LYS 21 N 0.85 1.11 -0.11 0.28 1.57 -1.22 -1.46 116.57 117.58 2k3w h LYS 21 Ca 0.38 -0.30 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2k3w h LYS 21 Cb 0.27 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.45 2k3w h LYS 21 CO -0.21 1.02 0.00 0.00 -0.57 0.00 0.00 179.45 179.69 2k3w n ALA 22 N -2.47 2.13 -2.04 3.86 0.00 -0.04 -4.77 120.51 117.17 2k3w n ALA 22 Ca 0.04 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.33 2k3w n ALA 22 Cb 0.30 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.72 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 -0.38 -1.20 -2.78 0.00 4.76 -0.55 -4.92 118.16 113.09 2k3w n LYS 23 Ca 0.00 0.85 -0.42 0.00 -2.87 0.00 0.00 58.31 55.87 2k3w n LYS 23 Cb 0.03 -5.16 0.01 0.00 -1.84 0.00 0.00 35.03 28.07 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 -0.86 6.61 -0.34 4.39 4.13 0.13 -4.80 115.26 124.52 2k3w n ASN 24 Ca -0.18 -3.44 0.04 0.00 1.68 0.00 0.00 54.58 52.68 2k3w n ASN 24 Cb 0.60 -1.27 0.19 0.00 -1.54 0.00 0.00 39.78 37.76 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 5.11 1.06 0.30 3.10 0.05 -1.86 0.47 116.97 125.21 2k3w h TYR 25 Ca 0.34 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 59.13 2k3w h TYR 25 Cb 0.52 -0.34 0.00 0.00 1.01 0.00 0.00 36.73 37.93 2k3w h TYR 25 CO 1.16 0.48 -0.15 0.93 -1.05 0.00 0.00 178.16 179.53 2k3w h GLU 26 N 0.99 -0.39 -0.21 4.88 5.08 -1.95 0.30 114.58 123.28 2k3w h GLU 26 Ca 0.43 0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.80 2k3w h GLU 26 Cb 0.32 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 2k3w h GLU 26 CO -0.22 -0.21 0.03 1.49 -1.00 0.00 0.00 179.01 179.10 2k3w h GLU 27 N -0.49 0.35 -0.63 2.33 4.57 -1.86 -2.27 114.58 116.57 2k3w h GLU 27 Ca -0.04 -0.10 0.07 0.00 -1.18 0.00 0.00 59.36 58.11 2k3w h GLU 27 Cb 0.37 -0.04 -0.06 0.00 -0.16 0.00 0.00 28.75 28.86 2k3w h GLU 27 CO 0.07 0.50 0.32 0.00 -1.18 0.00 0.00 179.01 178.72 2k3w h ALA 28 N 0.83 0.84 -0.41 2.92 0.00 -0.02 -1.81 119.26 121.62 2k3w h ALA 28 Ca 0.06 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.04 2k3w h ALA 28 Cb 0.33 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2k3w h ALA 28 CO 0.01 -0.05 0.22 1.25 0.00 0.00 0.00 179.25 180.67 2k3w h LEU 29 N 0.57 0.33 -0.34 0.00 5.85 -0.21 0.14 115.31 121.66 2k3w h LEU 29 Ca 0.30 0.01 0.04 0.00 0.84 0.00 0.00 57.88 59.07 2k3w h LEU 29 Cb 0.25 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.20 2k3w h LEU 29 CO -0.22 0.24 0.12 0.03 -0.34 0.00 0.00 178.44 178.27 2k3w h ARG 30 N 0.44 0.26 -0.78 1.25 3.08 -0.77 -1.28 114.38 116.58 2k3w h ARG 30 Ca 0.17 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 60.16 2k3w h ARG 30 Cb 0.05 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.01 2k3w h ARG 30 CO -0.10 0.17 0.33 -0.07 -1.07 0.00 0.00 179.97 179.22 2k3w h LEU 31 N 0.27 1.06 0.02 3.04 4.07 -0.87 -1.17 115.31 121.73 2k3w h LEU 31 Ca 0.15 -0.15 -0.00 0.00 0.08 0.00 0.00 57.88 57.96 2k3w h LEU 31 Cb 0.12 -0.27 0.00 0.00 1.08 0.00 0.00 40.66 41.59 2k3w h LEU 31 CO -0.15 0.93 -0.01 1.88 -1.08 0.00 0.00 178.44 180.01 2k3w h TYR 32 N 1.13 -0.02 -0.58 1.13 0.05 -0.01 0.41 116.97 119.07 2k3w h TYR 32 Ca 0.26 -0.00 -0.03 0.00 0.05 0.00 0.00 58.73 59.01 2k3w h TYR 32 Cb 0.19 0.01 -0.03 0.00 1.01 0.00 0.00 36.73 37.91 2k3w h TYR 32 CO 0.02 0.00 0.25 1.96 -1.05 0.00 0.00 178.16 179.34 2k3w h GLN 33 N -0.04 0.85 0.06 4.88 4.20 -1.12 -1.77 115.11 122.18 2k3w h GLN 33 Ca -0.00 -0.14 -0.00 0.00 0.06 0.00 0.00 58.65 58.56 2k3w h GLN 33 Cb 0.03 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.67 2k3w h GLN 33 CO 0.00 0.72 -0.03 0.45 -0.67 0.00 0.00 178.83 179.30 2k3w h HIS 34 N 0.80 -0.07 -0.45 2.96 3.86 -0.97 -1.81 115.15 119.46 2k3w h HIS 34 Ca 0.20 -0.00 0.09 0.00 -1.16 0.00 0.00 60.37 59.49 2k3w h HIS 34 Cb 0.16 0.02 -0.09 0.00 1.06 0.00 0.00 27.41 28.57 2k3w h HIS 34 CO 0.00 0.11 -0.12 0.00 0.86 0.00 0.00 177.93 178.78 2k3w h ALA 35 N 0.69 0.28 -0.64 2.45 0.00 -0.04 -0.41 119.26 121.58 2k3w h ALA 35 Ca -0.01 0.17 0.05 0.00 0.00 0.00 0.00 54.91 55.12 2k3w h ALA 35 Cb 0.21 0.36 -0.05 0.00 0.00 0.00 0.00 17.79 18.31 2k3w h ALA 35 CO 0.01 -0.46 0.37 0.28 0.00 0.00 0.00 179.25 179.46 2k3w h VAL 36 N -0.01 1.00 -0.28 0.00 2.07 -1.18 -0.17 116.25 117.68 2k3w h VAL 36 Ca 0.22 -0.24 0.05 0.00 0.82 0.00 0.00 66.70 67.55 2k3w h VAL 36 Cb 0.34 0.24 -0.05 0.00 -1.52 0.00 0.00 31.29 30.30 2k3w h VAL 36 CO -0.47 0.13 -0.05 -0.08 0.02 0.00 0.00 177.57 177.12 2k3w h GLU 37 N 0.70 0.03 -0.63 1.57 4.81 -0.22 0.27 114.58 121.11 2k3w h GLU 37 Ca 0.28 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.45 2k3w h GLU 37 Cb 0.13 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.47 2k3w h GLU 37 CO -0.15 0.02 0.16 1.88 -0.73 0.00 0.00 179.01 180.18 2k3w h TYR 38 N 0.03 1.02 -0.22 0.92 -1.99 -0.71 -0.67 116.97 115.34 2k3w h TYR 38 Ca 0.14 -0.11 -0.00 0.00 2.00 0.00 0.00 58.73 60.76 2k3w h TYR 38 Cb 0.20 -0.29 -0.01 0.00 