#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 2.59 0.00 -1.84 1.43 -1.26 -5.15 118.68 114.45 2no8 s LEU 3 Ca 0.00 -1.04 0.04 0.00 -1.03 0.00 0.00 54.13 52.10 2no8 s LEU 3 Cb 0.00 -0.99 0.04 0.00 0.03 0.00 0.00 46.19 45.27 2no8 s LEU 3 CO 0.00 -0.03 0.34 2.29 0.23 0.00 0.00 176.35 179.18 2no8 n LYS 4 N -0.57 0.88 0.00 1.70 2.85 -1.26 -5.05 118.16 116.71 2no8 n LYS 4 Ca -0.06 -1.48 0.00 0.00 -1.05 0.00 0.00 58.31 55.72 2no8 n LYS 4 Cb 0.60 -0.05 0.00 0.00 -0.65 0.00 0.00 35.03 34.93 2no8 n LYS 4 CO 0.00 0.00 0.00 -2.39 -0.05 0.00 0.00 177.40 174.96 2no8 n HIS 5 N -1.49 0.00 -3.83 5.58 1.44 -1.26 -5.11 115.22 110.55 2no8 n HIS 5 Ca 0.06 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.76 2no8 n HIS 5 Cb 0.28 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.40 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 -0.40 -1.18 0.04 4.39 3.41 -1.26 -5.00 113.62 113.62 2no8 n SER 6 Ca 0.00 -1.54 -0.08 0.00 -0.26 0.00 0.00 58.87 56.99 2no8 n SER 6 Cb 0.03 1.90 0.07 0.00 -0.26 0.00 0.00 64.21 65.95 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 1.73 1.34 -0.09 -1.33 2.10 -1.89 -3.12 117.51 116.25 2no8 h ILE 7 Ca -0.19 -1.88 0.00 0.00 1.08 0.00 0.00 64.86 63.87 2no8 h ILE 7 Cb 0.88 1.88 0.00 0.00 -1.09 0.00 0.00 36.82 38.49 2no8 h ILE 7 CO 0.26 0.57 0.00 -1.54 -1.08 0.00 0.00 178.15 176.36 2no8 n SER 8 N -3.92 0.58 0.07 2.19 3.41 -1.24 -1.42 113.62 113.29 2no8 n SER 8 Ca -0.03 -1.84 -0.04 0.00 -0.26 0.00 0.00 58.87 56.70 2no8 n SER 8 Cb 0.62 -0.06 -0.07 0.00 -0.26 0.00 0.00 64.21 64.43 2no8 n SER 8 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 2no8 h ASP 9 N 0.67 0.00 -3.61 4.04 1.82 -1.87 -3.25 116.42 114.22 2no8 h ASP 9 Ca 0.00 0.00 -0.51 0.00 -0.39 0.00 0.00 57.03 56.13 2no8 h ASP 9 Cb 0.15 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 40.13 2no8 h ASP 9 CO 0.00 0.81 0.12 -0.31 -1.61 0.00 0.00 179.24 178.25 2no8 s TYR 10 N -2.79 3.61 0.87 0.28 2.02 -0.51 -4.79 117.35 116.04 2no8 s TYR 10 Ca 0.01 1.39 -0.13 0.00 -0.37 0.00 0.00 57.07 57.97 2no8 s TYR 10 Cb 0.09 -2.63 0.14 0.00 -0.40 0.00 0.00 41.96 39.16 2no8 s TYR 10 CO 0.80 0.30 1.22 0.95 -1.57 0.00 0.00 175.55 177.24 2no8 s THR 11 N -1.59 2.04 0.29 -0.71 -4.23 -1.26 -0.09 115.64 110.09 2no8 s THR 11 Ca 0.45 -0.08 -0.02 0.00 -1.18 0.00 0.00 61.69 60.86 2no8 s THR 11 Cb -0.16 -2.96 0.22 0.00 1.34 0.00 0.00 72.50 70.94 2no8 s THR 11 CO 0.21 0.00 1.92 -0.08 -0.54 0.00 0.00 174.62 176.12 2no8 h GLU 12 N -1.26 1.02 -0.30 3.99 4.81 -1.90 -0.08 114.58 120.86 2no8 h GLU 12 Ca -0.44 -0.11 -0.09 0.00 -0.13 0.00 0.00 59.36 58.59 2no8 h GLU 12 Cb 1.28 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 30.44 2no8 h GLU 12 CO 0.49 0.74 -0.17 0.00 -0.73 0.00 0.00 179.01 179.35 2no8 h ALA 13 N 1.42 0.42 -0.17 