#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 0.04 0.13 -1.84 1.43 -1.26 -5.13 118.68 112.05 2no8 s LEU 3 Ca 0.00 -0.03 0.05 0.00 -1.03 0.00 0.00 54.13 53.12 2no8 s LEU 3 Cb 0.00 0.13 -0.04 0.00 0.03 0.00 0.00 46.19 46.31 2no8 s LEU 3 CO 0.00 -0.29 0.07 -1.59 0.23 0.00 0.00 176.35 174.77 2no8 s LYS 4 N 2.25 2.73 -0.13 1.70 0.00 -1.26 -5.03 119.74 119.99 2no8 s LYS 4 Ca 0.04 -0.87 0.18 0.00 0.00 0.00 0.00 55.97 55.33 2no8 s LYS 4 Cb -0.14 -2.59 -0.26 0.00 0.00 0.00 0.00 37.83 34.85 2no8 s LYS 4 CO -0.07 0.51 0.26 -2.39 0.00 0.00 0.00 175.35 173.66 2no8 n HIS 5 N 0.07 0.16 -3.25 1.78 1.44 -1.26 -5.05 115.22 109.11 2no8 n HIS 5 Ca -0.09 0.05 -0.03 0.00 -2.01 0.00 0.00 57.72 55.64 2no8 n HIS 5 Cb 0.53 -0.92 0.01 0.00 0.12 0.00 0.00 29.99 29.74 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 -2.68 -0.72 0.20 4.39 3.41 -1.26 -5.00 113.62 111.96 2no8 n SER 6 Ca -0.24 -1.49 0.07 0.00 -0.26 0.00 0.00 58.87 56.94 2no8 n SER 6 Cb 1.00 1.19 0.37 0.00 -0.26 0.00 0.00 64.21 66.51 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 1.31 0.82 0.00 -1.33 2.10 -1.85 -2.94 117.51 115.61 2no8 h ILE 7 Ca -0.10 -1.42 0.00 0.00 1.08 0.00 0.00 64.86 64.42 2no8 h ILE 7 Cb 0.38 1.88 0.00 0.00 -1.09 0.00 0.00 36.82 38.00 2no8 h ILE 7 CO 0.13 0.33 0.00 -1.20 -1.08 0.00 0.00 178.15 176.33 2no8 n SER 8 N -3.52 0.00 0.09 2.19 7.64 -1.12 -1.63 113.62 117.26 2no8 n SER 8 Ca -0.00 -0.93 -0.08 0.00 1.01 0.00 0.00 58.87 58.86 2no8 n SER 8 Cb 0.49 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.68 2no8 n SER 8 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 2no8 h ASP 9 N 0.00 0.24 -3.37 6.43 1.82 -1.81 -3.20 116.42 116.53 2no8 h ASP 9 Ca 0.00 -0.19 -0.55 0.00 -0.39 0.00 0.00 57.03 55.89 2no8 h ASP 9 Cb 0.00 -0.07 -0.04 0.00 0.68 0.00 0.00 39.33 39.90 2no8 h ASP 9 CO 0.00 0.99 -0.01 -0.31 -1.61 0.00 0.00 179.24 178.30 2no8 s TYR 10 N -3.22 3.68 0.71 0.28 1.51 -0.65 -4.77 117.35 114.89 2no8 s TYR 10 Ca -0.03 1.22 -0.10 0.00 -1.01 0.00 0.00 57.07 57.15 2no8 s TYR 10 Cb 0.10 -2.48 0.03 0.00 -0.11 0.00 0.00 41.96 39.50 2no8 s TYR 10 CO 0.82 0.45 1.07 0.95 -1.11 0.00 0.00 175.55 177.74 2no8 s THR 11 N -1.37 3.11 0.25 -0.71 -4.23 -1.26 0.09 115.64 111.52 2no8 s THR 11 Ca 0.37 0.23 -0.05 0.00 -1.18 0.00 0.00 61.69 61.06 2no8 s THR 11 Cb -0.17 -3.34 0.24 0.00 1.34 0.00 0.00 72.50 70.57 2no8 s THR 11 CO 0.20 -0.42 1.88 -0.08 -0.54 0.00 0.00 174.62 175.66 2no8 h GLU 12 N -0.65 1.08 -0.60 3.99 4.81 -1.85 0.12 114.58 121.48 2no8 h GLU 12 Ca -0.45 -0.07 -0.08 0.00 -0.13 0.00 0.00 59.36 58.63 2no8 h GLU 12 Cb 1.27 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 30.39 2no8 h GLU 12 CO 0.63 0.72 0.06 0.00 -0.73 0.00 0.00 179.01 179.69 2no8 h ALA 13 N 1.40 0.96 -0.02 2.92 0.00 -1.93 0.49 