#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 0.99 -0.15 3.17 8.00 -1.26 -4.51 116.55 122.79 1ap4 n ASP 2 Ca 0.00 -0.36 0.00 0.00 0.71 0.00 0.00 54.79 55.14 1ap4 n ASP 2 Cb 0.00 -1.20 0.00 0.00 -0.02 0.00 0.00 41.12 39.90 1ap4 n ASP 2 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1ap4 n ASP 3 N 12.85 0.00 -0.04 -2.24 -0.08 -1.26 -4.85 116.55 120.93 1ap4 n ASP 3 Ca 0.53 -1.21 -0.16 0.00 -1.51 0.00 0.00 54.79 52.44 1ap4 n ASP 3 Cb 0.28 -0.04 -0.06 0.00 2.34 0.00 0.00 41.12 43.63 1ap4 n ASP 3 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 1ap4 h ILE 4 N 4.01 1.29 0.00 5.18 2.04 -2.00 -2.81 117.51 125.22 1ap4 h ILE 4 Ca 0.00 -1.84 -0.00 0.00 1.00 0.00 0.00 64.86 64.02 1ap4 h ILE 4 Cb 1.08 1.90 0.00 0.00 -0.74 0.00 0.00 36.82 39.06 1ap4 h ILE 4 CO 0.00 0.58 -0.00 1.88 0.00 0.00 0.00 178.15 180.61 1ap4 h TYR 5 N 0.49 -0.00 -0.98 1.37 0.05 -1.98 -2.56 116.97 113.36 1ap4 h TYR 5 Ca -0.02 -0.00 0.23 0.00 0.05 0.00 0.00 58.73 58.99 1ap4 h TYR 5 Cb 1.26 0.00 -0.08 0.00 1.01 0.00 0.00 36.73 38.91 1ap4 h TYR 5 CO 0.09 0.91 0.64 0.87 -1.05 0.00 0.00 178.16 179.61 1ap4 h LYS 6 N -0.95 0.43 0.00 4.88 1.57 -1.89 0.34 116.57 120.95 1ap4 h LYS 6 Ca -0.00 -0.03 -0.18 0.00 -1.87 0.00 0.00 60.65 58.58 1ap4 h LYS 6 Cb 0.91 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 33.10 1ap4 h LYS 6 CO 0.00 0.29 -0.84 0.00 -0.57 0.00 0.00 179.45 178.33 1ap4 h ALA 7 N 1.61 0.49 -0.20 3.86 0.00 -1.56 -2.88 119.26 120.58 1ap4 h ALA 7 Ca 0.54 -0.77 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 1ap4 h ALA 7 Cb 1.30 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1ap4 h ALA 7 CO -0.25 1.05 0.00 0.00 0.00 0.00 0.00 179.25 180.05 1ap4 h ALA 8 N 1.16 0.27 -0.00 0.00 0.00 0.09 -1.07 119.26 119.70 1ap4 h ALA 8 Ca -0.01 -0.21 -0.11 0.00 0.00 0.00 0.00 54.91 54.58 1ap4 h ALA 8 Cb 1.60 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.30 1ap4 h ALA 8 CO 0.11 -0.02 -0.53 0.28 0.00 0.00 0.00 179.25 179.09 1ap4 h VAL 9 N 0.11 1.38 0.00 0.00 2.07 -1.41 -2.79 116.25 115.61 1ap4 h VAL 9 Ca 0.06 -1.81 -0.02 0.00 0.82 0.00 0.00 66.70 65.75 1ap4 h VAL 9 Cb 0.39 1.97 -0.00 0.00 -1.52 0.00 0.00 31.29 32.13 1ap4 h VAL 9 CO 0.01 0.52 -0.08 -0.08 0.02 0.00 0.00 177.57 177.96 1ap4 h GLU 10 N 0.01 0.00 0.00 1.57 4.22 -1.34 -3.09 114.58 115.95 1ap4 h GLU 10 Ca -0.00 0.00 -0.06 0.00 0.08 0.00 0.00 59.36 59.38 1ap4 h GLU 10 Cb 0.94 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 1ap4 h GLU 10 CO 0.07 0.08 -0.28 1.96 -2.18 0.00 0.00 179.01 178.65 1ap4 h GLN 11 N 0.00 0.00 -6.57 1.92 7.50 -0.90 -3.44 115.11 113.62 1ap4 h GLN 11 Ca -0.00 0.00 -0.54 0.00 0.50 0.00 0.00 58.65 58.61 1ap4 h GLN 11 Cb 0.90 0.00 0.21 0.00 0.05 0.00 0.00 27.48 28.65 1ap4 h GLN 11 CO 0.01 0.28 -0.84 1.28 -1.50 0.00 0.00 178.83 178.06 1ap4 n LEU 12 N -4.01 -1.41 -4.77 1.46 4.77 -1.17 -4.98 117.00 106.90 