2.00 0.00 0.00 36.73 38.62 2k3w h TYR 38 CO -0.25 0.84 0.13 0.74 -0.00 0.00 0.00 178.16 179.62 2k3w h PHE 39 N 0.94 0.30 -0.73 4.88 0.04 -0.15 0.20 116.94 122.43 2k3w h PHE 39 Ca 0.20 -0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.91 2k3w h PHE 39 Cb 0.33 -0.10 -0.03 0.00 2.20 0.00 0.00 35.95 38.35 2k3w h PHE 39 CO 0.02 0.24 0.24 -0.07 -0.60 0.00 0.00 178.31 178.14 2k3w h LEU 40 N 0.27 1.05 -1.44 1.54 3.38 -0.77 -1.16 115.31 118.17 2k3w h LEU 40 Ca 0.08 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 2k3w h LEU 40 Cb 0.03 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 2k3w h LEU 40 CO -0.01 0.96 -0.13 -0.74 0.09 0.00 0.00 178.44 178.61 2k3w h HIS 41 N 1.08 0.00 -0.02 1.13 2.76 -0.69 -2.18 115.15 117.23 2k3w h HIS 41 Ca 0.24 0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.34 2k3w h HIS 41 Cb 0.29 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.25 2k3w h HIS 41 CO 0.02 0.13 -0.24 0.00 -1.30 0.00 0.00 177.93 176.55 2k3w h ALA 42 N 1.87 0.05 -0.11 5.26 0.00 0.61 0.36 119.26 127.29 2k3w h ALA 42 Ca -0.00 -0.44 -0.07 0.00 0.00 0.00 0.00 54.91 54.39 2k3w h ALA 42 Cb 0.57 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2k3w h ALA 42 CO 0.02 0.08 -0.25 -0.84 0.00 0.00 0.00 179.25 178.26 2k3w h ILE 43 N -0.44 1.23 0.07 0.00 3.07 -1.30 2.19 117.51 122.33 2k3w h ILE 43 Ca -0.03 -1.07 -0.10 0.00 1.55 0.00 0.00 64.86 65.22 2k3w h ILE 43 Cb 0.96 1.42 0.01 0.00 -0.27 0.00 0.00 36.82 38.93 2k3w h ILE 43 CO 0.05 0.32 -0.47 0.11 -1.05 0.00 0.00 178.15 177.11 2k3w h LYS 44 N 0.18 0.15 0.00 0.16 1.57 -1.43 -2.90 116.57 114.31 2k3w h LYS 44 Ca 0.03 -0.26 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 2k3w h LYS 44 Cb 0.54 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.95 2k3w h LYS 44 CO 0.04 1.12 -1.20 0.66 -0.57 0.00 0.00 179.45 179.50 2k3w n TYR 45 N -4.35 0.30 -2.04 -1.35 4.02 0.11 -4.27 117.16 109.58 2k3w n TYR 45 Ca -0.13 0.09 -0.10 0.00 -0.01 0.00 0.00 57.90 57.75 2k3w n TYR 45 Cb 0.66 -0.50 0.08 0.00 -0.02 0.00 0.00 39.34 39.57 2k3w n TYR 45 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 2k3w n GLU 46 N -2.09 2.47 -0.04 -0.72 -0.58 0.74 -5.01 120.64 115.42 2k3w n GLU 46 Ca 0.01 -3.65 -0.01 0.00 -0.42 0.00 0.00 57.16 53.08 2k3w n GLU 46 Cb 0.47 -1.81 -0.00 0.00 -0.57 0.00 0.00 31.44 29.53 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 -0.72 -0.55 -3.00 0.62 0.00 -1.09 -4.64 120.51 111.13 2k3w n ALA 47 Ca 0.29 