119.26 123.08 2no8 h ALA 13 Ca 0.38 -0.28 -0.14 0.00 0.00 0.00 0.00 54.91 54.88 2no8 h ALA 13 Cb 0.08 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2no8 h ALA 13 CO -0.15 0.64 -0.64 0.93 0.00 0.00 0.00 179.25 180.04 2no8 h GLU 14 N 0.94 0.07 0.02 0.00 5.08 -1.72 -1.64 114.58 117.32 2no8 h GLU 14 Ca 0.18 -0.05 -0.20 0.00 -1.00 0.00 0.00 59.36 58.29 2no8 h GLU 14 Cb 0.47 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 2no8 h GLU 14 CO 0.02 0.68 -0.92 0.35 -1.00 0.00 0.00 179.01 178.13 2no8 h PHE 15 N 0.05 0.25 0.00 4.33 3.57 -0.58 -2.72 116.94 121.83 2no8 h PHE 15 Ca -0.01 -0.15 0.00 0.00 3.53 0.00 0.00 57.97 61.35 2no8 h PHE 15 Cb 1.14 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.85 2no8 h PHE 15 CO 0.01 0.99 0.00 1.25 -2.23 0.00 0.00 178.31 178.33 2no8 h LEU 16 N 0.08 0.00 -0.28 0.59 6.46 0.30 0.27 115.31 122.73 2no8 h LEU 16 Ca -0.05 0.00 -0.02 0.00 -0.12 0.00 0.00 57.88 57.70 2no8 h LEU 16 Cb 1.58 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.51 2no8 h LEU 16 CO 0.14 0.00 -0.08 -0.33 -0.62 0.00 0.00 178.44 177.55 2no8 h GLU 17 N 0.00 0.00 -0.23 1.25 5.08 -1.01 -3.16 114.58 116.52 2no8 h GLU 17 Ca 0.00 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.42 2no8 h GLU 17 Cb 0.51 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.71 2no8 h GLU 17 CO 0.00 0.08 -0.15 0.27 -1.00 0.00 0.00 179.01 178.21 2no8 h PHE 18 N 0.00 -0.37 -0.17 4.33 -5.15 -0.22 0.31 116.94 115.67 2no8 h PHE 18 Ca -0.00 0.03 -0.16 0.00 -0.20 0.00 0.00 57.97 57.64 2no8 h PHE 18 Cb 0.96 0.20 0.00 0.00 0.22 0.00 0.00 35.95 37.34 2no8 h PHE 18 CO 0.00 -0.22 -0.51 -0.24 -2.00 0.00 0.00 178.31 175.34 2no8 h VAL 19 N -0.14 1.32 -0.20 0.88 3.04 -1.65 -2.09 116.25 117.41 2no8 h VAL 19 Ca 0.13 -1.76 -0.06 0.00 -1.01 0.00 0.00 66.70 64.00 2no8 h VAL 19 Cb 0.33 1.96 -0.01 0.00 -2.01 0.00 0.00 31.29 31.55 2no8 h VAL 19 CO -0.31 0.55 -0.13 0.11 -1.01 0.00 0.00 177.57 176.77 2no8 h LYS 20 N 0.33 0.32 -0.42 4.17 1.57 -1.42 0.11 116.57 121.23 2no8 h LYS 20 Ca -0.02 -0.08 -0.10 0.00 -1.87 0.00 0.00 60.65 58.58 2no8 h LYS 20 Cb 1.13 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.39 2no8 h LYS 20 CO 0.11 0.46 -0.14 0.87 -0.57 0.00 0.00 179.45 180.17 2no8 h LYS 21 N 0.30 0.79 -0.25 3.15 1.57 -0.20 -2.44 116.57 119.50 2no8 h LYS 21 Ca 0.06 -0.28 -0.15 0.00 -1.87 0.00 0.00 60.65 58.42 2no8 h LYS 21 Cb 0.42 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 2no8 h LYS 21 CO 0.02 0.88 -0.45 0.82 -0.57 0.00 0.00 179.45 180.16 2no8 h ILE 22 N 0.70 1.30 -0.08 1.86 2.04 -0.55 -1.27 117.51 121.51 2no8 h ILE 22 Ca 0.11 -1.64 0.02 0.00 1.00 0.00 0.00 64.86 64.35 2no8 h ILE 22 Cb 0.63 1.59 -0.00 0.00 -0.74 0.00 0.00 36.82 38.30 2no8 h ILE 22 CO 0.04 0.52 0.06 0.00 0.00 0.00 0.00 178.15 178.77 