#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 0.00 -4.80 -1.84 4.77 -1.26 -5.07 117.00 108.80 2no8 n LEU 3 Ca 0.00 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.76 2no8 n LEU 3 Cb 0.00 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.04 2no8 n LEU 3 CO 0.00 0.00 -0.11 -1.59 -1.33 0.00 0.00 177.39 174.36 2no8 s LYS 4 N -2.77 2.47 -0.14 3.23 0.00 -1.26 -5.05 119.74 116.23 2no8 s LYS 4 Ca 0.00 -1.54 0.19 0.00 0.00 0.00 0.00 55.97 54.62 2no8 s LYS 4 Cb 0.00 -2.27 -0.27 0.00 0.00 0.00 0.00 37.83 35.29 2no8 s LYS 4 CO 0.00 -0.02 0.22 -2.39 0.00 0.00 0.00 175.35 173.16 2no8 n HIS 5 N -1.33 0.07 -3.48 1.78 1.44 -1.26 -5.08 115.22 107.36 2no8 n HIS 5 Ca -0.00 0.02 -0.01 0.00 -2.01 0.00 0.00 57.72 55.72 2no8 n HIS 5 Cb 0.62 -0.88 0.00 0.00 0.12 0.00 0.00 29.99 29.85 2no8 n HIS 5 CO 0.00 0.00 0.00 -1.13 -2.81 0.00 0.00 176.34 172.40 2no8 n SER 6 N -2.64 -0.34 0.20 4.39 3.41 -1.26 -4.99 113.62 112.39 2no8 n SER 6 Ca -0.24 -1.19 0.04 0.00 -0.26 0.00 0.00 58.87 57.22 2no8 n SER 6 Cb 0.99 0.56 0.42 0.00 -0.26 0.00 0.00 64.21 65.92 2no8 n SER 6 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 2no8 h ILE 7 N 1.19 1.15 -0.01 -1.33 2.10 -1.94 -2.59 117.51 116.08 2no8 h ILE 7 Ca -0.05 -1.13 0.00 0.00 1.08 0.00 0.00 64.86 64.76 2no8 h ILE 7 Cb 0.23 1.62 0.00 0.00 -1.09 0.00 0.00 36.82 37.58 2no8 h ILE 7 CO 0.07 0.31 -0.04 -0.24 -1.08 0.00 0.00 178.15 177.17 2no8 n SER 8 N -4.04 0.59 0.07 2.19 2.88 -1.26 -2.39 113.62 111.66 2no8 n SER 8 Ca -0.02 -0.97 -0.14 0.00 -1.33 0.00 0.00 58.87 56.41 2no8 n SER 8 Cb 0.37 -0.03 -0.05 0.00 -0.75 0.00 0.00 64.21 63.75 2no8 n SER 8 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 2no8 h ASP 9 N 0.86 0.56 -3.97 -3.46 1.82 -1.79 -3.35 116.42 107.09 2no8 h ASP 9 Ca 0.00 -0.45 -0.49 0.00 -0.39 0.00 0.00 57.03 55.69 2no8 h ASP 9 Cb 0.28 -0.17 0.04 0.00 0.68 0.00 0.00 39.33 40.15 2no8 h ASP 9 CO 0.00 1.26 0.45 -0.31 -1.61 0.00 0.00 179.24 179.02 2no8 s TYR 10 N -3.24 3.12 0.61 0.28 1.51 -1.00 -4.78 117.35 113.84 2no8 s TYR 10 Ca -0.06 1.60 -0.05 0.00 -1.01 0.00 0.00 57.07 57.55 2no8 s TYR 10 Cb 0.09 -3.24 0.02 0.00 -0.11 0.00 0.00 41.96 38.72 2no8 s TYR 10 CO 0.87 -0.98 0.91 0.95 -1.11 0.00 0.00 175.55 176.19 2no8 s THR 11 N -1.59 3.22 0.24 -0.71 -4.23 -1.26 -0.71 115.64 110.60 2no8 s THR 11 Ca 0.59 -0.15 -0.05 0.00 -1.18 0.00 0.00 61.69 60.91 2no8 s THR 11 Cb -0.25 -3.29 0.20 0.00 1.34 0.00 0.00 72.50 70.50 2no8 s THR 11 CO 0.31 -0.29 1.78 -0.08 -0.54 0.00 0.00 174.62 175.79 2no8 h GLU 12 N -0.24 0.62 -0.24 3.99 4.81 -1.43 0.97 114.58 123.05 2no8 h GLU 12 Ca -0.45 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 58.72 2no8 h GLU 12 Cb 1.28 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.51 2no8 h GLU 12 CO 0.60 0.41 0.05 0.00 -0.73 0.00 0.00 179.01 179.33 