1ap4 n LEU 12 Ca -0.02 0.35 -0.29 0.00 -0.03 0.00 0.00 56.01 56.02 1ap4 n LEU 12 Cb 0.35 -1.10 -0.06 0.00 -2.33 0.00 0.00 43.42 40.27 1ap4 n LEU 12 CO 0.36 -4.11 -0.26 0.42 -1.33 0.00 0.00 177.39 172.48 1ap4 s THR 13 N -2.21 4.43 0.39 -5.08 -4.23 -1.26 -4.99 115.64 102.69 1ap4 s THR 13 Ca 0.55 -0.90 0.15 0.00 -1.18 0.00 0.00 61.69 60.30 1ap4 s THR 13 Cb -0.24 -3.17 0.36 0.00 1.34 0.00 0.00 72.50 70.80 1ap4 s THR 13 CO 0.69 0.05 1.83 1.05 -0.54 0.00 0.00 174.62 177.70 1ap4 h GLU 14 N 3.05 0.48 -0.14 3.99 4.11 -1.97 0.31 114.58 124.41 1ap4 h GLU 14 Ca -0.47 -0.03 -0.04 0.00 0.07 0.00 0.00 59.36 58.89 1ap4 h GLU 14 Cb 1.17 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.31 1ap4 h GLU 14 CO 0.64 0.32 -0.09 1.05 0.07 0.00 0.00 179.01 181.00 1ap4 h GLU 15 N 0.49 0.21 0.03 1.06 4.11 -1.99 -0.18 114.58 118.31 1ap4 h GLU 15 Ca 0.50 -0.04 -0.07 0.00 0.07 0.00 0.00 59.36 59.82 1ap4 h GLU 15 Cb 1.13 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 30.36 1ap4 h GLU 15 CO -0.23 0.31 -0.30 0.37 0.07 0.00 0.00 179.01 179.23 1ap4 h GLN 16 N 0.20 0.15 0.00 1.06 4.15 -0.81 -3.23 115.11 116.63 1ap4 h GLN 16 Ca 0.04 -0.20 0.00 0.00 0.77 0.00 0.00 58.65 59.26 1ap4 h GLN 16 Cb 0.29 0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.04 1ap4 h GLN 16 CO 0.01 1.01 0.00 0.87 -1.93 0.00 0.00 178.83 178.79 1ap4 h LYS 17 N -0.61 0.00 -0.00 1.69 1.57 -1.24 -2.69 116.57 115.29 1ap4 h LYS 17 Ca -0.05 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.57 1ap4 h LYS 17 Cb 1.14 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.42 1ap4 h LYS 17 CO 0.06 0.00 -0.79 -0.91 -0.57 0.00 0.00 179.45 177.24 1ap4 h ASN 18 N 0.00 0.03 0.09 0.86 2.35 -1.05 -2.80 115.58 115.07 1ap4 h ASN 18 Ca 0.00 -0.02 -0.21 0.00 -0.55 0.00 0.00 56.30 55.51 1ap4 h ASN 18 Cb 0.39 -0.01 0.02 0.00 0.05 0.00 0.00 38.32 38.77 1ap4 h ASN 18 CO 0.00 0.80 -0.89 -0.33 -1.65 0.00 0.00 177.43 175.37 1ap4 h GLU 19 N 0.01 0.43 -0.08 0.81 4.39 -1.51 -3.27 114.58 115.37 1ap4 h GLU 19 Ca -0.01 -0.59 -0.05 0.00 0.34 0.00 0.00 59.36 59.04 1ap4 h GLU 19 Cb 1.39 0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 30.23 1ap4 h GLU 19 CO 0.10 1.24 -0.20 0.74 -1.16 0.00 0.00 179.01 179.74 1ap4 h PHE 20 N -0.09 0.13 -0.72 4.33 0.04 -1.61 -2.75 116.94 116.27 1ap4 h PHE 20 Ca -0.14 -0.02 0.10 0.00 2.80 0.00 0.00 57.97 60.72 1ap4 h PHE 20 Cb 1.63 -0.04 -0.07 0.00 2.20 0.00 0.00 35.95 39.67 1ap4 h PHE 20 CO 0.16 0.32 0.35 -0.22 -0.60 0.00 0.00 178.31 178.32 1ap4 h LYS 21 N 0.12 0.57 -0.42 1.51 3.64 -1.54 0.95 116.57 121.40 1ap4 h LYS 21 Ca 0.02 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.29 1ap4 h LYS 21 Cb 0.42 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.10 1ap4 h LYS 21 CO 0.03 0.38 -0.05 0.00 -2.27 0.00 0.00 179.45 177.53 1ap4 h ALA 22 N 1.45 0.57 -0.23 5.00 0.00 -1.60 -2.98 119.26 121.46 1ap4 h ALA 22 Ca 