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.74 2k3w n ALA 47 Cb 0.88 -0.04 0.00 0.00 0.00 0.00 0.00 19.45 20.29 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 0.04 0.00 -3.63 0.00 8.25 -1.26 -5.02 115.22 113.59 2k3w n HIS 48 Ca 0.00 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.16 2k3w n HIS 48 Cb 0.00 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.07 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 1.00 6.49 0.31 0.41 0.01 -1.26 -4.91 113.70 115.75 2k3w s SER 49 Ca 0.00 0.62 0.08 0.00 1.31 0.00 0.00 55.95 57.96 2k3w s SER 49 Cb 0.00 -2.10 0.85 0.00 0.21 0.00 0.00 66.02 64.98 2k3w s SER 49 CO 0.00 0.01 1.73 -0.78 0.41 0.00 0.00 173.24 174.62 2k3w h ASP 50 N 2.65 0.65 -0.64 2.44 1.82 -2.00 0.49 116.42 121.83 2k3w h ASP 50 Ca -0.46 0.13 -0.05 0.00 -0.39 0.00 0.00 57.03 56.26 2k3w h ASP 50 Cb 1.17 0.03 -0.03 0.00 0.68 0.00 0.00 39.33 41.18 2k3w h ASP 50 CO 0.71 0.12 0.20 0.11 -1.61 0.00 0.00 179.24 178.77 2k3w h LYS 51 N 0.59 0.99 0.44 0.28 1.57 -1.99 -1.82 116.57 116.62 2k3w h LYS 51 Ca 0.63 -0.21 -0.02 0.00 -1.87 0.00 0.00 60.65 59.17 2k3w h LYS 51 Cb 1.16 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.33 2k3w h LYS 51 CO -0.47 0.87 -0.21 0.00 -0.57 0.00 0.00 179.45 179.07 2k3w h ALA 52 N 1.07 -0.59 -0.44 3.86 0.00 -0.52 -1.78 119.26 120.87 2k3w h ALA 52 Ca 0.21 -0.16 0.09 0.00 0.00 0.00 0.00 54.91 55.05 2k3w h ALA 52 Cb 0.29 0.23 -0.09 0.00 0.00 0.00 0.00 17.79 18.22 2k3w h ALA 52 CO -0.01 -0.77 -0.23 0.87 0.00 0.00 0.00 179.25 179.11 2k3w h LYS 53 N -0.71 -0.14 -0.88 0.00 6.56 -0.81 0.38 116.57 120.97 2k3w h LYS 53 Ca -0.06 0.01 0.14 0.00 -1.06 0.00 0.00 60.65 59.68 2k3w h LYS 53 Cb 0.51 0.03 -0.09 0.00 -0.57 0.00 0.00 32.23 32.11 2k3w h LYS 53 CO 0.10 -0.09 0.48 0.93 -2.06 0.00 0.00 179.45 178.80 2k3w h GLU 54 N -0.14 0.67 -0.47 3.15 5.08 -1.22 0.39 114.58 122.04 2k3w h GLU 54 Ca 0.21 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.51 2k3w h GLU 54 Cb 0.47 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 2k3w h GLU 54 CO -0.53 0.44 0.23 1.03 -1.00 0.00 0.00 179.01 179.19 2k3w h SER 55 N 0.69 0.60 -0.29 1.42 0.87 0.55 -0.68 113.55 116.70 2k3w h SER 55 Ca 0.47 -0.12 -0.05 0.00 -1.23 0.00 0.00 61.79 60.87 2k3w h SER 55 Cb 0.64 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.43 2k3w h SER 55 CO -0.34 0.55 -0.01 0.40 -0.53 0.00 0.00 176.83 176.89 2k3w h ILE 56 N 0.61 1.26 0.83 2.23 1.08 0.12 -1.83 117.51 121.81 2k3w h ILE 56 