2no8 h ALA 13 N 1.48 0.32 -0.42 2.92 0.00 -1.93 0.73 119.26 122.36 2no8 h ALA 13 Ca 0.39 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 2no8 h ALA 13 Cb 0.46 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2no8 h ALA 13 CO -0.30 -0.01 -0.12 0.93 0.00 0.00 0.00 179.25 179.75 2no8 h GLU 14 N 0.21 0.75 -0.08 0.00 4.39 -1.77 -1.20 114.58 116.89 2no8 h GLU 14 Ca 0.07 -0.25 -0.14 0.00 0.34 0.00 0.00 59.36 59.38 2no8 h GLU 14 Cb 0.31 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.88 2no8 h GLU 14 CO 0.00 0.84 -0.58 0.35 -1.16 0.00 0.00 179.01 178.46 2no8 h PHE 15 N 0.68 0.32 0.00 4.33 3.04 -0.75 -2.20 116.94 122.36 2no8 h PHE 15 Ca 0.11 -0.12 0.00 0.00 3.98 0.00 0.00 57.97 61.95 2no8 h PHE 15 Cb 0.59 -0.06 0.00 0.00 2.56 0.00 0.00 35.95 39.04 2no8 h PHE 15 CO 0.03 0.77 0.00 1.25 -2.02 0.00 0.00 178.31 178.34 2no8 h LEU 16 N 0.19 0.00 -0.17 0.59 6.46 -0.15 0.31 115.31 122.54 2no8 h LEU 16 Ca -0.00 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.75 2no8 h LEU 16 Cb 1.08 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.01 2no8 h LEU 16 CO 0.09 0.00 -0.02 -0.33 -0.62 0.00 0.00 178.44 177.56 2no8 h GLU 17 N 0.00 0.00 -0.35 1.25 4.39 -0.62 -3.28 114.58 115.97 2no8 h GLU 17 Ca 0.00 0.00 0.07 0.00 0.34 0.00 0.00 59.36 59.77 2no8 h GLU 17 Cb 0.47 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.05 2no8 h GLU 17 CO 0.00 0.02 -0.09 0.27 -1.16 0.00 0.00 179.01 178.05 2no8 h PHE 18 N 0.00 -0.19 -0.18 4.33 -0.00 -0.04 0.53 116.94 121.39 2no8 h PHE 18 Ca -0.00 0.03 -0.19 0.00 -0.00 0.00 0.00 57.97 57.81 2no8 h PHE 18 Cb 0.96 0.14 0.00 0.00 -0.00 0.00 0.00 35.95 37.05 2no8 h PHE 18 CO 0.00 -0.15 -0.66 -0.24 -0.00 0.00 0.00 178.31 177.26 2no8 h VAL 19 N -0.00 1.31 -0.53 0.88 3.04 -1.66 -2.37 116.25 116.92 2no8 h VAL 19 Ca 0.17 -1.90 -0.09 0.00 -1.01 0.00 0.00 66.70 63.87 2no8 h VAL 19 Cb 0.26 1.86 -0.02 0.00 -2.01 0.00 0.00 31.29 31.38 2no8 h VAL 19 CO -0.36 0.60 -0.01 0.11 -1.01 0.00 0.00 177.57 176.89 2no8 h LYS 20 N 0.50 0.91 -0.49 4.17 1.57 -1.42 0.08 116.57 121.88 2no8 h LYS 20 Ca -0.02 -0.27 -0.07 0.00 -1.87 0.00 0.00 60.65 58.42 2no8 h LYS 20 Cb 1.25 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 33.45 2no8 h LYS 20 CO 0.13 0.91 0.02 0.87 -0.57 0.00 0.00 179.45 180.81 2no8 h LYS 21 N 0.84 0.81 -0.26 3.15 1.57 -0.72 -2.11 116.57 119.84 2no8 h LYS 21 Ca 0.15 -0.21 -0.11 0.00 -1.87 0.00 0.00 60.65 58.61 2no8 h LYS 21 Cb 0.51 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 2no8 h LYS 21 CO 0.03 0.80 -0.30 0.82 -0.57 0.00 0.00 179.45 180.23 2no8 h ILE 22 N 0.76 1.28 -0.34 1.86 2.04 -0.88 -1.94 117.51 120.29 2no8 h ILE 22 Ca 0.15 -1.37 0.03 0.00 1.00 0.00 0.00 64.86 64.67 2no8 h ILE 22 Cb 0.43 1.