0.36 -0.29 -0.15 0.00 0.00 0.00 0.00 54.91 54.83 1ap4 h ALA 22 Cb 0.41 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1ap4 h ALA 22 CO -0.29 0.40 -0.46 0.00 0.00 0.00 0.00 179.25 178.90 1ap4 h ALA 23 N 0.87 0.76 -0.78 0.00 0.00 -1.24 -3.09 119.26 115.79 1ap4 h ALA 23 Ca 0.11 -0.47 0.15 0.00 0.00 0.00 0.00 54.91 54.70 1ap4 h ALA 23 Cb 0.56 -0.10 -0.10 0.00 0.00 0.00 0.00 17.79 18.15 1ap4 h ALA 23 CO 0.03 0.67 0.31 0.35 0.00 0.00 0.00 179.25 180.61 1ap4 h PHE 24 N 0.48 0.53 0.00 0.00 3.04 0.10 0.61 116.94 121.71 1ap4 h PHE 24 Ca 0.03 0.04 0.00 0.00 3.98 0.00 0.00 57.97 62.02 1ap4 h PHE 24 Cb 0.99 -0.12 0.00 0.00 2.56 0.00 0.00 35.95 39.38 1ap4 h PHE 24 CO 0.04 0.05 0.00 -0.44 -2.02 0.00 0.00 178.31 175.95 1ap4 h ASP 25 N 0.45 0.00 0.42 0.41 3.32 -1.46 -2.58 116.42 116.98 1ap4 h ASP 25 Ca 0.43 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.34 1ap4 h ASP 25 Cb 0.68 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 1ap4 h ASP 25 CO -0.42 0.00 -0.60 0.40 -1.72 0.00 0.00 179.24 176.90 1ap4 h ILE 26 N 0.00 1.40 0.03 0.35 1.08 0.21 -1.83 117.51 118.74 1ap4 h ILE 26 Ca 0.00 -2.00 -0.23 0.00 -0.39 0.00 0.00 64.86 62.25 1ap4 h ILE 26 Cb 0.35 2.03 -0.00 0.00 -3.07 0.00 0.00 36.82 36.12 1ap4 h ILE 26 CO 0.00 0.58 -1.00 -0.26 -0.69 0.00 0.00 178.15 176.79 1ap4 h PHE 27 N 0.13 0.43 -0.49 1.37 0.04 -1.32 -3.15 116.94 113.95 1ap4 h PHE 27 Ca -0.01 -0.26 0.00 0.00 2.80 0.00 0.00 57.97 60.50 1ap4 h PHE 27 Cb 1.09 -0.04 0.00 0.00 2.20 0.00 0.00 35.95 39.20 1ap4 h PHE 27 CO 0.02 1.11 0.00 1.33 -0.60 0.00 0.00 178.31 180.17 1ap4 n VAL 28 N -3.64 1.48 -1.54 -0.55 0.24 -1.18 -4.89 118.33 108.24 1ap4 n VAL 28 Ca -0.06 -0.91 -0.18 0.00 -2.04 0.00 0.00 64.34 61.15 1ap4 n VAL 28 Cb 0.88 -0.02 -0.12 0.00 -1.47 0.00 0.00 33.84 33.11 1ap4 n VAL 28 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58 1ap4 n LEU 29 N 0.77 0.77 0.00 1.34 7.94 -0.70 0.45 117.00 127.57 1ap4 n LEU 29 Ca 0.20 -1.08 0.00 0.00 -1.11 0.00 0.00 56.01 54.02 1ap4 n LEU 29 Cb 0.74 -1.28 0.00 0.00 0.53 0.00 0.00 43.42 43.41 1ap4 n LEU 29 CO 0.19 -2.13 0.00 0.61 -1.11 0.00 0.00 177.39 174.95 1ap4 n GLY 30 N 6.34 1.32 3.89 -3.96 0.00 -1.26 -5.10 105.19 106.42 1ap4 n GLY 30 Ca 0.54 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.26 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 2.10 -0.08 4.61 0.00 0.17 -5.01 121.76 121.56 1ap4 s ALA 31 Ca 0.00 -1.10 0.17 0.00 0.00 0.00 0.00 51.96 51.02 1ap4 s ALA 31 Cb 0.00 -2.81 -0.25 0.00 0.00 0.00 0.00 23.12 20.06 1ap4 s ALA 31 CO 0.00 -2.48 0.27 -0.85 0.00 0.00 0.00 175.76 172.70 1ap4 n GLU 32 N -3.82 0.82 0.00 0.00 0.28 -1.26 -4.62 120.64 112.04 1ap4 n GLU 32 Ca 0.14 -0.11 0.00 0.00 -0.16 0.00 0.00 57.16 57.03 1ap4 n GLU 32 Cb 0.60 -1.42 0.00 0.00 1.43 0.00 0.00 31.44 32.04 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 -2.30 2.72 -0.25 -1.84 5.68 -1.26 -5.03 116.55 114.26 1ap4 n ASP 33 Ca -0.12 -0.16 0.00 0.00 -0.50 0.00 0.00 54.79 54.01 1ap4 n ASP 33 Cb 0.68 0.86 0.00 0.00 -1.14 0.00 0.00 41.12 41.52 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 1.68 0.95 3.41 6.12 0.00 -1.26 -5.09 105.19 110.99 1ap4 n GLY 34 Ca 0.00 -0.32 -0.27 0.00 0.00 0.00 0.00 46.02 45.43 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 -1.59 5.26 1.02 0.00 1.01 -1.01 -4.59 121.20 121.30 1ap4 s ILE 36 Ca 0.19 -2.97 -0.15 0.00 0.00 0.00 0.00 60.65 57.72 1ap4 s ILE 36 Cb -0.08 -4.24 0.06 0.00 0.01 0.00 0.00 42.46 38.21 1ap4 s ILE 36 CO 0.09 -1.05 0.22 -1.20 0.00 0.00 0.00 174.94 173.00 1ap4 n SER 37 N 3.36 -2.27 -0.06 3.58 7.64 -1.26 -1.67 113.62 122.94 1ap4 n SER 37 Ca 0.16 0.14 0.02 0.00 1.01 0.00 0.00 58.87 60.21 1ap4 n SER 37 Cb 0.42 -1.10 0.35 0.00 -1.01 0.00 0.00 64.21 62.87 1ap4 n SER 37 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1ap4 h THR 38 N -1.76 1.15 0.00 0.44 1.35 -1.93 -0.99 112.91 111.17 1ap4 h THR 38 Ca -0.48 -0.37 -0.02 0.00 -0.55 0.00 0.00 66.41 65.00 1ap4 h THR 38 Cb 1.31 0.48 -0.00 0.00 -1.73 0.00 0.00 68.15 68.22 1ap4 h THR 38 CO 0.36 0.16 -0.09 0.50 -0.25 0.00 0.00 175.52 176.19 1ap4 h LYS 39 N 0.67 0.00 -0.46 4.72 3.64 -1.96 -1.93 116.57 121.26 1ap4 h LYS 39 Ca 0.17 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1ap4 h LYS 39 Cb 0.01 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 1ap4 h LYS 39 CO -0.03 0.09 0.00 0.39 -2.27 0.00 0.00 179.45 177.63 1ap4 n GLU 40 N -3.69 3.07 -0.06 1.90 4.71 -0.43 -4.53 120.64 121.60 1ap4 n GLU 40 Ca -0.02 -2.47 -0.20 0.00 -0.01 0.00 0.00 57.16 54.45 1ap4 n GLU 40 Cb 0.20 -1.56 -0.13 0.00 -1.01 0.00 0.00 31.44 28.95 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 2.79 0.12 -0.90 -4.62 6.46 -0.69 -3.36 115.31 115.10 1ap4 h LEU 41 Ca 0.00 -0.72 0.24 0.00 -0.12 0.00 0.00 57.88 57.28 1ap4 h LEU 41 Cb 1.06 -0.04 -0.16 0.00 -0.73 0.00 0.00 40.66 40.79 1ap4 h LEU 41 CO 0.09 1.45 0.09 1.23 -0.62 0.00 0.00 178.44 180.69 1ap4 h GLY 42 N -0.61 1.20 1.07 3.75 0.00 -1.80 1.80 103.07 108.49 1ap4 h GLY 42 Ca -0.28 0.08 0.10 0.00 0.00 0.00 0.00 47.33 47.23 1ap4 h GLY 42 CO -0.08 -0.42 0.37 0.50 0.00 0.00 0.00 176.54 176.90 1ap4 h LYS 43 N 0.09 0.00 0.08 4.80 6.56 -1.86 -1.65 116.57 124.59 1ap4 h LYS 43 Ca 0.54 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 60.13 1ap4 h LYS 43 Cb 1.09 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.75 1ap4 h LYS 43 CO -0.78 0.00 -0.04 0.28 -2.06 0.00 0.00 179.45 176.85 1ap4 h VAL 44 N 0.00 1.16 -0.12 0.50 2.07 0.26 -3.01 116.25 117.12 1ap4 h VAL 44 Ca 0.16 -1.39 0.04 0.00 0.82 0.00 0.00 66.70 66.32 1ap4 h VAL 44 Cb 0.90 1.99 -0.00 0.00 -1.52 0.00 0.00 31.29 32.66 1ap4 h VAL 44 CO -0.00 0.32 0.12 0.24 0.02 0.00 0.00 177.57 178.26 1ap4 h MET 45 N -0.80 0.00 -0.07 1.57 2.86 -1.19 0.58 114.93 117.89 1ap4 h MET 45 