#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2no8 s LEU 3 N 0.00 2.51 0.22 4.31 1.43 -1.26 -5.16 118.68 120.72 2no8 s LEU 3 Ca 0.00 -1.04 0.12 0.00 -1.03 0.00 0.00 54.13 52.18 2no8 s LEU 3 Cb 0.00 -0.44 -0.05 0.00 0.03 0.00 0.00 46.19 45.73 2no8 s LEU 3 CO 0.00 -0.30 -0.23 -1.59 0.23 0.00 0.00 176.35 174.46 2no8 s LYS 4 N -3.73 1.57 -0.08 1.70 0.00 -1.26 -5.03 119.74 112.91 2no8 s LYS 4 Ca 0.20 -1.59 0.13 0.00 0.00 0.00 0.00 55.97 54.71 2no8 s LYS 4 Cb 0.02 -1.83 -0.24 0.00 0.00 0.00 0.00 37.83 35.79 2no8 s LYS 4 CO 0.03 0.38 0.51 -2.39 0.00 0.00 0.00 175.35 173.89 2no8 n HIS 5 N 0.02 0.77 -2.96 1.78 1.44 -1.26 -5.05 115.22 109.96 2no8 n HIS 5 Ca -0.10 0.27 0.00 0.00 -2.01 0.00 0.00 57.72 55.88 2no8 n HIS 5 Cb 0.57 -1.14 0.00 0.00 0.12 0.00 0.00 29.99 29.54 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 -2.99 0.00 0.14 4.39 3.41 -1.26 -5.00 113.62 112.31 2no8 n SER 6 Ca -0.21 -0.87 0.04 0.00 -0.26 0.00 0.00 58.87 57.57 2no8 n SER 6 Cb 1.08 0.00 0.46 0.00 -0.26 0.00 0.00 64.21 65.49 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 0.87 1.12 0.00 -1.33 2.10 -1.88 -2.35 117.51 116.04 2no8 h ILE 7 Ca 0.00 -0.49 0.00 0.00 1.08 0.00 0.00 64.86 65.45 2no8 h ILE 7 Cb 0.00 1.06 0.00 0.00 -1.09 0.00 0.00 36.82 36.79 2no8 h ILE 7 CO 0.00 0.16 0.00 -0.24 -1.08 0.00 0.00 178.15 176.99 2no8 n SER 8 N -4.37 0.00 0.14 2.19 2.88 -1.21 -1.42 113.62 111.82 2no8 n SER 8 Ca -0.01 0.28 0.12 0.00 -1.33 0.00 0.00 58.87 57.93 2no8 n SER 8 Cb 0.19 -0.42 0.07 0.00 -0.75 0.00 0.00 64.21 63.30 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 0.00 0.00 -3.49 -3.46 1.82 -1.74 -3.19 116.42 106.37 2no8 h ASP 9 Ca 0.00 -0.01 -0.53 0.00 -0.39 0.00 0.00 57.03 56.10 2no8 h ASP 9 Cb 0.38 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.37 2no8 h ASP 9 CO 0.00 0.01 0.37 -0.31 -1.61 0.00 0.00 179.24 177.69 2no8 s TYR 10 N -3.30 3.74 0.62 0.28 1.51 -0.51 -4.77 117.35 114.92 2no8 s TYR 10 Ca 0.02 1.75 -0.11 0.00 -1.01 0.00 0.00 57.07 57.73 2no8 s TYR 10 Cb 0.08 -3.09 -0.04 0.00 -0.11 0.00 0.00 41.96 38.81 2no8 s TYR 10 CO 0.75 0.10 1.03 0.95 -1.11 0.00 0.00 175.55 177.26 2no8 s THR 11 N 0.50 4.65 0.37 -0.71 -4.23 -1.26 0.19 115.64 115.16 2no8 s THR 11 Ca 0.49 0.85 0.06 0.00 -1.18 0.00 0.00 61.69 61.91 2no8 s THR 11 Cb -0.22 -3.85 0.29 0.00 1.34 0.00 0.00 72.50 70.05 2no8 s THR 11 CO 0.29 -1.12 1.99 -0.08 -0.54 0.00 0.00 174.62 175.16 2no8 h GLU 12 N -0.32 0.71 -0.26 3.99 4.81 -1.81 0.31 114.58 122.01 2no8 h GLU 12 Ca -0.44 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 58.70 2no8 h GLU 12 Cb 1.19 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.40 2no8 h GLU 12 CO 0.62 0.47 -0.01 0.00 -0.73 0.00 0.00 179.01 179.36 2no8 h ALA 13 N 1.63 0.35 0.00 2.92 0.00 -1.87 0.13 119.26 122.43 2no8 h ALA 