#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 -5.15 0.00 6.12 2.03 -1.26 -5.04 116.55 113.25 1ap4 n ASP 2 Ca 0.00 1.06 0.00 0.00 0.52 0.00 0.00 54.79 56.37 1ap4 n ASP 2 Cb 0.00 -3.17 0.00 0.00 -0.72 0.00 0.00 41.12 37.23 1ap4 n ASP 2 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 1ap4 n ASP 3 N 1.90 0.00 0.00 1.67 5.75 -1.26 -4.78 116.55 119.82 1ap4 n ASP 3 Ca -0.14 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.64 1ap4 n ASP 3 Cb 0.29 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.38 1ap4 n ASP 3 CO 0.00 0.00 0.00 -0.38 -0.11 0.00 0.00 177.20 176.71 1ap4 n ILE 4 N 0.00 0.00 0.07 2.12 5.41 -1.26 -3.75 119.36 121.94 1ap4 n ILE 4 Ca 0.00 0.00 -0.09 0.00 1.00 0.00 0.00 62.75 63.66 1ap4 n ILE 4 Cb 0.00 0.00 0.03 0.00 -0.71 0.00 0.00 39.64 38.96 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 0.45 0.00 1.39 0.05 -2.01 -2.92 116.97 113.92 1ap4 h TYR 5 Ca 0.00 -0.21 0.00 0.00 0.05 0.00 0.00 58.73 58.57 1ap4 h TYR 5 Cb 0.00 -0.06 0.00 0.00 1.01 0.00 0.00 36.73 37.68 1ap4 h TYR 5 CO 0.00 0.97 0.00 1.63 -1.05 0.00 0.00 178.16 179.71 1ap4 n LYS 6 N -3.79 0.05 -0.02 4.88 4.76 -1.25 -1.84 118.16 120.95 1ap4 n LYS 6 Ca -0.04 0.49 -0.16 0.00 -2.87 0.00 0.00 58.31 55.73 1ap4 n LYS 6 Cb 0.73 -1.64 -0.14 0.00 -1.84 0.00 0.00 35.03 32.14 1ap4 n LYS 6 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ap4 n ALA 7 N -1.59 1.17 0.31 7.82 0.00 -1.11 -3.84 120.51 123.27 1ap4 n ALA 7 Ca 0.00 -0.75 0.17 0.00 0.00 0.00 0.00 53.44 52.87 1ap4 n ALA 7 Cb 0.05 -0.65 0.76 0.00 0.00 0.00 0.00 19.45 19.61 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 0.42 1.00 0.17 0.00 0.00 -1.41 -1.92 119.26 117.52 1ap4 h ALA 8 Ca -0.40 0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.22 1ap4 h ALA 8 Cb 2.03 0.00 0.02 0.00 0.00 0.00 0.00 17.79 19.84 1ap4 h ALA 8 CO 0.06 0.00 -1.35 0.28 0.00 0.00 0.00 179.25 178.25 1ap4 h VAL 9 N 0.00 1.20 0.00 0.00 2.07 -1.67 -3.32 116.25 114.52 1ap4 h VAL 9 Ca 0.00 -2.53 -0.14 0.00 0.82 0.00 0.00 66.70 64.85 1ap4 h VAL 9 Cb 0.31 2.94 -0.02 0.00 -1.52 0.00 0.00 31.29 33.00 1ap4 h VAL 9 CO 0.00 0.77 -0.65 -0.33 0.02 0.00 0.00 177.57 177.38 1ap4 h GLU 10 N -0.12 0.00 0.00 1.57 5.08 -1.62 -2.94 114.58 116.55 1ap4 h GLU 10 Ca -0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 1ap4 h GLU 10 Cb 1.91 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.16 1ap4 h GLU 10 CO 0.16 0.65 0.00 1.04 -1.00 0.00 0.00 179.01 179.87 1ap4 n GLN 11 N -3.61 0.02 -1.70 2.33 3.00 -0.74 -4.79 117.38 111.89 1ap4 n GLN 11 Ca -0.00 0.24 -0.43 0.00 -0.01 0.00 0.00 57.00 56.80 1ap4 n GLN 11 Cb 0.68 -1.50 -0.02 0.00 0.00 0.00 0.00 30.24 29.40 1ap4 n GLN 11 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1ap4 n LEU 12 N -1.48 3.65 -4.77 1.08 4.77 -1.11 -4.94 117.00 114.20 1ap4 n LEU 12 Ca 0.04 1.17 -0.33 0.00 -0.03 0.00 0.00 56.01 56.86 1ap4 n LEU 12 Cb 