#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ap4 n ASP 2 N 0.00 3.49 -3.35 3.17 8.00 -1.26 -4.71 116.55 121.89 1ap4 n ASP 2 Ca 0.00 -2.57 -0.05 0.00 0.71 0.00 0.00 54.79 52.88 1ap4 n ASP 2 Cb 0.00 -1.15 -0.06 0.00 -0.02 0.00 0.00 41.12 39.89 1ap4 n ASP 2 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 1ap4 s ASP 3 N 4.31 -0.29 0.00 -2.24 -4.77 -1.26 -5.07 116.67 107.36 1ap4 s ASP 3 Ca 0.51 0.54 0.00 0.00 -3.30 0.00 0.00 52.55 50.30 1ap4 s ASP 3 Cb 0.13 1.46 0.00 0.00 -1.09 0.00 0.00 42.92 43.42 1ap4 s ASP 3 CO 0.05 -0.28 0.00 -0.38 0.70 0.00 0.00 175.17 175.26 1ap4 n ILE 4 N 5.39 0.00 -0.37 2.11 5.41 -1.26 -4.63 119.36 126.01 1ap4 n ILE 4 Ca -0.04 0.02 -0.02 0.00 1.00 0.00 0.00 62.75 63.72 1ap4 n ILE 4 Cb 0.50 -1.00 0.12 0.00 -0.71 0.00 0.00 39.64 38.55 1ap4 n ILE 4 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 176.55 178.43 1ap4 h TYR 5 N 0.00 1.25 -0.88 1.39 -1.99 -2.01 -2.00 116.97 112.72 1ap4 h TYR 5 Ca 0.00 0.03 0.15 0.00 2.00 0.00 0.00 58.73 60.91 1ap4 h TYR 5 Cb 0.00 -0.42 -0.07 0.00 2.00 0.00 0.00 36.73 38.24 1ap4 h TYR 5 CO 0.00 0.79 0.57 0.87 -0.00 0.00 0.00 178.16 180.39 1ap4 h LYS 6 N 1.34 0.64 0.00 4.88 1.57 -1.98 0.20 116.57 123.22 1ap4 h LYS 6 Ca 0.36 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 59.09 1ap4 h LYS 6 Cb -0.15 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.01 1ap4 h LYS 6 CO -0.08 0.42 -0.04 0.00 -0.57 0.00 0.00 179.45 179.18 1ap4 h ALA 7 N 1.60 1.89 0.16 3.86 0.00 -1.62 -2.23 119.26 122.93 1ap4 h ALA 7 Ca 0.45 -0.04 -0.30 0.00 0.00 0.00 0.00 54.91 55.02 1ap4 h ALA 7 Cb 0.76 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.56 1ap4 h ALA 7 CO -0.20 0.05 -1.30 0.00 0.00 0.00 0.00 179.25 177.80 1ap4 h ALA 8 N 1.96 0.01 -0.58 0.00 0.00 -0.67 -3.14 119.26 116.83 1ap4 h ALA 8 Ca -0.00 -0.84 -0.00 0.00 0.00 0.00 0.00 54.91 54.06 1ap4 h ALA 8 Cb 0.08 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1ap4 h ALA 8 CO 0.01 0.82 0.34 0.28 0.00 0.00 0.00 179.25 180.69 1ap4 h VAL 9 N 0.15 1.17 0.00 0.00 2.07 -0.91 -1.41 116.25 117.32 1ap4 h VAL 9 Ca -0.18 -0.38 -0.02 0.00 0.82 0.00 0.00 66.70 66.94 1ap4 h VAL 9 Cb 2.00 0.36 -0.00 0.00 -1.52 0.00 0.00 31.29 32.13 1ap4 h VAL 9 CO 0.23 0.18 -0.10 -0.08 0.02 0.00 0.00 177.57 177.82 1ap4 h GLU 10 N 0.80 0.00 0.00 1.57 4.81 -1.54 -3.04 114.58 117.18 1ap4 h GLU 10 Ca 0.21 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.44 1ap4 h GLU 10 Cb -0.02 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.36 1ap4 h GLU 10 CO -0.04 0.10 0.00 0.37 -0.73 0.00 0.00 179.01 178.71 1ap4 h GLN 11 N 0.00 0.00 -6.88 1.92 4.15 -1.20 -3.44 115.11 109.67 1ap4 h GLN 11 Ca -0.00 0.00 -0.53 0.00 0.77 0.00 0.00 58.65 58.89 1ap4 h GLN 11 Cb 0.89 0.00 0.08 0.00 0.21 0.00 0.00 27.48 28.67 1ap4 h GLN 11 CO 0.01 0.00 0.76 -0.51 -1.93 0.00 0.00 178.83 177.16 1ap4 s LEU 12 N -5.53 4.36 0.33 -2.39 1.43 -1.15 -4.93 118.68 110.79 