#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2no8 n LEU 3 N 0.00 -0.65 -3.86 4.31 7.94 -1.26 -5.14 117.00 118.35 2no8 n LEU 3 Ca 0.00 0.15 -0.10 0.00 -1.11 0.00 0.00 56.01 54.95 2no8 n LEU 3 Cb 0.00 0.96 -0.06 0.00 0.53 0.00 0.00 43.42 44.85 2no8 n LEU 3 CO 0.00 -0.39 0.09 -1.59 -1.11 0.00 0.00 177.39 174.40 2no8 s LYS 4 N -1.17 1.23 -0.00 1.96 0.00 -1.26 -5.02 119.74 115.49 2no8 s LYS 4 Ca 0.00 -1.04 0.11 0.00 0.00 0.00 0.00 55.97 55.04 2no8 s LYS 4 Cb 0.00 0.43 -0.12 0.00 0.00 0.00 0.00 37.83 38.15 2no8 s LYS 4 CO 0.00 -0.48 0.46 -2.39 0.00 0.00 0.00 175.35 172.94 2no8 n HIS 5 N -0.26 0.00 -3.83 1.78 1.44 -1.26 -5.06 115.22 108.04 2no8 n HIS 5 Ca -0.09 0.00 -0.03 0.00 -2.01 0.00 0.00 57.72 55.59 2no8 n HIS 5 Cb 0.63 -0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.74 2no8 n HIS 5 CO 0.00 0.00 0.00 -1.54 -2.81 0.00 0.00 176.34 171.99 2no8 s SER 6 N -2.04 -0.06 0.40 4.39 1.04 -1.26 -5.00 113.70 111.17 2no8 s SER 6 Ca 0.04 -0.57 0.15 0.00 0.48 0.00 0.00 55.95 56.05 2no8 s SER 6 Cb 0.08 0.49 0.84 0.00 0.10 0.00 0.00 66.02 67.52 2no8 s SER 6 CO 0.44 -0.94 1.87 -0.29 0.98 0.00 0.00 173.24 175.31 2no8 h ILE 7 N 2.00 1.15 -0.01 -1.02 2.10 -1.92 -2.64 117.51 117.18 2no8 h ILE 7 Ca -0.27 -1.11 0.00 0.00 1.08 0.00 0.00 64.86 64.57 2no8 h ILE 7 Cb 1.22 1.61 0.00 0.00 -1.09 0.00 0.00 36.82 38.56 2no8 h ILE 7 CO 0.32 0.31 0.00 -0.24 -1.08 0.00 0.00 178.15 177.46 2no8 n SER 8 N -4.06 0.16 -0.06 2.19 2.88 -1.24 -1.58 113.62 111.91 2no8 n SER 8 Ca -0.02 -1.18 0.11 0.00 -1.33 0.00 0.00 58.87 56.45 2no8 n SER 8 Cb 0.37 -0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.81 2no8 n SER 8 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2no8 n ASP 9 N -0.81 1.01 -4.74 -3.46 2.03 -0.99 -2.85 116.55 106.74 2no8 n ASP 9 Ca 0.20 -0.90 -0.39 0.00 0.52 0.00 0.00 54.79 54.23 2no8 n ASP 9 Cb 0.12 0.75 -0.05 0.00 -0.72 0.00 0.00 41.12 41.22 2no8 n ASP 9 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 2no8 s TYR 10 N -2.92 3.62 0.87 -0.67 1.51 -0.62 -4.77 117.35 114.37 2no8 s TYR 10 Ca 0.10 1.18 -0.14 0.00 -1.01 0.00 0.00 57.07 57.21 2no8 s TYR 10 Cb 0.17 -2.68 0.13 0.00 -0.11 0.00 0.00 41.96 39.46 2no8 s TYR 10 CO 0.79 0.22 1.24 0.95 -1.11 0.00 0.00 175.55 177.64 2no8 s THR 11 N 0.31 2.00 0.24 -0.71 -4.23 -1.26 0.43 115.64 112.41 2no8 s THR 11 Ca 0.33 -0.00 -0.07 0.00 -1.18 0.00 0.00 61.69 60.77 2no8 s THR 11 Cb -0.18 -3.00 0.23 0.00 1.34 0.00 0.00 72.50 70.90 2no8 s THR 11 CO 0.17 0.00 1.89 -0.08 -0.54 0.00 0.00 174.62 176.06 2no8 h GLU 12 N -1.29 1.29 -0.58 3.99 4.81 -1.92 -0.66 114.58 120.22 2no8 h GLU 12 Ca -0.45 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 58.66 2no8 h GLU 12 Cb 1.29 -0.27 -0.03 0.00 0.63 0.00 0.00 28.75 30.37 2no8 h GLU 12 CO 0.55 0.89 0.33 0.00 -0.73 0.00 0.00 179.01 180.05 2no8 h ALA 13 N 1.32 