#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 -0.17 0.00 7.83 -0.08 -1.26 -5.02 116.55 117.85 1ap4 n ASP 2 Ca 0.00 -1.26 0.00 0.00 -1.51 0.00 0.00 54.79 52.02 1ap4 n ASP 2 Cb 0.00 -0.65 0.00 0.00 2.34 0.00 0.00 41.12 42.81 1ap4 n ASP 2 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1ap4 n ASP 3 N -3.64 0.00 0.01 1.67 8.00 -1.26 -4.86 116.55 116.47 1ap4 n ASP 3 Ca 0.11 -1.00 -0.12 0.00 0.71 0.00 0.00 54.79 54.48 1ap4 n ASP 3 Cb 0.37 0.00 -0.09 0.00 -0.02 0.00 0.00 41.12 41.38 1ap4 n ASP 3 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1ap4 h ILE 4 N 2.20 1.21 0.00 0.53 2.04 -2.00 -3.04 117.51 118.45 1ap4 h ILE 4 Ca 0.00 -1.23 -0.00 0.00 1.00 0.00 0.00 64.86 64.63 1ap4 h ILE 4 Cb 0.80 1.98 -0.00 0.00 -0.74 0.00 0.00 36.82 38.86 1ap4 h ILE 4 CO 0.00 0.29 -0.00 1.88 0.00 0.00 0.00 178.15 180.32 1ap4 h TYR 5 N -0.68 0.00 -0.38 1.37 -1.99 -1.99 -1.77 116.97 111.53 1ap4 h TYR 5 Ca -0.01 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.67 1ap4 h TYR 5 Cb 0.56 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.27 1ap4 h TYR 5 CO 0.11 0.00 0.06 0.87 -0.00 0.00 0.00 178.16 179.20 1ap4 h LYS 6 N 0.00 0.63 0.00 4.88 1.79 -1.87 -2.04 116.57 119.96 1ap4 h LYS 6 Ca -0.00 -0.17 0.00 0.00 -2.18 0.00 0.00 60.65 58.30 1ap4 h LYS 6 Cb 0.00 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 30.58 1ap4 h LYS 6 CO 0.00 0.70 0.00 0.00 -1.08 0.00 0.00 179.45 179.07 1ap4 n ALA 7 N -2.36 2.05 0.04 3.86 0.00 -0.71 -2.94 120.51 120.44 1ap4 n ALA 7 Ca -0.01 -0.06 -0.09 0.00 0.00 0.00 0.00 53.44 53.27 1ap4 n ALA 7 Cb 0.23 -1.38 -0.13 0.00 0.00 0.00 0.00 19.45 18.17 1ap4 n ALA 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ap4 h ALA 8 N 2.73 0.47 0.06 0.00 0.00 -0.88 -2.50 119.26 119.14 1ap4 h ALA 8 Ca 0.00 -1.13 -0.27 0.00 0.00 0.00 0.00 54.91 53.51 1ap4 h ALA 8 Cb 0.43 0.13 0.02 0.00 0.00 0.00 0.00 17.79 18.37 1ap4 h ALA 8 CO 0.00 1.33 -1.12 0.28 0.00 0.00 0.00 179.25 179.74 1ap4 h VAL 9 N 0.01 1.34 0.00 0.00 2.07 -1.32 -3.25 116.25 115.10 1ap4 h VAL 9 Ca -0.14 -2.48 -0.10 0.00 0.82 0.00 0.00 66.70 64.80 1ap4 h VAL 9 Cb 1.90 2.58 -0.01 0.00 -1.52 0.00 0.00 31.29 34.23 1ap4 h VAL 9 CO 0.12 0.75 -0.49 -0.08 0.02 0.00 0.00 177.57 177.89 1ap4 h GLU 10 N 0.27 0.00 0.00 1.57 4.81 -1.66 -3.09 114.58 116.47 1ap4 h GLU 10 Ca -0.14 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.09 1ap4 h GLU 10 Cb 1.79 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.17 1ap4 h GLU 10 CO 0.21 0.49 0.00 1.04 -0.73 0.00 0.00 179.01 180.02 1ap4 n GLN 11 N -3.26 0.04 -1.77 1.92 3.00 -0.94 -4.75 117.38 111.62 1ap4 n GLN 11 Ca 0.02 0.31 -0.42 0.00 -0.01 0.00 0.00 57.00 56.90 1ap4 n GLN 11 Cb 0.71 -1.58 -0.02 0.00 0.00 0.00 0.00 30.24 29.34 1ap4 n GLN 11 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1ap4 s LEU 12 N -3.31 4.36 0.84 1.08 1.43 -1.17 -4.93 118.68 116.98 1ap4 s LEU 12 Ca 0.06 2.87 -0.14 0.00 -1.03 0.00 0.00 54.13 55.90 1ap4 s LEU 12 Cb 0.09 -3.61 0.04 0.00 0.03 0.00 0.00 46.19 42.74 1ap4 s LEU 12 CO 0.27 -0.93 0.77 0.35 0.23 0.00 0.00 176.35 177.03 1ap4 n THR 13 N 3.30 1.14 0.44 5.49 -2.24 -1.26 -4.77 114.28 116.38 1ap4 n THR 13 Ca 0.13 -0.23 -0.17 0.00 -2.27 0.00 0.00 64.05 61.50 1ap4 n THR 13 Cb 0.36 -0.88 -0.08 0.00 -2.10 0.00 0.00 70.33 67.63 1ap4 n THR 13 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1ap4 h GLU 14 N -1.07 -1.08 -1.45 -0.78 4.39 -1.94 -2.49 114.58 110.16 1ap4 h GLU 14 Ca -0.45 0.07 0.44 0.00 0.34 0.00 0.00 59.36 59.76 1ap4 h GLU 14 Cb 1.30 0.25 -0.09 0.00 -0.10 0.00 0.00 28.75 30.11 1ap4 h GLU 14 CO 0.41 -0.72 1.00 1.05 -1.16 0.00 0.00 179.01 179.59 1ap4 h GLU 15 N -1.23 0.07 0.00 2.33 4.11 -1.97 0.25 114.58 118.13 1ap4 h GLU 15 Ca -0.11 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.31 1ap4 h GLU 15 Cb 0.86 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.09 1ap4 h GLU 15 CO 0.19 0.05 0.00 0.94 0.07 0.00 0.00 179.01 180.25 1ap4 n GLN 16 N -4.34 0.00 -0.18 1.06 -0.06 -0.96 -1.55 117.38 111.36 1ap4 n GLN 16 Ca 0.35 0.46 0.20 0.00 -2.00 0.00 0.00 57.00 56.01 1ap4 n GLN 16 Cb 1.50 -1.31 0.57 0.00 -4.06 0.00 0.00 30.24 26.95 1ap4 n GLN 16 CO 0.00 0.00 0.00 0.87 -0.20 0.00 0.00 177.06 177.73 1ap4 h LYS 17 N 0.00 0.27 -0.91 3.69 1.57 -1.08 0.19 116.57 120.31 1ap4 h LYS 17 Ca 0.00 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 1ap4 h LYS 17 Cb 0.00 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.21 1ap4 h LYS 17 CO 0.00 0.18 0.50 -0.91 -0.57 0.00 0.00 179.45 178.65 1ap4 h ASN 18 N 0.28 1.13 1.71 0.86 4.21 -0.51 -1.88 115.58 121.37 1ap4 h ASN 18 Ca 0.40 -0.10 -0.01 0.00 1.21 0.00 0.00 56.30 57.81 1ap4 h ASN 18 Cb 1.16 -0.29 -0.00 0.00 -1.12 0.00 0.00 38.32 38.07 1ap4 h ASN 18 CO -0.11 0.90 -0.29 -0.33 -1.29 0.00 0.00 177.43 176.31 1ap4 h GLU 19 N 1.27 0.00 -0.39 0.81 5.08 0.33 -3.29 114.58 118.38 1ap4 h GLU 19 Ca 0.32 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.52 1ap4 h GLU 19 Cb 0.01 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1ap4 h GLU 19 CO -0.05 0.04 -0.36 0.74 -1.00 0.00 0.00 179.01 178.38 1ap4 h PHE 20 N 0.00 1.12 -0.23 4.33 -1.00 -0.21 -2.66 116.94 118.29 1ap4 h PHE 20 Ca -0.00 -0.33 0.01 0.00 2.81 0.00 0.00 57.97 60.46 1ap4 h PHE 20 Cb 1.04 -0.24 -0.02 0.00 3.61 0.00 0.00 35.95 40.34 1ap4 h PHE 20 CO 0.00 1.16 0.12 -0.22 -1.61 0.00 0.00 178.31 177.75 1ap4 h LYS 21 N 0.76 0.24 0.51 1.51 1.63 -1.48 0.18 116.57 119.91 1ap4 h LYS 21 Ca 0.07 -0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.84 1ap4 h LYS 21 Cb 0.96 -0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 32.52 1ap4 h LYS 21 CO 0.09 0.16 -0.38 0.00 -3.45 0.00 0.00 179.45 175.87 1ap4 h ALA 22 N 1.12 -0.91 -0.65 5.00 0.00 -1.66 -2.57 119.26 119.59 1ap4 h ALA 22 Ca 0.10 -0.16 0.09 0.00 0.00 0.00 0.00 54.91 54.93 1ap4 h ALA 22 Cb 0.02 0.51 -0.07 