1ap4 s LEU 12 Ca 0.02 2.89 -0.29 0.00 -1.03 0.00 0.00 54.13 55.72 1ap4 s LEU 12 Cb 0.09 -3.65 -0.10 0.00 0.03 0.00 0.00 46.19 42.56 1ap4 s LEU 12 CO 0.47 -0.77 1.35 0.42 0.23 0.00 0.00 176.35 178.04 1ap4 s THR 13 N -0.77 2.61 0.11 5.49 -4.23 -1.26 -4.85 115.64 112.74 1ap4 s THR 13 Ca 0.55 0.61 -0.30 0.00 -1.18 0.00 0.00 61.69 61.36 1ap4 s THR 13 Cb -0.44 -3.39 -0.09 0.00 1.34 0.00 0.00 72.50 69.92 1ap4 s THR 13 CO 0.55 0.14 1.60 -0.33 -0.54 0.00 0.00 174.62 176.04 1ap4 h GLU 14 N 3.49 -0.59 -0.30 3.99 5.08 -1.93 0.95 114.58 125.27 1ap4 h GLU 14 Ca -0.49 0.04 0.09 0.00 -1.00 0.00 0.00 59.36 58.00 1ap4 h GLU 14 Cb 1.23 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.60 1ap4 h GLU 14 CO 0.66 -0.39 0.42 1.05 -1.00 0.00 0.00 179.01 179.75 1ap4 h GLU 15 N -0.61 0.00 0.06 2.33 4.11 -1.98 0.16 114.58 118.65 1ap4 h GLU 15 Ca 0.03 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.46 1ap4 h GLU 15 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1ap4 h GLU 15 CO -0.24 0.00 -0.03 0.37 0.07 0.00 0.00 179.01 179.18 1ap4 h GLN 16 N 0.00 -0.08 -0.39 1.06 5.75 -1.19 -3.16 115.11 117.10 1ap4 h GLN 16 Ca 0.14 0.01 0.06 0.00 -0.15 0.00 0.00 58.65 58.71 1ap4 h GLN 16 Cb 0.98 0.02 -0.02 0.00 1.07 0.00 0.00 27.48 29.53 1ap4 h GLN 16 CO -0.00 -0.05 0.27 1.57 -2.65 0.00 0.00 178.83 177.97 1ap4 h LYS 17 N -0.25 0.25 -0.85 1.69 2.10 -1.16 -0.63 116.57 117.73 1ap4 h LYS 17 Ca -0.01 -0.02 0.11 0.00 -2.00 0.00 0.00 60.65 58.74 1ap4 h LYS 17 Cb 0.06 -0.06 -0.06 0.00 -0.90 0.00 0.00 32.23 31.27 1ap4 h LYS 17 CO 0.01 0.17 0.55 -0.91 -2.00 0.00 0.00 179.45 177.27 1ap4 h ASN 18 N 0.26 0.68 -0.22 7.07 2.35 -0.78 -1.17 115.58 123.76 1ap4 h ASN 18 Ca 0.18 0.03 -0.07 0.00 -0.55 0.00 0.00 56.30 55.89 1ap4 h ASN 18 Cb 0.37 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 1ap4 h ASN 18 CO -0.03 0.38 -0.12 -0.08 -1.65 0.00 0.00 177.43 175.93 1ap4 h GLU 19 N 0.74 0.47 -0.90 0.81 4.81 -1.07 -2.97 114.58 116.47 1ap4 h GLU 19 Ca 0.40 -0.21 0.10 0.00 -0.13 0.00 0.00 59.36 59.52 1ap4 h GLU 19 Cb 0.54 -0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.85 1ap4 h GLU 19 CO -0.17 0.76 0.58 0.74 -0.73 0.00 0.00 179.01 180.19 1ap4 h PHE 20 N 0.18 0.96 -0.45 0.92 -1.00 -1.18 -2.58 116.94 113.80 1ap4 h PHE 20 Ca 0.05 0.03 0.05 0.00 2.81 0.00 0.00 57.97 60.90 1ap4 h PHE 20 Cb 0.62 -0.31 -0.08 0.00 3.61 0.00 0.00 35.95 39.79 1ap4 h PHE 20 CO 0.06 0.43 -0.51 -0.22 -1.61 0.00 0.00 178.31 176.47 1ap4 h LYS 21 N 0.88 -0.29 -0.93 1.51 3.64 -1.16 1.03 116.57 121.25 1ap4 h LYS 21 Ca 0.42 0.02 0.18 0.00 -1.27 0.00 0.00 60.65 60.00 1ap4 h LYS 21 Cb 0.43 0.07 -0.11 0.00 -0.41 0.00 0.00 32.23 32.21 1ap4 h LYS 21 CO -0.19 -0.20 0.52 0.00 -2.27 0.00 0.00 179.45 177.32 1ap4 h ALA 22 N -0.10 1.50 -0.30 5.00 0.00 -1.56 -0.22 119.26 123.58 1ap4 h ALA 22 Ca 0.08 0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 1ap4 h ALA 22 Cb 0.51 