2.92 0.00 -1.92 0.16 119.26 122.09 2no8 h ALA 13 Ca 0.26 -0.34 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 2no8 h ALA 13 Cb 0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2no8 h ALA 13 CO -0.04 0.33 -0.41 0.93 0.00 0.00 0.00 179.25 180.06 2no8 h GLU 14 N 0.38 0.39 -0.00 0.00 4.39 -1.84 -0.89 114.58 117.02 2no8 h GLU 14 Ca 0.06 -0.19 -0.19 0.00 0.34 0.00 0.00 59.36 59.38 2no8 h GLU 14 Cb 0.70 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.33 2no8 h GLU 14 CO 0.05 0.73 -0.84 0.35 -1.16 0.00 0.00 179.01 178.14 2no8 h PHE 15 N 0.32 0.24 0.00 4.33 3.57 -0.96 -2.66 116.94 121.80 2no8 h PHE 15 Ca 0.03 -0.13 -0.02 0.00 3.53 0.00 0.00 57.97 61.38 2no8 h PHE 15 Cb 0.86 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.57 2no8 h PHE 15 CO 0.02 0.93 -0.08 1.25 -2.23 0.00 0.00 178.31 178.20 2no8 h LEU 16 N 0.09 0.00 -0.73 0.59 6.46 -0.11 0.37 115.31 121.99 2no8 h LEU 16 Ca -0.04 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.72 2no8 h LEU 16 Cb 1.46 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.39 2no8 h LEU 16 CO 0.13 0.08 0.00 -0.33 -0.62 0.00 0.00 178.44 177.70 2no8 h GLU 17 N 0.00 0.00 -0.22 1.25 5.08 -0.83 -3.18 114.58 116.68 2no8 h GLU 17 Ca -0.00 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.41 2no8 h GLU 17 Cb 0.47 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.66 2no8 h GLU 17 CO 0.01 0.00 -0.16 0.27 -1.00 0.00 0.00 179.01 178.13 2no8 h PHE 18 N 0.00 -0.41 -0.14 4.33 -0.00 -0.02 0.33 116.94 121.03 2no8 h PHE 18 Ca 0.00 0.03 -0.18 0.00 -0.00 0.00 0.00 57.97 57.82 2no8 h PHE 18 Cb 0.73 0.22 -0.00 0.00 -0.00 0.00 0.00 35.95 36.90 2no8 h PHE 18 CO 0.00 -0.23 -0.67 -0.24 -0.00 0.00 0.00 178.31 177.17 2no8 h VAL 19 N -0.16 1.33 -0.49 0.88 3.04 -1.63 -1.22 116.25 118.00 2no8 h VAL 19 Ca 0.13 -1.97 -0.12 0.00 -1.01 0.00 0.00 66.70 63.73 2no8 h VAL 19 Cb 0.35 1.94 -0.01 0.00 -2.01 0.00 0.00 31.29 31.56 2no8 h VAL 19 CO -0.32 0.61 -0.17 0.11 -1.01 0.00 0.00 177.57 176.79 2no8 h LYS 20 N 0.40 0.99 -0.66 4.17 1.57 -1.45 -0.17 116.57 121.42 2no8 h LYS 20 Ca -0.02 -0.40 -0.04 0.00 -1.87 0.00 0.00 60.65 58.32 2no8 h LYS 20 Cb 1.24 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.48 2no8 h LYS 20 CO 0.12 1.08 0.25 -0.22 -0.57 0.00 0.00 179.45 180.12 2no8 h LYS 21 N 0.84 0.98 -0.19 3.15 3.64 -0.07 -1.40 116.57 123.52 2no8 h LYS 21 Ca 0.12 -0.17 -0.03 0.00 -1.27 0.00 0.00 60.65 59.30 2no8 h LYS 21 Cb 0.75 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.39 2no8 h LYS 21 CO 0.06 0.80 -0.02 0.82 -2.27 0.00 0.00 179.45 178.85 2no8 h ILE 22 N 0.96 1.27 -0.55 2.00 2.04 -0.93 -0.97 117.51 121.33 2no8 h ILE 22 Ca 0.22 -0.93 0.10 0.00 1.00 0.00 0.00 64.86 65.26 2no8 h ILE 22 Cb 0.20 1.50 -0.03 0.00 -0.74 0.00 0.00 36.82 37.75 2no8 h ILE 22 CO -0.02 