13 Ca 0.27 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2no8 h ALA 13 Cb 0.16 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2no8 h ALA 13 CO -0.08 0.10 -0.35 0.93 0.00 0.00 0.00 179.25 179.84 2no8 h GLU 14 N 0.24 0.00 -0.00 0.00 4.39 -1.75 -1.99 114.58 115.47 2no8 h GLU 14 Ca 0.07 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.58 2no8 h GLU 14 Cb 0.43 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.07 2no8 h GLU 14 CO 0.01 0.35 -0.86 0.35 -1.16 0.00 0.00 179.01 177.70 2no8 h PHE 15 N 0.00 0.32 -0.91 4.33 3.57 -0.20 -2.42 116.94 121.63 2no8 h PHE 15 Ca -0.00 -0.17 0.07 0.00 3.53 0.00 0.00 57.97 61.39 2no8 h PHE 15 Cb 0.99 -0.04 -0.07 0.00 2.79 0.00 0.00 35.95 39.63 2no8 h PHE 15 CO 0.00 0.98 0.57 1.25 -2.23 0.00 0.00 178.31 178.88 2no8 h LEU 16 N 0.12 0.90 -2.55 0.59 7.12 -0.40 0.17 115.31 121.26 2no8 h LEU 16 Ca -0.04 0.02 -0.00 0.00 0.13 0.00 0.00 57.88 57.98 2no8 h LEU 16 Cb 1.48 -0.17 -0.00 0.00 -0.53 0.00 0.00 40.66 41.44 2no8 h LEU 16 CO 0.13 0.56 -0.02 -0.33 -0.13 0.00 0.00 178.44 178.66 2no8 h GLU 17 N 1.03 0.00 0.34 1.25 4.39 -0.89 -1.93 114.58 118.77 2no8 h GLU 17 Ca 0.40 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 60.08 2no8 h GLU 17 Cb 0.20 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 2no8 h GLU 17 CO -0.18 0.02 -0.16 0.27 -1.16 0.00 0.00 179.01 177.79 2no8 h PHE 18 N 0.00 -0.42 -0.08 4.33 -0.00 -0.34 0.21 116.94 120.64 2no8 h PHE 18 Ca -0.00 -0.01 -0.18 0.00 -0.00 0.00 0.00 57.97 57.78 2no8 h PHE 18 Cb 0.11 0.14 -0.01 0.00 -0.00 0.00 0.00 35.95 36.19 2no8 h PHE 18 CO 0.00 -0.26 -0.72 -0.24 -0.00 0.00 0.00 178.31 177.09 2no8 h VAL 19 N -0.46 1.38 -0.62 0.88 3.04 -1.51 -0.19 116.25 118.78 2no8 h VAL 19 Ca -0.05 -2.13 -0.07 0.00 -1.01 0.00 0.00 66.70 63.44 2no8 h VAL 19 Cb 0.35 2.10 -0.02 0.00 -2.01 0.00 0.00 31.29 31.71 2no8 h VAL 19 CO 0.08 0.64 0.11 0.11 -1.01 0.00 0.00 177.57 177.50 2no8 h LYS 20 N 0.27 1.01 -0.67 4.17 1.57 -1.21 0.04 116.57 121.75 2no8 h LYS 20 Ca -0.03 -0.27 -0.05 0.00 -1.87 0.00 0.00 60.65 58.44 2no8 h LYS 20 Cb 1.29 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 33.45 2no8 h LYS 20 CO 0.12 0.94 0.22 -0.22 -0.57 0.00 0.00 179.45 179.95 2no8 h LYS 21 N 0.92 1.04 -0.36 3.15 3.64 -0.19 0.35 116.57 125.13 2no8 h LYS 21 Ca 0.19 -0.22 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 2no8 h LYS 21 Cb 0.41 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.06 2no8 h LYS 21 CO 0.01 0.89 0.09 0.82 -2.27 0.00 0.00 179.45 179.00 2no8 h ILE 22 N 0.97 1.16 0.13 2.00 2.04 -0.67 0.64 117.51 123.79 2no8 h ILE 22 Ca 0.22 -0.57 -0.30 0.00 1.00 0.00 0.00 64.86 65.21 2no8 h ILE 22 Cb 0.28 0.79 0.03 0.00 -0.74 0.00 0.00 36.82 37.18 2no8 h ILE 22 CO -0.01 0.21 -1.27 0.00 0.00 0.00 0.00 178.15 177.08 2no8 n ARG 24 N -3.79 