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1ap4 h ALA 22 CO -0.58 -0.11 -0.07 0.00 0.00 0.00 0.00 179.25 178.48 1ap4 h ALA 23 N 1.63 0.42 -0.97 0.00 0.00 -0.31 -2.91 119.26 117.12 1ap4 h ALA 23 Ca 0.54 -0.29 0.28 0.00 0.00 0.00 0.00 54.91 55.44 1ap4 h ALA 23 Cb 0.85 -0.11 -0.14 0.00 0.00 0.00 0.00 17.79 18.39 1ap4 h ALA 23 CO -0.40 0.24 0.49 0.35 0.00 0.00 0.00 179.25 179.93 1ap4 h PHE 24 N 0.35 0.80 0.00 0.00 3.04 0.27 1.99 116.94 123.40 1ap4 h PHE 24 Ca 0.08 0.04 0.00 0.00 3.98 0.00 0.00 57.97 62.07 1ap4 h PHE 24 Cb 0.56 -0.20 0.00 0.00 2.56 0.00 0.00 35.95 38.87 1ap4 h PHE 24 CO 0.05 -0.11 0.00 -0.25 -2.02 0.00 0.00 178.31 175.98 1ap4 n ASP 25 N -5.05 0.10 0.04 0.41 8.00 -1.05 -2.65 116.55 116.35 1ap4 n ASP 25 Ca 0.27 0.52 -0.10 0.00 0.71 0.00 0.00 54.79 56.20 1ap4 n ASP 25 Cb 0.83 -0.54 -0.13 0.00 -0.02 0.00 0.00 41.12 41.26 1ap4 n ASP 25 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1ap4 h ILE 26 N 0.00 1.29 0.02 0.53 2.04 0.32 -3.32 117.51 118.38 1ap4 h ILE 26 Ca 0.00 -3.03 -0.21 0.00 1.00 0.00 0.00 64.86 62.63 1ap4 h ILE 26 Cb 0.28 2.69 -0.02 0.00 -0.74 0.00 0.00 36.82 39.03 1ap4 h ILE 26 CO 0.00 0.78 -0.98 -0.26 0.00 0.00 0.00 178.15 177.69 1ap4 h PHE 27 N 0.02 0.08 0.00 1.37 0.04 -1.33 -3.11 116.94 114.00 1ap4 h PHE 27 Ca -0.16 -0.05 0.00 0.00 2.80 0.00 0.00 57.97 60.55 1ap4 h PHE 27 Cb 1.91 -0.00 0.00 0.00 2.20 0.00 0.00 35.95 40.06 1ap4 h PHE 27 CO 0.02 0.99 0.00 1.33 -0.60 0.00 0.00 178.31 180.05 1ap4 n VAL 28 N -3.44 0.00 -0.43 -0.55 0.24 -1.19 -3.84 118.33 109.13 1ap4 n VAL 28 Ca -0.01 0.00 0.37 0.00 -2.04 0.00 0.00 64.34 62.66 1ap4 n VAL 28 Cb 0.91 -0.52 0.71 0.00 -1.47 0.00 0.00 33.84 33.47 1ap4 n VAL 28 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 1ap4 h LEU 29 N 0.00 0.12 -3.04 1.34 5.85 -1.64 2.12 115.31 120.06 1ap4 h LEU 29 Ca 0.00 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1ap4 h LEU 29 Cb 0.00 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.05 1ap4 h LEU 29 CO 0.00 -0.02 0.00 0.61 -0.34 0.00 0.00 178.44 178.69 1ap4 n GLY 30 N -1.71 2.82 3.91 3.75 0.00 -1.25 -4.97 105.19 107.74 1ap4 n GLY 30 Ca 0.32 -0.79 -0.27 0.00 0.00 0.00 0.00 46.02 45.28 1ap4 n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ap4 s ALA 31 N -1.64 3.46 -0.17 4.61 0.00 0.72 -5.03 121.76 123.71 1ap4 s ALA 31 Ca 0.46 -0.55 -0.23 0.00 0.00 0.00 0.00 51.96 51.64 1ap4 s ALA 31 Cb 0.29 -2.50 -0.22 0.00 0.00 0.00 0.00 23.12 20.68 1ap4 s ALA 31 CO 0.24 -0.24 0.44 0.93 0.00 0.00 0.00 175.76 177.13 1ap4 h GLU 32 N 0.47 0.03 0.00 0.00 5.08 -1.93 -3.41 114.58 114.83 1ap4 h GLU 32 Ca -0.47 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 57.73 1ap4 h GLU 32 Cb 1.20 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.45 1ap4 h GLU 32 CO 0.62 1.02 -1.94 -0.40 -1.00 0.00 0.00 179.01 177.32 1ap4 n ASP 33 N -4.43 0.87 0.00 1.42 5.68 -1.26 -5.03 116.55 113.80 1ap4 n ASP 33 Ca -0.24 