2no8 n ARG 24 N -4.52 2.54 -0.17 0.00 1.85 -0.94 -4.69 116.66 110.73 2no8 n ARG 24 Ca -0.01 -2.36 0.01 0.00 -1.00 0.00 0.00 57.85 54.49 2no8 n ARG 24 Cb 0.15 -1.52 0.07 0.00 -1.05 0.00 0.00 32.46 30.11 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 1.50 2.77 -0.35 2.89 0.00 -0.33 -4.41 120.51 122.59 2no8 n ALA 25 Ca 0.20 -0.36 0.15 0.00 0.00 0.00 0.00 53.44 53.43 2no8 n ALA 25 Cb 0.60 -1.03 0.34 0.00 0.00 0.00 0.00 19.45 19.37 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 0.69 0.67 0.00 0.00 -0.00 -1.84 -2.61 114.58 111.50 2no8 h GLU 26 Ca 0.01 -0.04 0.00 0.00 -0.00 0.00 0.00 59.36 59.33 2no8 h GLU 26 Cb 0.80 -0.15 0.00 0.00 -0.00 0.00 0.00 28.75 29.40 2no8 h GLU 26 CO 0.10 0.44 0.00 0.41 -0.00 0.00 0.00 179.01 179.96 2no8 n GLY 27 N -1.32 3.67 0.11 1.06 0.00 -1.26 -2.69 105.19 104.75 2no8 n GLY 27 Ca 0.25 0.02 -0.12 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 n ALA 28 N 11.67 1.43 -3.19 4.61 0.00 -1.26 -5.00 120.51 128.77 2no8 n ALA 28 Ca 0.00 -1.10 -0.11 0.00 0.00 0.00 0.00 53.44 52.23 2no8 n ALA 28 Cb 0.00 -0.35 -0.04 0.00 0.00 0.00 0.00 19.45 19.07 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 -2.53 0.04 -1.69 0.00 2.01 -1.09 -5.04 115.64 107.34 2no8 s THR 29 Ca -0.15 -0.42 0.05 0.00 0.31 0.00 0.00 61.69 61.48 2no8 s THR 29 Cb 0.07 -1.18 0.11 0.00 0.01 0.00 0.00 72.50 71.51 2no8 s THR 29 CO 0.77 -0.18 0.89 -1.84 -0.69 0.00 0.00 174.62 173.57 2no8 n GLU 30 N -0.30 0.11 0.21 4.92 0.28 -1.25 -0.37 120.64 124.24 2no8 n GLU 30 Ca -0.15 0.13 0.10 0.00 -0.16 0.00 0.00 57.16 57.08 2no8 n GLU 30 Cb 0.64 -1.50 0.36 0.00 1.43 0.00 0.00 31.44 32.37 2no8 n GLU 30 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 177.13 178.02 2no8 h GLU 31 N 0.00 0.00 0.00 3.44 4.11 -1.92 -2.66 114.58 117.55 2no8 h GLU 31 Ca 0.00 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.37 2no8 h GLU 31 Cb 0.02 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 2no8 h GLU 31 CO 0.00 0.21 -0.30 -0.44 0.07 0.00 0.00 179.01 178.55 2no8 h ASP 32 N 0.00 0.00 0.25 3.06 3.32 -0.96 -0.54 116.42 121.56 2no8 h ASP 32 Ca -0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 2no8 h ASP 32 Cb 0.88 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.43 2no8 h ASP 32 CO 0.03 0.30 -0.12 -0.78 -1.72 0.00 0.00 179.24 176.94 2no8 h ASP 33 N 0.00 -0.29 0.13 6.45 1.82 -1.17 -3.19 116.42 120.17 2no8 h ASP 33 Ca -0.00 -0.23 -0.03 0.00 -0.39 0.00 0.00 57.03 56.38 2no8 h ASP 33 Cb 0.90 0.07 -0.00 0.00 0.68 0.00 0.00 39.33 40.98 2no8 h ASP 33 CO 0.04 0.13 -0.13 -1.13 -1.61 0.00 0.00 179.24 176.54 2no8 h ASN 34 N -0.77 0.00 -0.97 2.28 -1.24 -1.29 -1.62 115.58 111.98 2no8 h ASN 34 Ca -0.03 0.00 0.06 0.00 0.71 0.00 0.00 56.30 57.03 2no8 h ASN 34 Cb 0.50 0.00 -0.06 0.00 0.73 0.00 0.00 