#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 4.51 0.00 -1.84 1.43 -1.26 -5.03 118.68 116.49 2no8 s LEU 3 Ca 0.00 1.58 0.05 0.00 -1.03 0.00 0.00 54.13 54.73 2no8 s LEU 3 Cb 0.00 -3.32 -0.02 0.00 0.03 0.00 0.00 46.19 42.88 2no8 s LEU 3 CO 0.00 0.07 0.35 2.29 0.23 0.00 0.00 176.35 179.29 2no8 n LYS 4 N 2.39 0.50 -0.06 1.70 0.00 -1.26 -5.05 118.16 116.38 2no8 n LYS 4 Ca -0.03 -3.13 -0.02 0.00 -0.00 0.00 0.00 58.31 55.14 2no8 n LYS 4 Cb 0.49 2.70 -0.14 0.00 -0.00 0.00 0.00 35.03 38.09 2no8 n LYS 4 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.40 175.01 2no8 n HIS 5 N -0.61 0.00 -3.83 5.58 1.44 -1.26 -5.07 115.22 111.47 2no8 n HIS 5 Ca 0.05 0.00 -0.06 0.00 -2.01 0.00 0.00 57.72 55.71 2no8 n HIS 5 Cb 0.59 -0.69 0.02 0.00 0.12 0.00 0.00 29.99 30.04 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 -2.45 -1.96 0.27 4.39 3.41 -1.26 -5.01 113.62 111.01 2no8 n SER 6 Ca -0.19 -2.22 0.17 0.00 -0.26 0.00 0.00 58.87 56.37 2no8 n SER 6 Cb 0.84 3.24 0.66 0.00 -0.26 0.00 0.00 64.21 68.69 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 1.96 0.03 0.00 -1.33 2.10 -1.91 -2.59 117.51 115.78 2no8 h ILE 7 Ca -0.30 -0.56 0.00 0.00 1.08 0.00 0.00 64.86 65.09 2no8 h ILE 7 Cb 1.18 1.54 0.00 0.00 -1.09 0.00 0.00 36.82 38.45 2no8 h ILE 7 CO 0.38 0.01 0.00 -1.28 -1.08 0.00 0.00 178.15 176.19 2no8 h SER 8 N 0.00 0.00 0.87 2.19 0.87 -1.95 -2.05 113.55 113.48 2no8 h SER 8 Ca -0.00 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.41 2no8 h SER 8 Cb 0.53 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.47 2no8 h SER 8 CO 0.00 0.00 -0.72 -0.78 -0.53 0.00 0.00 176.83 174.80 2no8 h ASP 9 N 0.00 0.00 -3.33 6.23 3.58 -1.77 -3.22 116.42 117.92 2no8 h ASP 9 Ca 0.00 0.00 -0.53 0.00 0.42 0.00 0.00 57.03 56.92 2no8 h ASP 9 Cb 0.53 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.59 2no8 h ASP 9 CO 0.00 0.72 0.58 -0.31 -2.88 0.00 0.00 179.24 177.35 2no8 s TYR 10 N -3.21 3.41 0.62 0.28 2.02 -0.77 -4.75 117.35 114.95 2no8 s TYR 10 Ca 0.00 1.33 -0.12 0.00 -0.37 0.00 0.00 57.07 57.92 2no8 s TYR 10 Cb 0.11 -3.45 -0.04 0.00 -0.40 0.00 0.00 41.96 38.18 2no8 s TYR 10 CO 0.77 -1.35 1.03 0.99 -1.57 0.00 0.00 175.55 175.42 2no8 s THR 11 N 0.46 4.58 0.17 -0.71 2.01 -1.26 -0.61 115.64 120.28 2no8 s THR 11 Ca 0.56 0.89 -0.17 0.00 0.31 0.00 0.00 61.69 63.28 2no8 s THR 11 Cb -0.32 -3.78 0.10 0.00 0.01 0.00 0.00 72.50 68.51 2no8 s THR 11 CO 0.33 -1.04 1.67 -0.08 -0.69 0.00 0.00 174.62 174.81 2no8 h GLU 12 N -0.21 -0.00 -0.64 4.92 4.81 -1.35 0.11 114.58 122.22 2no8 h GLU 12 Ca -0.44 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.79 2no8 h GLU 12 Cb 1.19 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.54 2no8 h GLU 12 CO 0.61 -0.00 0.39 0.00 -0.73 0.00 0.00 179.01 179.28 2no8 h ALA 13 N 