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.05 1ap4 n ASP 33 Cb 0.64 1.52 0.00 0.00 -1.14 0.00 0.00 41.12 42.14 1ap4 n ASP 33 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ap4 n GLY 34 N 1.64 1.11 3.36 6.12 0.00 -1.26 -5.18 105.19 110.98 1ap4 n GLY 34 Ca -0.11 -0.41 -0.10 0.00 0.00 0.00 0.00 46.02 45.40 1ap4 n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ap4 n ILE 36 N -0.24 3.59 -0.61 0.00 5.41 -1.07 -3.70 119.36 122.74 1ap4 n ILE 36 Ca -0.14 -5.55 -0.21 0.00 1.00 0.00 0.00 62.75 57.86 1ap4 n ILE 36 Cb 0.63 -1.88 0.13 0.00 -0.71 0.00 0.00 39.64 37.81 1ap4 n ILE 36 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1ap4 n SER 37 N 0.61 -2.81 -0.08 4.38 3.41 -1.26 -3.44 113.62 114.42 1ap4 n SER 37 Ca 0.31 -0.28 -0.13 0.00 -0.26 0.00 0.00 58.87 58.52 1ap4 n SER 37 Cb 0.37 -0.75 -0.05 0.00 -0.26 0.00 0.00 64.21 63.52 1ap4 n SER 37 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1ap4 h THR 38 N -2.38 1.31 -0.99 6.66 1.35 -1.94 -3.06 112.91 113.87 1ap4 h THR 38 Ca -0.29 -1.24 0.31 0.00 -0.55 0.00 0.00 66.41 64.63 1ap4 h THR 38 Cb 0.86 1.65 -0.15 0.00 -1.73 0.00 0.00 68.15 68.78 1ap4 h THR 38 CO 0.19 0.38 0.52 0.11 -0.25 0.00 0.00 175.52 176.47 1ap4 h LYS 39 N 0.18 0.31 -1.45 4.72 1.79 -1.98 0.47 116.57 120.63 1ap4 h LYS 39 Ca 0.04 -0.02 -0.63 0.00 -2.18 0.00 0.00 60.65 57.86 1ap4 h LYS 39 Cb 0.65 -0.07 -0.25 0.00 -1.58 0.00 0.00 32.23 30.98 1ap4 h LYS 39 CO 0.04 0.21 0.81 0.39 -1.08 0.00 0.00 179.45 179.82 1ap4 n GLU 40 N -5.07 2.55 0.00 3.15 4.71 -1.16 -4.31 120.64 120.51 1ap4 n GLU 40 Ca 0.30 -3.00 0.00 0.00 -0.01 0.00 0.00 57.16 54.45 1ap4 n GLU 40 Cb 0.93 -2.17 0.00 0.00 -1.01 0.00 0.00 31.44 29.19 1ap4 n GLU 40 CO 0.00 0.00 0.00 -0.11 0.09 0.00 0.00 177.13 177.11 1ap4 n LEU 41 N -0.45 1.85 -0.00 -4.62 -0.00 0.17 -4.53 117.00 109.42 1ap4 n LEU 41 Ca 0.54 0.00 -0.00 0.00 -0.00 0.00 0.00 56.01 56.55 1ap4 n LEU 41 Cb 0.52 0.00 -0.00 0.00 -0.00 0.00 0.00 43.42 43.94 1ap4 n LEU 41 CO 0.61 0.29 0.50 1.23 -0.00 0.00 0.00 177.39 180.02 1ap4 h GLY 42 N 0.00 -1.60 0.24 -3.96 0.00 -1.75 0.42 103.07 96.41 1ap4 h GLY 42 Ca 0.00 0.69 0.21 0.00 0.00 0.00 0.00 47.33 48.23 1ap4 h GLY 42 CO 0.00 -0.61 0.61 0.07 0.00 0.00 0.00 176.54 176.61 1ap4 h LYS 43 N -0.00 0.42 0.36 4.80 2.10 -1.88 -1.52 116.57 120.84 1ap4 h LYS 43 Ca 0.00 -0.03 -0.02 0.00 -2.00 0.00 0.00 60.65 58.61 1ap4 h LYS 43 Cb 0.00 -0.09 0.00 0.00 -0.90 0.00 0.00 32.23 31.24 1ap4 h LYS 43 CO -0.00 0.28 -0.17 0.28 -2.00 0.00 0.00 179.45 177.83 1ap4 h VAL 44 N 0.43 0.66 -1.24 0.07 2.07 -1.31 -2.25 116.25 114.68 1ap4 h VAL 44 Ca 0.49 -0.20 0.36 0.00 0.82 0.00 0.00 66.70 68.17 1ap4 h VAL 44 Cb 1.20 0.76 -0.07 0.00 -1.52 0.00 0.00 31.29 31.66 1ap4 h VAL 44 CO -0.20 0.04 0.86 0.24 0.02 0.00 0.00 177.57 178.53 1ap4 h MET 45 N -0.59 0.10 -0.43 1.57 2.86 0.81 0.62 114.93 119.87 1ap4 h MET 45 Ca -0.05 -0.01 -0.13 0.00 -2.06 0.00 0.00 59.70 57.45 1ap4 h MET 45 Cb 