0.28 0.37 0.00 0.00 0.00 0.00 178.15 178.79 2no8 n ARG 24 N -4.46 2.61 0.00 0.00 1.85 -0.58 -4.62 116.66 111.46 2no8 n ARG 24 Ca 0.09 -2.47 0.00 0.00 -1.00 0.00 0.00 57.85 54.47 2no8 n ARG 24 Cb 0.40 -1.54 0.00 0.00 -1.05 0.00 0.00 32.46 30.26 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 1.57 2.40 -0.90 2.89 0.00 0.19 -4.35 120.51 122.31 2no8 n ALA 25 Ca 0.22 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.56 2no8 n ALA 25 Cb 0.61 -1.00 -0.14 0.00 0.00 0.00 0.00 19.45 18.92 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 -0.31 1.81 0.25 0.00 1.02 -1.26 -3.76 120.64 118.38 2no8 n GLU 26 Ca 0.00 -0.84 -0.13 0.00 -0.02 0.00 0.00 57.16 56.18 2no8 n GLU 26 Cb 0.08 -1.85 -0.07 0.00 -0.02 0.00 0.00 31.44 29.58 2no8 n GLU 26 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 2no8 h GLY 27 N 4.75 -0.69 0.00 0.62 0.00 -1.98 -3.42 103.07 102.34 2no8 h GLY 27 Ca 0.16 0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.75 2no8 h GLY 27 CO 0.20 -0.25 -0.23 0.00 0.00 0.00 0.00 176.54 176.26 2no8 n ALA 28 N -2.63 0.20 -3.42 3.60 0.00 -1.26 -5.11 120.51 111.90 2no8 n ALA 28 Ca -0.10 -0.37 -0.10 0.00 0.00 0.00 0.00 53.44 52.87 2no8 n ALA 28 Cb 0.30 0.01 -0.02 0.00 0.00 0.00 0.00 19.45 19.74 2no8 n ALA 28 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2no8 s THR 29 N -1.44 0.00 0.60 0.00 -4.23 -1.26 -5.04 115.64 104.27 2no8 s THR 29 Ca -0.07 -1.26 0.29 0.00 -1.18 0.00 0.00 61.69 59.48 2no8 s THR 29 Cb 0.01 -2.55 0.36 0.00 1.34 0.00 0.00 72.50 71.66 2no8 s THR 29 CO 0.10 0.00 2.04 1.05 -0.54 0.00 0.00 174.62 177.26 2no8 h GLU 30 N 2.08 0.00 0.00 3.99 4.11 -1.95 0.06 114.58 122.88 2no8 h GLU 30 Ca -0.28 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.14 2no8 h GLU 30 Cb 1.25 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.50 2no8 h GLU 30 CO 0.37 0.00 -0.04 1.05 0.07 0.00 0.00 179.01 180.46 2no8 h GLU 31 N 0.00 0.00 -0.31 1.06 4.11 -1.96 -0.80 114.58 116.68 2no8 h GLU 31 Ca 0.11 0.00 -0.16 0.00 0.07 0.00 0.00 59.36 59.38 2no8 h GLU 31 Cb 0.68 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.93 2no8 h GLU 31 CO -0.00 0.04 -0.42 0.22 0.07 0.00 0.00 179.01 178.91 2no8 h ASP 32 N 0.00 0.92 0.35 3.06 1.82 -1.24 0.10 116.42 121.44 2no8 h ASP 32 Ca -0.00 -0.50 -0.02 0.00 -0.39 0.00 0.00 57.03 56.13 2no8 h ASP 32 Cb 0.70 -0.26 0.00 0.00 0.68 0.00 0.00 39.33 40.45 2no8 h ASP 32 CO 0.00 1.23 -0.19 -0.78 -1.61 0.00 0.00 179.24 177.90 2no8 h ASP 33 N 0.62 -0.45 -0.73 2.28 1.82 -1.53 -3.01 116.42 115.41 2no8 h ASP 33 Ca 0.04 0.02 -0.02 0.00 -0.39 0.00 0.00 57.03 56.68 2no8 h ASP 33 Cb 1.02 0.13 -0.03 0.00 0.68 0.00 0.00 39.33 41.12 2no8 h ASP 33 CO 0.10 -0.31 0.37 -1.13 -1.61 0.00 0.00 179.24 176.66 2no8 h ASN 34 N -0.50 0.93 0.48 2.28 -1.24 -1.05 -1.95 115.58 114.53 