Ca -0.01 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.60 1ap4 h MET 45 Cb 0.60 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.26 1ap4 h MET 45 CO 0.02 0.00 -0.06 0.00 1.06 0.00 0.00 176.91 177.93 1ap4 h ARG 46 N 0.00 0.16 0.00 1.72 3.08 -1.29 2.29 114.38 120.34 1ap4 h ARG 46 Ca 0.06 -0.08 -0.21 0.00 0.07 0.00 0.00 59.98 59.82 1ap4 h ARG 46 Cb 0.29 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.31 1ap4 h ARG 46 CO -0.00 0.58 -1.15 0.00 -1.07 0.00 0.00 179.97 178.33 1ap4 h MET 47 N -0.25 0.00 0.00 0.04 -0.00 -1.27 -3.29 114.93 110.16 1ap4 h MET 47 Ca 0.01 0.00 -0.04 0.00 -0.00 0.00 0.00 59.70 59.67 1ap4 h MET 47 Cb 0.55 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.14 1ap4 h MET 47 CO 0.02 0.68 -0.20 -0.07 -0.00 0.00 0.00 176.91 177.33 1ap4 h LEU 48 N 0.00 0.00 0.00 -0.10 -0.00 0.09 -3.45 115.31 111.85 1ap4 h LEU 48 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.78 1ap4 h LEU 48 Cb 1.74 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.40 1ap4 h LEU 48 CO 0.09 0.20 0.00 0.61 -0.00 0.00 0.00 178.44 179.34 1ap4 n GLY 49 N -0.66 1.00 3.54 0.83 0.00 -1.05 -5.05 105.19 103.80 1ap4 n GLY 49 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.75 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 1.83 -0.40 1.61 -0.21 0.77 -5.00 119.66 118.26 1ap4 s GLN 50 Ca 0.00 -2.04 0.10 0.00 0.02 0.00 0.00 55.36 53.44 1ap4 s GLN 50 Cb 0.00 -1.22 0.34 0.00 1.00 0.00 0.00 33.01 33.13 1ap4 s GLN 50 CO 0.00 -0.15 0.82 0.27 -2.12 0.00 0.00 175.29 174.11 1ap4 n ASN 51 N -0.87 -0.09 -2.50 5.90 0.23 -1.25 -2.97 115.26 113.71 1ap4 n ASN 51 Ca -0.05 -3.18 -0.07 0.00 -0.53 0.00 0.00 54.58 50.76 1ap4 n ASN 51 Cb 0.67 0.08 0.05 0.00 -2.08 0.00 0.00 39.78 38.50 1ap4 n ASN 51 CO 0.00 0.00 0.00 -0.81 -0.93 0.00 0.00 177.26 175.52 1ap4 n PRO 52 N 0.38 -0.57 -4.43 -0.53 -0.04 -1.26 -5.08 135.00 123.46 1ap4 n PRO 52 Ca 0.20 -0.44 -0.26 0.00 -0.04 0.00 0.00 63.50 62.96 1ap4 n PRO 52 Cb 0.66 -0.32 -0.09 0.00 -0.04 0.00 0.00 33.50 33.71 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 -1.60 2.34 0.07 0.52 -4.23 -1.26 -5.04 115.64 106.44 1ap4 s THR 53 Ca 0.17 -2.01 -0.15 0.00 -1.18 0.00 0.00 61.69 58.52 1ap4 s THR 53 Cb -0.01 -2.82 -0.20 0.00 1.34 0.00 0.00 72.50 70.81 1ap4 s THR 53 CO 0.12 -0.13 1.22 1.55 -0.54 0.00 0.00 174.62 176.83 1ap4 h PRO 54 N 1.82 0.68 0.00 3.99 0.13 -1.98 -2.83 132.00 133.80 1ap4 h PRO 54 Ca -0.43 -0.64 -0.02 0.00 -0.87 0.00 0.00 66.00 64.04 1ap4 h PRO 54 Cb 1.25 0.16 -0.00 0.00 0.13 0.00 0.00 31.00 32.54 1ap4 h PRO 54 CO 0.71 1.25 -0.08 0.93 -0.23 0.00 0.00 178.00 180.58 1ap4 h GLU 55 N 0.34 0.00 0.00 0.86 5.08 -2.01 -3.12 114.58 115.73 1ap4 h GLU 55 Ca -0.09 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 1ap4 h GLU 55 Cb 1.49 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.74 1ap4 h GLU 55 CO 0.17 0.08 -0.28 0.93 -1.00 0.00 0.00 179.01 178.91 1ap4 h GLU 56 N 0.00 0.00 -0.44 2.33 4.39 -1.97 -3.33 114.58 115.56 1ap4 h GLU 56 Ca -0.00 0.00 0.04 0.00 0.34 0.00 0.00 59.36 59.74 1ap4 h GLU 56 Cb 0.22 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.82 1ap4 h GLU 56 CO 0.01 0.19 -0.28 -0.07 -1.16 0.00 0.00 179.01 177.70 1ap4 h LEU 57 N -1.00 -1.01 -0.93 1.33 4.07 -1.50 0.54 115.31 116.80 1ap4 h LEU 57 Ca -0.03 0.15 0.20 0.00 0.08 0.00 0.00 57.88 58.28 1ap4 h LEU 57 Cb 0.39 0.44 -0.18 0.00 1.08 0.00 0.00 40.66 42.40 1ap4 h LEU 57 CO -0.02 -0.12 -0.18 -0.61 -1.08 0.00 0.00 178.44 176.43 1ap4 h GLN 58 N -0.02 0.01 -0.67 1.13 -0.00 -1.75 0.58 115.11 114.38 1ap4 h GLN 58 Ca 0.07 -0.00 -0.03 0.00 -0.00 0.00 0.00 58.65 58.69 1ap4 h GLN 58 Cb 0.21 -0.00 -0.03 0.00 0.00 0.00 0.00 27.48 27.65 1ap4 h GLN 58 CO -0.42 0.00 0.28 0.93 0.00 0.00 0.00 178.83 179.62 1ap4 h GLU 59 N 0.01 0.97 0.01 1.69 4.39 -1.06 -2.54 114.58 118.05 1ap4 h GLU 59 Ca 0.47 -0.15 -0.01 0.00 0.34 0.00 0.00 59.36 60.00 1ap4 h GLU 59 Cb 0.76 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 29.25 1ap4 h GLU 59 CO -0.94 0.78 -0.06 1.98 -1.16 0.00 0.00 179.01 179.61 1ap4 h MET 60 N 0.96 0.03 -0.89 2.33 4.05 0.11 -3.32 114.93 118.20 1ap4 h MET 60 Ca 0.23 -0.04 0.19 0.00 -0.28 0.00 0.00 59.70 59.80 1ap4 h MET 60 Cb 0.16 0.01 -0.11 0.00 -0.80 0.00 0.00 31.60 30.86 1ap4 h MET 60 CO -0.02 0.94 0.44 0.82 0.23 0.00 0.00 176.91 179.31 1ap4 h ILE 61 N -0.87 0.60 0.00 1.77 2.04 -0.12 0.54 117.51 121.48 1ap4 h ILE 61 Ca -0.01 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.67 1ap4 h ILE 61 Cb 0.96 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 37.07 1ap4 h ILE 61 CO 0.01 0.10 0.00 -0.78 0.00 0.00 0.00 178.15 177.48 1ap4 h ASP 62 N 0.53 0.00 0.24 1.72 3.58 -1.55 0.11 116.42 121.05 1ap4 h ASP 62 Ca 0.52 0.00 -0.33 0.00 0.42 0.00 0.00 57.03 57.64 1ap4 h ASP 62 Cb 0.88 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 41.87 1ap4 h ASP 62 CO -0.44 0.00 -2.04 -0.62 -2.88 0.00 0.00 179.24 173.26 1ap4 n GLU 63 N -2.94 0.67 0.14 0.28 1.02 0.18 -4.23 120.64 115.76 1ap4 n GLU 63 Ca -0.03 0.17 0.11 0.00 -0.02 0.00 0.00 57.16 57.39 1ap4 n GLU 63 Cb 0.08 -1.67 0.05 0.00 -0.02 0.00 0.00 31.44 29.88 1ap4 n GLU 63 CO 0.00 0.00 0.00 -0.24 1.18 0.00 0.00 177.13 178.07 1ap4 h VAL 64 N 0.01 0.05 -2.37 2.62 3.04 -0.64 -3.43 116.25 115.53 1ap4 h VAL 64 Ca -0.42 -1.08 -0.57 0.00 -1.01 0.00 0.00 66.70 63.63 1ap4 h VAL 64 Cb 2.10 1.72 -0.10 0.00 -2.01 0.00 0.00 31.29 33.00 1ap4 h VAL 64 CO 0.05 0.03 0.96 -0.62 -1.01 0.00 0.00 177.57 176.98 1ap4 s ASP 65 N -5.69 6.18 0.00 3.17 2.15 0.30 -4.78 116.67 118.01 1ap4 s ASP 65 Ca 0.02 -0.64 0.14 0.00 0.43 0.00 0.00 52.55 52.50 1ap4 s ASP 65 Cb 0.08 -2.53 0.10 0.00 -0.30 0.00 0.00 42.92 40.28 1ap4 s ASP 65 CO 0.75 -1.72 0.93 -0.62 -0.17 0.00 0.00 175.17 174.34 1ap4 n GLU 66 N 8.94 1.01 