0.44 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.06 1ap4 h MET 45 CO 0.08 0.06 -0.25 0.00 1.06 0.00 0.00 176.91 177.87 1ap4 h ARG 46 N 0.10 0.90 0.77 1.72 2.47 -1.26 0.29 114.38 119.37 1ap4 h ARG 46 Ca 0.63 -0.39 -0.04 0.00 -1.26 0.00 0.00 59.98 58.92 1ap4 h ARG 46 Cb 2.26 -0.03 0.01 0.00 -1.65 0.00 0.00 29.97 30.56 1ap4 h ARG 46 CO -0.11 1.05 -0.37 0.52 0.56 0.00 0.00 179.97 181.61 1ap4 h MET 47 N 0.78 -0.99 0.00 0.04 2.86 0.43 -3.34 114.93 114.71 1ap4 h MET 47 Ca 0.10 0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 1ap4 h MET 47 Cb 0.80 0.23 0.00 0.00 0.06 0.00 0.00 31.60 32.69 1ap4 h MET 47 CO 0.07 -0.66 0.00 1.28 1.06 0.00 0.00 176.91 178.66 1ap4 n LEU 48 N -5.16 0.00 0.00 1.22 4.77 -1.04 -4.85 117.00 111.94 1ap4 n LEU 48 Ca -0.13 0.84 0.00 0.00 -0.03 0.00 0.00 56.01 56.69 1ap4 n LEU 48 Cb 0.41 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 1ap4 n LEU 48 CO 0.31 -0.34 0.00 0.61 -1.33 0.00 0.00 177.39 176.64 1ap4 n GLY 49 N -0.93 0.00 3.23 -0.72 0.00 -1.05 -5.13 105.19 100.60 1ap4 n GLY 49 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1ap4 n GLY 49 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ap4 s GLN 50 N 0.00 1.07 -0.39 1.61 -1.52 0.98 -5.02 119.66 116.38 1ap4 s GLN 50 Ca 0.00 -1.50 0.08 0.00 -1.95 0.00 0.00 55.36 51.99 1ap4 s GLN 50 Cb 0.00 -0.26 0.26 0.00 -0.22 0.00 0.00 33.01 32.80 1ap4 s GLN 50 CO 0.00 -0.11 0.58 0.09 -0.25 0.00 0.00 175.29 175.59 1ap4 n ASN 51 N -0.21 0.08 -3.59 5.90 3.02 -1.26 -3.12 115.26 116.07 1ap4 n ASN 51 Ca -0.07 -2.78 -0.28 0.00 -0.03 0.00 0.00 54.58 51.42 1ap4 n ASN 51 Cb 0.63 -0.48 0.22 0.00 -0.61 0.00 0.00 39.78 39.54 1ap4 n ASN 51 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1ap4 n PRO 52 N 1.25 -2.48 -4.05 3.52 -0.04 -1.26 -5.08 135.00 126.86 1ap4 n PRO 52 Ca 0.21 -1.75 -0.24 0.00 -0.04 0.00 0.00 63.50 61.68 1ap4 n PRO 52 Cb 0.56 -1.48 -0.06 0.00 -0.04 0.00 0.00 33.50 32.48 1ap4 n PRO 52 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1ap4 s THR 53 N -3.16 2.59 0.09 0.52 -4.23 -1.26 -4.99 115.64 105.20 1ap4 s THR 53 Ca 0.69 -1.66 0.33 0.00 -1.18 0.00 0.00 61.69 59.87 1ap4 s THR 53 Cb -0.05 -2.98 0.39 0.00 1.34 0.00 0.00 72.50 71.20 1ap4 s THR 53 CO 0.51 -0.07 1.97 1.55 -0.54 0.00 0.00 174.62 178.05 1ap4 h PRO 54 N 1.42 0.00 0.08 3.99 0.13 -1.99 -0.62 132.00 135.01 1ap4 h PRO 54 Ca -0.43 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.56 1ap4 h PRO 54 Cb 1.25 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.39 1ap4 h PRO 54 CO 0.66 0.00 -0.64 1.49 -0.23 0.00 0.00 178.00 179.28 1ap4 h GLU 55 N 0.00 0.18 -0.02 0.86 4.81 -2.02 -3.33 114.58 115.06 1ap4 h GLU 55 Ca -0.00 -0.30 -0.14 0.00 -0.13 0.00 0.00 59.36 58.79 1ap4 h GLU 55 Cb 0.53 0.11 -0.02 0.00 0.63 0.00 0.00 28.75 30.00 1ap4 h GLU 55 CO 0.00 1.15 -0.63 0.93 -0.73 0.00 0.00 179.01 179.72 1ap4 h GLU 56 N -0.61 0.07 -0.12 1.92 3.07 -1.95 -3.10 114.58 