0.00 0.00 0.00 0.00 17.79 18.25 1ap4 h ALA 22 CO -0.07 -1.04 0.29 0.00 0.00 0.00 0.00 179.25 178.44 1ap4 h ALA 23 N -0.53 0.87 -0.89 0.00 0.00 -1.30 -1.75 119.26 115.66 1ap4 h ALA 23 Ca -0.06 0.06 0.21 0.00 0.00 0.00 0.00 54.91 55.13 1ap4 h ALA 23 Cb 0.74 -0.00 -0.16 0.00 0.00 0.00 0.00 17.79 18.36 1ap4 h ALA 23 CO 0.01 -0.11 -0.05 0.35 0.00 0.00 0.00 179.25 179.45 1ap4 h PHE 24 N 0.51 -0.16 0.00 0.00 3.57 -0.23 2.09 116.94 122.71 1ap4 h PHE 24 Ca 0.32 0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.89 1ap4 h PHE 24 Cb 0.36 0.21 0.00 0.00 2.79 0.00 0.00 35.95 39.31 1ap4 h PHE 24 CO -0.13 -0.35 0.00 -0.25 -2.23 0.00 0.00 178.31 175.34 1ap4 n ASP 25 N -5.46 0.68 0.12 0.41 8.00 -0.67 -2.54 116.55 117.08 1ap4 n ASP 25 Ca 0.17 0.67 -0.01 0.00 0.71 0.00 0.00 54.79 56.33 1ap4 n ASP 25 Cb 0.58 -0.81 0.06 0.00 -0.02 0.00 0.00 41.12 40.93 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 1.32 0.00 0.53 1.08 0.35 -3.20 117.51 117.60 1ap4 h ILE 26 Ca 0.00 -2.52 -0.16 0.00 -0.39 0.00 0.00 64.86 61.79 1ap4 h ILE 26 Cb 0.37 2.43 -0.03 0.00 -3.07 0.00 0.00 36.82 36.53 1ap4 h ILE 26 CO 0.00 0.68 -1.12 -0.26 -0.69 0.00 0.00 178.15 176.76 1ap4 h PHE 27 N 0.00 0.00 -0.86 1.37 0.04 -1.22 -3.31 116.94 112.96 1ap4 h PHE 27 Ca -0.01 0.00 -0.45 0.00 2.80 0.00 0.00 57.97 60.31 1ap4 h PHE 27 Cb 1.37 0.00 -0.27 0.00 2.20 0.00 0.00 35.95 39.25 1ap4 h PHE 27 CO 0.00 0.60 0.57 1.33 -0.60 0.00 0.00 178.31 180.22 1ap4 n VAL 28 N -3.03 2.92 -1.82 -0.55 0.24 -1.18 -4.87 118.33 110.04 1ap4 n VAL 28 Ca -0.06 -1.67 -0.22 0.00 -2.04 0.00 0.00 64.34 60.35 1ap4 n VAL 28 Cb 0.82 -0.55 -0.09 0.00 -1.47 0.00 0.00 33.84 32.55 1ap4 n VAL 28 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1ap4 n LEU 29 N -0.92 2.26 0.00 1.34 4.77 -1.21 -1.51 117.00 121.73 1ap4 n LEU 29 Ca 0.52 -2.84 0.00 0.00 -0.03 0.00 0.00 56.01 53.66 1ap4 n LEU 29 Cb 1.51 -1.72 0.00 0.00 -2.33 0.00 0.00 43.42 40.87 1ap4 n LEU 29 CO 0.53 -2.68 0.00 0.61 -1.33 0.00 0.00 177.39 174.52 1ap4 n GLY 30 N 5.92 1.55 3.63 -0.72 0.00 -1.26 -5.12 105.19 109.19 1ap4 n GLY 30 Ca 0.43 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.16 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 -2.00 0.72 -0.06 4.61 0.00 -0.57 -4.98 121.76 119.49 1ap4 s ALA 31 Ca 0.00 -0.66 0.19 0.00 0.00 0.00 0.00 51.96 51.49 1ap4 s ALA 31 Cb 0.00 -3.00 -0.29 0.00 0.00 0.00 0.00 23.12 19.83 1ap4 s ALA 31 CO 0.00 -3.25 0.36 -0.85 0.00 0.00 0.00 175.76 172.02 1ap4 n GLU 32 N -4.49 0.67 -0.10 0.00 0.28 -1.26 -4.50 120.64 111.24 1ap4 n GLU 32 Ca 0.09 -0.15 0.02 0.00 -0.16 0.00 0.00 57.16 56.96 1ap4 n GLU 32 Cb 0.58 -1.47 0.03 0.00 1.43 0.00 0.00 31.44 32.02 1ap4 n GLU 32 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1ap4 n ASP 33 N -2.28 1.23 -3.20 -1.84 5.68 -1.26 -5.02 116.55 109.86 1ap4 n ASP 33 Ca -0.08 -2.00 -0.10 0.00 -0.50 0.00 0.00 54.79 52.11 1ap4 n ASP 33 Cb 0.62 -0.13 