#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dg7 h ARG 3 N 0.00 1.11 -0.53 0.00 2.43 -2.06 0.49 114.38 115.83 2dg7 h ARG 3 Ca 0.00 -0.22 0.00 0.00 -0.81 0.00 0.00 59.98 58.95 2dg7 h ARG 3 Cb 0.00 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.38 2dg7 h ARG 3 CO 0.00 0.93 0.00 -2.67 -1.51 0.00 0.00 179.97 176.72 2dg7 n TRP 4 N -4.27 0.69 -2.73 2.20 2.14 -1.26 -4.51 117.44 109.71 2dg7 n TRP 4 Ca 0.06 -0.35 -0.06 0.00 2.07 0.00 0.00 57.50 59.23 2dg7 n TRP 4 Cb 0.21 0.00 0.04 0.00 -0.81 0.00 0.00 31.31 30.75 2dg7 n TRP 4 CO 0.00 0.00 0.00 -3.47 2.07 0.00 0.00 177.69 176.29 2dg7 n ASP 5 N 1.43 -2.71 0.32 -0.67 2.03 -0.64 -5.03 116.55 111.28 2dg7 n ASP 5 Ca 0.21 -2.76 0.19 0.00 0.52 0.00 0.00 54.79 52.94 2dg7 n ASP 5 Cb 0.58 1.55 1.05 0.00 -0.72 0.00 0.00 41.12 43.58 2dg7 n ASP 5 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2dg7 h PRO 6 N 4.18 0.00 -0.00 -0.67 0.13 -0.28 -2.21 132.00 133.15 2dg7 h PRO 6 Ca -0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.04 2dg7 h PRO 6 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2dg7 h PRO 6 CO 0.12 0.00 -0.10 0.41 -0.23 0.00 0.00 178.00 178.21 2dg7 n GLY 7 N -1.18 -0.87 0.45 1.56 0.00 -1.26 -4.40 105.19 99.49 2dg7 n GLY 7 Ca -0.03 -0.28 -0.13 0.00 0.00 0.00 0.00 46.02 45.58 2dg7 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dg7 h ALA 8 N 3.69 -0.74 -0.53 4.61 0.00 -1.74 0.28 119.26 124.85 2dg7 h ALA 8 Ca 0.00 0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.97 2dg7 h ALA 8 Cb 0.35 1.10 -0.05 0.00 0.00 0.00 0.00 17.79 19.18 2dg7 h ALA 8 CO 0.00 -1.03 0.25 1.49 0.00 0.00 0.00 179.25 179.96 2dg7 h GLU 9 N -0.39 0.46 -0.48 0.00 4.81 -1.83 -0.31 114.58 116.84 2dg7 h GLU 9 Ca 0.08 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 2dg7 h GLU 9 Cb 0.60 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.85 2dg7 h GLU 9 CO -0.59 0.31 0.30 0.37 -0.73 0.00 0.00 179.01 178.66 2dg7 h GLN 10 N 0.48 0.64 -0.42 1.92 5.75 -1.71 0.82 115.11 122.59 2dg7 h GLN 10 Ca 0.24 -0.05 -0.05 0.00 -0.15 0.00 0.00 58.65 58.64 2dg7 h GLN 10 Cb 0.18 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.57 2dg7 h GLN 10 CO -0.19 0.44 0.06 0.00 -2.65 0.00 0.00 178.83 176.50 2dg7 h ARG 11 N 0.64 0.64 -0.20 1.69 3.08 -0.43 0.11 114.38 119.91 2dg7 h ARG 11 Ca 0.17 -0.13 -0.03 0.00 0.07 0.00 0.00 59.98 60.06 2dg7 h ARG 11 Cb -0.04 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 2dg7 h ARG 11 CO -0.03 0.62 -0.01 -0.07 -1.07 0.00 0.00 179.97 179.41 2dg7 h LEU 12 N 0.62 0.36 -0.86 3.04 3.38 -0.36 0.13 115.31 121.62 2dg7 h LEU 12 Ca 0.14 -0.32 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 2dg7 h LEU 12 Cb 0.30 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 2dg7 h LEU 12 CO 0.00 0.59 0.38 0.11 0.09 0.00 0.00 178.44 179.61 2dg7 h LYS 13 N 0.12 1.20 -0.22 1.13 1.57 -0.49 0.26 116.57 120.15 2dg7 h LYS 13 Ca 0.06 -0.19 -0.09 0.00 -1.87 0.00 0.00 60.65 58.56 2dg7 h LYS 13 Cb 0.41 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.51 