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.89 2no8 h ILE 22 CO 0.02 0.44 0.23 0.00 0.00 0.00 0.00 178.15 178.83 2no8 n ARG 24 N -4.49 2.54 -0.16 0.00 1.85 -0.92 -4.48 116.66 111.02 2no8 n ARG 24 Ca 0.03 -2.35 0.02 0.00 -1.00 0.00 0.00 57.85 54.55 2no8 n ARG 24 Cb 0.15 -1.53 0.09 0.00 -1.05 0.00 0.00 32.46 30.12 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 1.51 2.67 1.18 2.89 0.00 -0.37 -3.52 120.51 124.88 2no8 n ALA 25 Ca 0.21 -0.38 0.04 0.00 0.00 0.00 0.00 53.44 53.31 2no8 n ALA 25 Cb 0.61 -1.01 0.12 0.00 0.00 0.00 0.00 19.45 19.16 2no8 n ALA 25 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2no8 n GLU 26 N 0.08 1.59 0.00 0.00 0.28 -1.26 -2.58 120.64 118.76 2no8 n GLU 26 Ca 0.06 -0.92 0.00 0.00 -0.16 0.00 0.00 57.16 56.14 2no8 n GLU 26 Cb 0.33 -1.20 0.00 0.00 1.43 0.00 0.00 31.44 32.00 2no8 n GLU 26 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2no8 n GLY 27 N 0.91 -2.62 0.06 -1.84 0.00 -1.23 -4.24 105.19 96.23 2no8 n GLY 27 Ca 0.09 0.07 -0.02 0.00 0.00 0.00 0.00 46.02 46.16 2no8 n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2no8 h ALA 28 N -1.91 -0.61 -2.84 4.61 0.00 -1.92 -3.49 119.26 113.10 2no8 h ALA 28 Ca 0.00 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.93 2no8 h ALA 28 Cb 0.00 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2no8 h ALA 28 CO 0.00 -0.60 0.36 0.99 0.00 0.00 0.00 179.25 180.01 2no8 s THR 29 N -2.48 0.00 -0.12 0.00 2.01 -1.26 -5.01 115.64 108.79 2no8 s THR 29 Ca -0.02 -0.87 0.25 0.00 0.31 0.00 0.00 61.69 61.35 2no8 s THR 29 Cb 0.00 -2.75 0.25 0.00 0.01 0.00 0.00 72.50 70.01 2no8 s THR 29 CO 0.06 0.00 1.75 1.05 -0.69 0.00 0.00 174.62 176.79 2no8 h GLU 30 N 2.00 0.00 -0.13 4.92 4.11 -1.86 0.12 114.58 123.74 2no8 h GLU 30 Ca -0.29 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.13 2no8 h GLU 30 Cb 1.24 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 2no8 h GLU 30 CO 0.37 0.00 0.05 1.05 0.07 0.00 0.00 179.01 180.55 2no8 h GLU 31 N 0.00 0.18 -0.00 1.06 4.11 -1.95 -0.18 114.58 117.79 2no8 h GLU 31 Ca 0.00 -0.01 -0.17 0.00 0.07 0.00 0.00 59.36 59.24 2no8 h GLU 31 Cb 0.03 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2no8 h GLU 31 CO 0.00 0.15 -0.79 0.22 0.07 0.00 0.00 179.01 178.66 2no8 h ASP 32 N 0.18 0.11 0.53 3.06 3.58 -1.14 -1.44 116.42 121.31 2no8 h ASP 32 Ca 0.05 -0.08 -0.03 0.00 0.42 0.00 0.00 57.03 57.39 2no8 h ASP 32 Cb 0.04 -0.03 0.01 0.00 1.72 0.00 0.00 39.33 41.06 2no8 h ASP 32 CO -0.01 0.85 -0.26 0.44 -2.88 0.00 0.00 179.24 177.39 2no8 h ASP 33 N 0.05 -0.61 -0.90 2.28 3.32 -1.12 -3.31 116.42 116.13 2no8 h ASP 33 Ca -0.02 -0.03 0.11 0.00 0.02 0.00 0.00 57.03 57.11 2no8 h ASP 33 Cb 1.38 0.16 -0.08 0.00 0.22 0.00 0.00 39.33 41.01 2no8 h ASP 33 CO 0.11 -0.21 0.53 -1.13 -1.72 0.00 0.00 179.24 176.82 2no8 h ASN 34 N -1.11 0.76 0.21 6.45 -1.24 -0.98 -0.13 115.58 119.54 2no8 h ASN 34 Ca -0.07 0.05 -0.04 