0.75 -0.14 2.92 0.00 -1.92 0.31 119.26 122.50 2no8 h ALA 13 Ca 0.34 -0.09 -0.16 0.00 0.00 0.00 0.00 54.91 55.00 2no8 h ALA 13 Cb -0.07 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 2no8 h ALA 13 CO -0.07 0.26 -0.57 0.93 0.00 0.00 0.00 179.25 179.80 2no8 h GLU 14 N 0.79 0.44 -0.05 0.00 5.08 -1.82 -0.84 114.58 118.18 2no8 h GLU 14 Ca 0.21 -0.29 -0.18 0.00 -1.00 0.00 0.00 59.36 58.10 2no8 h GLU 14 Cb 0.03 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 2no8 h GLU 14 CO -0.03 0.89 -0.76 0.35 -1.00 0.00 0.00 179.01 178.46 2no8 h PHE 15 N 0.34 0.44 -0.81 4.33 3.57 -0.72 -2.51 116.94 121.58 2no8 h PHE 15 Ca 0.00 -0.21 0.01 0.00 3.53 0.00 0.00 57.97 61.30 2no8 h PHE 15 Cb 1.10 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 39.74 2no8 h PHE 15 CO 0.04 0.96 0.53 1.25 -2.23 0.00 0.00 178.31 178.86 2no8 h LEU 16 N 0.21 0.93 -2.53 0.59 7.12 -0.16 0.54 115.31 122.01 2no8 h LEU 16 Ca -0.03 -0.03 -0.00 0.00 0.13 0.00 0.00 57.88 57.95 2no8 h LEU 16 Cb 1.34 -0.23 -0.00 0.00 -0.53 0.00 0.00 40.66 41.23 2no8 h LEU 16 CO 0.12 0.68 -0.01 -0.33 -0.13 0.00 0.00 178.44 178.77 2no8 h GLU 17 N 1.10 0.00 0.11 1.25 4.39 -0.74 -2.74 114.58 117.94 2no8 h GLU 17 Ca 0.30 0.00 0.01 0.00 0.34 0.00 0.00 59.36 60.00 2no8 h GLU 17 Cb -0.12 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.51 2no8 h GLU 17 CO -0.06 0.01 -0.12 0.27 -1.16 0.00 0.00 179.01 177.94 2no8 h PHE 18 N 0.00 -0.32 -0.13 4.33 -0.00 -0.48 -0.12 116.94 120.22 2no8 h PHE 18 Ca -0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 57.97 57.79 2no8 h PHE 18 Cb 0.15 0.13 -0.00 0.00 -0.00 0.00 0.00 35.95 36.22 2no8 h PHE 18 CO 0.00 -0.19 -0.68 -0.24 -0.00 0.00 0.00 178.31 177.20 2no8 h VAL 19 N -0.27 1.34 -0.68 0.88 3.04 -1.52 -1.49 116.25 117.55 2no8 h VAL 19 Ca 0.01 -2.00 -0.04 0.00 -1.01 0.00 0.00 66.70 63.66 2no8 h VAL 19 Cb 0.26 1.98 -0.03 0.00 -2.01 0.00 0.00 31.29 31.49 2no8 h VAL 19 CO -0.05 0.61 0.27 0.11 -1.01 0.00 0.00 177.57 177.51 2no8 h LYS 20 N 0.38 1.01 -0.76 4.17 1.57 -1.39 -0.77 116.57 120.78 2no8 h LYS 20 Ca -0.02 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 2no8 h LYS 20 Cb 1.26 -0.16 -0.04 0.00 0.08 0.00 0.00 32.23 33.37 2no8 h LYS 20 CO 0.13 0.84 0.47 -0.22 -0.57 0.00 0.00 179.45 180.10 2no8 h LYS 21 N 0.96 1.02 -0.50 3.15 3.64 -0.54 0.19 116.57 124.48 2no8 h LYS 21 Ca 0.23 -0.08 -0.12 0.00 -1.27 0.00 0.00 60.65 59.40 2no8 h LYS 21 Cb 0.21 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 31.79 2no8 h LYS 21 CO -0.02 0.70 -0.16 0.82 -2.27 0.00 0.00 179.45 178.53 2no8 h ILE 22 N 1.03 1.27 -0.37 2.00 2.04 -0.95 0.48 117.51 123.02 2no8 h ILE 22 Ca 0.27 -1.31 -0.11 0.00 1.00 0.00 0.00 64.86 64.71 2no8 h ILE 22 Cb -0.07 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 2no8 h ILE 22 CO -0.05 0.46 -0.24 0.00 0.00 0.00 0.00 178.15 178.31 2no8 