1.41 1.49 -0.16 2.92 0.00 -1.93 0.22 119.26 123.20 2no8 h ALA 13 Ca 0.20 -0.07 -0.22 0.00 0.00 0.00 0.00 54.91 54.82 2no8 h ALA 13 Cb 0.30 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 17.84 2no8 h ALA 13 CO -0.42 0.45 -0.76 0.93 0.00 0.00 0.00 179.25 179.45 2no8 h GLU 14 N 0.88 0.78 -0.03 0.00 4.39 -1.57 -1.06 114.58 117.98 2no8 h GLU 14 Ca 0.23 -0.63 -0.16 0.00 0.34 0.00 0.00 59.36 59.15 2no8 h GLU 14 Cb -0.05 0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.71 2no8 h GLU 14 CO -0.05 1.24 -0.69 0.35 -1.16 0.00 0.00 179.01 178.70 2no8 h PHE 15 N 0.54 0.19 0.00 4.33 3.57 -0.57 -2.18 116.94 122.82 2no8 h PHE 15 Ca -0.05 -0.08 -0.04 0.00 3.53 0.00 0.00 57.97 61.33 2no8 h PHE 15 Cb 1.38 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 40.09 2no8 h PHE 15 CO 0.08 0.78 -0.19 1.25 -2.23 0.00 0.00 178.31 178.01 2no8 h LEU 16 N 0.09 0.00 -1.25 0.59 6.46 -0.30 0.37 115.31 121.28 2no8 h LEU 16 Ca -0.01 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.75 2no8 h LEU 16 Cb 1.23 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.16 2no8 h LEU 16 CO 0.10 0.19 0.00 -0.33 -0.62 0.00 0.00 178.44 177.78 2no8 h GLU 17 N 0.00 0.00 -0.17 1.25 5.08 -0.55 -2.87 114.58 117.33 2no8 h GLU 17 Ca -0.00 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.41 2no8 h GLU 17 Cb 0.42 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.61 2no8 h GLU 17 CO 0.02 0.00 -0.20 0.27 -1.00 0.00 0.00 179.01 178.11 2no8 h PHE 18 N 0.00 -0.51 -0.11 4.33 -0.00 -0.01 0.52 116.94 121.17 2no8 h PHE 18 Ca 0.00 0.03 -0.19 0.00 -0.00 0.00 0.00 57.97 57.80 2no8 h PHE 18 Cb 0.54 0.25 -0.00 0.00 -0.00 0.00 0.00 35.95 36.74 2no8 h PHE 18 CO 0.00 -0.27 -0.73 -0.24 -0.00 0.00 0.00 178.31 177.06 2no8 h VAL 19 N -0.23 1.34 -0.71 0.88 3.04 -1.61 -0.32 116.25 118.65 2no8 h VAL 19 Ca 0.11 -2.07 -0.05 0.00 -1.01 0.00 0.00 66.70 63.68 2no8 h VAL 19 Cb 0.40 2.05 -0.03 0.00 -2.01 0.00 0.00 31.29 31.70 2no8 h VAL 19 CO -0.30 0.63 0.26 0.11 -1.01 0.00 0.00 177.57 177.26 2no8 h LYS 20 N 0.36 1.07 -0.67 4.17 1.57 -1.22 0.22 116.57 122.08 2no8 h LYS 20 Ca -0.04 -0.21 -0.08 0.00 -1.87 0.00 0.00 60.65 58.46 2no8 h LYS 20 Cb 1.32 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 33.44 2no8 h LYS 20 CO 0.13 0.90 0.11 -0.22 -0.57 0.00 0.00 179.45 179.81 2no8 h LYS 21 N 1.02 1.10 -0.39 3.15 3.64 0.38 0.62 116.57 126.09 2no8 h LYS 21 Ca 0.23 -0.29 -0.07 0.00 -1.27 0.00 0.00 60.65 59.25 2no8 h LYS 21 Cb 0.25 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.92 2no8 h LYS 21 CO -0.01 1.01 -0.05 0.82 -2.27 0.00 0.00 179.45 178.94 2no8 h ILE 22 N 1.04 1.23 -0.29 2.00 2.04 -0.66 0.56 117.51 123.42 2no8 h ILE 22 Ca 0.21 -1.00 -0.16 0.00 1.00 0.00 0.00 64.86 64.91 2no8 h ILE 22 Cb 0.43 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 