0.05 0.00 -1.14 0.00 0.00 41.12 40.51 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 -0.50 -1.19 3.28 6.12 0.00 -1.26 -5.03 105.19 106.60 1ap4 n GLY 34 Ca 0.04 0.55 -0.09 0.00 0.00 0.00 0.00 46.02 46.51 1ap4 n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ap4 s ILE 36 N -3.97 4.83 0.98 0.00 1.01 -0.03 -4.35 121.20 119.67 1ap4 s ILE 36 Ca 0.17 -2.99 -0.12 0.00 0.00 0.00 0.00 60.65 57.71 1ap4 s ILE 36 Cb 0.04 -4.02 0.12 0.00 0.01 0.00 0.00 42.46 38.61 1ap4 s ILE 36 CO -0.01 -1.01 0.73 -1.20 0.00 0.00 0.00 174.94 173.45 1ap4 n SER 37 N 3.38 -1.11 0.20 3.58 7.64 -1.26 -2.01 113.62 124.03 1ap4 n SER 37 Ca 0.14 0.27 0.13 0.00 1.01 0.00 0.00 58.87 60.43 1ap4 n SER 37 Cb 0.41 -1.30 0.70 0.00 -1.01 0.00 0.00 64.21 63.02 1ap4 n SER 37 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ap4 h THR 38 N -1.87 0.00 -0.12 0.44 1.03 -1.95 -1.40 112.91 109.04 1ap4 h THR 38 Ca -0.46 -0.03 -0.07 0.00 -0.01 0.00 0.00 66.41 65.84 1ap4 h THR 38 Cb 1.29 0.63 -0.01 0.00 -1.07 0.00 0.00 68.15 68.99 1ap4 h THR 38 CO 0.39 0.00 -0.26 0.11 -0.01 0.00 0.00 175.52 175.75 1ap4 h LYS 39 N 0.00 0.22 0.00 0.00 1.79 -1.95 -2.98 116.57 113.64 1ap4 h LYS 39 Ca 0.00 -0.07 -0.20 0.00 -2.18 0.00 0.00 60.65 58.20 1ap4 h LYS 39 Cb 0.03 -0.02 -0.04 0.00 -1.58 0.00 0.00 32.23 30.63 1ap4 h LYS 39 CO 0.00 0.47 -1.74 0.39 -1.08 0.00 0.00 179.45 177.49 1ap4 n GLU 40 N -4.16 0.64 -0.03 3.15 4.71 -0.55 -4.37 120.64 120.04 1ap4 n GLU 40 Ca -0.01 0.12 -0.02 0.00 -0.01 0.00 0.00 57.16 57.24 1ap4 n GLU 40 Cb 0.36 -1.70 -0.01 0.00 -1.01 0.00 0.00 31.44 29.08 1ap4 n GLU 40 CO 0.00 0.00 0.00 1.25 0.09 0.00 0.00 177.13 178.47 1ap4 h LEU 41 N 0.00 -0.29 -0.92 -4.62 7.12 -1.33 1.72 115.31 117.00 1ap4 h LEU 41 Ca -0.24 0.04 0.26 0.00 0.13 0.00 0.00 57.88 58.08 1ap4 h LEU 41 Cb 1.68 0.12 -0.15 0.00 -0.53 0.00 0.00 40.66 41.78 1ap4 h LEU 41 CO 0.04 -0.06 0.25 1.23 -0.13 0.00 0.00 178.44 179.77 1ap4 h GLY 42 N -0.05 1.47 1.60 3.75 0.00 -1.78 0.98 103.07 109.04 1ap4 h GLY 42 Ca 0.01 -0.02 -0.13 0.00 0.00 0.00 0.00 47.33 47.19 1ap4 h GLY 42 CO -0.10 -0.44 -0.45 0.50 0.00 0.00 0.00 176.54 176.05 1ap4 h LYS 43 N 0.16 0.44 -0.10 4.80 1.79 -1.00 -3.12 116.57 119.52 1ap4 h LYS 43 Ca 0.60 -0.23 -0.01 0.00 -2.18 0.00 0.00 60.65 58.83 1ap4 h LYS 43 Cb 1.28 0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 31.93 1ap4 h LYS 43 CO -0.71 0.80 0.02 0.28 -1.08 0.00 0.00 179.45 178.76 1ap4 h VAL 44 N 0.35 1.20 -0.73 0.50 2.07 1.03 -2.42 116.25 118.25 1ap4 h VAL 44 Ca 0.02 -0.62 0.19 0.00 0.82 0.00 0.00 66.70 67.11 1ap4 h VAL 44 Cb 0.93 1.42 -0.04 0.00 -1.52 0.00 0.00 31.29 32.08 1ap4 h VAL 44 CO 0.08 0.18 0.51 0.24 0.02 0.00 0.00 177.57 178.60 1ap4 h MET 45 N -0.04 0.14 -0.18 1.57 2.86 -0.99 0.24 114.93 118.53 1ap4 h MET 45 Ca 0.03 -0.01 -0.14 0.00 -2.06 0.00 0.00 59.70 57.53 1ap4 h MET 45 Cb 0.26 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.88 1ap4 