2no8 h ASN 34 Ca -0.04 -0.12 -0.02 0.00 0.71 0.00 0.00 56.30 56.83 2no8 h ASN 34 Cb 0.40 -0.24 -0.00 0.00 0.73 0.00 0.00 38.32 39.21 2no8 h ASN 34 CO 0.06 0.78 -0.10 0.07 -1.29 0.00 0.00 177.43 176.95 2no8 h LYS 35 N 1.01 0.00 0.05 6.67 2.10 -0.96 0.20 116.57 125.65 2no8 h LYS 35 Ca 0.25 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.90 2no8 h LYS 35 Cb 0.08 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.41 2no8 h LYS 35 CO -0.04 0.10 -0.02 -0.07 -2.00 0.00 0.00 179.45 177.42 2no8 h LEU 36 N 0.00 -0.06 -0.59 7.07 3.38 -1.24 -3.21 115.31 120.66 2no8 h LEU 36 Ca -0.00 -0.48 0.12 0.00 0.09 0.00 0.00 57.88 57.61 2no8 h LEU 36 Cb 0.37 0.02 -0.09 0.00 0.09 0.00 0.00 40.66 41.05 2no8 h LEU 36 CO 0.01 0.46 0.07 0.58 0.09 0.00 0.00 178.44 179.66 2no8 h VAL 37 N -0.60 0.59 0.00 1.22 2.07 -0.69 -1.51 116.25 117.33 2no8 h VAL 37 Ca -0.01 -0.06 -0.03 0.00 0.82 0.00 0.00 66.70 67.41 2no8 h VAL 37 Cb 0.53 0.38 -0.00 0.00 -1.52 0.00 0.00 31.29 30.68 2no8 h VAL 37 CO 0.01 0.03 -0.16 0.03 0.02 0.00 0.00 177.57 177.51 2no8 h ARG 38 N 0.19 0.00 0.18 1.57 3.08 -1.08 0.16 114.38 118.48 2no8 h ARG 38 Ca 0.31 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 60.05 2no8 h ARG 38 Cb 0.48 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.54 2no8 h ARG 38 CO -0.44 0.16 -1.45 1.05 -1.07 0.00 0.00 179.97 178.21 2no8 h GLU 39 N 0.00 0.39 -0.52 0.04 4.11 -1.30 -3.19 114.58 114.10 2no8 h GLU 39 Ca -0.00 -0.66 -0.06 0.00 0.07 0.00 0.00 59.36 58.70 2no8 h GLU 39 Cb 0.33 0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.80 2no8 h GLU 39 CO 0.02 1.32 0.07 0.74 0.07 0.00 0.00 179.01 181.23 2no8 h PHE 40 N -0.05 0.86 0.00 2.06 0.04 -1.00 -1.33 116.94 117.52 2no8 h PHE 40 Ca -0.28 -0.10 0.00 0.00 2.80 0.00 0.00 57.97 60.39 2no8 h PHE 40 Cb 1.97 -0.24 0.00 0.00 2.20 0.00 0.00 35.95 39.88 2no8 h PHE 40 CO 0.13 0.76 0.00 0.93 -0.60 0.00 0.00 178.31 179.53 2no8 h GLU 41 N 0.78 0.00 0.01 1.51 4.39 -0.82 -0.57 114.58 119.89 2no8 h GLU 41 Ca 0.16 0.00 -0.25 0.00 0.34 0.00 0.00 59.36 59.62 2no8 h GLU 41 Cb 0.38 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.99 2no8 h GLU 41 CO 0.01 0.00 -1.29 -0.09 -1.16 0.00 0.00 179.01 176.48 2no8 h ARG 42 N 0.00 0.02 -0.14 2.33 9.65 -1.24 -0.27 114.38 124.73 2no8 h ARG 42 Ca 0.00 -0.04 -0.11 0.00 -1.10 0.00 0.00 59.98 58.73 2no8 h ARG 42 Cb 0.40 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.00 2no8 h ARG 42 CO 0.00 0.84 -0.33 -0.07 2.80 0.00 0.00 179.97 183.21 2no8 h LEU 43 N 0.01 0.52 -0.00 3.80 3.38 -0.83 -3.29 115.31 118.90 2no8 h LEU 43 Ca -0.12 -0.58 -0.21 0.00 0.09 0.00 0.00 57.88 57.06 2no8 h LEU 43 Cb 1.88 -0.15 0.02 0.00 0.09 0.00 0.00 40.66 42.49 2no8 h LEU 43 CO 0.12 1.00 -0.80 0.71 0.09 0.00 0.00 178.44 179.56 2no8 h THR 44 N 0.07 1.36 -1.73 0.22 1.35 -1.24 -3.44 112.91 109.50 2no8 h THR 44 Ca -0.00 -2.15 -0.33 0.00 -0.55 0.00 0.00 66.41 63.37 2no8 h THR 44 Cb 0.93 2.50 -0.06 0.00 -1.73 0.00 0.00 68.15 69.79 2no8 h THR 44 CO 0.07 0.65 -0.38 -0.62 -0.25 0.00 0.00 175.52 174.99 2no8 n GLU 45 N -4.05 -1.25 -2.55 4.72 1.02 -0.11 -4.95 120.64 113.46 2no8 n GLU 45 Ca -0.11 0.91 -0.42 0.00 -0.02 0.00 0.00 57.16 57.53 2no8 n GLU 45 Cb 0.77 -5.24 -0.03 0.00 -0.02 0.00 0.00 31.44 26.91 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 -2.74 3.58 0.20 -0.32 2.46 -1.25 -4.94 115.29 112.29 2no8 s HIS 46 Ca 0.00 1.55 -0.10 0.00 0.47 0.00 0.00 55.06 56.97 2no8 s HIS 46 Cb 0.00 -3.26 0.14 0.00 -0.13 0.00 0.00 32.58 29.33 2no8 s HIS 46 CO 0.00 -0.60 1.84 -1.00 -2.47 0.00 0.00 174.74 172.51 2no8 h PRO 47 N 6.11 1.01 -0.23 2.88 0.13 -1.94 -2.69 132.00 137.27 2no8 h PRO 47 Ca -0.42 -0.10 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 2no8 h PRO 47 Cb 1.21 -0.21 0.00 0.00 0.13 0.00 0.00 31.00 32.14 2no8 h PRO 47 CO 0.76 0.73 0.00 -0.25 -0.23 0.00 0.00 178.00 179.01 2no8 n ASP 48 N -4.50 3.34 -0.01 1.44 9.92 -1.26 -4.67 116.55 120.81 2no8 n ASP 48 Ca 0.07 -2.71 -0.11 0.00 -0.53 0.00 0.00 54.79 51.51 2no8 n ASP 48 Cb 0.07 -0.42 -0.05 0.00 -0.64 0.00 0.00 41.12 40.08 2no8 n ASP 48 CO 0.00 0.00 0.00 1.23 0.13 0.00 0.00 177.20 178.56 2no8 h GLY 49 N 1.51 0.18 1.45 0.44 0.00 -1.87 0.32 103.07 105.10 2no8 h GLY 49 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.27 2no8 h GLY 49 CO 0.13 0.06 0.00 -1.14 0.00 0.00 0.00 176.54 175.59 2no8 n SER 50 N -5.01 0.00 0.00 0.19 3.41 -1.26 -2.28 113.62 108.68 2no8 n SER 50 Ca -0.05 -0.20 -0.22 0.00 -0.26 0.00 0.00 58.87 58.15 2no8 n SER 50 Cb 0.03 -0.23 -0.14 0.00 -0.26 0.00 0.00 64.21 63.62 2no8 n SER 50 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2no8 h ASP 51 N 0.00 0.40 -0.95 4.04 3.32 -1.35 -3.40 116.42 118.49 2no8 h ASP 51 Ca 0.00 -0.92 0.27 0.00 0.02 0.00 0.00 57.03 56.40 2no8 h ASP 51 Cb 0.17 -0.13 -0.14 0.00 0.22 0.00 0.00 39.33 39.45 2no8 h ASP 51 CO 0.00 1.82 0.44 -0.07 -1.72 0.00 0.00 179.24 179.71 2no8 h LEU 52 N -0.02 0.34 -0.08 1.55 3.38 -0.03 0.48 115.31 120.93 2no8 h LEU 52 Ca -0.41 0.18 -0.22 0.00 0.09 0.00 0.00 57.88 57.53 2no8 h LEU 52 Cb 1.97 0.16 -0.02 0.00 0.09 0.00 0.00 40.66 42.87 2no8 h LEU 52 CO 0.07 -0.09 -1.00 0.40 0.09 0.00 0.00 178.44 177.91 2no8 h ILE 53 N 0.33 1.60 0.06 1.22 2.04 -1.77 -3.33 117.51 117.66 2no8 h ILE 53 Ca 0.64 -3.08 -0.37 0.00 1.00 0.00 0.00 64.86 63.05 2no8 h ILE 53 Cb 1.34 2.74 -0.04 0.00 -0.74 0.00 0.00 36.82 40.12 2no8 h ILE 53 CO -0.59 0.89 -2.16 -1.22 0.00 0.00 0.00 178.15 175.06 2no8 n TYR 54 N -3.49 0.72 -4.42 1.37 4.01 -0.20 -4.94 117.16 110.21 2no8 n TYR 54 Ca -0.03 0.17 -0.19 0.00 -0.16 0.00 0.00 57.90 57.68 2no8 n TYR 54 