2no8 h ILE 22 CO 0.01 0.34 -0.46 0.00 0.00 0.00 0.00 178.15 178.05 2no8 n ARG 24 N -4.02 0.63 -0.85 0.00 1.85 0.14 -4.54 116.66 109.87 2no8 n ARG 24 Ca -0.03 0.22 -0.00 0.00 -1.00 0.00 0.00 57.85 57.04 2no8 n ARG 24 Cb 0.57 -1.53 0.31 0.00 -1.05 0.00 0.00 32.46 30.76 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 -3.67 4.06 -0.18 2.89 0.00 0.19 -4.74 120.51 119.06 2no8 n ALA 25 Ca -0.48 -1.86 -0.04 0.00 0.00 0.00 0.00 53.44 51.05 2no8 n ALA 25 Cb 0.94 -1.18 -0.04 0.00 0.00 0.00 0.00 19.45 19.17 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 0.20 -0.18 0.00 0.00 1.02 -1.22 -4.91 120.64 115.55 2no8 n GLU 26 Ca 0.31 0.63 0.00 0.00 -0.02 0.00 0.00 57.16 58.08 2no8 n GLU 26 Cb 1.18 -0.93 0.00 0.00 -0.02 0.00 0.00 31.44 31.67 2no8 n GLU 26 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2no8 n GLY 27 N -1.11 0.43 0.18 0.62 0.00 -1.26 -2.37 105.19 101.68 2no8 n GLY 27 Ca 0.01 -1.64 -0.17 0.00 0.00 0.00 0.00 46.02 44.22 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 -1.00 1.59 -2.43 4.61 0.00 -1.26 -5.03 120.51 116.99 2no8 n ALA 28 Ca 0.00 -0.85 -0.21 0.00 0.00 0.00 0.00 53.44 52.38 2no8 n ALA 28 Cb 0.00 0.10 -0.10 0.00 0.00 0.00 0.00 19.45 19.45 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 -2.40 1.49 -0.41 0.00 2.01 -1.26 -5.03 115.64 110.04 2no8 s THR 29 Ca -0.28 -2.08 0.23 0.00 0.31 0.00 0.00 61.69 59.87 2no8 s THR 29 Cb 0.08 -2.54 0.24 0.00 0.01 0.00 0.00 72.50 70.29 2no8 s THR 29 CO 0.43 -0.22 1.70 -1.84 -0.69 0.00 0.00 174.62 174.00 2no8 n GLU 30 N -0.61 0.18 0.15 4.92 0.28 -1.26 -1.20 120.64 123.10 2no8 n GLU 30 Ca -0.05 0.48 0.01 0.00 -0.16 0.00 0.00 57.16 57.44 2no8 n GLU 30 Cb 0.64 -1.89 0.34 0.00 1.43 0.00 0.00 31.44 31.96 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 0.11 -0.34 3.44 4.11 -1.95 0.11 114.58 120.05 2no8 h GLU 31 Ca 0.00 -0.04 -0.13 0.00 0.07 0.00 0.00 59.36 59.26 2no8 h GLU 31 Cb 0.28 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2no8 h GLU 31 CO 0.00 0.42 -0.31 -0.44 0.07 0.00 0.00 179.01 178.75 2no8 h ASP 32 N 0.10 0.87 0.06 3.06 3.32 -1.40 0.17 116.42 122.59 2no8 h ASP 32 Ca 0.01 -0.46 -0.00 0.00 0.02 0.00 0.00 57.03 56.60 2no8 h ASP 32 Cb 0.62 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.93 2no8 h ASP 32 CO 0.05 1.15 -0.03 -0.78 -1.72 0.00 0.00 179.24 177.90 2no8 h ASP 33 N 0.60 -0.07 -0.83 6.45 1.82 -1.28 -2.46 116.42 120.65 2no8 h ASP 33 Ca 0.06 -0.01 0.03 0.00 -0.39 0.00 0.00 57.03 56.72 2no8 h ASP 33 Cb 0.89 0.02 -0.05 0.00 0.68 0.00 0.00 39.33 40.87 2no8 h ASP 33 CO 0.08 -0.04 0.53 -1.13 -1.61 0.00 0.00 179.24 177.07 2no8 h ASN 34 N -0.09 0.89 0.68 2.28 -0.73 -0.65 0.32 115.58 118.28 2no8 h ASN 34 Ca -0.01 -0.01 -0.09 0.00 1.87 0.00 0.00 56.30 58.07 2no8 h ASN 34 Cb 0.07 -0.20 -0.01 0.00 0.27 0.00 0.00 38.32 38.45 2no8 h ASN 34 CO 0.01 0.61 -0.41 0.07 -0.37 0.00 0.00 177.43 177.35 2no8 h LYS 35 N 1.04 0.00 -0.20 6.67 2.10 -0.57 0.38 116.57 125.99 2no8 h LYS 35 Ca 0.33 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.94 2no8 h LYS 35 Cb 0.00 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.32 2no8 h LYS 35 CO -0.11 0.41 -0.05 -0.07 -2.00 0.00 0.00 179.45 177.62 2no8 h LEU 36 N 0.00 0.39 -0.35 7.07 3.38 -0.78 -2.66 115.31 122.36 2no8 h LEU 36 Ca -0.00 -0.37 0.04 0.00 0.09 0.00 0.00 57.88 57.64 2no8 h LEU 36 Cb 0.86 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 41.46 2no8 h LEU 36 CO 0.05 0.67 0.13 0.58 0.09 0.00 0.00 178.44 179.96 2no8 h VAL 37 N 0.11 0.92 -0.40 1.22 2.07 -0.33 -2.22 116.25 117.61 2no8 h VAL 37 Ca 0.05 -0.10 0.02 0.00 0.82 0.00 0.00 66.70 67.50 2no8 h VAL 37 Cb 0.50 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.85 2no8 h VAL 37 CO 0.02 0.05 0.27 0.03 0.02 0.00 0.00 177.57 177.96 2no8 h ARG 38 N 0.29 0.44 0.34 1.57 3.08 -0.22 0.69 114.38 120.56 2no8 h ARG 38 Ca 0.16 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.16 2no8 h ARG 38 Cb 0.12 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.07 2no8 h ARG 38 CO -0.15 0.29 -0.16 1.49 -1.07 0.00 0.00 179.97 180.37 2no8 h GLU 39 N 0.45 -0.44 -0.02 0.04 4.57 -1.05 -1.74 114.58 116.40 2no8 h GLU 39 Ca 0.16 0.03 -0.23 0.00 -1.18 0.00 0.00 59.36 58.14 2no8 h GLU 39 Cb 0.08 0.10 0.01 0.00 -0.16 0.00 0.00 28.75 28.78 2no8 h GLU 39 CO -0.04 -0.22 -0.94 0.74 -1.18 0.00 0.00 179.01 177.38 2no8 h PHE 40 N -0.57 0.78 0.00 0.92 0.04 -0.93 -2.81 116.94 114.36 2no8 h PHE 40 Ca -0.05 -0.41 0.00 0.00 2.80 0.00 0.00 57.97 60.32 2no8 h PHE 40 Cb 0.42 -0.09 0.00 0.00 2.20 0.00 0.00 35.95 38.48 2no8 h PHE 40 CO -0.02 1.23 0.00 0.93 -0.60 0.00 0.00 178.31 179.84 2no8 h GLU 41 N 0.31 0.00 0.02 1.51 4.39 0.30 -0.24 114.58 120.88 2no8 h GLU 41 Ca -0.09 0.00 -0.21 0.00 0.34 0.00 0.00 59.36 59.40 2no8 h GLU 41 Cb 1.57 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.20 2no8 h GLU 41 CO 0.17 0.00 -0.99 -0.09 -1.16 0.00 0.00 179.01 176.94 2no8 h ARG 42 N 0.00 0.07 -0.07 2.33 9.65 -1.07 -2.31 114.38 122.97 2no8 h ARG 42 Ca 0.00 -0.10 -0.12 0.00 -1.10 0.00 0.00 59.98 58.66 2no8 h ARG 42 Cb 0.50 0.04 0.01 0.00 -1.39 0.00 0.00 29.97 29.12 2no8 h ARG 42 CO 0.00 1.00 -0.41 -0.07 2.80 0.00 0.00 179.97 183.29 2no8 h LEU 43 N 0.03 0.48 0.09 3.80 3.38 -1.04 -3.36 115.31 118.69 2no8 h LEU 43 Ca -0.03 -0.66 -0.28 0.00 0.09 0.00 0.00 57.88 56.99 2no8 h LEU 43 Cb 1.71 -0.14 0.01 0.00 0.09 0.00 0.00 40.66 42.33 2no8 h LEU 43 CO 0.14 1.07 -1.23 0.71 0.09 0.00 0.00 178.44 179.21 2no8 h THR 44 N -0.08 1.42 -1.59 0.22 1.35 -1.16 -3.44 112.91 109.63 2no8 h THR 44 Ca -0.03 -2.83 -0.33 0.00 -0.55 0.00 0.00 