0.16 -1.50 0.06 0.00 -2.33 0.00 0.00 43.42 39.81 1ap4 n LEU 12 CO 0.13 -0.29 0.74 0.42 -1.33 0.00 0.00 177.39 177.05 1ap4 s THR 13 N -0.45 3.22 0.36 -5.08 -4.23 -1.26 -4.88 115.64 103.32 1ap4 s THR 13 Ca 0.62 0.54 0.04 0.00 -1.18 0.00 0.00 61.69 61.71 1ap4 s THR 13 Cb -0.58 -3.06 0.23 0.00 1.34 0.00 0.00 72.50 70.44 1ap4 s THR 13 CO 0.54 -0.38 1.98 -0.08 -0.54 0.00 0.00 174.62 176.14 1ap4 h GLU 14 N -0.16 0.68 0.00 3.99 4.81 -1.96 -0.81 114.58 121.12 1ap4 h GLU 14 Ca -0.46 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 58.70 1ap4 h GLU 14 Cb 1.25 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.49 1ap4 h GLU 14 CO 0.53 0.51 0.00 1.05 -0.73 0.00 0.00 179.01 180.38 1ap4 h GLU 15 N 0.68 0.00 0.00 1.92 4.11 -1.99 -2.31 114.58 116.99 1ap4 h GLU 15 Ca 0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.60 1ap4 h GLU 15 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1ap4 h GLU 15 CO -0.03 0.00 -0.02 0.37 0.07 0.00 0.00 179.01 179.40 1ap4 h GLN 16 N 0.00 0.00 -0.26 1.06 4.15 -1.50 -3.26 115.11 115.30 1ap4 h GLN 16 Ca 0.00 0.00 0.08 0.00 0.77 0.00 0.00 58.65 59.50 1ap4 h GLN 16 Cb 0.30 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.98 1ap4 h GLN 16 CO 0.00 0.00 0.35 0.87 -1.93 0.00 0.00 178.83 178.12 1ap4 h LYS 17 N -0.43 0.00 0.00 1.69 1.57 -1.58 0.21 116.57 118.03 1ap4 h LYS 17 Ca 0.00 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.69 1ap4 h LYS 17 Cb 0.02 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 1ap4 h LYS 17 CO 0.00 0.00 -0.42 -0.91 -0.57 0.00 0.00 179.45 177.55 1ap4 h ASN 18 N 0.00 0.00 1.20 0.86 2.35 -1.52 -2.21 115.58 116.26 1ap4 h ASN 18 Ca 0.12 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.86 1ap4 h ASN 18 Cb 0.81 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.18 1ap4 h ASN 18 CO -0.00 0.42 -0.81 -0.33 -1.65 0.00 0.00 177.43 175.06 1ap4 h GLU 19 N 0.00 0.00 0.07 0.81 3.07 -0.62 -3.34 114.58 114.57 1ap4 h GLU 19 Ca -0.00 0.00 -0.25 0.00 -0.50 0.00 0.00 59.36 58.60 1ap4 h GLU 19 Cb 0.74 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.64 1ap4 h GLU 19 CO 0.05 0.03 -1.21 0.74 -1.40 0.00 0.00 179.01 177.23 1ap4 h PHE 20 N 0.00 0.26 -0.03 4.33 0.04 -1.18 -3.05 116.94 117.30 1ap4 h PHE 20 Ca -0.01 -0.19 0.02 0.00 2.80 0.00 0.00 57.97 60.59 1ap4 h PHE 20 Cb 1.05 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 39.16 1ap4 h PHE 20 CO 0.00 1.16 -0.09 -0.22 -0.60 0.00 0.00 178.31 178.56 1ap4 h LYS 21 N 0.04 -0.14 0.32 1.51 3.64 -1.52 0.49 116.57 120.91 1ap4 h LYS 21 Ca -0.11 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.27 1ap4 h LYS 21 Cb 1.90 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.75 1ap4 h LYS 21 CO 0.16 -0.09 -0.15 0.00 -2.27 0.00 0.00 179.45 177.10 1ap4 h ALA 22 N 0.87 -0.42 -0.73 5.00 0.00 -1.71 -2.81 119.26 119.45 1ap4 h ALA 22 Ca 0.05 -0.13 0.10 0.00 0.00 0.00 0.00 54.91 54.93 1ap4 