0.64 -0.86 0.00 1.85 0.12 -4.46 116.66 110.16 2no8 n ARG 24 Ca -0.14 0.20 0.01 0.00 -1.00 0.00 0.00 57.85 56.92 2no8 n ARG 24 Cb 1.00 -1.53 0.32 0.00 -1.05 0.00 0.00 32.46 31.19 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 -3.49 4.06 -0.04 2.89 0.00 0.22 -4.85 120.51 119.30 2no8 n ALA 25 Ca -0.47 -2.28 0.00 0.00 0.00 0.00 0.00 53.44 50.69 2no8 n ALA 25 Cb 0.96 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 19.34 2no8 n ALA 25 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2no8 n GLU 26 N -0.07 0.00 -3.61 0.00 1.02 -0.91 -4.74 120.64 112.32 2no8 n GLU 26 Ca 0.33 0.12 -0.03 0.00 -0.02 0.00 0.00 57.16 57.56 2no8 n GLU 26 Cb 1.22 -0.19 -0.02 0.00 -0.02 0.00 0.00 31.44 32.43 2no8 n GLU 26 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2no8 s GLY 27 N -0.74 -0.29 0.46 0.62 0.00 -1.26 -3.47 107.32 102.64 2no8 s GLY 27 Ca 0.00 1.54 0.26 0.00 0.00 0.00 0.00 44.72 46.52 2no8 s GLY 27 CO 0.00 0.50 1.71 0.00 0.00 0.00 0.00 173.10 175.31 2no8 h ALA 28 N 2.00 0.98 -2.97 3.20 0.00 -1.88 -3.46 119.26 117.13 2no8 h ALA 28 Ca -0.11 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.77 2no8 h ALA 28 Cb 1.16 -0.01 -0.11 0.00 0.00 0.00 0.00 17.79 18.84 2no8 h ALA 28 CO 0.23 0.05 0.23 0.99 0.00 0.00 0.00 179.25 180.74 2no8 s THR 29 N -3.34 0.00 0.57 0.00 2.01 -1.26 -5.02 115.64 108.60 2no8 s THR 29 Ca 0.05 -0.22 0.27 0.00 0.31 0.00 0.00 61.69 62.10 2no8 s THR 29 Cb 0.06 -1.22 0.34 0.00 0.01 0.00 0.00 72.50 71.70 2no8 s THR 29 CO 0.64 0.00 2.17 1.05 -0.69 0.00 0.00 174.62 177.79 2no8 h GLU 30 N 2.00 0.00 -0.63 4.92 4.11 -1.96 0.00 114.58 123.02 2no8 h GLU 30 Ca -0.30 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.04 2no8 h GLU 30 Cb 1.29 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.52 2no8 h GLU 30 CO 0.34 0.00 0.05 1.05 0.07 0.00 0.00 179.01 180.53 2no8 h GLU 31 N 0.00 1.08 0.00 1.06 4.11 -1.98 0.05 114.58 118.90 2no8 h GLU 31 Ca 0.04 -0.31 -0.11 0.00 0.07 0.00 0.00 59.36 59.05 2no8 h GLU 31 Cb 0.21 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 2no8 h GLU 31 CO -0.00 1.02 -0.50 0.22 0.07 0.00 0.00 179.01 179.82 2no8 h ASP 32 N 1.00 0.00 0.37 3.06 3.58 -1.38 -2.32 116.42 120.73 2no8 h ASP 32 Ca 0.19 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.62 2no8 h ASP 32 Cb 0.50 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.55 2no8 h ASP 32 CO 0.02 0.50 -0.18 -0.78 -2.88 0.00 0.00 179.24 175.93 2no8 h ASP 33 N 0.00 -0.42 -0.53 2.28 1.82 -1.13 -3.29 116.42 115.16 2no8 h ASP 33 Ca -0.01 -0.14 -0.01 0.00 -0.39 0.00 0.00 57.03 56.49 2no8 h ASP 33 Cb 1.10 0.11 -0.03 0.00 0.68 0.00 0.00 39.33 41.19 2no8 h ASP 33 CO 0.07 0.00 0.31 -1.13 -1.61 0.00 0.00 179.24 176.88 2no8 h ASN 34 N -0.94 0.65 0.92 2.28 -1.24 -0.91 -1.31 115.58 115.03 2no8 h ASN 34 Ca -0.05 -0.04 0.00 0.00 0.71 0.00 0.00 56.30 56.92 2no8 h ASN 34 Cb 0.53 -0.17 0.00 0.00 0.73 0.00 0.00 38.32 39.42 2no8 h ASN 34 CO 0.08 0.52 0.00 0.07 -1.29 0.00 0.00 177.43 176.81 2no8 h LYS 35 N 0.75 0.00 0.18 6.67 2.10 -1.53 0.31 116.57 125.06 2no8 h LYS 35 Ca 0.20 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.84 2no8 h LYS 35 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2no8 h LYS 35 CO -0.03 0.00 -0.09 -0.07 -2.00 0.00 0.00 179.45 177.26 2no8 h LEU 36 N 0.00 -0.21 -0.73 7.07 3.38 -1.31 -3.10 115.31 120.40 2no8 h LEU 36 Ca 0.00 -0.31 0.11 0.00 0.09 0.00 0.00 57.88 57.76 2no8 h LEU 36 Cb 0.46 0.05 -0.08 0.00 0.09 0.00 0.00 40.66 41.18 2no8 h LEU 36 CO 0.00 0.33 0.35 0.58 0.09 0.00 0.00 178.44 179.79 2no8 h VAL 37 N -0.88 0.79 -0.56 1.22 2.07 -1.10 -1.51 116.25 116.28 2no8 h VAL 37 Ca -0.03 -0.19 -0.07 0.00 0.82 0.00 0.00 66.70 67.23 2no8 h VAL 37 Cb 0.51 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 2no8 h VAL 37 CO 0.04 0.10 0.06 0.03 0.02 0.00 0.00 177.57 177.83 2no8 h ARG 38 N 0.57 0.91 -0.20 1.57 3.08 -0.52 0.26 114.38 120.04 2no8 h ARG 38 Ca 0.38 -0.23 -0.13 0.00 0.07 0.00 0.00 59.98 60.06 2no8 h ARG 38 Cb 0.45 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 2no8 h ARG 38 CO -0.31 0.86 -0.42 1.05 -1.07 0.00 0.00 179.97 180.08 2no8 h GLU 39 N 0.85 0.49 -0.27 0.04 4.11 -1.21 0.24 114.58 118.82 2no8 h GLU 39 Ca 0.17 -0.25 -0.12 0.00 0.07 0.00 0.00 59.36 59.23 2no8 h GLU 39 Cb 0.42 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.67 2no8 h GLU 39 CO 0.01 0.82 -0.30 0.74 0.07 0.00 0.00 179.01 180.35 2no8 h PHE 40 N 0.40 0.83 -0.15 2.06 0.04 -1.02 0.15 116.94 119.25 2no8 h PHE 40 Ca 0.03 -0.26 0.03 0.00 2.80 0.00 0.00 57.97 60.58 2no8 h PHE 40 Cb 0.90 -0.17 -0.01 0.00 2.20 0.00 0.00 35.95 38.88 2no8 h PHE 40 CO 0.03 1.00 0.10 0.93 -0.60 0.00 0.00 178.31 179.78 2no8 h GLU 41 N 0.41 0.04 0.00 1.51 5.08 -0.26 -1.04 114.58 120.33 2no8 h GLU 41 Ca 0.04 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.37 2no8 h GLU 41 Cb 0.88 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.12 2no8 h GLU 41 CO 0.07 0.03 -0.11 -0.09 -1.00 0.00 0.00 179.01 177.91 2no8 h ARG 42 N 0.04 0.07 -1.00 2.33 9.65 -0.35 0.99 114.38 126.12 2no8 h ARG 42 Ca 0.07 -0.08 0.06 0.00 -1.10 0.00 0.00 59.98 58.93 2no8 h ARG 42 Cb 0.21 0.02 -0.07 0.00 -1.39 0.00 0.00 29.97 28.75 2no8 h ARG 42 CO -0.00 0.87 0.65 -0.07 2.80 0.00 0.00 179.97 184.21 2no8 h LEU 43 N -0.68 1.04 0.00 3.80 3.38 -0.43 -1.23 115.31 121.19 2no8 h LEU 43 Ca -0.01 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2no8 h LEU 43 Cb 0.91 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.44 2no8 h LEU 43 CO 0.02 0.67 -0.64 0.71 0.09 0.00 0.00 178.44 179.30 2no8 h THR 44 N 1.19 0.00 -6.51 0.22 1.35 -1.28 -3.40 112.91 104.48 