n ARG 24 N -4.11 0.67 -0.66 0.00 1.85 0.59 -4.59 116.66 110.41 2no8 n ARG 24 Ca -0.00 0.10 0.04 0.00 -1.00 0.00 0.00 57.85 57.00 2no8 n ARG 24 Cb 0.44 -1.53 0.28 0.00 -1.05 0.00 0.00 32.46 30.60 2no8 n ARG 24 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2no8 n ALA 25 N -3.08 3.57 -0.28 2.89 0.00 0.17 -4.74 120.51 119.03 2no8 n ALA 25 Ca -0.41 -2.38 0.33 0.00 0.00 0.00 0.00 53.44 50.99 2no8 n ALA 25 Cb 1.05 -0.87 0.62 0.00 0.00 0.00 0.00 19.45 20.24 2no8 n ALA 25 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2no8 h GLU 26 N 2.15 0.00 0.00 0.00 -0.00 -1.62 -3.47 114.58 111.64 2no8 h GLU 26 Ca 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.44 2no8 h GLU 26 Cb 1.71 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.46 2no8 h GLU 26 CO 0.37 0.00 0.00 0.41 -0.00 0.00 0.00 179.01 179.79 2no8 n GLY 27 N -1.73 1.24 2.02 1.06 0.00 -1.26 -1.94 105.19 104.58 2no8 n GLY 27 Ca 0.25 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.41 2no8 n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2no8 n ALA 28 N 0.04 1.96 -2.80 4.61 0.00 -1.26 -5.10 120.51 117.97 2no8 n ALA 28 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.20 2no8 n ALA 28 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 2no8 n ALA 28 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2no8 s THR 29 N -2.00 4.39 -1.14 0.00 2.01 -1.26 -5.00 115.64 112.64 2no8 s THR 29 Ca 0.00 -1.26 0.16 0.00 0.31 0.00 0.00 61.69 60.90 2no8 s THR 29 Cb 0.00 -3.30 0.19 0.00 0.01 0.00 0.00 72.50 69.40 2no8 s THR 29 CO 0.00 -0.22 1.51 1.21 -0.69 0.00 0.00 174.62 176.43 2no8 n GLU 30 N -0.70 0.08 0.09 4.92 2.13 -1.26 -1.41 120.64 124.50 2no8 n GLU 30 Ca -0.08 0.19 -0.01 0.00 0.66 0.00 0.00 57.16 57.92 2no8 n GLU 30 Cb 0.56 -1.50 0.27 0.00 0.27 0.00 0.00 31.44 31.04 2no8 n GLU 30 CO 0.00 0.00 0.00 1.05 -0.41 0.00 0.00 177.13 177.77 2no8 h GLU 31 N 0.00 0.26 -0.03 5.31 4.11 -1.94 0.12 114.58 122.40 2no8 h GLU 31 Ca 0.00 -0.10 -0.23 0.00 0.07 0.00 0.00 59.36 59.10 2no8 h GLU 31 Cb 0.24 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.48 2no8 h GLU 31 CO 0.00 0.55 -0.90 0.22 0.07 0.00 0.00 179.01 178.95 2no8 h ASP 32 N 0.23 0.66 0.69 3.06 1.82 -1.43 -0.39 116.42 121.06 2no8 h ASP 32 Ca 0.03 -0.50 -0.03 0.00 -0.39 0.00 0.00 57.03 56.14 2no8 h ASP 32 Cb 0.67 -0.20 0.00 0.00 0.68 0.00 0.00 39.33 40.48 2no8 h ASP 32 CO 0.05 1.29 -0.38 -0.78 -1.61 0.00 0.00 179.24 177.81 2no8 h ASP 33 N 0.32 -0.94 -0.41 2.28 1.82 -1.17 -3.05 116.42 115.26 2no8 h ASP 33 Ca -0.08 0.05 -0.01 0.00 -0.39 0.00 0.00 57.03 56.60 2no8 h ASP 33 Cb 1.53 0.26 -0.02 0.00 0.68 0.00 0.00 39.33 41.78 2no8 h ASP 33 CO 0.17 -0.61 0.23 -1.13 -1.61 0.00 0.00 179.24 176.28 2no8 h ASN 34 N -0.99 0.53 0.88 2.28 -1.24 -0.71 -1.33 115.58 114.99 2no8 h ASN 34 Ca -0.09 -0.04 -0.01 0.00 0.71 0.00 0.00 56.30 