0.00 0.71 0.00 0.00 56.30 56.95 2no8 h ASN 34 Cb 0.60 -0.10 -0.01 0.00 0.73 0.00 0.00 38.32 39.55 2no8 h ASN 34 CO 0.12 0.41 -0.17 0.07 -1.29 0.00 0.00 177.43 176.57 2no8 h LYS 35 N 0.86 0.00 0.00 6.67 2.10 -1.38 0.32 116.57 125.14 2no8 h LYS 35 Ca 0.45 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 59.06 2no8 h LYS 35 Cb 0.44 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.78 2no8 h LYS 35 CO -0.27 0.17 -0.13 -0.07 -2.00 0.00 0.00 179.45 177.16 2no8 h LEU 36 N 0.00 0.11 -1.06 7.07 3.38 -1.19 -3.20 115.31 120.41 2no8 h LEU 36 Ca -0.00 -0.81 0.09 0.00 0.09 0.00 0.00 57.88 57.25 2no8 h LEU 36 Cb 0.32 -0.03 -0.07 0.00 0.09 0.00 0.00 40.66 40.97 2no8 h LEU 36 CO 0.02 0.90 0.63 0.58 0.09 0.00 0.00 178.44 180.66 2no8 h VAL 37 N -0.67 1.02 0.07 1.22 2.07 -0.23 -1.64 116.25 118.10 2no8 h VAL 37 Ca -0.02 -0.36 -0.00 0.00 0.82 0.00 0.00 66.70 67.14 2no8 h VAL 37 Cb 0.92 -0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 2no8 h VAL 37 CO 0.03 0.19 -0.04 0.03 0.02 0.00 0.00 177.57 177.80 2no8 h ARG 38 N 1.06 -0.10 -0.53 1.57 2.47 -0.48 0.36 114.38 118.73 2no8 h ARG 38 Ca 0.44 0.01 -0.05 0.00 -1.26 0.00 0.00 59.98 59.12 2no8 h ARG 38 Cb 0.30 0.02 -0.02 0.00 -1.65 0.00 0.00 29.97 28.62 2no8 h ARG 38 CO -0.20 -0.05 0.13 1.05 0.56 0.00 0.00 179.97 181.47 2no8 h GLU 39 N -0.11 0.85 -0.36 0.04 4.11 -1.40 -1.26 114.58 116.44 2no8 h GLU 39 Ca -0.01 -0.20 -0.10 0.00 0.07 0.00 0.00 59.36 59.11 2no8 h GLU 39 Cb 0.09 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 2no8 h GLU 39 CO 0.02 0.80 -0.18 0.74 0.07 0.00 0.00 179.01 180.45 2no8 h PHE 40 N 0.74 0.88 0.00 2.06 0.04 -1.17 -2.35 116.94 117.14 2no8 h PHE 40 Ca 0.17 -0.22 0.00 0.00 2.80 0.00 0.00 57.97 60.72 2no8 h PHE 40 Cb 0.33 -0.20 0.00 0.00 2.20 0.00 0.00 35.95 38.28 2no8 h PHE 40 CO 0.02 0.96 0.00 0.93 -0.60 0.00 0.00 178.31 179.62 2no8 h GLU 41 N 0.55 0.00 0.06 1.51 4.39 -0.10 0.39 114.58 121.37 2no8 h GLU 41 Ca 0.08 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.52 2no8 h GLU 41 Cb 0.73 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.39 2no8 h GLU 41 CO 0.05 0.00 -1.09 -0.09 -1.16 0.00 0.00 179.01 176.73 2no8 h ARG 42 N 0.00 0.45 -0.03 2.33 2.43 -0.93 -2.23 114.38 116.41 2no8 h ARG 42 Ca 0.00 -0.56 -0.05 0.00 -0.81 0.00 0.00 59.98 58.56 2no8 h ARG 42 Cb 0.42 0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.15 2no8 h ARG 42 CO 0.00 1.21 -0.18 -0.07 -1.51 0.00 0.00 179.97 179.42 2no8 h LEU 43 N 0.22 0.20 -0.44 3.80 3.38 -0.64 -3.32 115.31 118.51 2no8 h LEU 43 Ca -0.12 -0.69 -0.09 0.00 0.09 0.00 0.00 57.88 57.07 2no8 h LEU 43 Cb 1.75 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.43 2no8 h LEU 43 CO 0.19 0.86 -0.06 0.71 0.09 0.00 0.00 178.44 180.23 2no8 h THR 44 N -0.44 1.27 -5.21 0.22 1.35 -0.41 -3.42 112.91 106.27 2no8 h