2dg7 h LYS 13 CO 0.01 0.94 -0.21 -0.09 -0.57 0.00 0.00 179.45 179.53 2dg7 h ARG 14 N 1.19 0.52 -0.60 3.15 2.43 -0.89 -2.62 114.38 117.56 2dg7 h ARG 14 Ca 0.28 -0.27 0.04 0.00 -0.81 0.00 0.00 59.98 59.22 2dg7 h ARG 14 Cb 0.15 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.66 2dg7 h ARG 14 CO -0.03 0.86 0.34 0.00 -1.51 0.00 0.00 179.97 179.63 2dg7 h ALA 15 N 0.66 0.78 -0.12 2.80 0.00 -0.45 -1.47 119.26 121.46 2dg7 h ALA 15 Ca 0.03 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.97 2dg7 h ALA 15 Cb 0.76 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 2dg7 h ALA 15 CO 0.05 0.05 -0.05 0.00 0.00 0.00 0.00 179.25 179.30 2dg7 h ALA 16 N 1.29 0.06 -0.96 0.00 0.00 -0.90 0.38 119.26 119.13 2dg7 h ALA 16 Ca 0.25 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.23 2dg7 h ALA 16 Cb 0.09 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 2dg7 h ALA 16 CO -0.13 -0.50 0.63 -0.07 0.00 0.00 0.00 179.25 179.17 2dg7 h LEU 17 N -0.04 1.07 -0.22 0.00 3.38 -1.07 0.13 115.31 118.56 2dg7 h LEU 17 Ca 0.07 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 2dg7 h LEU 17 Cb 0.13 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 2dg7 h LEU 17 CO -0.15 0.76 -0.19 -0.33 0.09 0.00 0.00 178.44 178.62 2dg7 h GLU 18 N 1.25 0.52 -0.45 1.13 5.08 -0.85 -1.15 114.58 120.12 2dg7 h GLU 18 Ca 0.36 -0.26 -0.10 0.00 -1.00 0.00 0.00 59.36 58.36 2dg7 h GLU 18 Cb -0.08 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 2dg7 h GLU 18 CO -0.10 0.84 -0.10 -0.07 -1.00 0.00 0.00 179.01 178.58 2dg7 h LEU 19 N 0.22 0.86 -1.49 1.33 -0.00 -0.69 0.29 115.31 115.82 2dg7 h LEU 19 Ca 0.04 -0.36 -0.05 0.00 -0.00 0.00 0.00 57.88 57.50 2dg7 h LEU 19 Cb 0.73 -0.24 -0.01 0.00 -0.00 0.00 0.00 40.66 41.14 2dg7 h LEU 19 CO 0.05 1.02 -0.26 1.88 -0.00 0.00 0.00 178.44 181.13 2dg7 h TYR 20 N 0.69 0.00 0.03 1.13 0.99 -0.76 -1.54 116.97 117.51 2dg7 h TYR 20 Ca 0.11 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.84 2dg7 h TYR 20 Cb 0.64 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.37 2dg7 h TYR 20 CO 0.05 0.26 -0.01 0.77 -0.00 0.00 0.00 178.16 179.23 2dg7 h SER 21 N 0.00 -0.03 0.00 3.88 0.02 -0.77 -3.35 113.55 113.30 2dg7 h SER 21 Ca -0.00 -0.68 0.00 0.00 -0.84 0.00 0.00 61.79 60.26 2dg7 h SER 21 Cb 0.50 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.05 2dg7 h SER 21 CO 0.03 0.76 0.00 -0.62 -1.14 0.00 0.00 176.83 175.86 2dg7 n GLU 22 N -4.72 0.00 0.00 3.45 1.02 0.97 -4.74 120.64 116.63 2dg7 n GLU 22 Ca -0.08 0.08 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 2dg7 n GLU 22 Cb 0.35 -0.94 0.00 0.00 -0.02 0.00 0.00 31.44 30.83 2dg7 n GLU 22 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2dg7 n HIS 23 N -0.52 0.00 -4.39 -0.32 8.25 -0.59 -5.07 115.22 112.58 2dg7 n HIS 23 Ca 0.00 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.26 2dg7 n HIS 23 Cb 0.00 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.01 2dg7 n HIS 23 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2dg7 s