Cb 0.91 -1.10 -0.15 0.00 -0.31 0.00 0.00 39.34 38.69 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 -2.54 0.91 0.62 -0.72 2.02 0.15 -5.12 117.35 112.66 2no8 s TYR 55 Ca -0.24 -0.18 -0.16 0.00 -0.37 0.00 0.00 57.07 56.12 2no8 s TYR 55 Cb 0.07 -0.59 -0.02 0.00 -0.40 0.00 0.00 41.96 41.02 2no8 s TYR 55 CO 0.72 -0.03 1.09 -1.25 -1.57 0.00 0.00 175.55 174.52 2no8 s PRO 56 N -0.18 3.08 0.00 -1.71 0.04 -1.26 -3.97 135.00 131.01 2no8 s PRO 56 Ca 0.03 1.35 0.00 0.00 0.04 0.00 0.00 61.00 62.42 2no8 s PRO 56 Cb -0.05 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.50 2no8 s PRO 56 CO -0.00 -1.02 0.00 0.54 0.04 0.00 0.00 177.00 176.56 2no8 n ARG 57 N -2.10 0.00 0.00 4.56 1.74 -1.26 -5.03 116.66 114.57 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 0.00 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 0.01 0.14 0.55 -0.08 -1.26 -4.89 116.55 111.03 2no8 n ASP 58 Ca 0.00 0.00 0.12 0.00 -1.51 0.00 0.00 54.79 53.40 2no8 n ASP 58 Cb 0.00 -0.00 0.09 0.00 2.34 0.00 0.00 41.12 43.55 2no8 n ASP 58 CO 0.00 0.00 0.00 -0.78 0.12 0.00 0.00 177.20 176.54 2no8 h ASP 59 N 0.00 0.00 -3.53 1.67 3.58 -2.06 -3.46 116.42 112.62 2no8 h ASP 59 Ca 0.00 -0.02 -0.52 0.00 0.42 0.00 0.00 57.03 56.91 2no8 h ASP 59 Cb 0.00 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.02 2no8 h ASP 59 CO 0.00 0.01 0.03 -0.60 -2.88 0.00 0.00 179.24 175.80 2no8 s ARG 60 N -3.28 4.06 0.27 0.28 6.06 -1.26 -5.03 118.95 120.05 2no8 s ARG 60 Ca 0.03 0.64 -0.30 0.00 -2.50 0.00 0.00 55.73 53.61 2no8 s ARG 60 Cb 0.08 -2.75 -0.10 0.00 0.06 0.00 0.00 34.95 32.25 2no8 s ARG 60 CO 0.73 0.35 1.35 -2.00 -2.50 0.00 0.00 175.30 173.23 2no8 s GLU 61 N -2.34 4.34 -1.14 5.12 2.56 -1.26 -4.65 118.70 121.33 2no8 s GLU 61 Ca 0.45 2.20 -0.13 0.00 0.00 0.00 0.00 54.97 57.49 2no8 s GLU 61 Cb -0.14 -3.12 0.19 0.00 2.00 0.00 0.00 34.13 33.07 2no8 s GLU 61 CO 0.20 -0.28 1.30 0.34 -0.56 0.00 0.00 175.26 176.26 2no8 s ASP 62 N 0.01 7.07 0.09 -1.70 2.15 -1.26 -4.24 116.67 118.79 2no8 s ASP 62 Ca 0.54 -3.01 -0.10 0.00 0.43 0.00 0.00 52.55 50.41 2no8 s ASP 62 Cb -0.39 -2.35 0.01 0.00 -0.30 0.00 0.00 42.92 39.88 2no8 s ASP 62 CO 0.46 -0.67 0.23 -0.94 -0.17 0.00 0.00 175.17 174.08 2no8 s SER 63 N 2.56 0.04 0.41 -0.34 1.04 -1.26 -4.96 113.70 111.19 2no8 s SER 63 Ca 0.38 -0.56 0.16 0.00 0.48 0.00 0.00 55.95 56.40 2no8 s SER 63 Cb -0.05 0.36 1.04 0.00 0.10 0.00 0.00 66.02 67.47 2no8 s SER 63 CO -0.03 -0.74 1.88 -0.65 0.98 0.00 0.00 173.24 174.68 2no8 h PRO 64 N 2.72 0.43 -0.37 4.02 0.11 -1.94 -0.09 132.00 136.87 2no8 h PRO 64 Ca -0.34 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 65.61 2no8 h PRO 64 Cb 1.21 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 2no8 h PRO 64 CO 0.54 0.29 -0.28 0.93 -0.21 0.00 0.00 178.00 179.26 2no8 h GLU 65 