38.32 39.49 2no8 h ASN 34 CO 0.06 0.13 0.63 0.50 -1.29 0.00 0.00 177.43 177.46 2no8 h LYS 35 N 0.00 1.12 -0.03 6.67 3.64 -1.09 0.17 116.57 127.04 2no8 h LYS 35 Ca -0.00 -0.07 -0.23 0.00 -1.27 0.00 0.00 60.65 59.08 2no8 h LYS 35 Cb 0.23 -0.25 0.02 0.00 -0.41 0.00 0.00 32.23 31.81 2no8 h LYS 35 CO 0.02 0.74 -0.87 -0.07 -2.27 0.00 0.00 179.45 177.00 2no8 h LEU 36 N 1.15 0.81 -0.70 5.20 3.38 -1.30 -3.27 115.31 120.58 2no8 h LEU 36 Ca 0.41 -0.72 0.08 0.00 0.09 0.00 0.00 57.88 57.74 2no8 h LEU 36 Cb 0.14 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.58 2no8 h LEU 36 CO -0.15 1.42 0.38 0.58 0.09 0.00 0.00 178.44 180.76 2no8 h VAL 37 N 0.28 0.91 -0.66 1.22 2.07 -0.94 -2.66 116.25 116.47 2no8 h VAL 37 Ca -0.10 -0.23 0.02 0.00 0.82 0.00 0.00 66.70 67.21 2no8 h VAL 37 Cb 1.53 0.19 -0.04 0.00 -1.52 0.00 0.00 31.29 31.45 2no8 h VAL 37 CO 0.17 0.12 0.42 0.03 0.02 0.00 0.00 177.57 178.34 2no8 h ARG 38 N 0.66 0.83 -0.48 1.57 2.47 -0.76 0.29 114.38 118.96 2no8 h ARG 38 Ca 0.33 -0.05 -0.10 0.00 -1.26 0.00 0.00 59.98 58.90 2no8 h ARG 38 Cb 0.28 -0.19 -0.01 0.00 -1.65 0.00 0.00 29.97 28.40 2no8 h ARG 38 CO -0.23 0.55 -0.11 1.05 0.56 0.00 0.00 179.97 181.79 2no8 h GLU 39 N 0.85 0.92 -0.28 0.04 4.11 -1.56 -2.69 114.58 115.97 2no8 h GLU 39 Ca 0.25 -0.35 -0.18 0.00 0.07 0.00 0.00 59.36 59.16 2no8 h GLU 39 Cb -0.05 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.15 2no8 h GLU 39 CO -0.08 1.00 -0.52 0.74 0.07 0.00 0.00 179.01 180.23 2no8 h PHE 40 N 0.77 1.01 0.00 2.06 0.04 -1.16 -2.61 116.94 117.05 2no8 h PHE 40 Ca 0.12 -0.35 0.00 0.00 2.80 0.00 0.00 57.97 60.54 2no8 h PHE 40 Cb 0.66 -0.19 0.00 0.00 2.20 0.00 0.00 35.95 38.62 2no8 h PHE 40 CO 0.05 1.16 0.00 0.93 -0.60 0.00 0.00 178.31 179.85 2no8 h GLU 41 N 0.63 0.00 0.13 1.51 4.39 -0.39 0.26 114.58 121.11 2no8 h GLU 41 Ca 0.02 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.44 2no8 h GLU 41 Cb 1.11 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.78 2no8 h GLU 41 CO 0.11 0.00 -1.24 -0.09 -1.16 0.00 0.00 179.01 176.63 2no8 h ARG 42 N 0.00 0.39 -0.21 2.33 9.65 -1.12 -1.31 114.38 124.10 2no8 h ARG 42 Ca 0.00 -0.60 -0.14 0.00 -1.10 0.00 0.00 59.98 58.14 2no8 h ARG 42 Cb 0.32 0.21 0.00 0.00 -1.39 0.00 0.00 29.97 29.11 2no8 h ARG 42 CO 0.00 1.26 -0.43 -0.07 2.80 0.00 0.00 179.97 183.53 2no8 h LEU 43 N 0.14 0.74 -0.05 3.80 3.38 -0.95 -3.22 115.31 119.15 2no8 h LEU 43 Ca -0.16 -0.55 -0.26 0.00 0.09 0.00 0.00 57.88 57.01 2no8 h LEU 43 Cb 1.94 -0.21 0.02 0.00 0.09 0.00 0.00 40.66 42.49 2no8 h LEU 43 CO 0.22 1.15 -1.03 0.71 0.09 0.00 0.00 178.44 179.58 2no8 h THR 44 N 0.36 1.33 -4.89 0.22 1.35 -1.12 -3.39 112.91 106.76 2no8 h THR 44 Ca 0.01 -2.35 -0.41 0.00 -0.55 0.00 0.00 66.41 63.11 2no8 h THR 44 Cb 1.03 2.43 0.05 0.00 -1.73 0.00 