113.86 1ap4 h GLU 56 Ca -0.13 -0.05 0.01 0.00 -0.50 0.00 0.00 59.36 58.69 1ap4 h GLU 56 Cb 1.43 0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 29.33 1ap4 h GLU 56 CO 0.07 0.68 -0.08 1.25 -1.40 0.00 0.00 179.01 179.52 1ap4 h LEU 57 N 0.05 -0.30 -0.53 1.33 5.85 -1.22 0.79 115.31 121.28 1ap4 h LEU 57 Ca -0.01 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1ap4 h LEU 57 Cb 1.13 0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.29 1ap4 h LEU 57 CO 0.09 -0.04 0.00 -0.61 -0.34 0.00 0.00 178.44 177.54 1ap4 h GLN 58 N -0.01 0.00 0.08 1.25 5.75 -1.72 -2.44 115.11 118.01 1ap4 h GLN 58 Ca 0.02 0.00 -0.15 0.00 -0.15 0.00 0.00 58.65 58.37 1ap4 h GLN 58 Cb 0.07 0.00 0.02 0.00 1.07 0.00 0.00 27.48 28.63 1ap4 h GLN 58 CO -0.12 0.00 -0.62 1.49 -2.65 0.00 0.00 178.83 176.92 1ap4 h GLU 59 N 0.00 0.28 0.01 1.69 4.22 -0.63 -2.95 114.58 117.20 1ap4 h GLU 59 Ca 0.00 -0.41 -0.08 0.00 0.08 0.00 0.00 59.36 58.95 1ap4 h GLU 59 Cb 0.50 0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.90 1ap4 h GLU 59 CO 0.00 1.15 -0.31 0.52 -2.18 0.00 0.00 179.01 178.19 1ap4 h MET 60 N -0.40 0.19 -0.01 1.92 2.86 0.45 -2.93 114.93 117.01 1ap4 h MET 60 Ca -0.10 -0.22 0.03 0.00 -2.06 0.00 0.00 59.70 57.35 1ap4 h MET 60 Cb 1.44 0.07 -0.04 0.00 0.06 0.00 0.00 31.60 33.12 1ap4 h MET 60 CO 0.12 0.97 -0.21 0.82 1.06 0.00 0.00 176.91 179.67 1ap4 h ILE 61 N -0.49 0.50 0.00 -1.22 2.04 -1.60 0.21 117.51 116.95 1ap4 h ILE 61 Ca -0.04 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.82 1ap4 h ILE 61 Cb 1.09 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 1ap4 h ILE 61 CO 0.06 0.00 0.00 -0.67 0.00 0.00 0.00 178.15 177.54 1ap4 n ASP 62 N -5.34 0.00 -0.06 1.72 -0.08 -1.11 -1.55 116.55 110.14 1ap4 n ASP 62 Ca -0.05 0.37 -0.19 0.00 -1.51 0.00 0.00 54.79 53.41 1ap4 n ASP 62 Cb 0.25 -0.42 -0.13 0.00 2.34 0.00 0.00 41.12 43.16 1ap4 n ASP 62 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1ap4 n GLU 63 N -1.42 0.71 0.14 -0.67 -0.58 0.48 -4.31 120.64 114.98 1ap4 n GLU 63 Ca 0.03 0.21 0.04 0.00 -0.42 0.00 0.00 57.16 57.02 1ap4 n GLU 63 Cb 0.10 -1.63 0.03 0.00 -0.57 0.00 0.00 31.44 29.38 1ap4 n GLU 63 CO 0.00 0.00 0.00 -0.24 -0.48 0.00 0.00 177.13 176.41 1ap4 h VAL 64 N 0.04 0.66 -1.64 2.62 3.04 -0.58 -3.46 116.25 116.92 1ap4 h VAL 64 Ca -0.49 -1.96 -0.67 0.00 -1.01 0.00 0.00 66.70 62.56 1ap4 h VAL 64 Cb 1.98 2.27 0.08 0.00 -2.01 0.00 0.00 31.29 33.62 1ap4 h VAL 64 CO 0.01 0.37 0.05 -0.67 -1.01 0.00 0.00 177.57 176.33 1ap4 n ASP 65 N -3.14 0.57 -0.09 3.17 -0.08 -0.59 -4.91 116.55 111.47 1ap4 n ASP 65 Ca 0.01 1.15 -0.11 0.00 -1.51 0.00 0.00 54.79 54.33 1ap4 n ASP 65 Cb 0.71 -1.12 -0.04 0.00 2.34 0.00 0.00 41.12 43.02 1ap4 n ASP 65 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 1ap4 n GLU 66 N 1.44 0.53 0.29 -0.67 2.13 -1.26 -4.44 120.64 118.67 1ap4 n GLU 66 Ca 0.16 0.24 0.18 0.00 0.66 0.00 0.00 57.16 58.40 1ap4 n GLU 66 Cb 0.23 -1.46 