N 0.44 0.84 -0.29 1.05 5.08 -1.94 -2.87 114.58 116.90 2no8 h GLU 65 Ca 0.43 -0.41 -0.14 0.00 -1.00 0.00 0.00 59.36 58.24 2no8 h GLU 65 Cb 0.99 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.23 2no8 h GLU 65 CO -0.16 1.05 -0.38 0.78 -1.00 0.00 0.00 179.01 179.31 2no8 h GLY 66 N 0.64 0.72 0.65 -3.84 0.00 -1.41 -0.75 103.07 99.08 2no8 h GLY 66 Ca 0.07 -0.71 0.02 0.00 0.00 0.00 0.00 47.33 46.71 2no8 h GLY 66 CO 0.07 0.64 -0.18 -2.22 0.00 0.00 0.00 176.54 174.85 2no8 h ILE 67 N 0.55 0.58 -0.48 2.60 2.04 -1.01 0.21 117.51 122.00 2no8 h ILE 67 Ca 0.05 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.92 2no8 h ILE 67 Cb 0.90 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.53 2no8 h ILE 67 CO 0.08 0.00 0.32 0.58 0.00 0.00 0.00 178.15 179.13 2no8 h VAL 68 N -0.34 1.10 -0.26 1.67 2.07 -1.45 -1.04 116.25 118.01 2no8 h VAL 68 Ca 0.03 -0.21 -0.14 0.00 0.82 0.00 0.00 66.70 67.20 2no8 h VAL 68 Cb 0.37 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 2no8 h VAL 68 CO -0.12 0.11 -0.42 0.50 0.02 0.00 0.00 177.57 177.66 2no8 h LYS 69 N 0.61 0.62 -0.36 1.57 3.11 -0.02 0.17 116.57 122.28 2no8 h LYS 69 Ca 0.18 -0.33 -0.04 0.00 -2.81 0.00 0.00 60.65 57.66 2no8 h LYS 69 Cb -0.02 0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 31.21 2no8 h LYS 69 CO -0.04 0.93 0.08 1.49 -2.81 0.00 0.00 179.45 179.09 2no8 h GLU 70 N 0.51 0.58 -0.51 1.90 4.57 0.18 0.11 114.58 121.92 2no8 h GLU 70 Ca 0.04 -0.15 0.03 0.00 -1.18 0.00 0.00 59.36 58.10 2no8 h GLU 70 Cb 0.94 -0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 29.42 2no8 h GLU 70 CO 0.08 0.64 0.29 0.82 -1.18 0.00 0.00 179.01 179.66 2no8 h ILE 71 N 0.43 1.02 0.41 2.32 1.08 -0.81 -0.22 117.51 121.74 2no8 h ILE 71 Ca 0.11 -0.19 -0.02 0.00 -0.39 0.00 0.00 64.86 64.37 2no8 h ILE 71 Cb 0.32 0.40 0.00 0.00 -3.07 0.00 0.00 36.82 34.48 2no8 h ILE 71 CO 0.00 0.10 -0.20 0.07 -0.69 0.00 0.00 178.15 177.44 2no8 h LYS 72 N 0.57 -0.53 -0.43 2.37 2.10 -0.40 -2.57 116.57 117.67 2no8 h LYS 72 Ca 0.21 0.04 -0.07 0.00 -2.00 0.00 0.00 60.65 58.83 2no8 h LYS 72 Cb 0.06 0.12 -0.02 0.00 -0.90 0.00 0.00 32.23 31.49 2no8 h LYS 72 CO -0.11 -0.26 0.00 0.93 -2.00 0.00 0.00 179.45 178.01 2no8 h GLU 73 N -0.73 0.70 -0.10 0.07 4.39 -0.81 0.21 114.58 118.31 2no8 h GLU 73 Ca -0.06 -0.18 -0.03 0.00 0.34 0.00 0.00 59.36 59.44 2no8 h GLU 73 Cb 0.52 -0.09 -0.00 0.00 -0.10 0.00 0.00 28.75 29.07 2no8 h GLU 73 CO 0.09 0.72 -0.06 2.35 -1.16 0.00 0.00 179.01 180.95 2no8 h TRP 74 N 0.66 0.26 -0.01 4.33 7.01 -1.08 -0.84 115.95 126.28 2no8 h TRP 74 Ca 0.13 -0.07 -0.13 0.00 2.11 0.00 0.00 58.89 60.94 2no8 h TRP 74 Cb 0.41 -0.06 -0.02 0.00 -2.10 0.00 0.00 29.16 27.40 2no8 h TRP 74 CO 0.02 0.59 -0.61 0.00 -2.79 0.00 0.00 178.44 175.65 2no8 h ARG 75 N -0.15 0.03 -0.05 2.65 3.08 -1.22 