h ALA 22 Cb 0.21 0.16 -0.08 0.00 0.00 0.00 0.00 17.79 18.09 1ap4 h ALA 22 CO -0.12 -0.68 0.36 0.00 0.00 0.00 0.00 179.25 178.80 1ap4 h ALA 23 N 0.12 1.02 -0.68 0.00 0.00 -1.39 -1.21 119.26 117.11 1ap4 h ALA 23 Ca -0.04 0.06 0.15 0.00 0.00 0.00 0.00 54.91 55.08 1ap4 h ALA 23 Cb 0.39 -0.03 -0.12 0.00 0.00 0.00 0.00 17.79 18.04 1ap4 h ALA 23 CO 0.07 -0.07 0.01 0.35 0.00 0.00 0.00 179.25 179.61 1ap4 h PHE 24 N 0.59 -0.04 0.00 0.00 3.04 0.24 1.25 116.94 122.02 1ap4 h PHE 24 Ca 0.37 0.05 0.00 0.00 3.98 0.00 0.00 57.97 62.37 1ap4 h PHE 24 Cb 0.42 0.12 0.00 0.00 2.56 0.00 0.00 35.95 39.06 1ap4 h PHE 24 CO -0.11 -0.19 0.00 -0.25 -2.02 0.00 0.00 178.31 175.73 1ap4 n ASP 25 N -5.30 0.00 0.02 0.41 8.00 -0.48 -2.86 116.55 116.35 1ap4 n ASP 25 Ca 0.11 0.18 -0.22 0.00 0.71 0.00 0.00 54.79 55.57 1ap4 n ASP 25 Cb 0.41 -0.33 -0.14 0.00 -0.02 0.00 0.00 41.12 41.04 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 0.72 0.00 0.53 2.04 0.18 -3.33 117.51 117.65 1ap4 h ILE 26 Ca 0.00 -2.38 -0.03 0.00 1.00 0.00 0.00 64.86 63.45 1ap4 h ILE 26 Cb 0.14 2.57 -0.00 0.00 -0.74 0.00 0.00 36.82 38.79 1ap4 h ILE 26 CO 0.00 0.87 -0.14 -0.26 0.00 0.00 0.00 178.15 178.63 1ap4 h PHE 27 N 0.04 0.00 -0.44 1.37 0.04 -1.32 -2.86 116.94 113.77 1ap4 h PHE 27 Ca -0.40 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.37 1ap4 h PHE 27 Cb 2.02 0.00 0.00 0.00 2.20 0.00 0.00 35.95 40.17 1ap4 h PHE 27 CO 0.09 0.14 0.00 1.33 -0.60 0.00 0.00 178.31 179.26 1ap4 n VAL 28 N -3.22 2.09 -0.34 -0.55 0.24 -1.18 -4.48 118.33 110.89 1ap4 n VAL 28 Ca 0.01 -1.06 0.11 0.00 -2.04 0.00 0.00 64.34 61.36 1ap4 n VAL 28 Cb 0.44 -0.32 0.30 0.00 -1.47 0.00 0.00 33.84 32.79 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 3.04 0.82 0.00 1.34 7.12 -1.61 -1.64 115.31 124.39 1ap4 h LEU 29 Ca 0.00 0.07 0.00 0.00 0.13 0.00 0.00 57.88 58.08 1ap4 h LEU 29 Cb 1.62 -0.09 0.00 0.00 -0.53 0.00 0.00 40.66 41.66 1ap4 h LEU 29 CO 0.37 0.37 -1.43 0.61 -0.13 0.00 0.00 178.44 178.23 1ap4 n GLY 30 N -1.36 -1.02 3.12 3.75 0.00 -1.26 -4.98 105.19 103.45 1ap4 n GLY 30 Ca 0.21 -0.55 -0.36 0.00 0.00 0.00 0.00 46.02 45.32 1ap4 n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ap4 n ALA 31 N -1.85 -5.03 0.03 4.61 0.00 -0.62 -4.90 120.51 112.75 1ap4 n ALA 31 Ca 0.00 -1.27 0.10 0.00 0.00 0.00 0.00 53.44 52.28 1ap4 n ALA 31 Cb 0.44 -1.14 -0.11 0.00 0.00 0.00 0.00 19.45 18.64 1ap4 n ALA 31 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1ap4 n GLU 32 N 0.56 0.64 0.00 0.00 0.00 -1.26 -4.50 120.64 116.07 1ap4 n GLU 32 Ca -0.01 -0.07 0.00 0.00 0.00 0.00 0.00 57.16 57.09 1ap4 n GLU 32 Cb 0.68 -1.64 0.00 0.00 0.00 0.00 0.00 31.44 30.48 1ap4 n GLU 32 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 1ap4 n ASP 33 N -2.44 0.02 0.00 -1.84 5.68 -1.26 -5.01 116.55 111.69 1ap4 n ASP 33 Ca -0.04 -0.27 0.00 0.00 -0.50 0.00 0.00 54.79 53.98 1ap4 n ASP 33 Cb 