h MET 45 CO 0.00 0.09 -0.47 0.00 1.06 0.00 0.00 176.91 177.60 1ap4 h ARG 46 N 0.15 0.45 0.49 1.72 3.08 -1.39 0.23 114.38 119.11 1ap4 h ARG 46 Ca 0.36 -0.25 -0.02 0.00 0.07 0.00 0.00 59.98 60.13 1ap4 h ARG 46 Cb 1.19 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.26 1ap4 h ARG 46 CO -0.05 0.83 -0.23 0.52 -1.07 0.00 0.00 179.97 179.96 1ap4 h MET 47 N 0.36 -0.63 0.36 0.04 2.86 -0.26 -3.33 114.93 114.33 1ap4 h MET 47 Ca 0.02 0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.69 1ap4 h MET 47 Cb 0.96 0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.76 1ap4 h MET 47 CO 0.08 -0.32 -0.27 -0.07 1.06 0.00 0.00 176.91 177.38 1ap4 h LEU 48 N -0.97 -0.72 0.00 1.22 3.38 -1.50 -3.47 115.31 113.25 1ap4 h LEU 48 Ca -0.07 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1ap4 h LEU 48 Cb 0.60 0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.57 1ap4 h LEU 48 CO 0.11 -0.39 0.00 0.61 0.09 0.00 0.00 178.44 178.86 1ap4 n GLY 49 N -1.33 0.00 3.86 0.83 0.00 -0.87 -5.13 105.19 102.56 1ap4 n GLY 49 Ca -0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.66 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 2.23 -0.42 1.61 1.11 0.76 -5.02 119.66 119.92 1ap4 s GLN 50 Ca 0.00 -2.17 0.08 0.00 0.01 0.00 0.00 55.36 53.28 1ap4 s GLN 50 Cb 0.00 -1.89 0.30 0.00 -1.01 0.00 0.00 33.01 30.41 1ap4 s GLN 50 CO 0.00 -0.55 0.85 -1.71 0.01 0.00 0.00 175.29 173.89 1ap4 n ASN 51 N -1.61 -0.98 -4.74 5.90 5.15 -1.26 -4.40 115.26 113.32 1ap4 n ASN 51 Ca -0.08 -3.23 -0.29 0.00 -0.60 0.00 0.00 54.58 50.37 1ap4 n ASN 51 Cb 0.65 0.64 0.14 0.00 -0.53 0.00 0.00 39.78 40.69 1ap4 n ASN 51 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1ap4 s PRO 52 N -0.78 1.00 0.50 1.20 0.04 -1.26 -5.05 135.00 130.65 1ap4 s PRO 52 Ca 0.32 0.46 -0.00 0.00 0.04 0.00 0.00 61.00 61.82 1ap4 s PRO 52 Cb 0.28 -1.81 0.01 0.00 0.04 0.00 0.00 34.50 33.02 1ap4 s PRO 52 CO -0.11 -2.33 0.74 0.95 0.04 0.00 0.00 177.00 176.30 1ap4 s THR 53 N -3.12 3.51 0.26 1.26 -4.23 -1.26 -4.99 115.64 107.06 1ap4 s THR 53 Ca 0.64 -0.48 0.11 0.00 -1.18 0.00 0.00 61.69 60.77 1ap4 s THR 53 Cb -0.16 -3.32 -0.03 0.00 1.34 0.00 0.00 72.50 70.33 1ap4 s THR 53 CO 0.55 -0.24 1.60 1.55 -0.54 0.00 0.00 174.62 177.54 1ap4 h PRO 54 N 0.21 0.00 0.00 3.99 0.13 -2.02 -3.08 132.00 131.23 1ap4 h PRO 54 Ca -0.45 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.54 1ap4 h PRO 54 Cb 1.27 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.38 1ap4 h PRO 54 CO 0.56 0.63 -0.67 1.05 -0.23 0.00 0.00 178.00 179.34 1ap4 h GLU 55 N 0.00 0.00 -0.04 0.86 4.11 -2.03 -3.25 114.58 114.23 1ap4 h GLU 55 Ca -0.01 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 59.29 1ap4 h GLU 55 Cb 1.13 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.36 1ap4 h GLU 55 CO 0.08 0.67 -0.59 0.93 0.07 0.00 0.00 179.01 180.17 1ap4 h GLU 56 N 0.00 0.13 0.00 1.06 5.08 -1.93 -3.24 114.58 115.67 1ap4 