GLY 24 N 0.00 1.62 0.23 -1.41 0.00 -1.25 -4.68 107.32 101.82 2dg7 s GLY 24 Ca 0.00 -1.77 -0.08 0.00 0.00 0.00 0.00 44.72 42.87 2dg7 s GLY 24 CO 0.00 -1.81 1.67 -1.82 0.00 0.00 0.00 173.10 171.14 2dg7 h TYR 25 N 2.43 0.10 0.00 1.90 3.20 -1.88 0.95 116.97 123.68 2dg7 h TYR 25 Ca -0.39 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.53 2dg7 h TYR 25 Cb 1.23 0.06 0.00 0.00 1.54 0.00 0.00 36.73 39.56 2dg7 h TYR 25 CO 0.71 -0.13 0.00 -0.25 -1.64 0.00 0.00 178.16 176.85 2dg7 n ASP 26 N -5.23 0.41 -0.93 -2.11 10.43 -1.26 -2.93 116.55 114.94 2dg7 n ASP 26 Ca 0.12 0.61 0.10 0.00 2.57 0.00 0.00 54.79 58.19 2dg7 n ASP 26 Cb 0.41 -0.70 0.15 0.00 1.84 0.00 0.00 41.12 42.83 2dg7 n ASP 26 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 2dg7 n ASN 27 N -1.97 3.03 -4.43 -2.24 5.03 0.32 -4.97 115.26 110.04 2dg7 n ASN 27 Ca 0.02 -1.90 -0.31 0.00 0.87 0.00 0.00 54.58 53.27 2dg7 n ASN 27 Cb 0.18 -0.15 -0.13 0.00 -1.02 0.00 0.00 39.78 38.65 2dg7 n ASN 27 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2dg7 s VAL 28 N -1.43 2.66 0.32 2.41 1.01 -1.15 -4.86 120.40 119.37 2dg7 s VAL 28 Ca 0.30 -1.17 0.10 0.00 0.00 0.00 0.00 61.98 61.20 2dg7 s VAL 28 Cb 0.19 -2.09 -0.06 0.00 0.00 0.00 0.00 36.38 34.42 2dg7 s VAL 28 CO 0.26 0.38 -0.06 0.42 0.00 0.00 0.00 175.10 176.11 2dg7 s THR 29 N -0.87 2.57 0.53 3.92 -4.23 -1.26 -5.01 115.64 111.28 2dg7 s THR 29 Ca 0.14 -2.11 0.24 0.00 -1.18 0.00 0.00 61.69 58.77 2dg7 s THR 29 Cb -0.10 -2.67 0.30 0.00 1.34 0.00 0.00 72.50 71.36 2dg7 s THR 29 CO 0.04 -0.25 2.16 -0.37 -0.54 0.00 0.00 174.62 175.66 2dg7 h VAL 30 N 1.95 0.74 -0.46 2.29 -1.51 -1.98 -1.38 116.25 115.91 2dg7 h VAL 30 Ca -0.42 -0.17 -0.09 0.00 -1.23 0.00 0.00 66.70 64.79 2dg7 h VAL 30 Cb 1.25 1.10 -0.02 0.00 -2.13 0.00 0.00 31.29 31.50 2dg7 h VAL 30 CO 0.66 0.04 -0.05 0.74 -1.23 0.00 0.00 177.57 177.73 2dg7 h THR 31 N 0.00 1.27 -0.63 7.19 2.02 -1.95 0.15 112.91 120.96 2dg7 h THR 31 Ca -0.00 -1.14 -0.02 0.00 0.77 0.00 0.00 66.41 66.02 2dg7 h THR 31 Cb 0.10 1.07 -0.03 0.00 -1.74 0.00 0.00 68.15 67.55 2dg7 h THR 31 CO 0.01 0.39 0.33 0.44 0.37 0.00 0.00 175.52 177.06 2dg7 h ASP 32 N 0.69 0.81 -0.42 4.18 3.32 -1.67 -1.17 116.42 122.16 2dg7 h ASP 32 Ca 0.12 -0.11 -0.06 0.00 0.02 0.00 0.00 57.03 57.01 2dg7 h ASP 32 Cb 0.58 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.91 2dg7 h ASP 32 CO 0.03 0.68 0.03 0.40 -1.72 0.00 0.00 179.24 178.67 2dg7 h ILE 33 N 0.87 1.25 -0.01 0.35 2.04 -1.16 -1.78 117.51 119.07 2dg7 h ILE 33 Ca 0.22 -0.96 -0.00 0.00 1.00 0.00 0.00 64.86 65.12 2dg7 h ILE 33 Cb 0.07 1.06 -0.00 0.00 -0.74 0.00 0.00 36.82 37.21 2dg7 h ILE 33 CO -0.03 0.33 0.00 0.00 0.00 0.00 0.00 178.15 178.45 2dg7 h ALA 34 N 0.91 0.01 -0.74 1.87 0.00 -0.44 -2.69 119.26 118.19 2dg7 h ALA 34 Ca 0.12 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 2dg7 h ALA 34 Cb 0.43 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 2dg7 h ALA 34 CO 0.02 -0.45 0.21 0.93 0.00 0.00 0.00 179.25 179.96 2dg7 h GLU 35 N -0.07 