66.41 62.67 2no8 h THR 44 Cb 1.07 2.85 -0.07 0.00 -1.73 0.00 0.00 68.15 70.26 2no8 h THR 44 CO 0.08 0.84 -0.36 1.21 -0.25 0.00 0.00 175.52 177.04 2no8 n GLU 45 N -3.63 -1.21 -2.90 4.72 2.13 -0.87 -4.96 120.64 113.93 2no8 n GLU 45 Ca -0.10 0.91 -0.41 0.00 0.66 0.00 0.00 57.16 58.22 2no8 n GLU 45 Cb 1.00 -5.21 -0.04 0.00 0.27 0.00 0.00 31.44 27.46 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 -2.71 3.57 0.28 4.31 2.46 -1.26 -4.94 115.29 117.01 2no8 s HIS 46 Ca 0.00 1.41 -0.02 0.00 0.47 0.00 0.00 55.06 56.92 2no8 s HIS 46 Cb 0.00 -2.96 0.40 0.00 -0.13 0.00 0.00 32.58 29.89 2no8 s HIS 46 CO 0.00 -0.01 1.88 -1.00 -2.47 0.00 0.00 174.74 173.14 2no8 h PRO 47 N 6.88 0.97 -0.23 2.88 0.13 -1.95 -2.15 132.00 138.54 2no8 h PRO 47 Ca -0.39 -0.13 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 2no8 h PRO 47 Cb 1.19 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.14 2no8 h PRO 47 CO 0.77 0.75 0.00 -0.25 -0.23 0.00 0.00 178.00 179.04 2no8 n ASP 48 N -4.34 3.04 -0.13 1.44 8.00 -1.26 -4.70 116.55 118.61 2no8 n ASP 48 Ca 0.06 -2.45 -0.04 0.00 0.71 0.00 0.00 54.79 53.07 2no8 n ASP 48 Cb 0.14 -0.32 0.03 0.00 -0.02 0.00 0.00 41.12 40.94 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 1.43 0.38 0.81 0.44 0.00 -1.78 0.62 103.07 104.97 2no8 h GLY 49 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.42 2no8 h GLY 49 CO 0.07 -0.13 -0.17 1.48 0.00 0.00 0.00 176.54 177.80 2no8 h SER 50 N 0.06 -0.44 0.12 0.19 4.64 -1.84 -2.70 113.55 113.58 2no8 h SER 50 Ca 0.21 0.04 -0.01 0.00 -0.47 0.00 0.00 61.79 61.56 2no8 h SER 50 Cb 0.31 0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 62.55 2no8 h SER 50 CO -0.38 -0.25 -0.05 0.44 -0.87 0.00 0.00 176.83 175.71 2no8 h ASP 51 N -0.37 0.00 -0.65 4.97 5.19 -1.48 -1.24 116.42 122.84 2no8 h ASP 51 Ca -0.00 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2no8 h ASP 51 Cb 0.34 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.82 2no8 h ASP 51 CO -0.04 0.05 0.40 -0.07 -3.12 0.00 0.00 179.24 176.47 2no8 h LEU 52 N 0.00 0.79 -0.30 1.55 3.38 0.52 0.34 115.31 121.57 2no8 h LEU 52 Ca -0.00 -0.04 -0.18 0.00 0.09 0.00 0.00 57.88 57.75 2no8 h LEU 52 Cb 0.13 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 2no8 h LEU 52 CO 0.01 0.60 -0.85 0.40 0.09 0.00 0.00 178.44 178.69 2no8 h ILE 53 N 0.91 1.60 0.07 1.22 2.04 -1.25 -3.30 117.51 118.79 2no8 h ILE 53 Ca 0.24 -2.87 -0.28 0.00 1.00 0.00 0.00 64.86 62.95 2no8 h ILE 53 Cb -0.04 2.56 -0.02 0.00 -0.74 0.00 0.00 36.82 38.57 2no8 h ILE 53 CO -0.05 0.82 -1.42 1.88 0.00 0.00 0.00 178.15 179.39 2no8 h TYR 54 N 0.01 0.26 -1.74 1.37 0.05 -1.16 -3.48 116.97 112.29 2no8 h TYR 54 Ca -0.01 -0.19 0.02 0.00 0.05 0.00 0.00 58.73 58.60 2no8 h TYR 54 Cb 1.50 -0.01 -0.23 0.00 1.01 0.00 0.00 36.73 39.00 2no8 