Ca 0.16 -0.97 -0.04 0.00 -0.39 0.00 0.00 64.86 63.63 2k3w h ILE 56 Cb 0.10 1.32 0.01 0.00 -3.07 0.00 0.00 36.82 35.17 2k3w h ILE 56 CO -0.02 0.31 -0.41 0.03 -0.69 0.00 0.00 178.15 177.37 2k3w h ARG 57 N 0.30 -1.08 -0.31 2.37 3.08 -0.19 0.73 114.38 119.27 2k3w h ARG 57 Ca 0.08 0.07 0.07 0.00 0.07 0.00 0.00 59.98 60.28 2k3w h ARG 57 Cb 0.45 0.25 -0.08 0.00 0.08 0.00 0.00 29.97 30.67 2k3w h ARG 57 CO 0.02 -0.72 -0.24 0.00 -1.07 0.00 0.00 179.97 177.96 2k3w h ALA 58 N -0.95 -0.07 -0.81 0.04 0.00 -1.16 -0.87 119.26 115.44 2k3w h ALA 58 Ca -0.11 0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2k3w h ALA 58 Cb 0.87 0.52 -0.04 0.00 0.00 0.00 0.00 17.79 19.14 2k3w h ALA 58 CO 0.18 -0.64 0.39 0.87 0.00 0.00 0.00 179.25 180.05 2k3w h LYS 59 N -0.21 1.17 -0.98 0.00 1.79 -1.24 -2.05 116.57 115.05 2k3w h LYS 59 Ca 0.16 -0.17 0.15 0.00 -2.18 0.00 0.00 60.65 58.61 2k3w h LYS 59 Cb 0.46 -0.21 -0.10 0.00 -1.58 0.00 0.00 32.23 30.81 2k3w h LYS 59 CO -0.44 0.90 0.59 0.00 -1.08 0.00 0.00 179.45 179.43 2k3w h VAL 61 N 0.84 1.24 -0.55 0.00 2.07 -0.58 -0.98 116.25 118.28 2k3w h VAL 61 Ca 0.53 -0.75 0.09 0.00 0.82 0.00 0.00 66.70 67.38 2k3w h VAL 61 Cb 0.69 1.53 -0.07 0.00 -1.52 0.00 0.00 31.29 31.91 2k3w h VAL 61 CO -0.33 0.22 0.17 1.56 0.02 0.00 0.00 177.57 179.21 2k3w h GLN 62 N -0.07 0.32 -0.12 1.57 4.20 -0.65 0.48 115.11 120.85 2k3w h GLN 62 Ca 0.03 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 2k3w h GLN 62 Cb 0.33 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 2k3w h GLN 62 CO 0.00 0.21 0.05 1.88 -0.67 0.00 0.00 178.83 180.31 2k3w h TYR 63 N 0.33 0.18 -0.09 2.96 0.05 -0.93 -2.09 116.97 117.39 2k3w h TYR 63 Ca 0.27 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 59.04 2k3w h TYR 63 Cb 0.34 -0.05 -0.00 0.00 1.01 0.00 0.00 36.73 38.03 2k3w h TYR 63 CO -0.19 0.27 0.06 -0.07 -1.05 0.00 0.00 178.16 177.18 2k3w h LEU 64 N 0.04 0.10 -0.73 3.88 3.38 -0.39 -0.92 115.31 120.67 2k3w h LEU 64 Ca 0.04 -0.01 0.15 0.00 0.09 0.00 0.00 57.88 58.15 2k3w h LEU 64 Cb 0.16 -0.02 -0.10 0.00 0.09 0.00 0.00 40.66 40.79 2k3w h LEU 64 CO -0.00 0.08 0.24 -0.78 0.09 0.00 0.00 178.44 178.06 2k3w h ASP 65 N 0.11 0.15 -0.56 -0.43 1.82 0.06 0.35 116.42 117.92 2k3w h ASP 65 Ca 0.03 0.12 -0.01 0.00 -0.39 0.00 0.00 57.03 56.78 2k3w h ASP 65 Cb -0.01 0.13 -0.03 0.00 0.68 0.00 0.00 39.33 40.11 2k3w h ASP 65 CO -0.01 0.04 0.31 0.03 -1.61 0.00 0.00 179.24 178.01 2k3w h ARG 66 N 0.36 0.78 -0.56 0.28 