0.00 68.15 69.94 2no8 h THR 44 CO 0.10 0.72 -0.62 1.21 -0.25 0.00 0.00 175.52 176.67 2no8 n GLU 45 N -3.80 -5.26 -3.15 4.72 4.07 -0.50 -4.95 120.64 111.78 2no8 n GLU 45 Ca -0.10 0.84 -0.39 0.00 -0.06 0.00 0.00 57.16 57.45 2no8 n GLU 45 Cb 0.88 -5.72 -0.06 0.00 -0.06 0.00 0.00 31.44 26.49 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 -3.18 3.77 0.17 4.31 2.46 -1.24 -4.98 115.29 116.60 2no8 s HIS 46 Ca 0.38 1.34 -0.12 0.00 0.47 0.00 0.00 55.06 57.13 2no8 s HIS 46 Cb -0.17 -2.64 0.08 0.00 -0.13 0.00 0.00 32.58 29.72 2no8 s HIS 46 CO 0.47 0.44 1.74 -1.00 -2.47 0.00 0.00 174.74 173.92 2no8 h PRO 47 N 5.09 0.87 -0.09 2.88 0.13 -1.94 -3.18 132.00 135.77 2no8 h PRO 47 Ca -0.47 -0.14 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 2no8 h PRO 47 Cb 1.21 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.19 2no8 h PRO 47 CO 0.67 0.73 0.00 -0.25 -0.23 0.00 0.00 178.00 178.92 2no8 n ASP 48 N -4.50 2.79 -0.13 1.44 8.00 -1.26 -4.75 116.55 118.15 2no8 n ASP 48 Ca 0.04 -2.92 -0.04 0.00 0.71 0.00 0.00 54.79 52.58 2no8 n ASP 48 Cb 0.14 -0.41 0.04 0.00 -0.02 0.00 0.00 41.12 40.87 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 0.61 0.46 0.93 0.44 0.00 -1.96 0.51 103.07 104.06 2no8 h GLY 49 Ca 0.00 0.02 -0.03 0.00 0.00 0.00 0.00 47.33 47.32 2no8 h GLY 49 CO 0.06 -0.08 0.12 1.76 0.00 0.00 0.00 176.54 178.40 2no8 h SER 50 N 0.16 0.55 0.07 0.19 0.02 -1.85 -2.78 113.55 109.91 2no8 h SER 50 Ca 0.21 -0.21 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 2no8 h SER 50 Cb 0.28 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 62.67 2no8 h SER 50 CO -0.31 0.61 -0.07 0.44 -1.14 0.00 0.00 176.83 176.36 2no8 h ASP 51 N 0.46 0.00 -0.45 3.07 3.32 -1.48 -1.71 116.42 119.63 2no8 h ASP 51 Ca 0.12 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.17 2no8 h ASP 51 Cb 0.26 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 2no8 h ASP 51 CO -0.00 0.07 0.28 -0.07 -1.72 0.00 0.00 179.24 177.79 2no8 h LEU 52 N 0.00 0.55 0.09 1.55 3.38 0.24 0.62 115.31 121.74 2no8 h LEU 52 Ca -0.00 -0.03 -0.29 0.00 0.09 0.00 0.00 57.88 57.65 2no8 h LEU 52 Cb 0.12 -0.14 0.02 0.00 0.09 0.00 0.00 40.66 40.75 2no8 h LEU 52 CO 0.01 0.43 -1.22 0.40 0.09 0.00 0.00 178.44 178.15 2no8 h ILE 53 N 0.64 1.33 0.08 1.22 2.04 -1.34 -3.00 117.51 118.49 2no8 h ILE 53 Ca 0.17 -2.58 -0.30 0.00 1.00 0.00 0.00 64.86 63.16 2no8 h ILE 53 Cb -0.02 2.72 -0.02 0.00 -0.74 0.00 0.00 36.82 38.76 2no8 h ILE 53 CO -0.03 0.77 -1.55 1.88 0.00 0.00 0.00 178.15 179.22 2no8 h TYR 54 N 0.23 0.31 -2.54 1.37 0.05 -1.35 -3.42 116.97 111.62 2no8 h TYR 54 Ca -0.17 -0.23 -0.55 0.00 0.05 0.00 0.00 58.73 57.84 2no8 h TYR 54 Cb 1.90 -0.01 -0.38 0.00 1.01 0.00 0.00 36.73 39.24 2no8 h TYR 54 CO 0.10 1.30 -0.82 0.71 -1.05 0.00 0.00 178.16 178.40 