0.59 0.47 0.00 0.00 -1.14 0.00 0.00 41.12 41.04 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 0.47 1.28 3.59 6.12 0.00 -1.26 -5.12 105.19 110.26 1ap4 n GLY 34 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.31 5.31 1.30 0.00 1.01 -1.21 -4.23 121.20 122.07 1ap4 s ILE 36 Ca 0.23 -2.38 -0.19 0.00 0.00 0.00 0.00 60.65 58.30 1ap4 s ILE 36 Cb -0.11 -4.67 0.31 0.00 0.01 0.00 0.00 42.46 38.00 1ap4 s ILE 36 CO 0.15 -1.31 0.74 -1.54 0.00 0.00 0.00 174.94 172.98 1ap4 n SER 37 N 4.84 -3.25 0.09 3.58 3.41 -1.26 -2.24 113.62 118.79 1ap4 n SER 37 Ca 0.23 -0.56 -0.03 0.00 -0.26 0.00 0.00 58.87 58.25 1ap4 n SER 37 Cb 0.46 -1.02 -0.06 0.00 -0.26 0.00 0.00 64.21 63.32 1ap4 n SER 37 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ap4 h THR 38 N -3.13 1.35 -0.23 6.66 1.03 -1.95 -2.43 112.91 114.21 1ap4 h THR 38 Ca -0.45 -2.92 -0.02 0.00 -0.01 0.00 0.00 66.41 63.01 1ap4 h THR 38 Cb 1.25 2.67 -0.01 0.00 -1.07 0.00 0.00 68.15 70.98 1ap4 h THR 38 CO 0.31 0.77 0.04 0.11 -0.01 0.00 0.00 175.52 176.73 1ap4 h LYS 39 N 0.00 0.33 -0.47 0.00 1.57 -1.92 -1.98 116.57 114.10 1ap4 h LYS 39 Ca -0.01 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1ap4 h LYS 39 Cb 1.61 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.86 1ap4 h LYS 39 CO 0.10 0.33 0.00 0.39 -0.57 0.00 0.00 179.45 179.70 1ap4 n GLU 40 N -4.38 2.80 -0.03 3.15 -0.58 -1.22 -4.55 120.64 115.82 1ap4 n GLU 40 Ca 0.00 -2.24 -0.14 0.00 -0.42 0.00 0.00 57.16 54.36 1ap4 n GLU 40 Cb 0.17 -1.37 -0.10 0.00 -0.57 0.00 0.00 31.44 29.57 1ap4 n GLU 40 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1ap4 h LEU 41 N 2.77 0.13 -0.72 -4.62 7.12 -0.84 -3.27 115.31 115.89 1ap4 h LEU 41 Ca 0.00 -0.66 0.14 0.00 0.13 0.00 0.00 57.88 57.49 1ap4 h LEU 41 Cb 0.81 -0.04 -0.14 0.00 -0.53 0.00 0.00 40.66 40.77 1ap4 h LEU 41 CO 0.00 0.77 -0.23 1.23 -0.13 0.00 0.00 178.44 180.08 1ap4 h GLY 42 N -0.50 0.36 -0.10 3.75 0.00 -1.80 0.98 103.07 105.76 1ap4 h GLY 42 Ca -0.01 0.31 0.29 0.00 0.00 0.00 0.00 47.33 47.92 1ap4 h GLY 42 CO 0.02 -0.26 0.72 0.50 0.00 0.00 0.00 176.54 177.52 1ap4 h LYS 43 N -0.04 0.16 0.02 4.80 1.57 -1.86 0.10 116.57 121.31 1ap4 h LYS 43 Ca 0.33 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 59.10 1ap4 h LYS 43 Cb 0.55 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.82 1ap4 h LYS 43 CO -0.76 0.11 -0.01 0.28 -0.57 0.00 0.00 179.45 178.50 1ap4 h VAL 44 N 0.16 1.47 0.00 0.50 2.07 0.91 -2.88 116.25 118.48 1ap4 h VAL 44 Ca 0.53 -1.56 -0.01 0.00 0.82 0.00 0.00 66.70 66.49 1ap4 h VAL 44 Cb 1.79 2.50 -0.00 0.00 -1.52 0.00 0.00 31.29 34.06 1ap4 h VAL 44 CO -0.12 0.40 -0.03 0.24 0.02 0.00 0.00 177.57 178.08 1ap4 h MET 45 N -0.71 0.00 -0.03 1.57 2.86 -0.56 0.56 114.93 118.62 1ap4 h MET 45 Ca -0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1ap4 h MET 45 Cb 0.67 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.32 1ap4 