h GLU 56 Ca -0.01 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1ap4 h GLU 56 Cb 1.50 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.76 1ap4 h GLU 56 CO 0.09 0.68 0.00 1.28 -1.00 0.00 0.00 179.01 180.05 1ap4 n LEU 57 N -3.86 0.00 0.06 1.33 4.32 -1.19 0.16 117.00 117.81 1ap4 n LEU 57 Ca -0.02 0.69 -0.14 0.00 -0.02 0.00 0.00 56.01 56.52 1ap4 n LEU 57 Cb 0.60 -0.19 -0.07 0.00 -1.62 0.00 0.00 43.42 42.14 1ap4 n LEU 57 CO 0.43 -0.19 0.57 -0.61 -1.22 0.00 0.00 177.39 176.37 1ap4 h GLN 58 N 0.00 -0.58 -0.06 3.23 -0.00 -1.78 -1.54 115.11 114.38 1ap4 h GLN 58 Ca 0.00 0.04 0.02 0.00 -0.00 0.00 0.00 58.65 58.71 1ap4 h GLN 58 Cb 0.00 0.13 -0.04 0.00 0.00 0.00 0.00 27.48 27.57 1ap4 h GLN 58 CO 0.00 -0.38 -0.33 1.49 0.00 0.00 0.00 178.83 179.61 1ap4 h GLU 59 N -0.60 -0.35 -0.93 1.69 4.81 -1.52 0.24 114.58 117.91 1ap4 h GLU 59 Ca 0.04 0.02 0.28 0.00 -0.13 0.00 0.00 59.36 59.57 1ap4 h GLU 59 Cb 0.67 0.08 -0.15 0.00 0.63 0.00 0.00 28.75 29.98 1ap4 h GLU 59 CO -0.33 -0.24 0.32 0.52 -0.73 0.00 0.00 179.01 178.56 1ap4 h MET 60 N -0.37 0.19 0.00 1.92 2.86 0.17 1.90 114.93 121.61 1ap4 h MET 60 Ca 0.02 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1ap4 h MET 60 Cb 0.42 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.04 1ap4 h MET 60 CO -0.26 0.13 0.00 -0.89 1.06 0.00 0.00 176.91 176.95 1ap4 n ILE 61 N -5.22 0.01 0.03 -1.22 5.41 -0.42 -3.01 119.36 114.94 1ap4 n ILE 61 Ca 0.26 0.00 0.12 0.00 1.00 0.00 0.00 62.75 64.13 1ap4 n ILE 61 Cb 0.82 -0.51 0.26 0.00 -0.71 0.00 0.00 39.64 39.51 1ap4 n ILE 61 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1ap4 n ASP 62 N -1.34 3.70 0.00 4.38 2.03 0.64 -3.53 116.55 122.43 1ap4 n ASP 62 Ca 0.12 -2.00 0.00 0.00 0.52 0.00 0.00 54.79 53.43 1ap4 n ASP 62 Cb 0.26 -0.35 0.00 0.00 -0.72 0.00 0.00 41.12 40.31 1ap4 n ASP 62 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1ap4 n GLU 63 N 1.58 1.50 -0.07 -0.67 1.02 -0.94 -4.73 120.64 118.32 1ap4 n GLU 63 Ca 0.22 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.32 1ap4 n GLU 63 Cb 0.62 -0.98 -0.16 0.00 -0.02 0.00 0.00 31.44 30.89 1ap4 n GLU 63 CO 0.00 0.00 0.00 1.55 1.18 0.00 0.00 177.13 179.86 1ap4 n VAL 64 N -1.63 0.99 -2.05 2.62 3.14 -1.21 -4.84 118.33 115.35 1ap4 n VAL 64 Ca 0.00 -0.75 -0.40 0.00 -2.96 0.00 0.00 64.34 60.23 1ap4 n VAL 64 Cb 0.17 -0.34 -0.03 0.00 -1.06 0.00 0.00 33.84 32.59 1ap4 n VAL 64 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1ap4 s ASP 65 N -5.19 5.47 0.00 6.55 2.15 -1.23 -4.78 116.67 119.64 1ap4 s ASP 65 Ca -0.09 0.59 0.24 0.00 0.43 0.00 0.00 52.55 53.71 1ap4 s ASP 65 Cb 0.08 -2.53 0.24 0.00 -0.30 0.00 0.00 42.92 40.41 1ap4 s ASP 65 CO 0.84 -2.17 1.23 -0.62 -0.17 0.00 0.00 175.17 174.28 1ap4 n GLU 66 N 8.95 0.00 0.07 4.34 -0.58 -1.26 -4.19 120.64 127.96 1ap4 n GLU 66 Ca 0.21 -0.00 -0.21 0.00 -0.42 0.00 0.00 57.16 56.74 1ap4 n GLU 66 Cb 0.51 -1.50 -0.14 0.00 -0.57 0.00 