56.88 2no8 h ASN 34 Cb 0.79 -0.14 -0.00 0.00 0.73 0.00 0.00 38.32 39.70 2no8 h ASN 34 CO 0.12 0.44 -0.04 0.07 -1.29 0.00 0.00 177.43 176.73 2no8 h LYS 35 N 0.61 0.00 0.02 6.67 2.10 -0.96 0.27 116.57 125.28 2no8 h LYS 35 Ca 0.16 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.81 2no8 h LYS 35 Cb 0.03 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.36 2no8 h LYS 35 CO -0.03 0.04 -0.01 -0.07 -2.00 0.00 0.00 179.45 177.38 2no8 h LEU 36 N 0.00 -0.02 -0.55 7.07 3.38 -1.17 -3.20 115.31 120.81 2no8 h LEU 36 Ca -0.00 -0.59 0.11 0.00 0.09 0.00 0.00 57.88 57.49 2no8 h LEU 36 Cb 0.49 0.01 -0.09 0.00 0.09 0.00 0.00 40.66 41.15 2no8 h LEU 36 CO 0.00 0.59 -0.00 0.58 0.09 0.00 0.00 178.44 179.71 2no8 h VAL 37 N -0.66 0.56 -0.48 1.22 2.07 -0.91 -1.08 116.25 116.97 2no8 h VAL 37 Ca -0.00 -0.04 0.02 0.00 0.82 0.00 0.00 66.70 67.50 2no8 h VAL 37 Cb 0.62 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 2no8 h VAL 37 CO 0.00 0.02 0.32 0.03 0.02 0.00 0.00 177.57 177.96 2no8 h ARG 38 N 0.12 0.54 -0.04 1.57 3.08 -0.59 0.58 114.38 119.64 2no8 h ARG 38 Ca 0.28 -0.03 -0.21 0.00 0.07 0.00 0.00 59.98 60.10 2no8 h ARG 38 Cb 0.44 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.37 2no8 h ARG 38 CO -0.47 0.36 -0.83 1.05 -1.07 0.00 0.00 179.97 179.01 2no8 h GLU 39 N 0.56 0.42 -0.02 0.04 4.11 -1.21 -2.38 114.58 116.10 2no8 h GLU 39 Ca 0.19 -0.39 -0.23 0.00 0.07 0.00 0.00 59.36 59.00 2no8 h GLU 39 Cb 0.06 0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.42 2no8 h GLU 39 CO -0.05 1.05 -0.92 0.74 0.07 0.00 0.00 179.01 179.90 2no8 h PHE 40 N 0.26 0.69 -0.23 2.06 0.04 -0.77 -1.50 116.94 117.49 2no8 h PHE 40 Ca -0.05 -0.36 0.02 0.00 2.80 0.00 0.00 57.97 60.37 2no8 h PHE 40 Cb 1.44 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 39.49 2no8 h PHE 40 CO 0.05 1.18 0.15 0.93 -0.60 0.00 0.00 178.31 180.02 2no8 h GLU 41 N 0.28 0.23 -0.03 1.51 5.08 0.15 -0.23 114.58 121.56 2no8 h GLU 41 Ca -0.08 -0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 58.14 2no8 h GLU 41 Cb 1.55 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 30.76 2no8 h GLU 41 CO 0.16 0.15 -0.46 -0.09 -1.00 0.00 0.00 179.01 177.77 2no8 h ARG 42 N 0.24 0.36 -0.94 2.33 9.65 -1.13 0.51 114.38 125.39 2no8 h ARG 42 Ca 0.09 -0.35 0.06 0.00 -1.10 0.00 0.00 59.98 58.67 2no8 h ARG 42 Cb 0.08 0.09 -0.06 0.00 -1.39 0.00 0.00 29.97 28.69 2no8 h ARG 42 CO -0.02 1.02 0.60 -0.07 2.80 0.00 0.00 179.97 184.31 2no8 h LEU 43 N -0.16 0.98 0.00 3.80 3.38 -0.86 -2.25 115.31 120.20 2no8 h LEU 43 Ca -0.05 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2no8 h LEU 43 Cb 1.16 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.71 2no8 h LEU 43 CO 0.09 0.63 -0.81 0.71 0.09 0.00 0.00 178.44 179.15 2no8 h THR 44 N 1.12 0.00 -3.27 0.22 1.35 -1.06 -3.42 112.91 107.85 2no8 h THR 44 Ca 0.40 -0.74 -0.34 0.00 -0.55 0.00 0.00 66.41 65.18 2no8 h THR 44 Cb 0.12 1.27 -0.02 0.00 -1.73 0.00 0.00 68.15 67.79 2no8 h THR 44 CO -0.16 0.00 -0.43 -0.62 -0.25 0.00 0.00 175.52 174.06 2no8 n GLU 45 N -2.39 -1.90 -3.23 4.72 1.02 0.17 -4.90 120.64 114.13 2no8 n GLU 45 Ca 0.02 0.84 -0.39 0.00 -0.02 0.00 0.00 57.16 57.61 2no8 n GLU 45 Cb 0.49 -5.46 -0.06 0.00 -0.02 0.00 0.00 31.44 26.39 2no8 n GLU 45 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2no8 s HIS 46 N -2.84 3.43 0.07 -0.32 2.46 -0.63 -4.98 115.29 112.49 2no8 s HIS 46 Ca 0.00 0.87 -0.30 0.00 0.47 0.00 0.00 55.06 56.10 2no8 s HIS 46 Cb 0.00 -2.66 -0.18 0.00 -0.13 0.00 0.00 32.58 29.61 2no8 s HIS 46 CO 0.00 -0.01 1.64 -1.00 -2.47 0.00 0.00 174.74 172.89 2no8 h PRO 47 N 7.17 -0.63 -0.72 2.88 0.13 -1.90 -2.48 132.00 136.45 2no8 h PRO 47 Ca -0.36 0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 2no8 h PRO 47 Cb 1.16 0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.44 2no8 h PRO 47 CO 0.75 -0.41 0.00 -0.25 -0.23 0.00 0.00 178.00 177.86 2no8 n ASP 48 N -5.37 3.96 0.19 1.44 8.00 -1.26 -4.40 116.55 119.12 2no8 n ASP 48 Ca -0.12 -2.56 0.17 0.00 0.71 0.00 0.00 54.79 52.99 2no8 n ASP 48 Cb 0.28 -0.60 0.80 0.00 -0.02 0.00 0.00 41.12 41.58 2no8 n ASP 48 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 2no8 h GLY 49 N 4.42 0.00 0.00 0.44 0.00 -1.82 0.32 103.07 106.42 2no8 h GLY 49 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.27 2no8 h GLY 49 CO 0.30 0.00 -0.34 1.48 0.00 0.00 0.00 176.54 177.98 2no8 h SER 50 N 0.00 0.00 -0.97 0.19 4.64 -1.82 -3.37 113.55 112.21 2no8 h SER 50 Ca 0.10 -0.66 0.17 0.00 -0.47 0.00 0.00 61.79 60.93 2no8 h SER 50 Cb 0.50 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.49 2no8 h SER 50 CO -0.00 1.02 0.58 0.44 -0.87 0.00 0.00 176.83 178.00 2no8 h ASP 51 N -1.00 0.76 -0.87 4.97 5.19 -1.30 -1.30 116.42 122.86 2no8 h ASP 51 Ca -0.08 0.09 0.12 0.00 -0.62 0.00 0.00 57.03 56.53 2no8 h ASP 51 Cb 0.88 -0.05 -0.07 0.00 0.18 0.00 0.00 39.33 40.28 2no8 h ASP 51 CO -0.05 0.30 0.56 -0.07 -3.12 0.00 0.00 179.24 176.87 2no8 h LEU 52 N 0.78 0.70 -0.13 1.55 3.38 -0.61 0.64 115.31 121.62 2no8 h LEU 52 Ca 0.54 0.03 -0.23 0.00 0.09 0.00 0.00 57.88 58.32 2no8 h LEU 52 Cb 0.77 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 2no8 h LEU 52 CO -0.36 0.39 -0.99 0.40 0.09 0.00 0.00 178.44 177.97 2no8 h ILE 53 N 0.76 1.47 0.03 1.22 2.04 -1.41 -3.01 117.51 118.62 2no8 h ILE 53 Ca 0.42 -2.70 -0.29 0.00 1.00 0.00 0.00 64.86 63.29 2no8 h ILE 53 Cb 0.56 2.58 -0.04 0.00 -0.74 0.00 0.00 36.82 39.19 2no8 h ILE 53 CO -0.18 0.79 -1.57 1.88 0.00 0.00 0.00 178.15 179.07 2no8 h TYR 54 N 0.14 0.12 -2.13 1.37 0.05 -1.17 -3.43 116.97 111.93 2no8 h TYR 54 Ca -0.08 -0.09 -0.32 0.00 0.05 0.00 0.00 58.73 58.29 2no8 h TYR 54 Cb 1.65 -0.00 -0.33 0.00 1.01 0.00 0.00 36.73 