h MET 45 CO 0.00 0.03 -0.03 -0.09 1.06 0.00 0.00 176.91 177.88 1ap4 h ARG 46 N 0.00 0.08 0.00 1.72 2.43 -1.03 0.86 114.38 118.44 1ap4 h ARG 46 Ca -0.00 -0.04 -0.21 0.00 -0.81 0.00 0.00 59.98 58.92 1ap4 h ARG 46 Cb 0.06 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.58 1ap4 h ARG 46 CO 0.00 0.54 -1.00 0.00 -1.51 0.00 0.00 179.97 178.01 1ap4 h MET 47 N -0.38 0.00 -0.05 0.20 -0.00 -1.24 -3.24 114.93 110.22 1ap4 h MET 47 Ca 0.01 -0.00 -0.03 0.00 -0.00 0.00 0.00 59.70 59.68 1ap4 h MET 47 Cb 0.53 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.12 1ap4 h MET 47 CO 0.01 1.00 -0.09 -0.07 -0.00 0.00 0.00 176.91 177.75 1ap4 h LEU 48 N 0.00 0.06 0.00 -0.10 3.38 0.07 -3.45 115.31 115.27 1ap4 h LEU 48 Ca -0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1ap4 h LEU 48 Cb 1.77 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.50 1ap4 h LEU 48 CO 0.13 0.17 0.00 0.61 0.09 0.00 0.00 178.44 179.44 1ap4 n GLY 49 N -1.18 0.72 3.84 0.83 0.00 -1.08 -5.06 105.19 103.26 1ap4 n GLY 49 Ca -0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.74 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 2.27 -0.40 1.61 -1.52 0.30 -5.02 119.66 116.90 1ap4 s GLN 50 Ca 0.00 -1.97 0.10 0.00 -1.95 0.00 0.00 55.36 51.54 1ap4 s GLN 50 Cb 0.00 -2.03 0.32 0.00 -0.22 0.00 0.00 33.01 31.08 1ap4 s GLN 50 CO 0.00 -0.41 0.78 -1.71 -0.25 0.00 0.00 175.29 173.70 1ap4 n ASN 51 N -1.54 -0.22 -4.79 5.90 2.85 -1.26 -3.75 115.26 112.44 1ap4 n ASN 51 Ca -0.03 -3.11 -0.30 0.00 -0.11 0.00 0.00 54.58 51.03 1ap4 n ASN 51 Cb 0.64 0.08 0.10 0.00 1.24 0.00 0.00 39.78 41.84 1ap4 n ASN 51 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 1ap4 s PRO 52 N -1.40 1.97 0.50 1.20 0.04 -1.26 -5.07 135.00 130.97 1ap4 s PRO 52 Ca 0.35 0.67 0.07 0.00 0.04 0.00 0.00 61.00 62.13 1ap4 s PRO 52 Cb 0.29 -1.90 0.04 0.00 0.04 0.00 0.00 34.50 32.97 1ap4 s PRO 52 CO -0.09 -1.71 0.68 0.95 0.04 0.00 0.00 177.00 176.87 1ap4 s THR 53 N -3.12 2.68 0.12 1.26 -4.23 -1.26 -4.97 115.64 106.12 1ap4 s THR 53 Ca 0.61 -0.93 -0.10 0.00 -1.18 0.00 0.00 61.69 60.09 1ap4 s THR 53 Cb -0.15 -2.75 -0.14 0.00 1.34 0.00 0.00 72.50 70.80 1ap4 s THR 53 CO 0.55 0.00 1.34 1.55 -0.54 0.00 0.00 174.62 177.52 1ap4 h PRO 54 N 0.37 0.71 0.00 3.99 0.13 -2.00 -1.57 132.00 133.63 1ap4 h PRO 54 Ca -0.37 -0.58 -0.13 0.00 -0.87 0.00 0.00 66.00 64.05 1ap4 h PRO 54 Cb 1.28 0.12 -0.02 0.00 0.13 0.00 0.00 31.00 32.51 1ap4 h PRO 54 CO 0.45 1.19 -0.64 0.93 -0.23 0.00 0.00 178.00 179.70 1ap4 h GLU 55 N 0.49 0.00 0.00 0.86 3.07 -2.03 -3.14 114.58 113.83 1ap4 h GLU 55 Ca -0.05 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 58.60 1ap4 h GLU 55 Cb 1.38 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 29.26 1ap4 h GLU 55 CO 0.15 0.64 -1.07 0.93 -1.40 0.00 0.00 179.01 178.26 1ap4 h GLU 56 N 0.00 0.00 -0.55 2.33 4.39 -1.95 -3.32 114.58 115.48 1ap4 h GLU 56 Ca -0.01 