1.16 0.00 0.00 5.08 -0.75 0.44 114.58 120.43 2dg7 h GLU 35 Ca 0.00 -0.26 -0.01 0.00 -1.00 0.00 0.00 59.36 58.09 2dg7 h GLU 35 Cb 0.09 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.17 2dg7 h GLU 35 CO -0.00 1.00 -0.05 -0.09 -1.00 0.00 0.00 179.01 178.87 2dg7 h ARG 36 N 1.11 0.00 -0.16 2.33 9.65 -1.27 -0.09 114.38 125.94 2dg7 h ARG 36 Ca 0.24 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.12 2dg7 h ARG 36 Cb 0.33 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.91 2dg7 h ARG 36 CO -0.00 0.05 0.00 0.00 2.80 0.00 0.00 179.97 182.81 2dg7 n ALA 37 N -2.21 2.47 -1.00 2.80 0.00 -0.62 -4.94 120.51 117.00 2dg7 n ALA 37 Ca -0.02 -0.73 -0.00 0.00 0.00 0.00 0.00 53.44 52.69 2dg7 n ALA 37 Cb 0.17 -0.92 -0.00 0.00 0.00 0.00 0.00 19.45 18.69 2dg7 n ALA 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dg7 n GLY 38 N 1.35 0.40 3.55 0.00 0.00 -0.05 -4.88 105.19 105.56 2dg7 n GLY 38 Ca 0.17 -0.97 -0.26 0.00 0.00 0.00 0.00 46.02 44.96 2dg7 n GLY 38 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dg7 s LEU 39 N -0.04 2.73 0.47 0.99 1.43 0.14 -4.97 118.68 119.44 2dg7 s LEU 39 Ca 0.00 -1.24 -0.00 0.00 -1.03 0.00 0.00 54.13 51.86 2dg7 s LEU 39 Cb 0.00 -0.93 0.00 0.00 0.03 0.00 0.00 46.19 45.29 2dg7 s LEU 39 CO 0.00 -0.28 0.70 0.42 0.23 0.00 0.00 176.35 177.42 2dg7 s THR 40 N -2.68 3.87 0.26 5.49 -4.23 -1.26 -2.23 115.64 114.86 2dg7 s THR 40 Ca 0.33 -0.47 -0.02 0.00 -1.18 0.00 0.00 61.69 60.35 2dg7 s THR 40 Cb 0.04 -3.44 0.25 0.00 1.34 0.00 0.00 72.50 70.69 2dg7 s THR 40 CO 0.16 -0.32 1.83 -0.09 -0.54 0.00 0.00 174.62 175.67 2dg7 h ARG 41 N 0.33 0.91 -0.65 3.99 2.43 -1.89 -2.07 114.38 117.43 2dg7 h ARG 41 Ca -0.46 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 58.65 2dg7 h ARG 41 Cb 1.26 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 30.57 2dg7 h ARG 41 CO 0.57 0.60 0.39 -0.09 -1.51 0.00 0.00 179.97 179.93 2dg7 h ARG 42 N 0.93 0.88 -0.62 0.20 2.43 -1.97 -2.72 114.38 113.52 2dg7 h ARG 42 Ca 0.44 -0.08 -0.01 0.00 -0.81 0.00 0.00 59.98 59.52 2dg7 h ARG 42 Cb 0.38 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 29.71 2dg7 h ARG 42 CO -0.24 0.63 0.34 0.77 -1.51 0.00 0.00 179.97 179.96 2dg7 h SER 43 N 0.88 0.75 -0.35 -3.80 0.02 -1.77 -2.96 113.55 106.32 2dg7 h SER 43 Ca 0.23 -0.05 0.08 0.00 -0.84 0.00 0.00 61.79 61.21 2dg7 h SER 43 Cb -0.03 -0.19 -0.08 0.00 0.14 0.00 0.00 62.40 62.25 2dg7 h SER 43 CO -0.04 0.60 -0.17 0.22 -1.14 0.00 0.00 176.83 176.30 2dg7 h TYR 44 N 0.86 -0.41 0.00 3.45 5.03 -1.25 -1.09 116.97 123.56 2dg7 h TYR 44 Ca 0.22 0.04 0.00 0.00 2.58 0.00 0.00 58.73 61.57 2dg7 h TYR 44 Cb 0.01 0.23 0.00 0.00 1.55 0.00 0.00 36.73 38.52 2dg7 h TYR 44 CO 0.00 -0.24 0.00 1.19 -1.32 0.00 0.00 178.16 177.79 2dg7 n PHE 45 N -5.35 0.00 0.15 -3.82 3.01 -1.12 -0.39 117.46 109.95 2dg7 n PHE 45 Ca 0.01 0.00 0.09 0.00 1.01 0.00 0.00 57.45 58.57 2dg7 n PHE 45 Cb 0.26 -0.25 0.07 0.00 -0.01 0.00 0.00 39.48 39.55 2dg7 n PHE 45 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 