0.85 0.00 0.27 0.00 0.00 31.44 31.33 1ap4 n GLU 66 CO 0.00 0.00 0.00 0.38 -0.41 0.00 0.00 177.13 177.10 1ap4 h ASP 67 N -1.00 0.00 -0.37 4.31 3.04 -1.97 -3.46 116.42 116.98 1ap4 h ASP 67 Ca -0.07 0.00 -0.05 0.00 -3.24 0.00 0.00 57.03 53.67 1ap4 h ASP 67 Cb 1.02 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 39.31 1ap4 h ASP 67 CO -0.04 0.03 -0.07 0.61 -2.04 0.00 0.00 179.24 177.73 1ap4 n GLY 68 N -0.39 0.28 0.00 7.15 0.00 -1.26 -4.91 105.19 106.06 1ap4 n GLY 68 Ca -0.01 -0.79 0.12 0.00 0.00 0.00 0.00 46.02 45.34 1ap4 n GLY 68 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ap4 n SER 69 N 1.49 0.00 0.00 1.61 3.41 -1.26 -4.89 113.62 113.98 1ap4 n SER 69 Ca -0.03 0.43 0.00 0.00 -0.26 0.00 0.00 58.87 59.01 1ap4 n SER 69 Cb 0.49 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 63.97 1ap4 n SER 69 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ap4 n GLY 70 N 1.00 2.52 3.94 5.00 0.00 -1.26 -5.00 105.19 111.38 1ap4 n GLY 70 Ca 0.07 -0.44 -0.25 0.00 0.00 0.00 0.00 46.02 45.40 1ap4 n GLY 70 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ap4 s THR 71 N -1.00 4.52 -0.26 2.61 -4.23 -1.26 -4.58 115.64 111.44 1ap4 s THR 71 Ca 0.00 -0.28 -0.07 0.00 -1.18 0.00 0.00 61.69 60.16 1ap4 s THR 71 Cb 0.00 -3.69 -0.01 0.00 1.34 0.00 0.00 72.50 70.14 1ap4 s THR 71 CO 0.00 -0.54 0.06 -0.69 -0.54 0.00 0.00 174.62 172.92 1ap4 s VAL 72 N -2.57 4.07 0.72 2.29 1.01 -1.22 -4.93 120.40 119.77 1ap4 s VAL 72 Ca 0.46 -0.41 0.02 0.00 0.00 0.00 0.00 61.98 62.05 1ap4 s VAL 72 Cb -0.10 -2.98 0.14 0.00 0.00 0.00 0.00 36.38 33.44 1ap4 s VAL 72 CO 0.40 0.25 0.99 1.51 0.00 0.00 0.00 175.10 178.24 1ap4 s ASP 73 N 1.56 4.34 0.55 3.32 -4.77 -1.26 -2.60 116.67 117.81 1ap4 s ASP 73 Ca 0.05 -0.59 0.27 0.00 -3.30 0.00 0.00 52.55 48.98 1ap4 s ASP 73 Cb -0.16 0.29 1.45 0.00 -1.09 0.00 0.00 42.92 43.42 1ap4 s ASP 73 CO 0.02 -1.89 1.97 0.15 0.70 0.00 0.00 175.17 176.12 1ap4 h PHE 74 N -0.47 0.00 0.06 2.11 3.57 -1.97 0.43 116.94 120.67 1ap4 h PHE 74 Ca -0.33 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.17 1ap4 h PHE 74 Cb 1.27 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.01 1ap4 h PHE 74 CO -0.15 0.00 -0.03 -0.44 -2.23 0.00 0.00 178.31 175.46 1ap4 h ASP 75 N 0.00 -0.07 -0.53 0.41 5.19 -2.01 -3.09 116.42 116.32 1ap4 h ASP 75 Ca 0.26 0.00 0.04 0.00 -0.62 0.00 0.00 57.03 56.71 1ap4 h ASP 75 Cb 1.12 0.02 -0.04 0.00 0.18 0.00 0.00 39.33 40.60 1ap4 h ASP 75 CO -0.00 -0.01 0.29 -0.33 -3.12 0.00 0.00 179.24 176.07 1ap4 h GLU 76 N -0.15 0.55 -1.27 3.56 5.08 -1.86 -1.11 114.58 119.38 1ap4 h GLU 76 Ca -0.01 -0.03 0.39 0.00 -1.00 0.00 0.00 59.36 58.70 1ap4 h GLU 76 Cb 0.06 -0.12 -0.10 0.00 0.50 0.00 0.00 28.75 29.08 1ap4 h GLU 76 CO 0.01 0.37 0.84 0.35 -1.00 0.00 0.00 179.01 179.58 1ap4 h PHE 77 N 0.57 0.46 0.20 4.33 3.57 -0.27 0.14 116.94 125.94 1ap4 h PHE 77 Ca 0.23 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.74 