39.06 2no8 h TYR 54 CO 0.05 1.14 -0.63 0.71 -1.05 0.00 0.00 178.16 178.38 2no8 s TYR 55 N -2.62 -0.50 -0.55 4.88 2.02 0.21 -5.08 117.35 115.72 2no8 s TYR 55 Ca -0.06 -0.13 -0.27 0.00 -0.37 0.00 0.00 57.07 56.24 2no8 s TYR 55 Cb 0.08 -0.44 -0.03 0.00 -0.40 0.00 0.00 41.96 41.17 2no8 s TYR 55 CO 0.82 -0.92 1.99 -2.14 -1.57 0.00 0.00 175.55 173.73 2no8 s PRO 56 N 2.37 2.59 0.00 -1.71 0.02 -1.14 -4.03 135.00 133.11 2no8 s PRO 56 Ca 0.09 0.90 0.00 0.00 0.02 0.00 0.00 61.00 62.02 2no8 s PRO 56 Cb -0.14 -4.41 0.00 0.00 0.02 0.00 0.00 34.50 29.97 2no8 s PRO 56 CO -0.32 -2.76 0.00 0.54 -0.33 0.00 0.00 177.00 174.13 2no8 n ARG 57 N 9.06 0.00 0.00 5.54 1.74 -1.26 -4.26 116.66 127.47 2no8 n ARG 57 Ca 0.25 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.33 2no8 n ARG 57 Cb 0.52 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.96 2no8 n ARG 57 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2no8 n ASP 58 N 0.00 0.89 0.07 0.55 2.03 -1.26 -4.73 116.55 114.09 2no8 n ASP 58 Ca 0.00 0.00 0.12 0.00 0.52 0.00 0.00 54.79 55.43 2no8 n ASP 58 Cb 0.00 0.00 0.46 0.00 -0.72 0.00 0.00 41.12 40.86 2no8 n ASP 58 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2no8 n ASP 59 N -2.83 0.43 -4.80 1.67 8.00 -1.26 -4.85 116.55 112.90 2no8 n ASP 59 Ca 0.00 0.57 -0.34 0.00 0.71 0.00 0.00 54.79 55.73 2no8 n ASP 59 Cb 0.46 -0.67 -0.03 0.00 -0.02 0.00 0.00 41.12 40.85 2no8 n ASP 59 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2no8 s ARG 60 N -3.12 3.80 0.37 -1.24 1.81 -1.26 -5.04 118.95 114.28 2no8 s ARG 60 Ca 0.09 1.36 -0.24 0.00 -1.72 0.00 0.00 55.73 55.21 2no8 s ARG 60 Cb 0.12 -2.10 -0.10 0.00 -0.45 0.00 0.00 34.95 32.43 2no8 s ARG 60 CO 0.46 -0.43 0.95 -2.00 -0.68 0.00 0.00 175.30 173.60 2no8 s GLU 61 N -3.24 4.43 -1.24 3.54 2.56 -1.26 -4.91 118.70 118.57 2no8 s GLU 61 Ca 0.67 1.26 -0.12 0.00 0.00 0.00 0.00 54.97 56.78 2no8 s GLU 61 Cb -0.16 -2.56 0.17 0.00 2.00 0.00 0.00 34.13 33.58 2no8 s GLU 61 CO 0.20 0.14 1.60 -3.47 -0.56 0.00 0.00 175.26 173.17 2no8 n ASP 62 N 0.08 5.17 -3.87 -1.70 2.03 -1.26 -4.55 116.55 112.45 2no8 n ASP 62 Ca 0.04 -3.03 -0.11 0.00 0.52 0.00 0.00 54.79 52.21 2no8 n ASP 62 Cb 0.51 -1.54 -0.11 0.00 -0.72 0.00 0.00 41.12 39.27 2no8 n ASP 62 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2no8 s SER 63 N 2.11 0.00 0.31 1.67 1.04 -1.26 -4.99 113.70 112.59 2no8 s SER 63 Ca 0.42 -0.11 0.08 0.00 0.48 0.00 0.00 55.95 56.82 2no8 s SER 63 Cb 0.02 0.22 0.89 0.00 0.10 0.00 0.00 66.02 67.25 2no8 s SER 63 CO 0.00 -0.28 1.66 -0.65 0.98 0.00 0.00 173.24 174.95 2no8 h PRO 64 N 4.73 0.28 -0.23 4.02 0.11 -1.94 0.37 132.00 139.33 2no8 h PRO 64 Ca -0.29 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.67 2no8 h PRO 64 Cb 1.20 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2no8 h PRO 64 CO 0.41 0.18 -0.40 0.93 -0.21 0.00 