0.00 0.05 0.00 0.34 0.00 0.00 59.36 59.75 1ap4 h GLU 56 Cb 1.16 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.73 1ap4 h GLU 56 CO 0.08 0.85 -0.41 1.25 -1.16 0.00 0.00 179.01 179.62 1ap4 h LEU 57 N 0.00 -1.46 0.69 1.33 5.85 -1.22 0.81 115.31 121.31 1ap4 h LEU 57 Ca -0.06 0.21 -0.03 0.00 0.84 0.00 0.00 57.88 58.84 1ap4 h LEU 57 Cb 1.76 0.63 0.01 0.00 0.37 0.00 0.00 40.66 43.43 1ap4 h LEU 57 CO 0.11 -0.21 -0.33 -0.61 -0.34 0.00 0.00 178.44 177.06 1ap4 h GLN 58 N -0.10 -0.89 -1.09 1.25 -0.00 -1.72 -2.49 115.11 110.06 1ap4 h GLN 58 Ca 0.09 0.06 0.31 0.00 -0.00 0.00 0.00 58.65 59.12 1ap4 h GLN 58 Cb 0.34 0.20 -0.04 0.00 0.00 0.00 0.00 27.48 27.98 1ap4 h GLN 58 CO -0.58 -0.60 0.93 1.49 0.00 0.00 0.00 178.83 180.08 1ap4 h GLU 59 N -1.00 0.00 0.00 1.69 4.57 -1.58 -2.28 114.58 115.98 1ap4 h GLU 59 Ca -0.09 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.09 1ap4 h GLU 59 Cb 0.71 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.30 1ap4 h GLU 59 CO 0.16 0.00 0.00 -1.33 -1.18 0.00 0.00 179.01 176.66 1ap4 n MET 60 N -3.80 0.00 -0.31 1.92 2.81 0.28 -3.52 117.12 114.50 1ap4 n MET 60 Ca 0.24 0.26 0.33 0.00 -1.81 0.00 0.00 57.70 56.72 1ap4 n MET 60 Cb 1.29 -0.94 0.55 0.00 -0.71 0.00 0.00 33.22 33.41 1ap4 n MET 60 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 1ap4 h ILE 61 N 0.00 0.04 0.00 2.02 2.04 -1.17 1.44 117.51 121.88 1ap4 h ILE 61 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1ap4 h ILE 61 Cb 0.00 0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.13 1ap4 h ILE 61 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 178.15 177.48 1ap4 n ASP 62 N -3.45 0.00 0.00 1.72 2.03 -0.88 -0.57 116.55 115.40 1ap4 n ASP 62 Ca 0.27 0.30 -0.08 0.00 0.52 0.00 0.00 54.79 55.81 1ap4 n ASP 62 Cb 1.58 -0.37 -0.13 0.00 -0.72 0.00 0.00 41.12 41.47 1ap4 n ASP 62 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 1ap4 h GLU 63 N 0.00 0.00 0.00 -0.67 4.11 0.19 -3.38 114.58 114.83 1ap4 h GLU 63 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1ap4 h GLU 63 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1ap4 h GLU 63 CO 0.00 0.59 -1.50 1.55 0.07 0.00 0.00 179.01 179.73 1ap4 n VAL 64 N -3.11 0.00 -1.50 -1.06 3.14 -0.87 -4.88 118.33 110.05 1ap4 n VAL 64 Ca -0.13 -0.28 -0.14 0.00 -2.96 0.00 0.00 64.34 60.83 1ap4 n VAL 64 Cb 1.01 0.28 -0.11 0.00 -1.06 0.00 0.00 33.84 33.96 1ap4 n VAL 64 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 1ap4 n ASP 65 N -1.89 0.64 -0.05 6.55 2.03 0.27 -4.69 116.55 119.41 1ap4 n ASP 65 Ca -0.02 -1.44 -0.15 0.00 0.52 0.00 0.00 54.79 53.71 1ap4 n ASP 65 Cb 0.32 -1.32 -0.07 0.00 -0.72 0.00 0.00 41.12 39.32 1ap4 n ASP 65 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1ap4 h GLU 66 N 11.82 0.53 0.00 -0.67 5.08 -1.89 -2.91 114.58 126.53 1ap4 h GLU 66 Ca 0.01 -0.36 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 1ap4 h GLU 