2dg7 h ARG 46 N 0.00 0.00 0.00 -1.08 1.12 -1.32 -3.39 114.38 109.72 2dg7 h ARG 46 Ca 0.00 0.00 -0.32 0.00 -1.11 0.00 0.00 59.98 58.55 2dg7 h ARG 46 Cb 0.01 0.00 -0.05 0.00 -0.01 0.00 0.00 29.97 29.92 2dg7 h ARG 46 CO 0.00 0.09 -2.04 0.66 -3.11 0.00 0.00 179.97 175.57 2dg7 n TYR 47 N -2.96 0.00 -4.29 2.20 4.01 0.48 -5.03 117.16 111.57 2dg7 n TYR 47 Ca 0.01 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.56 2dg7 n TYR 47 Cb 0.59 -0.77 -0.13 0.00 -0.31 0.00 0.00 39.34 38.72 2dg7 n TYR 47 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 2dg7 s PHE 48 N -2.51 1.14 0.00 -0.72 0.40 -0.73 -5.04 117.98 110.52 2dg7 s PHE 48 Ca -0.32 -0.37 0.12 0.00 -0.60 0.00 0.00 56.93 55.76 2dg7 s PHE 48 Cb 0.11 -0.67 -0.00 0.00 0.51 0.00 0.00 43.02 42.97 2dg7 s PHE 48 CO 0.41 0.03 1.40 -1.00 0.70 0.00 0.00 175.22 176.76 2dg7 h PRO 49 N 4.84 0.00 -4.38 0.24 0.13 -1.86 -3.30 132.00 127.66 2dg7 h PRO 49 Ca -0.38 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.40 2dg7 h PRO 49 Cb 1.18 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.22 2dg7 h PRO 49 CO 0.43 0.71 -0.27 0.16 -0.23 0.00 0.00 178.00 178.80 2dg7 s ASP 50 N -6.58 1.26 0.00 1.44 1.47 -1.26 -4.99 116.67 108.01 2dg7 s ASP 50 Ca 0.02 -1.61 0.25 0.00 1.18 0.00 0.00 52.55 52.39 2dg7 s ASP 50 Cb 0.09 0.65 1.36 0.00 -0.34 0.00 0.00 42.92 44.68 2dg7 s ASP 50 CO 0.77 -1.25 1.84 2.29 0.68 0.00 0.00 175.17 179.50 2dg7 n LYS 51 N -0.61 0.54 -0.05 2.11 2.85 -1.26 -3.53 118.16 118.22 2dg7 n LYS 51 Ca 0.03 0.03 -0.22 0.00 -1.05 0.00 0.00 58.31 57.10 2dg7 n LYS 51 Cb 0.62 -1.50 -0.13 0.00 -0.65 0.00 0.00 35.03 33.37 2dg7 n LYS 51 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 177.40 175.22 2dg7 n ARG 52 N -1.16 0.67 0.27 -1.58 0.63 -1.26 -4.29 116.66 109.94 2dg7 n ARG 52 Ca 0.15 0.36 0.18 0.00 -0.92 0.00 0.00 57.85 57.62 2dg7 n ARG 52 Cb 0.15 -1.69 0.82 0.00 0.45 0.00 0.00 32.46 32.18 2dg7 n ARG 52 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 2dg7 h GLU 53 N -0.37 0.00 0.00 -0.14 4.39 -1.98 -2.27 114.58 114.21 2dg7 h GLU 53 Ca -0.43 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.27 2dg7 h GLU 53 Cb 1.75 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.40 2dg7 h GLU 53 CO -0.06 0.00 0.00 -0.24 -1.16 0.00 0.00 179.01 177.55 2dg7 h VAL 54 N 0.00 0.00 0.00 3.13 3.04 -1.75 0.67 116.25 121.34 2dg7 h VAL 54 Ca 0.00 -0.22 0.00 0.00 -1.01 0.00 0.00 66.70 65.47 2dg7 h VAL 54 Cb 0.29 0.99 0.00 0.00 -2.01 0.00 0.00 31.29 30.56 2dg7 h VAL 54 CO 0.00 0.00 -0.64 0.18 -1.01 0.00 0.00 177.57 176.10 2dg7 n LEU 55 N -2.55 0.59 -0.00 3.16 4.77 -0.85 -4.48 117.00 117.63 2dg7 n LEU 55 Ca 0.00 -0.02 -0.01 0.00 -0.03 0.00 0.00 56.01 55.96 2dg7 n LEU 55 Cb 0.19 -0.20 -0.00 0.00 -2.33 0.00 0.00 43.42 41.08 2dg7 n LEU 55 CO 0.19 0.10 -0.52 0.49 -1.33 0.00 0.00 177.39 176.32 2dg7 n PHE 56 N -1.65 0.00 0.00 -1.77 3.72 -0.48 -4.75 117.46 112.54 2dg7 n PHE 56 Ca 0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 2dg7 n PHE 56 Cb 0.36 