h TYR 54 CO 0.00 1.22 0.38 1.52 -1.05 0.00 0.00 178.16 180.23 2no8 s TYR 55 N -2.64 -0.53 0.70 4.88 1.13 0.11 -5.08 117.35 115.92 2no8 s TYR 55 Ca -0.06 1.08 -0.11 0.00 -1.41 0.00 0.00 57.07 56.57 2no8 s TYR 55 Cb 0.08 0.39 0.01 0.00 -1.10 0.00 0.00 41.96 41.34 2no8 s TYR 55 CO 0.84 -0.38 1.06 -1.25 -2.51 0.00 0.00 175.55 173.31 2no8 s PRO 56 N -0.56 2.91 0.00 -3.49 0.04 -1.26 -4.07 135.00 128.57 2no8 s PRO 56 Ca -0.02 0.86 0.00 0.00 0.04 0.00 0.00 61.00 61.88 2no8 s PRO 56 Cb -0.02 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.52 2no8 s PRO 56 CO 0.01 -1.09 0.00 0.54 0.04 0.00 0.00 177.00 176.50 2no8 n ARG 57 N -3.11 0.00 0.03 4.56 1.74 -1.26 -5.01 116.66 113.60 2no8 n ARG 57 Ca 0.07 0.00 -0.00 0.00 -0.77 0.00 0.00 57.85 57.15 2no8 n ARG 57 Cb 0.54 0.00 -0.00 0.00 -1.02 0.00 0.00 32.46 31.98 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 0.59 0.05 0.55 2.03 -1.26 -4.80 116.55 113.71 2no8 n ASP 58 Ca 0.00 0.07 0.12 0.00 0.52 0.00 0.00 54.79 55.50 2no8 n ASP 58 Cb 0.00 -0.18 0.18 0.00 -0.72 0.00 0.00 41.12 40.40 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 -3.03 0.66 -4.69 1.67 8.00 -1.26 -4.86 116.55 113.05 2no8 n ASP 59 Ca -0.00 0.07 -0.42 0.00 0.71 0.00 0.00 54.79 55.15 2no8 n ASP 59 Cb 0.00 0.18 -0.03 0.00 -0.02 0.00 0.00 41.12 41.26 2no8 n ASP 59 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2no8 s ARG 60 N -3.15 4.13 0.04 -1.24 3.00 -1.26 -4.93 118.95 115.55 2no8 s ARG 60 Ca 0.07 2.62 -0.30 0.00 -1.00 0.00 0.00 55.73 57.12 2no8 s ARG 60 Cb 0.14 -3.71 -0.04 0.00 0.00 0.00 0.00 34.95 31.34 2no8 s ARG 60 CO 0.72 -0.87 0.96 -2.00 0.00 0.00 0.00 175.30 174.10 2no8 s GLU 61 N 3.10 4.61 -1.25 5.12 2.56 -1.26 -4.40 118.70 127.18 2no8 s GLU 61 Ca 0.83 1.41 -0.12 0.00 0.00 0.00 0.00 54.97 57.09 2no8 s GLU 61 Cb -0.46 -3.42 0.16 0.00 2.00 0.00 0.00 34.13 32.41 2no8 s GLU 61 CO 0.38 0.07 1.64 -3.47 -0.56 0.00 0.00 175.26 173.31 2no8 n ASP 62 N 3.41 5.14 -3.81 -1.70 2.03 -1.26 -3.86 116.55 116.50 2no8 n ASP 62 Ca 0.04 -3.03 -0.11 0.00 0.52 0.00 0.00 54.79 52.22 2no8 n ASP 62 Cb 0.50 -1.54 -0.08 0.00 -0.72 0.00 0.00 41.12 39.29 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 2.08 -0.02 0.32 1.67 1.04 -1.26 -4.97 113.70 112.56 2no8 s SER 63 Ca 0.42 -0.35 0.09 0.00 0.48 0.00 0.00 55.95 56.59 2no8 s SER 63 Cb 0.03 0.33 0.95 0.00 0.10 0.00 0.00 66.02 67.42 2no8 s SER 63 CO 0.00 -0.62 1.62 -0.65 0.98 0.00 0.00 173.24 174.58 2no8 h PRO 64 N 3.22 0.16 -0.24 4.02 0.11 -1.92 0.89 132.00 138.23 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 1.20 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 2no8 h PRO 64 CO 0.49 0.10 0.08 0.93 -0.21 0.00 0.00 178.00 179.39 2no8 h GLU 65 N 0.16 0.38 -0.00 1.05 5.08 -1.92 -2.85 114.58 116.47 2no8 h GLU 65 Ca 0.67 -0.08 -0.10 0.00 -1.00 0.00 0.00 59.36 58.85 2no8 h GLU 65 Cb 1.52 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.70 2no8 h GLU 65 CO -0.72 0.45 -0.46 0.78 -1.00 0.00 0.00 179.01 178.07 2no8 h GLY 66 N 0.23 0.00 0.73 -3.84 0.00 -1.21 -1.18 103.07 97.81 2no8 h GLY 66 Ca 0.08 -0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.40 2no8 h GLY 66 CO -0.00 0.00 0.00 -2.22 0.00 0.00 0.00 176.54 174.32 2no8 h ILE 67 N 0.00 1.23 -0.17 2.60 2.04 -0.84 -1.20 117.51 121.18 2no8 h ILE 67 Ca -0.00 -0.69 -0.07 0.00 1.00 0.00 0.00 64.86 65.10 2no8 h ILE 67 Cb 0.81 1.63 -0.01 0.00 -0.74 0.00 0.00 36.82 38.51 2no8 h ILE 67 CO 0.06 0.18 -0.21 0.58 0.00 0.00 0.00 178.15 178.76 2no8 h VAL 68 N -0.22 1.23 -0.60 1.67 2.07 -1.44 -1.82 116.25 117.13 2no8 h VAL 68 Ca 0.01 -1.05 -0.05 0.00 0.82 0.00 0.00 66.70 66.43 2no8 h VAL 68 Cb 0.29 1.34 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 2no8 h VAL 68 CO 0.00 0.33 0.18 0.50 0.02 0.00 0.00 177.57 178.60 2no8 h LYS 69 N 0.27 0.91 -0.49 1.57 3.11 -1.02 -0.99 116.57 119.93 2no8 h LYS 69 Ca 0.05 -0.18 -0.07 0.00 -2.81 0.00 0.00 60.65 57.64 2no8 h LYS 69 Cb 0.53 -0.14 -0.02 0.00 -1.00 0.00 0.00 32.23 31.60 2no8 h LYS 69 CO 0.04 0.79 0.04 1.49 -2.81 0.00 0.00 179.45 179.00 2no8 h GLU 70 N 0.88 0.84 -0.03 1.90 4.57 -0.44 -2.18 114.58 120.13 2no8 h GLU 70 Ca 0.20 -0.24 0.01 0.00 -1.18 0.00 0.00 59.36 58.15 2no8 h GLU 70 Cb 0.26 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.75 2no8 h GLU 70 CO -0.01 0.86 -0.05 0.82 -1.18 0.00 0.00 179.01 179.45 2no8 h ILE 71 N 0.71 0.86 0.50 2.32 1.08 -0.60 -1.67 117.51 120.70 2no8 h ILE 71 Ca 0.14 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.59 2no8 h ILE 71 Cb 0.45 0.86 0.00 0.00 -3.07 0.00 0.00 36.82 35.06 2no8 h ILE 71 CO 0.02 0.00 -0.24 0.07 -0.69 0.00 0.00 178.15 177.31 2no8 h LYS 72 N -0.07 -0.64 0.00 2.37 2.10 -1.16 -1.04 116.57 118.13 2no8 h LYS 72 Ca 0.03 0.04 -0.04 0.00 -2.00 0.00 0.00 60.65 58.69 2no8 h LYS 72 Cb 0.12 0.15 -0.01 0.00 -0.90 0.00 0.00 32.23 31.59 2no8 h LYS 72 CO -0.07 -0.39 -0.18 0.93 -2.00 0.00 0.00 179.45 177.74 2no8 h GLU 73 N -0.74 0.00 0.13 0.07 4.39 -1.29 0.71 114.58 117.85 2no8 h GLU 73 Ca -0.07 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.63 2no8 h GLU 73 Cb 0.54 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 2no8 h GLU 73 CO 0.11 0.18 -0.06 2.35 -1.16 0.00 0.00 179.01 180.42 2no8 h TRP 74 N 0.00 -0.17 -0.44 4.33 7.01 -1.19 -2.41 115.95 123.09 2no8 h TRP 74 Ca -0.00 -0.00 -0.11 0.00 2.11 0.00 0.00 58.89 60.89 2no8 h TRP 74 Cb 0.31 0.06 -0.02 0.00 -2.10 0.00 0.00 29.16 27.41 2no8 h TRP 74 CO 0.00 0.29 -0.16 0.00 -2.79 0.00 0.00 178.44 175.78 2no8 h ARG 75 N -0.87 0.83 -0.12 2.65 3.08 -0.57 -0.42 114.38 118.97 2no8 h ARG 75 Ca -0.02 -0.31 -0.03 