2no8 s TYR 55 N -2.62 0.52 -0.52 4.88 2.02 0.22 -5.08 117.35 116.77 2no8 s TYR 55 Ca -0.08 -1.40 -0.27 0.00 -0.37 0.00 0.00 57.07 54.95 2no8 s TYR 55 Cb 0.07 -0.84 -0.03 0.00 -0.40 0.00 0.00 41.96 40.76 2no8 s TYR 55 CO 0.84 -0.85 1.97 -2.14 -1.57 0.00 0.00 175.55 173.80 2no8 s PRO 56 N 1.28 2.67 0.00 -1.71 0.02 -1.13 -4.16 135.00 131.98 2no8 s PRO 56 Ca 0.16 0.99 0.00 0.00 0.02 0.00 0.00 61.00 62.17 2no8 s PRO 56 Cb -0.21 -4.39 0.00 0.00 0.02 0.00 0.00 34.50 29.92 2no8 s PRO 56 CO -0.05 -2.65 0.00 0.54 -0.33 0.00 0.00 177.00 174.50 2no8 n ARG 57 N 8.98 0.00 0.02 5.54 1.74 -1.26 -4.73 116.66 126.95 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 0.51 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.95 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 0.39 0.16 0.55 2.03 -1.26 -4.87 116.55 113.55 2no8 n ASP 58 Ca 0.00 0.06 0.10 0.00 0.52 0.00 0.00 54.79 55.47 2no8 n ASP 58 Cb 0.00 -0.11 0.07 0.00 -0.72 0.00 0.00 41.12 40.37 2no8 n ASP 58 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 2no8 h ASP 59 N 0.00 0.00 -3.56 1.67 3.58 -2.04 -3.47 116.42 112.61 2no8 h ASP 59 Ca 0.00 0.00 -0.57 0.00 0.42 0.00 0.00 57.03 56.88 2no8 h ASP 59 Cb 0.00 0.00 0.15 0.00 1.72 0.00 0.00 39.33 41.20 2no8 h ASP 59 CO 0.00 0.11 0.20 0.54 -2.88 0.00 0.00 179.24 177.21 2no8 n ARG 60 N -2.96 1.08 -2.12 0.28 5.12 -1.26 -4.91 116.66 111.90 2no8 n ARG 60 Ca 0.01 0.41 -0.42 0.00 -1.93 0.00 0.00 57.85 55.92 2no8 n ARG 60 Cb 0.59 -2.20 -0.03 0.00 -1.16 0.00 0.00 32.46 29.65 2no8 n ARG 60 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 2no8 s GLU 61 N -2.65 4.28 -1.38 5.56 2.56 -1.26 -4.84 118.70 120.96 2no8 s GLU 61 Ca 0.73 2.11 -0.09 0.00 0.00 0.00 0.00 54.97 57.72 2no8 s GLU 61 Cb -0.44 -3.39 0.09 0.00 2.00 0.00 0.00 34.13 32.39 2no8 s GLU 61 CO 0.49 -0.54 2.29 -3.47 -0.56 0.00 0.00 175.26 173.47 2no8 n ASP 62 N 4.62 6.54 -4.02 -1.70 -0.08 -1.26 -4.34 116.55 116.31 2no8 n ASP 62 Ca 0.13 -2.99 -0.08 0.00 -1.51 0.00 0.00 54.79 50.34 2no8 n ASP 62 Cb 0.42 -1.48 -0.10 0.00 2.34 0.00 0.00 41.12 42.30 2no8 n ASP 62 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 2no8 s SER 63 N 1.25 0.35 0.42 1.67 1.04 -1.26 -4.98 113.70 112.19 2no8 s SER 63 Ca 0.51 -0.78 0.19 0.00 0.48 0.00 0.00 55.95 56.35 2no8 s SER 63 Cb 0.15 0.19 1.12 0.00 0.10 0.00 0.00 66.02 67.58 2no8 s SER 63 CO -0.05 -0.53 1.82 -0.65 0.98 0.00 0.00 173.24 174.81 2no8 h PRO 64 N 3.53 0.37 -0.22 4.02 0.11 -1.94 0.31 132.00 138.18 2no8 h PRO 64 Ca -0.33 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.71 2no8 h PRO 64 Cb 1.17 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 2no8 h PRO 64 CO 0.57 0.24 -0.05 0.93 -0.21 0.00 0.00 178.00 179.48 2no8 h GLU 65 N 0.38 0.42 -0.00 1.05 5.08 -1.93 -1.95 114.58 117.63 