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 38.87 2dg7 n PHE 56 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dg7 n GLY 57 N 3.39 0.00 0.28 1.37 0.00 0.22 -0.39 105.19 110.06 2dg7 n GLY 57 Ca -0.01 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.08 2dg7 n GLY 57 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dg7 n GLY 58 N -0.52 4.17 1.60 -0.02 0.00 -1.26 -4.64 105.19 104.52 2dg7 n GLY 58 Ca 0.00 -1.00 -0.08 0.00 0.00 0.00 0.00 46.02 44.94 2dg7 n GLY 58 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dg7 n SER 59 N -1.11 3.04 -3.56 1.61 7.64 0.47 -4.90 113.62 116.82 2dg7 n SER 59 Ca 0.14 -3.41 -0.18 0.00 1.01 0.00 0.00 58.87 56.43 2dg7 n SER 59 Cb 0.68 -0.42 -0.09 0.00 -1.01 0.00 0.00 64.21 63.37 2dg7 n SER 59 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 2dg7 s GLU 60 N -3.16 1.65 -0.15 1.43 -1.05 -1.13 -4.89 118.70 111.40 2dg7 s GLU 60 Ca 0.42 -1.94 -0.03 0.00 -0.15 0.00 0.00 54.97 53.26 2dg7 s GLU 60 Cb 0.38 0.28 -0.03 0.00 -0.44 0.00 0.00 34.13 34.33 2dg7 s GLU 60 CO -0.03 -0.59 -0.04 -0.51 0.95 0.00 0.00 175.26 175.04 2dg7 s LEU 61 N -3.34 3.24 -0.15 1.83 1.43 -1.26 -4.94 118.68 115.49 2dg7 s LEU 61 Ca 0.40 -0.12 -0.23 0.00 -1.03 0.00 0.00 54.13 53.15 2dg7 s LEU 61 Cb 0.03 -1.77 -0.02 0.00 0.03 0.00 0.00 46.19 44.46 2dg7 s LEU 61 CO 0.24 0.19 0.72 -0.76 0.23 0.00 0.00 176.35 176.97 2dg7 s LEU 62 N 0.23 4.20 0.23 1.79 1.43 -1.26 -4.95 118.68 120.35 2dg7 s LEU 62 Ca -0.03 1.04 -0.06 0.00 -1.03 0.00 0.00 54.13 54.06 2dg7 s LEU 62 Cb -0.14 -3.06 0.40 0.00 0.03 0.00 0.00 46.19 43.42 2dg7 s LEU 62 CO 0.03 -0.27 1.74 1.55 0.23 0.00 0.00 176.35 179.63 2dg7 h PRO 63 N 7.23 0.44 -0.99 1.29 0.13 -1.93 -1.55 132.00 136.62 2dg7 h PRO 63 Ca -0.33 -0.03 0.04 0.00 -0.87 0.00 0.00 66.00 64.81 2dg7 h PRO 63 Cb 1.15 -0.10 -0.06 0.00 0.13 0.00 0.00 31.00 32.13 2dg7 h PRO 63 CO 0.79 0.29 0.65 -1.35 -0.23 0.00 0.00 178.00 178.15 2dg7 h PRO 64 N 0.45 1.21 -0.43 1.56 0.11 -1.93 0.14 132.00 133.11 2dg7 h PRO 64 Ca 0.38 -0.07 -0.04 0.00 0.11 0.00 0.00 66.00 66.37 2dg7 h PRO 64 Cb 0.53 -0.27 -0.02 0.00 0.11 0.00 0.00 31.00 31.35 2dg7 h PRO 64 CO -0.36 0.80 0.10 0.00 -0.21 0.00 0.00 178.00 178.33 2dg7 h ALA 65 N 1.43 0.57 -0.50 -0.75 0.00 -1.75 -0.52 119.26 117.74 2dg7 h ALA 65 Ca 0.40 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 2dg7 h ALA 65 Cb 0.03 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2dg7 h ALA 65 CO -0.13 0.25 0.11 0.28 0.00 0.00 0.00 179.25 179.76 2dg7 h VAL 66 N 0.56 1.24 -0.13 0.00 2.07 -0.73 -1.82 116.25 117.46 2dg7 h VAL 66 Ca 0.14 -0.88 0.02 0.00 0.82 0.00 0.00 66.70 66.80 2dg7 h VAL 66 Cb 0.32 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 2dg7 h VAL 66 CO 0.00 0.32 -0.01 0.00 0.02 0.00 0.00 177.57 177.90 2dg7 h ALA 67 N 0.98 0.10 -0.95 1.67 0.00 -0.49 -0.95 119.26 119.62 2dg7 h ALA 67 Ca 0.15 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.13 2dg7 h ALA 67 Cb 0.36 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 2dg7 h ALA 67 CO 