THR 44 Ca -0.02 -1.14 -0.39 0.00 -0.55 0.00 0.00 66.41 64.31 2no8 h THR 44 Cb 0.86 1.11 0.11 0.00 -1.73 0.00 0.00 68.15 68.50 2no8 h THR 44 CO 0.04 0.39 -0.63 1.21 -0.25 0.00 0.00 175.52 176.27 2no8 n GLU 45 N -4.32 -6.69 -3.37 4.72 2.13 -0.84 -4.95 120.64 107.32 2no8 n GLU 45 Ca -0.00 0.83 -0.38 0.00 0.66 0.00 0.00 57.16 58.27 2no8 n GLU 45 Cb 0.34 -5.75 -0.07 0.00 0.27 0.00 0.00 31.44 26.23 2no8 n GLU 45 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 2no8 s HIS 46 N -3.26 3.37 0.29 4.31 2.46 -1.26 -4.97 115.29 116.24 2no8 s HIS 46 Ca 0.47 0.63 0.01 0.00 0.47 0.00 0.00 55.06 56.64 2no8 s HIS 46 Cb -0.21 -2.55 0.54 0.00 -0.13 0.00 0.00 32.58 30.24 2no8 s HIS 46 CO 0.58 -0.03 1.88 -1.00 -2.47 0.00 0.00 174.74 173.70 2no8 h PRO 47 N 7.42 0.99 -0.16 2.88 0.13 -1.95 -0.21 132.00 141.10 2no8 h PRO 47 Ca -0.35 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 2no8 h PRO 47 Cb 1.16 -0.22 0.00 0.00 0.13 0.00 0.00 31.00 32.07 2no8 h PRO 47 CO 0.72 0.65 0.00 -0.25 -0.23 0.00 0.00 178.00 178.89 2no8 n ASP 48 N -4.54 2.97 -0.12 1.44 8.00 -1.26 -4.76 116.55 118.28 2no8 n ASP 48 Ca 0.16 -2.71 -0.05 0.00 0.71 0.00 0.00 54.79 52.90 2no8 n ASP 48 Cb 0.28 -0.37 0.02 0.00 -0.02 0.00 0.00 41.12 41.02 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 1.02 0.32 1.05 0.44 0.00 -1.43 0.54 103.07 105.01 2no8 h GLY 49 Ca 0.00 0.10 -0.09 0.00 0.00 0.00 0.00 47.33 47.34 2no8 h GLY 49 CO 0.08 -0.14 -0.04 1.76 0.00 0.00 0.00 176.54 178.21 2no8 h SER 50 N 0.03 0.95 -0.69 0.19 0.02 -1.86 -2.73 113.55 109.47 2no8 h SER 50 Ca 0.19 -0.32 -0.00 0.00 -0.84 0.00 0.00 61.79 60.81 2no8 h SER 50 Cb 0.29 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.53 2no8 h SER 50 CO -0.38 1.05 0.42 0.44 -1.14 0.00 0.00 176.83 177.22 2no8 h ASP 51 N 0.83 0.83 -0.79 3.07 3.32 -1.49 -2.60 116.42 119.60 2no8 h ASP 51 Ca 0.15 -0.04 0.19 0.00 0.02 0.00 0.00 57.03 57.34 2no8 h ASP 51 Cb 0.58 -0.21 -0.05 0.00 0.22 0.00 0.00 39.33 39.88 2no8 h ASP 51 CO 0.04 0.64 0.54 -0.07 -1.72 0.00 0.00 179.24 178.66 2no8 h LEU 52 N 0.96 0.27 0.13 1.55 3.38 0.34 0.70 115.31 122.64 2no8 h LEU 52 Ca 0.25 0.02 -0.29 0.00 0.09 0.00 0.00 57.88 57.95 2no8 h LEU 52 Cb -0.04 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.68 2no8 h LEU 52 CO -0.05 0.12 -1.40 0.40 0.09 0.00 0.00 178.44 177.61 2no8 h ILE 53 N 0.27 1.32 0.04 1.22 2.04 -1.52 -3.38 117.51 117.50 2no8 h ILE 53 Ca 0.39 -2.91 -0.23 0.00 1.00 0.00 0.00 64.86 63.10 2no8 h ILE 53 Cb 1.12 2.86 -0.02 0.00 -0.74 0.00 0.00 36.82 40.04 2no8 h ILE 53 CO -0.10 0.85 -1.26 1.88 0.00 0.00 0.00 178.15 179.52 2no8 h TYR 54 N 0.08 0.15 -3.17 1.37 0.05 -1.11 -3.45 116.97 110.88 2no8 h TYR 54 Ca -0.19 -0.11 -0.60 0.00 0.05 0.00 0.00 58.73 57.88 2no8 h TYR 54 Cb 2.01 -0.01 -0.36 0.00 1.01 0.00 0.00 36.73 39.38 2no8 h TYR 