2no8 h GLU 65 Ca 0.52 -0.16 -0.06 0.00 -1.00 0.00 0.00 59.36 58.66 2no8 h GLU 65 Cb 1.35 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.57 2no8 h GLU 65 CO -0.21 0.66 -0.29 0.78 -1.00 0.00 0.00 179.01 178.95 2no8 h GLY 66 N 0.15 0.00 0.72 -3.84 0.00 -1.35 0.74 103.07 99.49 2no8 h GLY 66 Ca 0.06 -0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.35 2no8 h GLY 66 CO 0.02 0.00 -0.04 -2.22 0.00 0.00 0.00 176.54 174.30 2no8 h ILE 67 N 0.00 1.31 -0.81 2.60 2.04 -0.87 -0.84 117.51 120.94 2no8 h ILE 67 Ca -0.00 -1.03 0.07 0.00 1.00 0.00 0.00 64.86 64.90 2no8 h ILE 67 Cb 0.51 1.75 -0.05 0.00 -0.74 0.00 0.00 36.82 38.29 2no8 h ILE 67 CO 0.04 0.29 0.53 0.58 0.00 0.00 0.00 178.15 179.59 2no8 h VAL 68 N -0.11 1.03 -0.77 1.67 2.07 -0.99 -1.49 116.25 117.67 2no8 h VAL 68 Ca 0.03 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 2no8 h VAL 68 Cb 0.48 0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.31 2no8 h VAL 68 CO 0.01 0.16 0.43 0.50 0.02 0.00 0.00 177.57 178.69 2no8 h LYS 69 N 0.86 1.06 -0.65 1.57 1.63 -0.54 0.37 116.57 120.88 2no8 h LYS 69 Ca 0.35 -0.12 0.04 0.00 -0.85 0.00 0.00 60.65 60.07 2no8 h LYS 69 Cb 0.26 -0.21 -0.05 0.00 -0.60 0.00 0.00 32.23 31.63 2no8 h LYS 69 CO -0.13 0.78 0.38 0.93 -3.45 0.00 0.00 179.45 177.97 2no8 h GLU 70 N 1.06 0.71 -0.49 1.90 4.39 -0.17 0.37 114.58 122.35 2no8 h GLU 70 Ca 0.27 -0.04 -0.09 0.00 0.34 0.00 0.00 59.36 59.83 2no8 h GLU 70 Cb 0.02 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 28.49 2no8 h GLU 70 CO -0.05 0.47 -0.06 0.82 -1.16 0.00 0.00 179.01 179.04 2no8 h ILE 71 N 0.74 1.27 0.79 3.13 1.08 -0.54 -2.36 117.51 121.62 2no8 h ILE 71 Ca 0.27 -1.17 -0.04 0.00 -0.39 0.00 0.00 64.86 63.53 2no8 h ILE 71 Cb 0.08 1.04 0.01 0.00 -3.07 0.00 0.00 36.82 34.88 2no8 h ILE 71 CO -0.13 0.41 -0.38 0.50 -0.69 0.00 0.00 178.15 177.85 2no8 h LYS 72 N 0.75 -1.03 -0.49 2.37 1.63 0.21 -2.00 116.57 118.02 2no8 h LYS 72 Ca 0.13 0.07 -0.05 0.00 -0.85 0.00 0.00 60.65 59.95 2no8 h LYS 72 Cb 0.60 0.23 -0.02 0.00 -0.60 0.00 0.00 32.23 32.44 2no8 h LYS 72 CO 0.04 -0.68 0.11 0.93 -3.45 0.00 0.00 179.45 176.40 2no8 h GLU 73 N -1.24 0.74 -0.05 1.90 4.39 -0.33 0.12 114.58 120.11 2no8 h GLU 73 Ca -0.11 -0.15 -0.11 0.00 0.34 0.00 0.00 59.36 59.34 2no8 h GLU 73 Cb 0.83 -0.11 0.01 0.00 -0.10 0.00 0.00 28.75 29.37 2no8 h GLU 73 CO 0.18 0.68 -0.39 2.35 -1.16 0.00 0.00 179.01 180.67 2no8 h TRP 74 N 0.72 0.48 -0.10 4.33 7.01 -1.49 -2.62 115.95 124.29 2no8 h TRP 74 Ca 0.16 -0.23 -0.18 0.00 2.11 0.00 0.00 58.89 60.75 2no8 h TRP 74 Cb 0.28 -0.07 -0.01 0.00 -2.10 0.00 0.00 29.16 27.27 2no8 h TRP 74 CO 0.01 1.00 -0.69 0.00 -2.79 0.00 0.00 178.44 175.98 2no8 h ARG 75 N -0.17 0.42 -0.05 2.65 3.08 -1.10 -0.69 114.38 118.52 2no8 h ARG 75 Ca -0.04 -0.32 -0.08 