0.00 178.00 178.91 2no8 h GLU 65 N 0.29 0.55 0.00 1.05 5.08 -1.96 -2.84 114.58 116.75 2no8 h GLU 65 Ca 0.64 -0.28 -0.04 0.00 -1.00 0.00 0.00 59.36 58.68 2no8 h GLU 65 Cb 1.37 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.62 2no8 h GLU 65 CO -0.62 0.86 -0.19 0.78 -1.00 0.00 0.00 179.01 178.83 2no8 h GLY 66 N 1.06 0.00 1.14 -3.84 0.00 -1.23 -1.15 103.07 99.06 2no8 h GLY 66 Ca 0.04 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.19 2no8 h GLY 66 CO 0.08 0.00 -0.53 -2.22 0.00 0.00 0.00 176.54 173.87 2no8 h ILE 67 N 0.00 1.27 -0.16 2.60 2.04 -1.06 -2.94 117.51 119.26 2no8 h ILE 67 Ca -0.00 -1.71 -0.03 0.00 1.00 0.00 0.00 64.86 64.12 2no8 h ILE 67 Cb 0.37 1.60 -0.01 0.00 -0.74 0.00 0.00 36.82 38.04 2no8 h ILE 67 CO 0.03 0.56 -0.01 0.58 0.00 0.00 0.00 178.15 179.30 2no8 h VAL 68 N 0.68 1.12 -0.88 1.67 2.07 -1.05 -0.94 116.25 118.92 2no8 h VAL 68 Ca 0.02 -0.46 0.03 0.00 0.82 0.00 0.00 66.70 67.11 2no8 h VAL 68 Cb 1.14 1.01 -0.05 0.00 -1.52 0.00 0.00 31.29 31.87 2no8 h VAL 68 CO 0.12 0.15 0.58 0.50 0.02 0.00 0.00 177.57 178.94 2no8 h LYS 69 N 0.23 1.08 0.15 1.57 1.63 -1.08 0.42 116.57 120.58 2no8 h LYS 69 Ca 0.06 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 2no8 h LYS 69 Cb 0.19 -0.24 -0.01 0.00 -0.60 0.00 0.00 32.23 31.56 2no8 h LYS 69 CO 0.00 0.71 -0.15 0.93 -3.45 0.00 0.00 179.45 177.50 2no8 h GLU 70 N 1.11 -0.31 -0.24 1.90 4.39 -1.09 0.16 114.58 120.50 2no8 h GLU 70 Ca 0.35 0.02 0.00 0.00 0.34 0.00 0.00 59.36 60.07 2no8 h GLU 70 Cb 0.01 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.72 2no8 h GLU 70 CO -0.10 -0.21 0.15 0.82 -1.16 0.00 0.00 179.01 178.52 2no8 h ILE 71 N -0.32 1.07 0.18 3.13 5.03 -1.28 -1.43 117.51 123.90 2no8 h ILE 71 Ca 0.00 -0.15 0.01 0.00 -0.12 0.00 0.00 64.86 64.60 2no8 h ILE 71 Cb 0.30 0.74 -0.04 0.00 -3.03 0.00 0.00 36.82 34.79 2no8 h ILE 71 CO -0.03 0.07 -0.47 0.50 -0.68 0.00 0.00 178.15 177.53 2no8 h LYS 72 N 0.32 -0.72 -0.53 2.37 1.63 0.16 0.31 116.57 120.11 2no8 h LYS 72 Ca 0.09 0.05 -0.06 0.00 -0.85 0.00 0.00 60.65 59.88 2no8 h LYS 72 Cb -0.02 0.16 -0.02 0.00 -0.60 0.00 0.00 32.23 31.75 2no8 h LYS 72 CO -0.02 -0.48 0.09 0.93 -3.45 0.00 0.00 179.45 176.52 2no8 h GLU 73 N -0.75 0.83 0.20 1.90 4.39 -0.65 0.77 114.58 121.26 2no8 h GLU 73 Ca -0.00 -0.19 -0.01 0.00 0.34 0.00 0.00 59.36 59.50 2no8 h GLU 73 Cb 0.74 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.28 2no8 h GLU 73 CO -0.23 0.77 -0.09 2.35 -1.16 0.00 0.00 179.01 180.65 2no8 h TRP 74 N 0.79 -0.25 -0.93 4.33 7.01 -0.86 0.15 115.95 126.20 2no8 h TRP 74 Ca 0.17 -0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.19 2no8 h TRP 74 Cb 0.35 0.08 -0.05 0.00 -2.10 0.00 0.00 29.16 27.44 2no8 h TRP 74 CO 0.02 0.12 0.61 0.00 -2.79 0.00 0.00 178.44 176.39 2no8 h ARG 75 N -0.66 1.16 -0.30 2.65 2.47 -0.23 -0.00 114.38 119.47 