54 CO 0.07 1.49 -0.83 0.71 -1.05 0.00 0.00 178.16 178.55 2no8 s TYR 55 N -2.40 2.16 0.90 4.88 2.02 0.23 -5.11 117.35 120.03 2no8 s TYR 55 Ca -0.25 -1.24 -0.12 0.00 -0.37 0.00 0.00 57.07 55.08 2no8 s TYR 55 Cb 0.05 -1.58 0.13 0.00 -0.40 0.00 0.00 41.96 40.16 2no8 s TYR 55 CO 0.66 -0.67 1.11 -1.25 -1.57 0.00 0.00 175.55 173.83 2no8 s PRO 56 N 1.49 1.24 0.00 -1.71 0.04 -1.26 -3.99 135.00 130.81 2no8 s PRO 56 Ca 0.04 0.48 0.00 0.00 0.04 0.00 0.00 61.00 61.56 2no8 s PRO 56 Cb -0.13 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.57 2no8 s PRO 56 CO -0.10 -2.17 0.00 0.54 0.04 0.00 0.00 177.00 175.31 2no8 n ARG 57 N -3.78 0.00 0.01 4.56 1.74 -1.26 -5.06 116.66 112.87 2no8 n ARG 57 Ca 0.06 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 2no8 n ARG 57 Cb 0.58 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.02 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 0.15 0.07 0.55 2.03 -1.26 -4.92 116.55 113.16 2no8 n ASP 58 Ca 0.00 0.03 0.11 0.00 0.52 0.00 0.00 54.79 55.46 2no8 n ASP 58 Cb 0.00 -0.03 -0.03 0.00 -0.72 0.00 0.00 41.12 40.34 2no8 n ASP 58 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2no8 n ASP 59 N -2.67 0.63 -4.74 1.67 2.03 -1.26 -4.92 116.55 107.28 2no8 n ASP 59 Ca 0.00 0.17 -0.33 0.00 0.52 0.00 0.00 54.79 55.15 2no8 n ASP 59 Cb 0.00 0.82 0.09 0.00 -0.72 0.00 0.00 41.12 41.30 2no8 n ASP 59 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2no8 s ARG 60 N -3.36 2.26 -0.21 -0.67 1.04 -1.26 -4.89 118.95 111.85 2no8 s ARG 60 Ca -0.01 1.52 -0.29 0.00 -1.04 0.00 0.00 55.73 55.91 2no8 s ARG 60 Cb 0.11 -1.87 -0.03 0.00 -2.04 0.00 0.00 34.95 31.12 2no8 s ARG 60 CO 0.81 -1.69 1.61 -2.00 -0.04 0.00 0.00 175.30 173.99 2no8 s GLU 61 N -4.20 3.83 -1.19 3.89 2.12 -1.26 -4.89 118.70 117.00 2no8 s GLU 61 Ca 0.69 1.70 -0.20 0.00 0.36 0.00 0.00 54.97 57.51 2no8 s GLU 61 Cb -0.23 -4.03 0.05 0.00 0.26 0.00 0.00 34.13 30.17 2no8 s GLU 61 CO 0.47 -1.26 1.68 0.34 -0.54 0.00 0.00 175.26 175.95 2no8 s ASP 62 N 4.15 6.51 0.15 -1.70 -1.08 -1.26 -3.92 116.67 119.52 2no8 s ASP 62 Ca 0.71 -2.00 -0.10 0.00 -0.52 0.00 0.00 52.55 50.64 2no8 s ASP 62 Cb -0.25 -2.58 -0.00 0.00 -1.46 0.00 0.00 42.92 38.63 2no8 s ASP 62 CO 0.29 -1.50 0.29 -0.94 0.52 0.00 0.00 175.17 173.83 2no8 s SER 63 N 4.81 0.02 0.48 -0.34 1.04 -1.26 -4.96 113.70 113.49 2no8 s SER 63 Ca 0.53 -0.77 0.16 0.00 0.48 0.00 0.00 55.95 56.35 2no8 s SER 63 Cb 0.02 0.43 1.16 0.00 0.10 0.00 0.00 66.02 67.73 2no8 s SER 63 CO 0.03 -0.88 2.06 -0.65 0.98 0.00 0.00 173.24 174.78 2no8 h PRO 64 N 2.54 0.20 -0.15 4.02 0.11 -1.93 -1.52 132.00 135.28 2no8 h PRO 64 Ca -0.32 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.76 2no8 h PRO 64 Cb 1.23 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 2no8 h PRO 64 CO 0.49 0.13 0.03 0.93 -0.21 0.00 0.00 178.00 