0.55 114.38 119.27 2no8 h ARG 75 Ca 0.02 -0.02 -0.08 0.00 0.07 0.00 0.00 59.98 59.97 2no8 h ARG 75 Cb 0.53 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.57 2no8 h ARG 75 CO 0.02 0.63 -0.33 0.00 -1.07 0.00 0.00 179.97 179.22 2no8 h ALA 76 N 1.36 1.36 0.13 0.04 0.00 -0.49 0.11 119.26 121.78 2no8 h ALA 76 Ca -0.01 -0.32 -0.25 0.00 0.00 0.00 0.00 54.91 54.33 2no8 h ALA 76 Cb 1.08 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.81 2no8 h ALA 76 CO 0.08 0.46 -1.21 0.00 0.00 0.00 0.00 179.25 178.59 2no8 h ALA 77 N 1.58 0.06 0.00 0.00 0.00 -0.58 -3.31 119.26 117.02 2no8 h ALA 77 Ca 0.01 -0.94 -0.06 0.00 0.00 0.00 0.00 54.91 53.93 2no8 h ALA 77 Cb 0.63 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 2no8 h ALA 77 CO 0.05 0.66 -0.27 -0.91 0.00 0.00 0.00 179.25 178.77 2no8 h ASN 78 N -0.30 0.00 -1.31 0.00 -0.26 -0.83 -3.47 115.58 109.42 2no8 h ASN 78 Ca -0.24 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.50 2no8 h ASN 78 Cb 1.74 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 39.00 2no8 h ASN 78 CO 0.10 0.27 0.00 0.61 -1.06 0.00 0.00 177.43 177.36 2no8 n GLY 79 N -0.69 0.62 0.00 2.83 0.00 0.18 -5.07 105.19 103.06 2no8 n GLY 79 Ca -0.02 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.66 2.22 -1.03 1.61 5.02 0.02 -5.05 118.16 120.29 2no8 n LYS 80 Ca 0.00 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 56.00 2no8 n LYS 80 Cb 0.39 0.00 0.20 0.00 -0.02 0.00 0.00 35.03 35.60 2no8 n LYS 80 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2no8 s SER 81 N -0.73 2.01 0.00 4.39 0.15 -1.26 -4.82 113.70 113.43 2no8 s SER 81 Ca 0.00 1.16 0.00 0.00 0.70 0.00 0.00 55.95 57.81 2no8 s SER 81 Cb 0.00 -1.80 0.00 0.00 -1.71 0.00 0.00 66.02 62.51 2no8 s SER 81 CO 0.00 -3.51 0.00 0.61 1.20 0.00 0.00 173.24 171.54 2no8 n GLY 82 N -0.70 5.31 3.69 9.45 0.00 -1.26 -4.67 105.19 117.02 2no8 n GLY 82 Ca 0.05 -1.56 -0.24 0.00 0.00 0.00 0.00 46.02 44.28 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 1.50 2.65 0.10 1.61 0.08 -1.26 -3.68 117.98 118.99 2no8 s PHE 83 Ca 0.00 -0.39 -0.31 0.00 0.12 0.00 0.00 56.93 56.35 2no8 s PHE 83 Cb 0.00 -1.56 -0.07 0.00 -0.57 0.00 0.00 43.02 40.82 2no8 s PHE 83 CO 0.00 0.40 1.24 0.21 -0.10 0.00 0.00 175.22 176.98 2no8 s LYS 84 N -3.79 4.42 -0.02 0.44 2.20 0.87 -4.88 119.74 118.97 2no8 s LYS 84 Ca 0.36 1.86 0.01 0.00 -0.36 0.00 0.00 55.97 57.84 2no8 s LYS 84 Cb -0.02 -3.30 0.05 0.00 -1.51 0.00 0.00 37.83 33.05 2no8 s LYS 84 CO 0.21 -0.27 0.85 0.00 -0.36 0.00 0.00 175.35 175.79 2no8 n GLN 85 N 3.65 1.16 0.00 4.03 0.00 -1.26 -3.73 117.38 121.23 2no8 n GLN 85 Ca 0.09 -0.20 0.00 0.00 0.00 0.00 0.00 57.00 56.88 2no8 n GLN 85 Cb 0.45 -1.28 0.00 0.00 0.00 0.00 0.00 30.24 29.41 2no8 n GLN 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47