66 Cb 1.03 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1ap4 h GLU 66 CO 1.15 0.97 0.00 -0.40 -1.00 0.00 0.00 179.01 179.73 1ap4 n ASP 67 N -4.31 0.00 -3.98 1.42 5.68 -1.26 -4.89 116.55 109.21 1ap4 n ASP 67 Ca -0.07 -0.92 -0.29 0.00 -0.50 0.00 0.00 54.79 53.02 1ap4 n ASP 67 Cb 0.52 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.48 1ap4 n ASP 67 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ap4 n GLY 68 N 0.74 -0.36 0.12 6.12 0.00 -1.10 -4.87 105.19 105.84 1ap4 n GLY 68 Ca 0.20 0.21 -0.16 0.00 0.00 0.00 0.00 46.02 46.27 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 -2.86 1.65 0.00 1.61 3.41 -1.26 -5.01 113.62 111.15 1ap4 n SER 69 Ca -0.27 -0.11 0.00 0.00 -0.26 0.00 0.00 58.87 58.23 1ap4 n SER 69 Cb 0.67 -0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 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 2.19 1.47 3.97 5.00 0.00 -1.26 -5.09 105.19 111.46 1ap4 n GLY 70 Ca -0.43 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.38 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 -1.64 4.37 -0.30 2.61 -4.23 -1.26 -3.90 115.64 111.29 1ap4 s THR 71 Ca 0.00 -0.73 -0.01 0.00 -1.18 0.00 0.00 61.69 59.77 1ap4 s THR 71 Cb 0.00 -3.57 0.06 0.00 1.34 0.00 0.00 72.50 70.33 1ap4 s THR 71 CO 0.00 -0.31 -0.00 -0.69 -0.54 0.00 0.00 174.62 173.08 1ap4 s VAL 72 N -2.31 2.87 0.65 2.29 1.01 -0.95 -4.97 120.40 119.00 1ap4 s VAL 72 Ca 0.44 -1.49 -0.03 0.00 0.00 0.00 0.00 61.98 60.90 1ap4 s VAL 72 Cb -0.10 -2.69 0.06 0.00 0.00 0.00 0.00 36.38 33.65 1ap4 s VAL 72 CO 0.34 -0.15 0.92 -1.81 0.00 0.00 0.00 175.10 174.40 1ap4 s ASP 73 N 1.26 4.92 0.25 3.32 1.11 -1.26 -3.35 116.67 122.92 1ap4 s ASP 73 Ca -0.04 0.17 -0.09 0.00 0.18 0.00 0.00 52.55 52.77 1ap4 s ASP 73 Cb -0.20 -0.88 0.41 0.00 1.07 0.00 0.00 42.92 43.32 1ap4 s ASP 73 CO -0.02 -1.46 1.60 0.15 1.18 0.00 0.00 175.17 176.62 1ap4 h PHE 74 N -0.34 -0.30 -0.86 4.23 3.04 -1.96 1.69 116.94 122.45 1ap4 h PHE 74 Ca -0.43 0.07 0.13 0.00 3.98 0.00 0.00 57.97 61.72 1ap4 h PHE 74 Cb 1.30 0.26 -0.09 0.00 2.56 0.00 0.00 35.95 39.98 1ap4 h PHE 74 CO 0.26 -0.33 0.46 -0.44 -2.02 0.00 0.00 178.31 176.25 1ap4 h ASP 75 N 0.03 0.60 0.00 0.41 3.32 -2.01 -1.82 116.42 116.95 1ap4 h ASP 75 Ca 0.42 0.08 -0.13 0.00 0.02 0.00 0.00 57.03 57.41 1ap4 h ASP 75 Cb 0.69 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.19 1ap4 h ASP 75 CO -0.80 0.29 -0.75 -0.33 -1.72 0.00 0.00 179.24 175.93 1ap4 h GLU 76 N 0.70 0.00 -1.28 3.56 5.08 -0.37 -3.25 114.58 119.02 1ap4 h GLU 76 Ca 0.45 0.00 0.43 0.00 -1.00 0.00 0.00 59.36 59.24 1ap4 h GLU 76 Cb 0.57 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 29.69 1ap4 h GLU 76 CO -0.32 0.94 0.82 0.35 -1.00 0.00 0.00 179.01 179.80 1ap4 h PHE 77 N -1.00 0.56 0.33 4.33 3.57 0.23 0.23 116.94 125.19 1ap4 h PHE 77 Ca -0.20 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.31 1ap4 h PHE 77 Cb 