179.37 2no8 h GLU 65 N 0.21 0.24 0.00 1.05 5.08 -1.91 -2.88 114.58 116.37 2no8 h GLU 65 Ca 0.15 -0.06 -0.08 0.00 -1.00 0.00 0.00 59.36 58.38 2no8 h GLU 65 Cb 0.34 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 2no8 h GLU 65 CO -0.03 0.41 -0.36 0.78 -1.00 0.00 0.00 179.01 178.81 2no8 h GLY 66 N 0.03 0.00 0.91 -3.84 0.00 -1.48 0.24 103.07 98.93 2no8 h GLY 66 Ca 0.05 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.28 2no8 h GLY 66 CO 0.00 0.00 -0.20 -2.22 0.00 0.00 0.00 176.54 174.12 2no8 h ILE 67 N 0.00 1.31 -0.56 2.60 2.04 -1.28 -0.76 117.51 120.86 2no8 h ILE 67 Ca -0.00 -1.34 -0.06 0.00 1.00 0.00 0.00 64.86 64.46 2no8 h ILE 67 Cb 0.74 1.58 -0.03 0.00 -0.74 0.00 0.00 36.82 38.38 2no8 h ILE 67 CO 0.05 0.42 0.12 0.58 0.00 0.00 0.00 178.15 179.32 2no8 h VAL 68 N 0.34 1.24 -0.72 1.67 2.07 -1.26 -2.16 116.25 117.42 2no8 h VAL 68 Ca 0.05 -0.88 0.00 0.00 0.82 0.00 0.00 66.70 66.69 2no8 h VAL 68 Cb 0.75 0.68 -0.04 0.00 -1.52 0.00 0.00 31.29 31.16 2no8 h VAL 68 CO 0.05 0.33 0.46 0.50 0.02 0.00 0.00 177.57 178.93 2no8 h LYS 69 N 0.84 0.96 -0.69 1.57 1.63 -0.32 0.21 116.57 120.77 2no8 h LYS 69 Ca 0.18 -0.07 -0.03 0.00 -0.85 0.00 0.00 60.65 59.88 2no8 h LYS 69 Cb 0.34 -0.21 -0.03 0.00 -0.60 0.00 0.00 32.23 31.72 2no8 h LYS 69 CO 0.00 0.66 0.33 1.49 -3.45 0.00 0.00 179.45 178.48 2no8 h GLU 70 N 0.99 1.00 0.02 1.90 4.57 -0.49 0.26 114.58 122.82 2no8 h GLU 70 Ca 0.26 -0.15 -0.00 0.00 -1.18 0.00 0.00 59.36 58.29 2no8 h GLU 70 Cb -0.08 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 28.33 2no8 h GLU 70 CO -0.05 0.79 -0.01 0.82 -1.18 0.00 0.00 179.01 179.38 2no8 h ILE 71 N 0.97 1.23 0.36 2.32 1.08 -0.97 -2.52 117.51 119.97 2no8 h ILE 71 Ca 0.24 -0.77 -0.00 0.00 -0.39 0.00 0.00 64.86 63.93 2no8 h ILE 71 Cb 0.13 1.75 -0.03 0.00 -3.07 0.00 0.00 36.82 35.59 2no8 h ILE 71 CO -0.03 0.20 -0.44 0.50 -0.69 0.00 0.00 178.15 177.69 2no8 h LYS 72 N -0.36 -0.80 -0.04 2.37 3.64 -0.25 0.24 116.57 121.36 2no8 h LYS 72 Ca -0.00 0.05 -0.11 0.00 -1.27 0.00 0.00 60.65 59.33 2no8 h LYS 72 Cb 0.35 0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.34 2no8 h LYS 72 CO 0.00 -0.53 -0.46 0.93 -2.27 0.00 0.00 179.45 177.12 2no8 h GLU 73 N -0.83 0.10 -0.00 1.90 4.39 -0.60 -0.39 114.58 119.14 2no8 h GLU 73 Ca -0.03 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.62 2no8 h GLU 73 Cb 0.76 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.41 2no8 h GLU 73 CO -0.11 0.54 -0.02 2.35 -1.16 0.00 0.00 179.01 180.61 2no8 h TRP 74 N 0.08 0.03 -0.23 4.33 7.01 -1.22 -1.81 115.95 124.13 2no8 h TRP 74 Ca 0.00 -0.01 -0.07 0.00 2.11 0.00 0.00 58.89 60.93 2no8 h TRP 74 Cb 0.85 -0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.89 2no8 h TRP 74 CO 0.01 0.65 -0.14 0.00 -2.79 0.00 0.00 178.44 176.16 2no8 h ARG 75 N -0.61 0.39 -0.26 2.65 