1ap4 h PHE 77 Cb 0.10 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 38.72 1ap4 h PHE 77 CO -0.08 -0.09 -0.10 -0.07 -2.23 0.00 0.00 178.31 175.74 1ap4 h LEU 78 N 0.16 -0.23 -0.79 0.59 3.38 -1.11 -3.12 115.31 114.19 1ap4 h LEU 78 Ca 0.73 -0.28 0.19 0.00 0.09 0.00 0.00 57.88 58.60 1ap4 h LEU 78 Cb 2.32 0.06 -0.12 0.00 0.09 0.00 0.00 40.66 43.01 1ap4 h LEU 78 CO -0.30 0.30 0.18 0.58 0.09 0.00 0.00 178.44 179.28 1ap4 h VAL 79 N -0.90 0.42 -0.72 1.22 2.07 -0.88 0.27 116.25 117.73 1ap4 h VAL 79 Ca -0.03 -0.08 0.11 0.00 0.82 0.00 0.00 66.70 67.52 1ap4 h VAL 79 Cb 0.50 0.17 -0.08 0.00 -1.52 0.00 0.00 31.29 30.36 1ap4 h VAL 79 CO 0.05 0.04 0.33 0.24 0.02 0.00 0.00 177.57 178.25 1ap4 h MET 80 N 0.23 0.52 0.55 1.57 2.86 -1.33 0.13 114.93 119.46 1ap4 h MET 80 Ca 0.46 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 58.04 1ap4 h MET 80 Cb 0.84 -0.12 0.01 0.00 0.06 0.00 0.00 31.60 32.39 1ap4 h MET 80 CO -0.58 0.34 -0.26 0.52 1.06 0.00 0.00 176.91 177.99 1ap4 h MET 81 N 0.53 -0.71 -1.03 1.72 2.07 -0.44 -2.07 114.93 114.99 1ap4 h MET 81 Ca 0.37 0.05 0.26 0.00 -2.07 0.00 0.00 59.70 58.31 1ap4 h MET 81 Cb 0.47 0.16 -0.11 0.00 -1.87 0.00 0.00 31.60 30.25 1ap4 h MET 81 CO -0.32 -0.47 0.64 -0.24 1.07 0.00 0.00 176.91 177.59 1ap4 h VAL 82 N -0.96 0.51 -0.46 -2.22 3.04 -1.10 0.63 116.25 115.69 1ap4 h VAL 82 Ca -0.08 -0.16 -0.03 0.00 -1.01 0.00 0.00 66.70 65.42 1ap4 h VAL 82 Cb 0.57 0.00 -0.02 0.00 -2.01 0.00 0.00 31.29 29.83 1ap4 h VAL 82 CO 0.12 0.09 0.17 0.03 -1.01 0.00 0.00 177.57 176.97 1ap4 h ARG 83 N 0.47 0.71 0.00 4.17 3.08 -0.64 -2.84 114.38 119.33 1ap4 h ARG 83 Ca 0.63 -0.14 -0.20 0.00 0.07 0.00 0.00 59.98 60.34 1ap4 h ARG 83 Cb 1.41 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 31.35 1ap4 h ARG 83 CO -0.38 0.66 -0.89 0.00 -1.07 0.00 0.00 179.97 178.29 1ap4 s MET 85 N -3.20 0.10 0.00 0.00 0.23 0.19 -5.07 119.30 111.55 1ap4 s MET 85 Ca -0.03 0.00 0.00 0.00 -1.03 0.00 0.00 55.69 54.63 1ap4 s MET 85 Cb 0.10 -1.64 0.00 0.00 -1.53 0.00 0.00 34.83 31.76 1ap4 s MET 85 CO 0.83 -0.66 0.01 1.63 -2.03 0.00 0.00 175.02 174.79 1ap4 n LYS 86 N 5.29 0.00 0.00 3.16 5.02 -1.09 -3.91 118.16 126.63 1ap4 n LYS 86 Ca -0.07 0.13 0.00 0.00 -2.02 0.00 0.00 58.31 56.35 1ap4 n LYS 86 Cb 0.49 -0.63 0.00 0.00 -0.02 0.00 0.00 35.03 34.87 1ap4 n LYS 86 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1ap4 n ASP 87 N -0.88 0.00 -1.99 4.39 -0.08 -1.26 -4.92 116.55 111.80 1ap4 n ASP 87 Ca 0.00 0.00 -0.12 0.00 -1.51 0.00 0.00 54.79 53.16 1ap4 n ASP 87 Cb 0.00 0.16 -0.17 0.00 2.34 0.00 0.00 41.12 43.46 1ap4 n ASP 87 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1ap4 n ASP 88 N -2.11 5.25 -0.51 1.67 2.03 -1.26 -5.28 116.55 116.34 1ap4 n ASP 88 Ca 0.00 -2.49 0.06 0.00 0.52 0.00 0.00 54.79 52.89 1ap4 n ASP 88 Cb 0.00 -1.41 0.05 0.00 -0.72 0.00 0.00 41.12 39.04 1ap4 n ASP 88 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08