2.47 -0.89 -1.70 114.38 115.11 2k3w h ARG 66 Ca 0.40 -0.09 -0.01 0.00 -1.26 0.00 0.00 59.98 59.03 2k3w h ARG 66 Cb 0.65 -0.15 -0.03 0.00 -1.65 0.00 0.00 29.97 28.78 2k3w h ARG 66 CO -0.44 0.59 0.30 0.00 0.56 0.00 0.00 179.97 180.98 2k3w h ALA 67 N 1.14 1.48 0.36 0.04 0.00 0.83 -0.85 119.26 122.27 2k3w h ALA 67 Ca 0.20 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2k3w h ALA 67 Cb 0.04 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.60 2k3w h ALA 67 CO -0.03 0.43 -0.17 0.93 0.00 0.00 0.00 179.25 180.40 2k3w h GLU 68 N 0.77 -0.47 -0.61 0.00 4.39 0.20 -1.29 114.58 117.57 2k3w h GLU 68 Ca 0.20 0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.92 2k3w h GLU 68 Cb 0.03 0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 28.75 2k3w h GLU 68 CO -0.03 -0.17 0.33 1.57 -1.16 0.00 0.00 179.01 179.55 2k3w h LYS 69 N -0.75 0.85 -0.10 2.33 2.10 -1.21 0.29 116.57 120.08 2k3w h LYS 69 Ca -0.05 -0.09 -0.00 0.00 -2.00 0.00 0.00 60.65 58.51 2k3w h LYS 69 Cb 0.51 -0.17 -0.00 0.00 -0.90 0.00 0.00 32.23 31.66 2k3w h LYS 69 CO 0.08 0.62 0.06 -0.07 -2.00 0.00 0.00 179.45 178.14 2k3w h LEU 70 N 0.85 0.12 -1.23 7.07 3.38 -1.05 -1.74 115.31 122.71 2k3w h LEU 70 Ca 0.22 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 2k3w h LEU 70 Cb 0.03 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 2k3w h LEU 70 CO -0.04 0.15 -0.15 0.50 0.09 0.00 0.00 178.44 178.99 2k3w h LYS 71 N 0.08 0.00 0.39 1.13 3.64 -0.85 -1.88 116.57 119.08 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 31.88 2k3w h LYS 71 CO -0.01 0.15 -0.19 0.22 -2.27 0.00 0.00 179.45 177.36 2k3w h ASP 72 N 0.00 -0.44 1.08 4.20 1.82 0.42 -2.01 116.42 121.49 2k3w h ASP 72 Ca -0.00 -0.13 -0.15 0.00 -0.39 0.00 0.00 57.03 56.36 2k3w h ASP 72 Cb 0.67 0.11 -0.02 0.00 0.68 0.00 0.00 39.33 40.77 2k3w h ASP 72 CO 0.02 -0.05 -0.71 0.10 -1.61 0.00 0.00 179.24 177.00 2k3w h TYR 73 N -0.92 0.00 -0.06 0.28 -0.00 -1.48 -3.22 116.97 111.58 2k3w h TYR 73 Ca -0.05 0.00 -0.00 0.00 0.00 0.00 0.00 58.73 58.68 2k3w h TYR 73 Cb 0.55 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.27 2k3w h TYR 73 CO 0.02 0.71 0.03 -0.07 -0.00 0.00 0.00 178.16 178.85 2k3w h LEU 74 N 0.00 0.07 0.00 0.10 3.38 -1.39 -3.52 115.31 113.95 2k3w h LEU 74 Ca -0.01 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2k3w h LEU 74 Cb 1.44 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.17 2k3w h LEU 74 CO 0.09 0.08 0.00 -1.14 0.09 0.00 0.00 178.44 177.56