3.08 -0.42 0.15 114.38 119.35 2no8 h ARG 75 Ca -0.00 -0.11 -0.11 0.00 0.07 0.00 0.00 59.98 59.83 2no8 h ARG 75 Cb 0.65 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.65 2no8 h ARG 75 CO 0.00 0.53 -0.32 0.00 -1.07 0.00 0.00 179.97 179.12 2no8 h ALA 76 N 1.49 0.96 0.00 0.04 0.00 -1.10 0.12 119.26 120.77 2no8 h ALA 76 Ca 0.07 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 2no8 h ALA 76 Cb 0.47 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 2no8 h ALA 76 CO 0.03 0.61 -0.33 0.00 0.00 0.00 0.00 179.25 179.56 2no8 h ALA 77 N 1.18 0.84 -0.00 0.00 0.00 -0.62 -3.25 119.26 117.41 2no8 h ALA 77 Ca 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2no8 h ALA 77 Cb 0.79 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2no8 h ALA 77 CO 0.06 0.07 -0.50 -1.71 0.00 0.00 0.00 179.25 177.17 2no8 n ASN 78 N -3.00 0.78 -0.06 0.00 2.85 0.46 -4.93 115.26 111.36 2no8 n ASN 78 Ca 0.02 -0.58 -0.01 0.00 -0.11 0.00 0.00 54.58 53.90 2no8 n ASN 78 Cb 0.56 0.33 -0.00 0.00 1.24 0.00 0.00 39.78 41.91 2no8 n ASN 78 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2no8 n GLY 79 N 1.45 0.41 3.96 8.20 0.00 -0.75 -5.03 105.19 113.43 2no8 n GLY 79 Ca 0.07 -1.01 -0.22 0.00 0.00 0.00 0.00 46.02 44.86 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 -2.57 2.45 1.06 1.61 1.02 0.34 -5.04 119.74 118.62 2no8 s LYS 80 Ca 0.00 -0.65 -0.13 0.00 0.02 0.00 0.00 55.97 55.20 2no8 s LYS 80 Cb 0.00 -2.41 0.22 0.00 -0.52 0.00 0.00 37.83 35.12 2no8 s LYS 80 CO 0.00 -0.85 1.08 0.45 -0.92 0.00 0.00 175.35 175.11 2no8 s SER 81 N -4.45 2.06 0.06 2.83 0.15 -1.26 -4.55 113.70 108.54 2no8 s SER 81 Ca 0.58 1.17 0.01 0.00 0.70 0.00 0.00 55.95 58.40 2no8 s SER 81 Cb -0.10 -1.83 -0.00 0.00 -1.71 0.00 0.00 66.02 62.38 2no8 s SER 81 CO 0.40 -3.48 0.02 0.61 1.20 0.00 0.00 173.24 171.99 2no8 n GLY 82 N -0.71 4.00 3.97 9.45 0.00 -1.26 -4.77 105.19 115.86 2no8 n GLY 82 Ca 0.05 -1.98 -0.23 0.00 0.00 0.00 0.00 46.02 43.86 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 -1.70 2.51 0.28 1.61 0.08 -1.26 -4.16 117.98 115.33 2no8 s PHE 83 Ca 0.03 0.04 -0.02 0.00 0.12 0.00 0.00 56.93 57.10 2no8 s PHE 83 Cb 0.00 -2.97 -0.04 0.00 -0.57 0.00 0.00 43.02 39.44 2no8 s PHE 83 CO 0.02 -1.28 0.50 0.21 -0.10 0.00 0.00 175.22 174.57 2no8 s LYS 84 N -5.02 3.55 -0.04 0.44 2.20 0.12 -4.86 119.74 116.13 2no8 s LYS 84 Ca 0.61 -0.22 0.02 0.00 -0.36 0.00 0.00 55.97 56.02 2no8 s LYS 84 Cb -0.09 -2.71 0.01 0.00 -1.51 0.00 0.00 37.83 33.53 2no8 s LYS 84 CO 0.42 0.25 -0.07 1.14 -0.36 0.00 0.00 175.35 176.73 2no8 s GLN 85 N -3.72 0.95 0.00 4.03 0.00 -1.26 -1.07 119.66 118.58 2no8 s GLN 85 Ca 0.41 -0.23 0.00 0.00 -0.00 0.00 0.00 55.36 55.54 2no8 s GLN 85 Cb -0.10 -0.89 0.00 0.00 0.00 0.00 0.00 33.01 32.02 2no8 s GLN 85 CO 0.32 0.03 0.00 0.41 0.00 0.00 0.00 175.29 176.05