2no8 h ARG 75 Ca -0.03 -0.07 -0.11 0.00 -1.26 0.00 0.00 59.98 58.51 2no8 h ARG 75 Cb 0.47 -0.26 -0.01 0.00 -1.65 0.00 0.00 29.97 28.52 2no8 h ARG 75 CO 0.04 0.77 -0.27 0.00 0.56 0.00 0.00 179.97 181.07 2no8 h ALA 76 N 1.37 0.97 0.03 0.04 0.00 -0.79 -0.20 119.26 120.67 2no8 h ALA 76 Ca 0.36 -0.37 -0.24 0.00 0.00 0.00 0.00 54.91 54.65 2no8 h ALA 76 Cb -0.04 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 2no8 h ALA 76 CO -0.11 0.60 -1.22 0.00 0.00 0.00 0.00 179.25 178.53 2no8 h ALA 77 N 1.18 0.39 0.00 0.00 0.00 -0.28 -2.99 119.26 117.57 2no8 h ALA 77 Ca 0.07 -1.04 0.00 0.00 0.00 0.00 0.00 54.91 53.94 2no8 h ALA 77 Cb 0.74 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2no8 h ALA 77 CO 0.06 1.27 0.00 0.09 0.00 0.00 0.00 179.25 180.67 2no8 n ASN 78 N -3.32 0.00 -0.79 0.00 5.03 -0.08 -4.87 115.26 111.23 2no8 n ASN 78 Ca -0.06 0.40 -0.08 0.00 0.87 0.00 0.00 54.58 55.71 2no8 n ASN 78 Cb 0.98 -0.46 -0.02 0.00 -1.02 0.00 0.00 39.78 39.26 2no8 n ASN 78 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2no8 n GLY 79 N 0.76 0.48 3.98 7.41 0.00 -1.02 -5.01 105.19 111.79 2no8 n GLY 79 Ca 0.06 -0.60 -0.23 0.00 0.00 0.00 0.00 46.02 45.26 2no8 n GLY 79 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2no8 s LYS 80 N -3.62 2.08 0.50 1.61 1.02 -0.12 -5.04 119.74 116.17 2no8 s LYS 80 Ca 0.00 -0.92 -0.22 0.00 0.02 0.00 0.00 55.97 54.84 2no8 s LYS 80 Cb 0.00 -2.39 -0.06 0.00 -0.52 0.00 0.00 37.83 34.86 2no8 s LYS 80 CO 0.00 -1.12 1.23 -1.12 -0.92 0.00 0.00 175.35 173.42 2no8 s SER 81 N -4.59 5.80 0.00 2.83 0.01 -1.26 -4.63 113.70 111.86 2no8 s SER 81 Ca 0.62 2.46 0.00 0.00 1.31 0.00 0.00 55.95 60.34 2no8 s SER 81 Cb -0.08 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.54 2no8 s SER 81 CO 0.42 -1.18 0.00 0.61 0.41 0.00 0.00 173.24 173.49 2no8 n GLY 82 N 0.53 4.51 3.90 3.44 0.00 -1.26 -4.83 105.19 111.49 2no8 n GLY 82 Ca 0.09 -2.15 -0.29 0.00 0.00 0.00 0.00 46.02 43.67 2no8 n GLY 82 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2no8 s PHE 83 N -0.08 2.97 -0.16 1.61 0.08 -1.26 -3.69 117.98 117.46 2no8 s PHE 83 Ca 0.00 0.72 -0.29 0.00 0.12 0.00 0.00 56.93 57.48 2no8 s PHE 83 Cb 0.00 -3.42 -0.02 0.00 -0.57 0.00 0.00 43.02 39.01 2no8 s PHE 83 CO 0.00 -1.68 1.38 0.21 -0.10 0.00 0.00 175.22 175.03 2no8 s LYS 84 N -5.51 4.16 -0.90 0.44 2.20 0.17 -4.89 119.74 115.41 2no8 s LYS 84 Ca 0.61 1.75 -0.25 0.00 -0.36 0.00 0.00 55.97 57.72 2no8 s LYS 84 Cb -0.11 -3.84 -0.08 0.00 -1.51 0.00 0.00 37.83 32.29 2no8 s LYS 84 CO 0.48 -0.82 2.07 1.14 -0.36 0.00 0.00 175.35 177.87 2no8 s GLN 85 N 3.76 2.25 0.00 4.03 0.00 -1.26 -4.01 119.66 124.43 2no8 s GLN 85 Ca 0.60 -0.16 0.02 0.00 -0.00 0.00 0.00 55.36 55.82 2no8 s GLN 85 Cb -0.24 -5.00 0.01 0.00 0.00 0.00 0.00 33.01 27.78 2no8 s GLN 85 CO 0.20 -3.79 0.55 0.41 0.00 0.00 0.00 175.29 172.66