0.00 31.44 29.74 1ap4 n GLU 66 CO 0.00 0.00 0.00 0.38 -0.48 0.00 0.00 177.13 177.03 1ap4 h ASP 67 N 0.00 0.60 -0.03 1.62 2.03 -1.99 -3.48 116.42 115.18 1ap4 h ASP 67 Ca 0.00 -0.90 0.00 0.00 -0.73 0.00 0.00 57.03 55.40 1ap4 h ASP 67 Cb 0.50 -0.19 0.00 0.00 -0.83 0.00 0.00 39.33 38.81 1ap4 h ASP 67 CO 0.00 1.45 0.00 0.61 -1.03 0.00 0.00 179.24 180.27 1ap4 n GLY 68 N 1.54 1.59 0.10 7.15 0.00 -1.26 -5.00 105.19 109.32 1ap4 n GLY 68 Ca -0.14 -0.16 -0.11 0.00 0.00 0.00 0.00 46.02 45.61 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 0.36 0.29 0.00 1.61 3.41 -1.26 -4.99 113.62 113.04 1ap4 n SER 69 Ca 0.00 0.01 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 1ap4 n SER 69 Cb 0.09 0.77 0.00 0.00 -0.26 0.00 0.00 64.21 64.81 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 1.80 3.13 3.83 5.00 0.00 -1.26 -5.04 105.19 112.64 1ap4 n GLY 70 Ca -0.34 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.32 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 -2.97 4.76 -0.29 2.61 -4.23 -1.26 -4.25 115.64 110.02 1ap4 s THR 71 Ca 0.00 1.04 -0.18 0.00 -1.18 0.00 0.00 61.69 61.38 1ap4 s THR 71 Cb 0.00 -3.81 -0.02 0.00 1.34 0.00 0.00 72.50 70.01 1ap4 s THR 71 CO 0.00 0.34 0.50 -0.69 -0.54 0.00 0.00 174.62 174.23 1ap4 s VAL 72 N -1.36 5.06 0.54 2.29 1.01 -0.85 -4.89 120.40 122.20 1ap4 s VAL 72 Ca 0.36 0.71 0.09 0.00 0.00 0.00 0.00 61.98 63.14 1ap4 s VAL 72 Cb -0.17 -3.86 0.07 0.00 0.00 0.00 0.00 36.38 32.42 1ap4 s VAL 72 CO 0.19 0.01 0.73 -0.62 0.00 0.00 0.00 175.10 175.42 1ap4 s ASP 73 N 1.62 5.23 0.58 3.32 -1.08 -1.26 -0.85 116.67 124.23 1ap4 s ASP 73 Ca 0.20 -0.75 0.28 0.00 -0.52 0.00 0.00 52.55 51.77 1ap4 s ASP 73 Cb -0.16 0.07 1.51 0.00 -1.46 0.00 0.00 42.92 42.88 1ap4 s ASP 73 CO 0.10 -1.20 1.95 0.15 0.52 0.00 0.00 175.17 176.70 1ap4 h PHE 74 N 0.30 0.00 0.04 -5.34 3.57 -1.97 1.57 116.94 115.12 1ap4 h PHE 74 Ca -0.32 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.17 1ap4 h PHE 74 Cb 1.29 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.03 1ap4 h PHE 74 CO 0.43 0.00 -0.02 0.22 -2.23 0.00 0.00 178.31 176.71 1ap4 h ASP 75 N 0.00 -0.05 0.15 0.41 1.82 -2.00 -3.06 116.42 113.68 1ap4 h ASP 75 Ca 0.20 -0.28 -0.15 0.00 -0.39 0.00 0.00 57.03 56.40 1ap4 h ASP 75 Cb 1.03 0.01 -0.01 0.00 0.68 0.00 0.00 39.33 41.04 1ap4 h ASP 75 CO -0.00 0.58 -0.56 -0.33 -1.61 0.00 0.00 179.24 177.31 1ap4 h GLU 76 N -1.00 0.43 -0.51 0.28 5.08 -1.76 -3.08 114.58 114.02 1ap4 h GLU 76 Ca -0.01 -0.28 0.04 0.00 -1.00 0.00 0.00 59.36 58.11 1ap4 h GLU 76 Cb 0.33 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.57 1ap4 h GLU 76 CO 0.01 0.88 0.28 0.35 -1.00 0.00 0.00 179.01 179.53 1ap4 h PHE 77 N 0.33 0.52 0.67 4.33 3.57 0.21 -1.80 116.94 124.78 1ap4 h PHE 77 Ca 0.00 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.49 1ap4 h PHE 77 Cb 1.09 -0.16 0.01 0.00 2.79 0.00 0.00 35.95 39.68 1ap4 h PHE 77 CO 0.04 0.27 -0.32 -0.07 -2.23 0.00 0.00 178.31 175.99 1ap4 h LEU 78 N 0.55 -0.77 -1.99 0.59 3.38 -1.50 -2.64 115.31 112.93 1ap4 h LEU 78 Ca 0.22 -0.01 0.25 0.00 0.09 0.00 0.00 57.88 58.43 1ap4 h LEU 78 Cb 0.09 0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 1ap4 h LEU 78 CO -0.13 -0.46 0.63 0.58 0.09 0.00 0.00 178.44 179.15 1ap4 h VAL 79 N -1.05 0.55 -0.32 1.22 2.07 -1.45 0.24 116.25 117.50 1ap4 h VAL 79 Ca -0.09 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.33 1ap4 h VAL 79 Cb 0.73 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 1ap4 h VAL 79 CO 0.15 0.00 -0.19 0.24 0.02 0.00 0.00 177.57 177.79 1ap4 h MET 80 N 0.00 0.60 0.26 1.57 2.86 -0.96 -2.45 114.93 116.81 1ap4 h MET 80 Ca 0.41 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 57.83 1ap4 h MET 80 Cb 1.68 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 33.30 1ap4 h MET 80 CO -0.00 0.75 -0.12 0.52 1.06 0.00 0.00 176.91 179.11 1ap4 h MET 81 N 0.53 -0.33 -0.68 1.72 2.07 -0.38 -3.17 114.93 114.69 1ap4 h MET 81 Ca 0.09 0.02 0.20 0.00 -2.07 0.00 0.00 59.70 57.94 1ap4 h MET 81 Cb 0.62 0.08 -0.03 0.00 -1.87 0.00 0.00 31.60 30.40 1ap4 h MET 81 CO 0.04 -0.14 0.69 -0.24 1.07 0.00 0.00 176.91 178.33 1ap4 h VAL 82 N -1.06 0.29 0.00 -2.22 3.04 -1.52 0.12 116.25 114.89 1ap4 h VAL 82 Ca -0.04 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.65 1ap4 h VAL 82 Cb 0.35 0.46 0.00 0.00 -2.01 0.00 0.00 31.29 30.09 1ap4 h VAL 82 CO 0.06 0.00 0.00 0.54 -1.01 0.00 0.00 177.57 177.16 1ap4 n ARG 83 N -3.67 0.00 0.16 4.17 1.74 -0.92 -3.00 116.66 115.14 1ap4 n ARG 83 Ca 0.14 0.26 0.11 0.00 -0.77 0.00 0.00 57.85 57.59 1ap4 n ARG 83 Cb 0.93 -1.16 0.59 0.00 -1.02 0.00 0.00 32.46 31.80 1ap4 n ARG 83 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ap4 n MET 85 N -2.26 0.51 0.00 0.00 2.81 0.00 -5.06 117.12 113.13 1ap4 n MET 85 Ca -0.01 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.88 1ap4 n MET 85 Cb 0.04 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.55 1ap4 n MET 85 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1ap4 n LYS 86 N -0.34 0.00 -4.47 0.03 5.02 -1.26 -5.03 118.16 112.12 1ap4 n LYS 86 Ca 0.00 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.05 1ap4 n LYS 86 Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 34.93 1ap4 n LYS 86 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1ap4 s ASP 87 N 1.73 2.56 0.00 4.39 -1.08 -1.26 -5.01 116.67 117.99 1ap4 s ASP 87 Ca 0.00 -1.71 0.31 0.00 -0.52 0.00 0.00 52.55 50.64 1ap4 s ASP 87 Cb 0.00 0.54 1.85 0.00 -1.46 0.00 0.00 42.92 43.85 1ap4 s ASP 87 CO 0.00 -0.97 2.19 0.47 0.52 0.00 0.00 175.17 177.37 1ap4 n ASP 88 N -1.38 0.00 0.00 -0.34 9.92 -1.26 -5.26 116.55 118.23 1ap4 n ASP 88 Ca -0.03 -0.93 0.00 0.00 -0.53 0.00 0.00 54.79 53.30 1ap4 n ASP 88 Cb 0.64 -0.02 0.00 0.00 -0.64 0.00 0.00 41.12 41.10 1ap4 n ASP 88 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79