0.24 4.34 -0.58 -1.26 -4.41 120.64 128.92 1ap4 n GLU 66 Ca 0.03 -1.29 0.13 0.00 -0.42 0.00 0.00 57.16 55.61 1ap4 n GLU 66 Cb 0.48 -1.26 0.45 0.00 -0.57 0.00 0.00 31.44 30.54 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 2.67 0.00 0.00 1.62 2.03 -1.98 -3.46 116.42 117.30 1ap4 h ASP 67 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1ap4 h ASP 67 Cb 0.58 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.08 1ap4 h ASP 67 CO 0.00 0.10 0.00 0.61 -1.03 0.00 0.00 179.24 178.92 1ap4 n GLY 68 N 0.41 0.61 0.09 7.15 0.00 -1.26 -4.98 105.19 107.20 1ap4 n GLY 68 Ca 0.01 -0.76 -0.10 0.00 0.00 0.00 0.00 46.02 45.18 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 1.43 1.86 0.00 1.61 3.41 -1.26 -5.02 113.62 115.65 1ap4 n SER 69 Ca 0.00 0.50 0.00 0.00 -0.26 0.00 0.00 58.87 59.11 1ap4 n SER 69 Cb 0.06 -0.84 0.00 0.00 -0.26 0.00 0.00 64.21 63.17 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 1.52 1.77 3.82 5.00 0.00 -1.26 -5.10 105.19 110.94 1ap4 n GLY 70 Ca -0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.01 2.29 -0.38 2.61 -4.23 -1.26 -4.45 115.64 108.20 1ap4 s THR 71 Ca 0.00 -1.53 -0.11 0.00 -1.18 0.00 0.00 61.69 58.87 1ap4 s THR 71 Cb 0.00 -2.81 0.03 0.00 1.34 0.00 0.00 72.50 71.05 1ap4 s THR 71 CO 0.00 0.00 0.22 -0.69 -0.54 0.00 0.00 174.62 173.61 1ap4 s VAL 72 N -2.59 4.62 0.73 2.29 1.01 -0.67 -4.91 120.40 120.89 1ap4 s VAL 72 Ca 0.42 -0.87 -0.04 0.00 0.00 0.00 0.00 61.98 61.49 1ap4 s VAL 72 Cb 0.00 -3.59 0.12 0.00 0.00 0.00 0.00 36.38 32.91 1ap4 s VAL 72 CO 0.24 -0.26 1.02 -1.81 0.00 0.00 0.00 175.10 174.29 1ap4 s ASP 73 N 1.57 4.34 0.62 3.32 1.11 -1.26 -2.40 116.67 123.97 1ap4 s ASP 73 Ca 0.02 -0.09 0.36 0.00 0.18 0.00 0.00 52.55 53.03 1ap4 s ASP 73 Cb -0.19 -0.34 2.05 0.00 1.07 0.00 0.00 42.92 45.50 1ap4 s ASP 73 CO 0.07 -1.87 2.28 0.15 1.18 0.00 0.00 175.17 176.98 1ap4 h PHE 74 N -0.64 0.00 0.09 4.23 3.57 -1.98 1.02 116.94 123.24 1ap4 h PHE 74 Ca -0.40 0.00 -0.17 0.00 3.53 0.00 0.00 57.97 60.94 1ap4 h PHE 74 Cb 1.27 0.00 0.01 0.00 2.79 0.00 0.00 35.95 40.02 1ap4 h PHE 74 CO -0.19 0.01 -0.79 -0.44 -2.23 0.00 0.00 178.31 174.67 1ap4 h ASP 75 N 0.00 0.30 0.69 0.41 3.32 -2.01 -3.31 116.42 115.82 1ap4 h ASP 75 Ca -0.00 -0.91 -0.26 0.00 0.02 0.00 0.00 57.03 55.88 1ap4 h ASP 75 Cb 0.06 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 1ap4 h ASP 75 CO 0.00 1.36 -1.30 -0.33 -1.72 0.00 0.00 179.24 177.25 1ap4 h GLU 76 N -0.56 0.14 -0.28 3.56 5.08 -1.82 -3.26 114.58 117.44 1ap4 h GLU 76 Ca -0.16 -0.25 0.07 0.00 -1.00 0.00 0.00 59.36 58.02 1ap4 h GLU 76 Cb 1.49 0.09 -0.07 0.00 0.50 0.00 0.00 28.75 30.76 1ap4 h GLU 76 CO 0.07 1.03 -0.16 0.35 -1.00 0.00 0.00 179.01 179.30 1ap4 h PHE 77 N 0.04 -0.40 -0.72 4.33 3.57 0.93 -1.37 116.94 123.31 1ap4 h PHE 77 Ca -0.14 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.36 1ap4 h PHE 77 Cb 1.92 0.22 -0.03 0.00 2.79 0.00 0.00 35.95 40.85 1ap4 h PHE 77 CO 0.03 -0.24 0.31 -0.07 -2.23 0.00 0.00 178.31 176.12 1ap4 h LEU 78 N -0.13 0.98 -0.53 0.59 3.38 -1.69 -2.75 115.31 115.16 1ap4 h LEU 78 Ca 0.15 -0.16 0.10 0.00 0.09 0.00 0.00 57.88 58.06 1ap4 h LEU 78 Cb 0.36 -0.25 -0.08 0.00 0.09 0.00 0.00 40.66 40.78 1ap4 h LEU 78 CO -0.37 0.87 0.09 0.58 0.09 0.00 0.00 178.44 179.71 1ap4 h VAL 79 N 1.03 0.68 -0.85 1.22 2.07 -1.32 0.12 116.25 119.19 1ap4 h VAL 79 Ca 0.24 -0.08 0.11 0.00 0.82 0.00 0.00 66.70 67.80 1ap4 h VAL 79 Cb 0.18 0.43 -0.06 0.00 -1.52 0.00 0.00 31.29 30.32 1ap4 h VAL 79 CO -0.02 0.04 0.55 -0.03 0.02 0.00 0.00 177.57 178.13 1ap4 h MET 80 N 0.23 0.73 0.50 1.57 4.05 -1.03 -0.77 114.93 120.20 1ap4 h MET 80 Ca 0.27 -0.04 -0.02 0.00 -0.28 0.00 0.00 59.70 59.62 1ap4 h MET 80 Cb 0.39 -0.16 0.00 0.00 -0.80 0.00 0.00 31.60 31.03 1ap4 h MET 80 CO -0.37 0.48 -0.24 0.52 0.23 0.00 0.00 176.91 177.54 1ap4 h MET 81 N 0.75 -0.65 -0.49 0.39 2.07 -0.74 -3.00 114.93 113.27 1ap4 h MET 81 Ca 0.40 0.04 0.14 0.00 -2.07 0.00 0.00 59.70 58.22 1ap4 h MET 81 Cb 0.53 0.15 -0.02 0.00 -1.87 0.00 0.00 31.60 30.39 1ap4 h MET 81 CO -0.17 -0.43 0.61 -0.24 1.07 0.00 0.00 176.91 177.75 1ap4 h VAL 82 N -1.15 0.24 0.59 -2.22 3.04 -0.89 0.81 116.25 116.69 1ap4 h VAL 82 Ca -0.07 0.00 -0.03 0.00 -1.01 0.00 0.00 66.70 65.59 1ap4 h VAL 82 Cb 0.51 0.50 0.01 0.00 -2.01 0.00 0.00 31.29 30.30 1ap4 h VAL 82 CO 0.11 0.00 -0.28 0.03 -1.01 0.00 0.00 177.57 176.42 1ap4 h ARG 83 N 0.00 -0.77 -0.03 4.17 3.08 -1.01 -3.21 114.38 116.61 1ap4 h ARG 83 Ca 0.23 0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.34 1ap4 h ARG 83 Cb 1.45 0.17 0.00 0.00 0.08 0.00 0.00 29.97 31.67 1ap4 h ARG 83 CO -0.00 -0.47 0.00 0.00 -1.07 0.00 0.00 179.97 178.43 1ap4 n MET 85 N 0.13 -0.81 -2.13 0.00 2.81 0.27 -5.09 117.12 112.31 1ap4 n MET 85 Ca 0.19 -1.72 -0.13 0.00 -1.81 0.00 0.00 57.70 54.23 1ap4 n MET 85 Cb 0.34 -0.96 0.05 0.00 -0.71 0.00 0.00 33.22 31.94 1ap4 n MET 85 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 1ap4 n LYS 86 N -3.06 0.56 -1.15 0.03 4.81 -1.26 -4.94 118.16 113.15 1ap4 n LYS 86 Ca 0.13 -1.90 0.00 0.00 -0.87 0.00 0.00 58.31 55.67 1ap4 n LYS 86 Cb 0.46 -0.24 0.00 0.00 0.02 0.00 0.00 35.03 35.27 1ap4 n LYS 86 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1ap4 n ASP 87 N -2.69 0.33 -3.23 3.14 8.00 -1.26 -5.00 116.55 115.84 1ap4 n ASP 87 Ca 0.10 -0.58 -0.12 0.00 0.71 0.00 0.00 54.79 54.91 1ap4 n ASP 87 Cb 0.38 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.49 1ap4 n ASP 87 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1ap4 n ASP 88 N -1.54 -6.45 0.00 -2.24 -0.08 -1.26 -5.32 116.55 99.67 1ap4 n ASP 88 Ca 0.00 0.34 0.00 0.00 -1.51 0.00 0.00 54.79 53.62 1ap4 n ASP 88 Cb 0.00 -2.13 0.00 0.00 2.34 0.00 0.00 41.12 41.33 1ap4 n ASP 88 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08