2no8 h THR 44 Ca 0.43 -0.95 -0.51 0.00 -0.55 0.00 0.00 66.41 64.83 2no8 h THR 44 Cb 0.15 1.62 -0.13 0.00 -1.73 0.00 0.00 68.15 68.06 2no8 h THR 44 CO -0.17 0.00 -0.79 1.21 -0.25 0.00 0.00 175.52 175.52 2no8 n GLU 45 N -2.75 -4.28 -3.52 4.72 4.07 0.21 -4.91 120.64 114.17 2no8 n GLU 45 Ca 0.02 0.48 -0.37 0.00 -0.06 0.00 0.00 57.16 57.22 2no8 n GLU 45 Cb 0.53 -5.29 -0.08 0.00 -0.06 0.00 0.00 31.44 26.53 2no8 n GLU 45 CO 0.00 0.00 0.00 -1.58 -0.06 0.00 0.00 177.13 175.49 2no8 s HIS 46 N -3.27 3.34 0.09 4.31 2.46 -0.39 -4.99 115.29 116.84 2no8 s HIS 46 Ca 0.71 0.43 -0.33 0.00 0.47 0.00 0.00 55.06 56.33 2no8 s HIS 46 Cb -0.37 -2.40 -0.15 0.00 -0.13 0.00 0.00 32.58 29.52 2no8 s HIS 46 CO 0.87 0.02 1.59 -1.00 -2.47 0.00 0.00 174.74 173.76 2no8 h PRO 47 N 7.44 -0.85 -0.92 2.88 0.13 -1.91 -2.41 132.00 136.37 2no8 h PRO 47 Ca -0.37 0.06 -0.34 0.00 -0.87 0.00 0.00 66.00 64.47 2no8 h PRO 47 Cb 1.17 0.19 -0.21 0.00 0.13 0.00 0.00 31.00 32.28 2no8 h PRO 47 CO 0.69 -0.57 0.44 -0.25 -0.23 0.00 0.00 178.00 178.08 2no8 n ASP 48 N -5.52 3.99 0.20 1.44 8.00 -1.26 -4.48 116.55 118.93 2no8 n ASP 48 Ca -0.11 -3.25 0.18 0.00 0.71 0.00 0.00 54.79 52.32 2no8 n ASP 48 Cb 0.41 -0.76 0.80 0.00 -0.02 0.00 0.00 41.12 41.55 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 2.05 0.00 0.00 0.44 0.00 -1.80 0.57 103.07 104.33 2no8 h GLY 49 Ca 0.42 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.73 2no8 h GLY 49 CO 0.83 0.00 -0.25 1.48 0.00 0.00 0.00 176.54 178.60 2no8 h SER 50 N 0.00 0.00 -0.44 0.19 4.64 -1.84 -3.38 113.55 112.72 2no8 h SER 50 Ca 0.11 -0.17 0.13 0.00 -0.47 0.00 0.00 61.79 61.39 2no8 h SER 50 Cb 0.80 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.87 2no8 h SER 50 CO -0.00 0.72 0.32 0.44 -0.87 0.00 0.00 176.83 177.44 2no8 h ASP 51 N -1.00 0.00 -0.83 4.97 5.19 -1.48 -0.76 116.42 122.51 2no8 h ASP 51 Ca -0.03 0.00 0.07 0.00 -0.62 0.00 0.00 57.03 56.45 2no8 h ASP 51 Cb 0.38 0.00 -0.05 0.00 0.18 0.00 0.00 39.33 39.84 2no8 h ASP 51 CO -0.02 0.00 0.54 -0.07 -3.12 0.00 0.00 179.24 176.58 2no8 h LEU 52 N 0.00 0.80 -0.25 1.55 3.38 -0.08 0.65 115.31 121.36 2no8 h LEU 52 Ca 0.21 0.01 -0.21 0.00 0.09 0.00 0.00 57.88 57.98 2no8 h LEU 52 Cb 0.86 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 2no8 h LEU 52 CO -0.00 0.51 -0.90 0.40 0.09 0.00 0.00 178.44 178.55 2no8 h ILE 53 N 0.91 1.47 0.00 1.22 2.04 -1.32 -3.30 117.51 118.54 2no8 h ILE 53 Ca 0.36 -2.58 -0.13 0.00 1.00 0.00 0.00 64.86 63.50 2no8 h ILE 53 Cb 0.23 2.46 -0.02 0.00 -0.74 0.00 0.00 36.82 38.75 2no8 h ILE 53 CO -0.13 0.76 -1.63 -1.22 0.00 0.00 0.00 178.15 175.92 2no8 n TYR 54 N -3.68 0.60 -3.70 1.37 4.01 -0.85 -4.86 117.16 110.06 2no8 n TYR 54 Ca -0.04 0.19 -0.18 0.00 -0.16 0.00 0.00 57.90 57.71 2no8 n TYR 54 Cb 0.82 -0.92 -0.17 0.00 -0.31 0.00 