0.00 -0.47 0.62 0.00 0.00 0.00 0.00 179.25 179.41 2dg7 h ARG 68 N 0.03 1.18 0.00 0.00 3.08 -0.95 -0.30 114.38 117.42 2dg7 h ARG 68 Ca 0.06 -0.07 -0.07 0.00 0.07 0.00 0.00 59.98 59.96 2dg7 h ARG 68 Cb 0.08 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 29.85 2dg7 h ARG 68 CO -0.11 0.78 -0.36 0.00 -1.07 0.00 0.00 179.97 179.21 2dg7 h ALA 69 N 1.44 1.38 -0.07 0.04 0.00 -0.80 -1.33 119.26 119.92 2dg7 h ALA 69 Ca 0.37 -0.32 -0.24 0.00 0.00 0.00 0.00 54.91 54.72 2dg7 h ALA 69 Cb -0.03 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 17.71 2dg7 h ALA 69 CO -0.10 0.45 -0.89 0.28 0.00 0.00 0.00 179.25 178.98 2dg7 h VAL 70 N 0.00 1.30 -0.03 0.00 2.07 0.02 -3.06 116.25 116.55 2dg7 h VAL 70 Ca -0.00 -2.15 -0.08 0.00 0.82 0.00 0.00 66.70 65.28 2dg7 h VAL 70 Cb 0.64 2.20 -0.01 0.00 -1.52 0.00 0.00 31.29 32.59 2dg7 h VAL 70 CO 0.05 0.67 -0.35 -0.07 0.02 0.00 0.00 177.57 177.88 2dg7 h LEU 71 N 0.42 0.06 0.00 2.57 3.38 -0.68 -2.90 115.31 118.16 2dg7 h LEU 71 Ca -0.08 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2dg7 h LEU 71 Cb 1.52 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.26 2dg7 h LEU 71 CO 0.17 0.41 -0.07 0.00 0.09 0.00 0.00 178.44 179.05 2dg7 n ALA 72 N -2.47 2.41 -1.43 1.53 0.00 -0.54 -4.91 120.51 115.10 2dg7 n ALA 72 Ca -0.02 -0.09 -0.33 0.00 0.00 0.00 0.00 53.44 53.00 2dg7 n ALA 72 Cb 0.40 -1.43 0.07 0.00 0.00 0.00 0.00 19.45 18.48 2dg7 n ALA 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dg7 s ALA 73 N -3.05 2.33 -0.04 0.00 0.00 -1.10 -4.93 121.76 114.97 2dg7 s ALA 73 Ca 0.12 0.63 -0.30 0.00 0.00 0.00 0.00 51.96 52.42 2dg7 s ALA 73 Cb 0.16 -3.36 -0.07 0.00 0.00 0.00 0.00 23.12 19.84 2dg7 s ALA 73 CO 0.58 -1.52 1.94 0.34 0.00 0.00 0.00 175.76 177.10 2dg7 s ASP 74 N -2.46 6.32 0.00 0.00 3.68 -1.26 -4.83 116.67 118.12 2dg7 s ASP 74 Ca 0.69 2.41 0.00 0.00 2.13 0.00 0.00 52.55 57.78 2dg7 s ASP 74 Cb -0.23 -2.53 0.00 0.00 -1.45 0.00 0.00 42.92 38.71 2dg7 s ASP 74 CO 0.44 -1.19 0.79 -2.65 0.13 0.00 0.00 175.17 172.69 2dg7 n PRO 75 N 7.68 0.00 0.10 4.34 -0.02 -1.26 -1.26 135.00 144.58 2dg7 n PRO 75 Ca 0.21 0.30 0.11 0.00 -2.02 0.00 0.00 63.50 62.10 2dg7 n PRO 75 Cb 0.42 -1.51 0.00 0.00 -0.02 0.00 0.00 33.50 32.40 2dg7 n PRO 75 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dg7 n GLY 76 N -1.29 -1.46 3.76 -1.23 0.00 -1.26 -4.93 105.19 98.78 2dg7 n GLY 76 Ca 0.00 -0.24 -0.35 0.00 0.00 0.00 0.00 46.02 45.44 2dg7 n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dg7 s ALA 77 N -3.36 2.52 0.28 4.61 0.00 -0.39 -4.97 121.76 120.45 2dg7 s ALA 77 Ca -0.00 0.79 -0.29 0.00 0.00 0.00 0.00 51.96 52.45 2dg7 s ALA 77 Cb 0.10 -3.38 -0.10 0.00 0.00 0.00 0.00 23.12 19.73 2dg7 s ALA 77 CO 0.79 -1.16 1.40 0.00 0.00 0.00 0.00 175.76 176.79 2dg7 s ALA 78 N -1.93 3.58 0.28 0.00 0.00 -1.26 -4.83 121.76 117.60 2dg7 s ALA 78 Ca 0.72 1.32 0.02 0.00 0.00 0.00 0.00 51.96 54.03 2dg7 s ALA 78 Cb -0.25 -3.53 0.67 0.00 0.00 0.00 0.00 23.12 20.01 2dg7 s ALA 78 CO 0.35 -0.73 1.70 -1.00 0.00 