0.00 0.07 0.00 0.00 59.98 59.69 2no8 h ARG 75 Cb 0.54 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 2no8 h ARG 75 CO 0.03 0.93 -0.07 0.00 -1.07 0.00 0.00 179.97 179.80 2no8 h ALA 76 N 1.08 1.67 0.15 0.04 0.00 0.31 0.23 119.26 122.73 2no8 h ALA 76 Ca 0.11 -0.14 -0.31 0.00 0.00 0.00 0.00 54.91 54.57 2no8 h ALA 76 Cb 0.68 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2no8 h ALA 76 CO 0.05 0.25 -1.53 0.00 0.00 0.00 0.00 179.25 178.01 2no8 h ALA 77 N 1.77 0.19 0.00 0.00 0.00 -0.86 -3.27 119.26 117.09 2no8 h ALA 77 Ca 0.04 -1.06 0.00 0.00 0.00 0.00 0.00 54.91 53.88 2no8 h ALA 77 Cb 0.24 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2no8 h ALA 77 CO 0.01 1.05 0.00 -0.91 0.00 0.00 0.00 179.25 179.41 2no8 h ASN 78 N 0.08 0.00 0.00 0.00 -0.26 -0.61 -3.46 115.58 111.33 2no8 h ASN 78 Ca -0.25 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.49 2no8 h ASN 78 Cb 2.04 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 39.30 2no8 h ASN 78 CO 0.18 0.00 0.00 0.61 -1.06 0.00 0.00 177.43 177.16 2no8 n GLY 79 N 0.22 0.47 0.00 2.83 0.00 -0.37 -5.04 105.19 103.30 2no8 n GLY 79 Ca 0.02 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.14 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 -1.82 0.68 -1.07 1.61 5.02 0.66 -5.03 118.16 118.21 2no8 n LYS 80 Ca 0.00 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.99 2no8 n LYS 80 Cb 0.27 0.00 0.15 0.00 -0.02 0.00 0.00 35.03 35.42 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 -1.00 3.30 0.31 4.39 0.15 -1.26 -4.65 113.70 114.94 2no8 s SER 81 Ca 0.00 1.65 0.03 0.00 0.70 0.00 0.00 55.95 58.32 2no8 s SER 81 Cb 0.00 -2.30 -0.05 0.00 -1.71 0.00 0.00 66.02 61.96 2no8 s SER 81 CO 0.00 -2.77 0.10 -0.83 1.20 0.00 0.00 173.24 170.94 2no8 s GLY 82 N -3.21 2.04 0.48 9.45 0.00 -1.26 -4.47 107.32 110.34 2no8 s GLY 82 Ca 0.64 -1.80 0.02 0.00 0.00 0.00 0.00 44.72 43.58 2no8 s GLY 82 CO 0.58 -1.70 0.68 -1.36 0.00 0.00 0.00 173.10 171.30 2no8 s PHE 83 N -3.51 3.03 0.27 1.90 0.08 -1.26 -3.79 117.98 114.70 2no8 s PHE 83 Ca 0.35 0.03 -0.29 0.00 0.12 0.00 0.00 56.93 57.14 2no8 s PHE 83 Cb 0.07 -2.46 -0.09 0.00 -0.57 0.00 0.00 43.02 39.96 2no8 s PHE 83 CO 0.15 -0.53 0.97 0.21 -0.10 0.00 0.00 175.22 175.91 2no8 s LYS 84 N -4.58 4.75 -0.13 0.44 2.20 0.22 -4.84 119.74 117.81 2no8 s LYS 84 Ca 0.52 1.50 -0.02 0.00 -0.36 0.00 0.00 55.97 57.61 2no8 s LYS 84 Cb -0.10 -3.14 -0.02 0.00 -1.51 0.00 0.00 37.83 33.05 2no8 s LYS 84 CO 0.37 0.41 -0.07 1.14 -0.36 0.00 0.00 175.35 176.84 2no8 s GLN 85 N -1.44 3.41 0.00 4.03 0.00 -1.26 -0.91 119.66 123.48 2no8 s GLN 85 Ca 0.44 -0.56 0.00 0.00 -0.00 0.00 0.00 55.36 55.24 2no8 s GLN 85 Cb -0.25 -2.78 0.00 0.00 0.00 0.00 0.00 33.01 29.98 2no8 s GLN 85 CO 0.31 0.33 0.00 0.41 0.00 0.00 0.00 175.29 176.34