0.00 39.34 38.75 2no8 n TYR 54 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 2no8 s TYR 55 N -3.07 0.03 0.55 -0.72 1.51 0.22 -5.09 117.35 110.79 2no8 s TYR 55 Ca -0.05 0.25 -0.18 0.00 -1.01 0.00 0.00 57.07 56.08 2no8 s TYR 55 Cb 0.10 -0.39 -0.05 0.00 -0.11 0.00 0.00 41.96 41.50 2no8 s TYR 55 CO 0.83 -0.17 1.08 -1.25 -1.11 0.00 0.00 175.55 174.94 2no8 s PRO 56 N 1.85 3.42 0.00 -1.71 0.04 -1.26 -4.12 135.00 133.22 2no8 s PRO 56 Ca 0.01 1.40 0.00 0.00 0.04 0.00 0.00 61.00 62.45 2no8 s PRO 56 Cb -0.12 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.38 2no8 s PRO 56 CO -0.03 -0.76 0.00 0.54 0.04 0.00 0.00 177.00 176.79 2no8 n ARG 57 N -1.52 0.00 0.03 4.56 1.74 -1.26 -4.97 116.66 115.24 2no8 n ARG 57 Ca 0.10 0.00 -0.00 0.00 -0.77 0.00 0.00 57.85 57.18 2no8 n ARG 57 Cb 0.52 -0.23 -0.00 0.00 -1.02 0.00 0.00 32.46 31.73 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 0.69 -0.05 0.55 -0.08 -1.26 -4.88 116.55 111.52 2no8 n ASP 58 Ca 0.00 0.09 0.01 0.00 -1.51 0.00 0.00 54.79 53.38 2no8 n ASP 58 Cb 0.00 -0.22 0.00 0.00 2.34 0.00 0.00 41.12 43.25 2no8 n ASP 58 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 2no8 n ASP 59 N -3.12 0.76 -4.73 1.67 2.03 -1.26 -5.03 116.55 106.87 2no8 n ASP 59 Ca -0.00 -0.88 -0.42 0.00 0.52 0.00 0.00 54.79 54.01 2no8 n ASP 59 Cb 0.01 0.37 -0.02 0.00 -0.72 0.00 0.00 41.12 40.75 2no8 n ASP 59 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 2no8 s ARG 60 N -0.52 4.21 -0.05 -0.67 3.00 -1.26 -4.90 118.95 118.75 2no8 s ARG 60 Ca 0.02 2.41 -0.35 0.00 -1.00 0.00 0.00 55.73 56.80 2no8 s ARG 60 Cb 0.01 -3.11 -0.13 0.00 0.00 0.00 0.00 34.95 31.73 2no8 s ARG 60 CO 0.04 -0.56 1.77 -1.91 0.00 0.00 0.00 175.30 174.64 2no8 n GLU 61 N 3.05 1.97 -2.62 5.12 2.13 -1.26 -4.72 120.64 124.31 2no8 n GLU 61 Ca 0.10 0.72 -0.43 0.00 0.66 0.00 0.00 57.16 58.22 2no8 n GLU 61 Cb 0.39 -2.52 -0.01 0.00 0.27 0.00 0.00 31.44 29.57 2no8 n GLU 61 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2no8 s ASP 62 N 3.14 6.80 0.01 4.31 2.15 -1.26 -4.29 116.67 127.53 2no8 s ASP 62 Ca 0.90 -2.31 -0.04 0.00 0.43 0.00 0.00 52.55 51.53 2no8 s ASP 62 Cb -0.76 -2.56 -0.01 0.00 -0.30 0.00 0.00 42.92 39.30 2no8 s ASP 62 CO 0.50 -1.19 0.06 -0.94 -0.17 0.00 0.00 175.17 173.44 2no8 s SER 63 N 4.22 0.12 0.33 -0.34 1.04 -1.26 -4.98 113.70 112.82 2no8 s SER 63 Ca 0.51 -0.34 0.11 0.00 0.48 0.00 0.00 55.95 56.71 2no8 s SER 63 Cb 0.02 0.16 0.95 0.00 0.10 0.00 0.00 66.02 67.25 2no8 s SER 63 CO 0.03 -0.34 1.71 -0.65 0.98 0.00 0.00 173.24 174.98 2no8 h PRO 64 N 4.44 0.49 -0.53 4.02 0.11 -1.94 -0.02 132.00 138.57 2no8 h PRO 64 Ca -0.31 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.68 2no8 h PRO 64 Cb 1.20 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 2no8 h PRO 64 CO 0.41 0.33 -0.02 0.93 -0.21 0.00 0.00 178.00 179.44 2no8 h GLU 65 N 0.51 0.95 -0.17 1.05 5.08 -1.92 -2.66 114.58 117.42 2no8 h GLU 65 Ca 0.67 -0.31 -0.07 0.00 -1.00 0.00 0.00 59.36 58.64 2no8 h GLU 65 Cb 1.36 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.52 2no8 h GLU 65 CO -0.50 0.98 -0.21 0.78 -1.00 0.00 0.00 179.01 179.06 2no8 h GLY 66 N 0.83 0.32 1.15 -3.84 0.00 -1.35 -2.39 103.07 97.80 2no8 h GLY 66 Ca 0.15 -0.23 -0.06 0.00 0.00 0.00 0.00 47.33 47.19 2no8 h GLY 66 CO 0.03 0.21 0.16 -2.22 0.00 0.00 0.00 176.54 174.73 2no8 h ILE 67 N 0.27 1.25 -0.15 2.60 2.04 -0.74 -1.62 117.51 121.17 2no8 h ILE 67 Ca 0.05 -0.93 -0.03 0.00 1.00 0.00 0.00 64.86 64.94 2no8 h ILE 67 Cb 0.53 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 2no8 h ILE 67 CO 0.04 0.36 -0.07 0.58 0.00 0.00 0.00 178.15 179.06 2no8 h VAL 68 N 1.00 1.14 0.00 1.67 2.07 -1.11 -0.17 116.25 120.84 2no8 h VAL 68 Ca 0.21 -0.58 -0.07 0.00 0.82 0.00 0.00 66.70 67.09 2no8 h VAL 68 Cb 0.35 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 2no8 h VAL 68 CO 0.00 0.18 -0.31 0.50 0.02 0.00 0.00 177.57 177.96 2no8 h LYS 69 N 0.21 0.00 -0.57 1.57 3.64 -0.94 -1.05 116.57 119.44 2no8 h LYS 69 Ca 0.05 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.40 2no8 h LYS 69 Cb 0.26 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.05 2no8 h LYS 69 CO 0.01 0.31 0.25 0.93 -2.27 0.00 0.00 179.45 178.69 2no8 h GLU 70 N 0.00 0.84 0.01 1.90 4.39 -0.51 0.40 114.58 121.61 2no8 h GLU 70 Ca -0.00 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 59.56 2no8 h GLU 70 Cb 0.67 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.18 2no8 h GLU 70 CO 0.04 0.70 -0.01 0.82 -1.16 0.00 0.00 179.01 179.41 2no8 h ILE 71 N 0.78 1.16 0.08 3.13 5.03 -1.28 -2.29 117.51 124.13 2no8 h ILE 71 Ca 0.19 -0.52 -0.00 0.00 -0.12 0.00 0.00 64.86 64.41 2no8 h ILE 71 Cb 0.16 1.51 0.00 0.00 -3.03 0.00 0.00 36.82 35.46 2no8 h ILE 71 CO -0.02 0.13 -0.04 0.07 -0.68 0.00 0.00 178.15 177.61 2no8 h LYS 72 N -0.24 -0.11 -0.57 2.37 2.10 -0.89 0.37 116.57 119.61 2no8 h LYS 72 Ca -0.00 0.01 0.04 0.00 -2.00 0.00 0.00 60.65 58.69 2no8 h LYS 72 Cb 0.23 0.02 -0.04 0.00 -0.90 0.00 0.00 32.23 31.54 2no8 h LYS 72 CO 0.00 -0.05 0.32 0.93 -2.00 0.00 0.00 179.45 178.65 2no8 h GLU 73 N -0.13 0.60 0.06 0.07 4.39 -0.26 0.69 114.58 120.01 2no8 h GLU 73 Ca -0.01 -0.04 -0.00 0.00 0.34 0.00 0.00 59.36 59.65 2no8 h GLU 73 Cb 0.10 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 28.62 2no8 h GLU 73 CO 0.02 0.40 -0.03 2.35 -1.16 0.00 0.00 179.01 180.59 2no8 h TRP 74 N 0.62 -0.08 -0.42 4.33 7.01 -1.29 -0.56 115.95 125.55 2no8 h TRP 74 Ca 0.24 -0.00 -0.08 0.00 2.11 0.00 0.00 58.89 61.16 2no8 h TRP 74 Cb 0.09 0.03 -0.02 0.00 -2.10 0.00 0.00 29.16 27.16 2no8 h TRP 74 CO -0.08 0.27 -0.06 0.00 -2.79 0.00 0.00 178.44 