1.14 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.74 1ap4 h PHE 77 CO 0.15 -0.22 -0.16 -0.07 -2.23 0.00 0.00 178.31 175.78 1ap4 h LEU 78 N 0.09 -0.37 -0.51 0.59 3.38 -1.46 -2.98 115.31 114.05 1ap4 h LEU 78 Ca 0.82 0.01 0.10 0.00 0.09 0.00 0.00 57.88 58.90 1ap4 h LEU 78 Cb 2.51 0.10 -0.09 0.00 0.09 0.00 0.00 40.66 43.26 1ap4 h LEU 78 CO -0.45 0.03 -0.09 0.58 0.09 0.00 0.00 178.44 178.60 1ap4 h VAL 79 N -1.04 0.52 -1.03 1.22 2.07 -1.15 0.29 116.25 117.13 1ap4 h VAL 79 Ca -0.04 -0.01 0.26 0.00 0.82 0.00 0.00 66.70 67.72 1ap4 h VAL 79 Cb 0.34 0.49 -0.09 0.00 -1.52 0.00 0.00 31.29 30.50 1ap4 h VAL 79 CO 0.07 0.01 0.66 -0.03 0.02 0.00 0.00 177.57 178.30 1ap4 h MET 80 N 0.03 0.41 0.22 1.57 4.05 -0.72 0.72 114.93 121.20 1ap4 h MET 80 Ca 0.25 -0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 59.63 1ap4 h MET 80 Cb 0.38 -0.09 0.00 0.00 -0.80 0.00 0.00 31.60 31.09 1ap4 h MET 80 CO -0.50 0.27 -0.11 0.52 0.23 0.00 0.00 176.91 177.33 1ap4 h MET 81 N 0.42 -0.28 -0.82 0.39 2.07 -0.29 -2.39 114.93 114.03 1ap4 h MET 81 Ca 0.59 0.02 0.21 0.00 -2.07 0.00 0.00 59.70 58.45 1ap4 h MET 81 Cb 1.45 0.06 -0.05 0.00 -1.87 0.00 0.00 31.60 31.20 1ap4 h MET 81 CO -0.30 -0.19 0.57 -0.24 1.07 0.00 0.00 176.91 177.82 1ap4 h VAL 82 N -0.56 0.65 0.00 -2.22 3.04 -0.87 0.53 116.25 116.82 1ap4 h VAL 82 Ca -0.03 -0.06 -0.07 0.00 -1.01 0.00 0.00 66.70 65.52 1ap4 h VAL 82 Cb 0.23 0.45 -0.01 0.00 -2.01 0.00 0.00 31.29 29.95 1ap4 h VAL 82 CO 0.05 0.03 -0.35 0.03 -1.01 0.00 0.00 177.57 176.32 1ap4 h ARG 83 N 0.18 0.00 -0.55 4.17 3.08 0.43 -2.59 114.38 119.10 1ap4 h ARG 83 Ca 0.41 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.46 1ap4 h ARG 83 Cb 1.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.36 1ap4 h ARG 83 CO -0.08 0.35 0.00 0.00 -1.07 0.00 0.00 179.97 179.18 1ap4 n MET 85 N 0.83 0.61 -2.88 0.00 2.81 -0.40 -5.04 117.12 113.04 1ap4 n MET 85 Ca 0.23 0.37 -0.06 0.00 -1.81 0.00 0.00 57.70 56.43 1ap4 n MET 85 Cb 0.80 -1.63 0.01 0.00 -0.71 0.00 0.00 33.22 31.69 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 -4.09 -2.17 -1.97 0.03 4.81 -1.24 -4.81 118.16 108.72 1ap4 n LYS 86 Ca -0.41 2.00 -0.42 0.00 -0.87 0.00 0.00 58.31 58.60 1ap4 n LYS 86 Cb 0.84 -5.68 -0.00 0.00 0.02 0.00 0.00 35.03 30.21 1ap4 n LYS 86 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1ap4 n ASP 87 N -0.59 4.16 -4.27 3.14 5.75 -1.26 -4.96 116.55 118.52 1ap4 n ASP 87 Ca 0.10 -2.86 -0.29 0.00 -0.01 0.00 0.00 54.79 51.72 1ap4 n ASP 87 Cb 0.47 -1.68 0.22 0.00 -1.03 0.00 0.00 41.12 39.10 1ap4 n ASP 87 CO 0.00 0.00 0.00 1.51 -0.11 0.00 0.00 177.20 178.60 1ap4 s ASP 88 N 3.52 1.41 0.00 -1.12 -4.77 -1.26 -5.31 116.67 109.14 1ap4 s ASP 88 Ca 0.49 1.02 0.05 0.00 -3.30 0.00 0.00 52.55 50.82 1ap4 s ASP 88 Cb 0.11 -1.56 0.32 0.00 -1.09 0.00 0.00 42.92 40.71 1ap4 s ASP 88 CO -0.04 -3.87 0.79 -1.20 0.70 0.00 0.00 175.17 171.55