0.00 0.07 0.00 0.00 59.98 59.61 2no8 h ARG 75 Cb 1.07 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.17 2no8 h ARG 75 CO 0.08 0.95 -0.35 0.00 -1.07 0.00 0.00 179.97 179.59 2no8 h ALA 76 N 0.96 1.33 0.19 0.04 0.00 -0.85 0.96 119.26 121.90 2no8 h ALA 76 Ca -0.02 -0.34 -0.31 0.00 0.00 0.00 0.00 54.91 54.24 2no8 h ALA 76 Cb 1.25 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 18.99 2no8 h ALA 76 CO 0.12 0.48 -1.48 0.00 0.00 0.00 0.00 179.25 178.37 2no8 h ALA 77 N 1.56 0.02 -0.20 0.00 0.00 -1.29 -3.32 119.26 116.03 2no8 h ALA 77 Ca 0.01 -0.98 -0.10 0.00 0.00 0.00 0.00 54.91 53.84 2no8 h ALA 77 Cb 0.66 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2no8 h ALA 77 CO 0.05 0.79 -0.31 -0.91 0.00 0.00 0.00 179.25 178.86 2no8 h ASN 78 N -0.02 0.40 -0.05 0.00 2.35 -1.01 -3.47 115.58 113.79 2no8 h ASN 78 Ca -0.28 -0.15 0.00 0.00 -0.55 0.00 0.00 56.30 55.32 2no8 h ASN 78 Cb 2.01 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 40.26 2no8 h ASN 78 CO 0.19 0.70 0.00 0.61 -1.65 0.00 0.00 177.43 177.28 2no8 n GLY 79 N -0.30 1.45 1.24 2.83 0.00 0.12 -5.07 105.19 105.45 2no8 n GLY 79 Ca -0.01 -0.08 -0.07 0.00 0.00 0.00 0.00 46.02 45.86 2no8 n GLY 79 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2no8 n LYS 80 N -0.57 0.53 -0.69 1.61 5.02 0.01 -5.05 118.16 119.03 2no8 n LYS 80 Ca 0.00 -0.90 -0.28 0.00 -2.02 0.00 0.00 58.31 55.10 2no8 n LYS 80 Cb 0.05 -0.17 0.24 0.00 -0.02 0.00 0.00 35.03 35.13 2no8 n LYS 80 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2no8 s SER 81 N -2.25 1.02 0.00 4.39 0.01 -1.26 -4.76 113.70 110.84 2no8 s SER 81 Ca 0.21 1.30 0.00 0.00 1.31 0.00 0.00 55.95 58.76 2no8 s SER 81 Cb -0.01 -2.00 0.00 0.00 0.21 0.00 0.00 66.02 64.21 2no8 s SER 81 CO 0.13 -4.14 0.00 0.61 0.41 0.00 0.00 173.24 170.25 2no8 n GLY 82 N 0.36 6.00 3.68 3.44 0.00 -1.26 -4.69 105.19 112.71 2no8 n GLY 82 Ca 0.04 -1.74 -0.24 0.00 0.00 0.00 0.00 46.02 44.08 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 1.24 2.59 0.16 1.61 0.08 -1.26 -2.80 117.98 119.60 2no8 s PHE 83 Ca 0.00 -0.48 -0.30 0.00 0.12 0.00 0.00 56.93 56.27 2no8 s PHE 83 Cb 0.00 -1.66 -0.07 0.00 -0.57 0.00 0.00 43.02 40.73 2no8 s PHE 83 CO 0.00 0.37 0.96 0.21 -0.10 0.00 0.00 175.22 176.66 2no8 s LYS 84 N -3.79 4.75 0.00 0.44 2.47 0.11 -4.86 119.74 118.86 2no8 s LYS 84 Ca 0.37 1.48 0.21 0.00 -1.56 0.00 0.00 55.97 56.46 2no8 s LYS 84 Cb 0.01 -3.34 0.13 0.00 -1.46 0.00 0.00 37.83 33.17 2no8 s LYS 84 CO 0.21 0.31 1.12 0.00 0.16 0.00 0.00 175.35 177.15 2no8 n GLN 85 N 2.33 1.79 0.00 4.03 0.00 -1.26 -2.77 117.38 121.50 2no8 n GLN 85 Ca 0.01 -1.56 0.00 0.00 0.00 0.00 0.00 57.00 55.45 2no8 n GLN 85 Cb 0.48 -1.40 0.00 0.00 0.00 0.00 0.00 30.24 29.33 2no8 n GLN 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47