175.78 2no8 h ARG 75 N -0.44 0.72 0.00 2.65 3.08 -0.53 0.23 114.38 120.09 2no8 h ARG 75 Ca -0.01 -0.21 -0.08 0.00 0.07 0.00 0.00 59.98 59.75 2no8 h ARG 75 Cb 0.38 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 2no8 h ARG 75 CO 0.01 0.77 -0.39 0.00 -1.07 0.00 0.00 179.97 179.30 2no8 h ALA 76 N 1.27 1.25 0.15 0.04 0.00 0.42 0.19 119.26 122.58 2no8 h ALA 76 Ca 0.12 -0.35 -0.27 0.00 0.00 0.00 0.00 54.91 54.41 2no8 h ALA 76 Cb 0.50 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.24 2no8 h ALA 76 CO 0.03 0.48 -1.30 0.00 0.00 0.00 0.00 179.25 178.46 2no8 h ALA 77 N 1.61 0.04 0.22 0.00 0.00 -0.48 -3.36 119.26 117.29 2no8 h ALA 77 Ca -0.00 -0.95 -0.00 0.00 0.00 0.00 0.00 54.91 53.96 2no8 h ALA 77 Cb 0.74 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 2no8 h ALA 77 CO 0.05 0.70 -0.18 -0.91 0.00 0.00 0.00 179.25 178.91 2no8 h ASN 78 N -0.20 -0.47 0.00 0.00 -0.26 -0.40 -3.47 115.58 110.77 2no8 h ASN 78 Ca -0.26 0.04 0.00 0.00 -0.56 0.00 0.00 56.30 55.52 2no8 h ASN 78 Cb 1.84 0.16 0.00 0.00 -1.06 0.00 0.00 38.32 39.25 2no8 h ASN 78 CO 0.14 -0.28 0.00 0.61 -1.06 0.00 0.00 177.43 176.84 2no8 n GLY 79 N -1.31 1.91 3.95 2.83 0.00 0.40 -5.08 105.19 107.89 2no8 n GLY 79 Ca -0.08 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.00 2.58 1.01 1.61 1.02 0.28 -5.02 119.74 121.21 2no8 s LYS 80 Ca 0.00 -0.46 -0.14 0.00 0.02 0.00 0.00 55.97 55.38 2no8 s LYS 80 Cb 0.00 -2.37 0.19 0.00 -0.52 0.00 0.00 37.83 35.13 2no8 s LYS 80 CO 0.00 -0.79 1.14 -1.12 -0.92 0.00 0.00 175.35 173.66 2no8 s SER 81 N -4.40 2.61 0.00 2.83 0.01 -1.26 -4.45 113.70 109.05 2no8 s SER 81 Ca 0.56 0.87 0.00 0.00 1.31 0.00 0.00 55.95 58.69 2no8 s SER 81 Cb -0.10 -1.34 0.00 0.00 0.21 0.00 0.00 66.02 64.78 2no8 s SER 81 CO 0.41 -3.10 0.00 0.61 0.41 0.00 0.00 173.24 171.57 2no8 n GLY 82 N -1.78 5.14 3.99 3.44 0.00 -1.26 -4.78 105.19 109.94 2no8 n GLY 82 Ca 0.08 -1.67 -0.22 0.00 0.00 0.00 0.00 46.02 44.21 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 2.48 1.40 -0.03 1.61 0.08 -1.26 -3.36 117.98 118.89 2no8 s PHE 83 Ca 0.00 -0.79 -0.20 0.00 0.12 0.00 0.00 56.93 56.06 2no8 s PHE 83 Cb 0.00 -2.10 -0.05 0.00 -0.57 0.00 0.00 43.02 40.30 2no8 s PHE 83 CO 0.00 -0.96 0.57 0.21 -0.10 0.00 0.00 175.22 174.94 2no8 s LYS 84 N -4.55 4.31 -1.28 0.44 2.20 0.13 -4.88 119.74 116.11 2no8 s LYS 84 Ca 0.52 0.67 -0.16 0.00 -0.36 0.00 0.00 55.97 56.64 2no8 s LYS 84 Cb -0.04 -3.36 0.11 0.00 -1.51 0.00 0.00 37.83 33.02 2no8 s LYS 84 CO 0.33 0.32 1.67 0.00 -0.36 0.00 0.00 175.35 177.31 2no8 n GLN 85 N 2.95 3.26 0.00 4.03 0.00 -1.26 -2.66 117.38 123.71 2no8 n GLN 85 Ca -0.07 -3.46 0.10 0.00 0.00 0.00 0.00 57.00 53.57 2no8 n GLN 85 Cb 0.51 -3.29 0.08 0.00 0.00 0.00 0.00 30.24 27.55 2no8 n GLN 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47