0.00 0.00 175.76 176.08 2dg7 h PRO 79 N 4.36 0.39 -0.53 0.00 0.13 -1.96 -0.79 132.00 133.59 2dg7 h PRO 79 Ca -0.47 -0.02 -0.07 0.00 -0.87 0.00 0.00 66.00 64.57 2dg7 h PRO 79 Cb 1.22 -0.09 -0.02 0.00 0.13 0.00 0.00 31.00 32.24 2dg7 h PRO 79 CO 0.73 0.25 0.08 1.25 -0.23 0.00 0.00 178.00 180.08 2dg7 h LEU 80 N 0.40 0.86 -0.57 1.56 5.85 -1.92 -1.08 115.31 120.41 2dg7 h LEU 80 Ca 0.53 -0.26 -0.07 0.00 0.84 0.00 0.00 57.88 58.91 2dg7 h LEU 80 Cb 0.98 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.76 2dg7 h LEU 80 CO -0.52 0.90 0.07 0.74 -0.34 0.00 0.00 178.44 179.30 2dg7 h THR 81 N 0.77 1.26 -0.50 1.05 2.02 -1.72 -0.32 112.91 115.48 2dg7 h THR 81 Ca 0.16 -1.02 -0.00 0.00 0.77 0.00 0.00 66.41 66.32 2dg7 h THR 81 Cb 0.42 0.81 -0.02 0.00 -1.74 0.00 0.00 68.15 67.61 2dg7 h THR 81 CO 0.01 0.37 0.30 0.00 0.37 0.00 0.00 175.52 176.57 2dg7 h ALA 82 N 0.99 0.63 -0.01 6.16 0.00 -0.98 0.27 119.26 126.32 2dg7 h ALA 82 Ca 0.17 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2dg7 h ALA 82 Cb 0.45 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 2dg7 h ALA 82 CO 0.02 0.12 -0.00 0.28 0.00 0.00 0.00 179.25 179.67 2dg7 h VAL 83 N 0.66 1.27 -0.62 0.00 2.07 -0.99 -1.18 116.25 117.47 2dg7 h VAL 83 Ca 0.18 -0.81 -0.03 0.00 0.82 0.00 0.00 66.70 66.87 2dg7 h VAL 83 Cb -0.00 1.81 -0.03 0.00 -1.52 0.00 0.00 31.29 31.54 2dg7 h VAL 83 CO -0.03 0.21 0.29 -0.07 0.02 0.00 0.00 177.57 177.98 2dg7 h LEU 84 N -0.32 0.80 -0.61 2.57 3.38 -0.98 -2.11 115.31 118.02 2dg7 h LEU 84 Ca 0.00 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 57.80 2dg7 h LEU 84 Cb 0.34 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 2dg7 h LEU 84 CO 0.00 0.69 0.03 0.44 0.09 0.00 0.00 178.44 179.69 2dg7 h ASP 85 N 0.88 1.03 0.00 -0.43 3.45 -0.88 -0.88 116.42 119.59 2dg7 h ASP 85 Ca 0.22 -0.29 0.00 0.00 0.43 0.00 0.00 57.03 57.38 2dg7 h ASP 85 Cb 0.11 -0.28 0.00 0.00 -0.56 0.00 0.00 39.33 38.61 2dg7 h ASP 85 CO -0.03 1.07 0.00 0.00 -1.57 0.00 0.00 179.24 178.71 2dg7 n ALA 86 N -2.47 1.46 0.00 3.45 0.00 -0.45 -0.76 120.51 121.74 2dg7 n ALA 86 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2dg7 n ALA 86 Cb 0.33 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.78 2dg7 n ALA 86 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2dg7 n SER 88 N 0.57 0.00 -0.17 0.00 7.64 -0.33 -1.45 113.62 119.88 2dg7 n SER 88 Ca 0.00 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.79 2dg7 n SER 88 Cb 0.07 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.28 2dg7 n SER 88 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 2dg7 h GLN 89 N 0.00 0.77 -0.03 1.43 4.15 -1.20 -0.04 115.11 120.19 2dg7 h GLN 89 Ca 0.00 -0.18 -0.14 0.00 0.77 0.00 0.00 58.65 59.11 2dg7 h GLN 89 Cb 0.00 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.57 2dg7 h GLN 89 CO 0.00 0.74 -0.62 0.28 -1.93 0.00 0.00 178.83 177.29 2dg7 h VAL 90 N 0.65 1.42 -0.56 2.39 2.07 -1.50 -3.08 116.25 117.65 2dg7 h VAL 90 Ca 0.15 -2.07 -0.03 0.00 0.82 0.00 0.00 66.70 65.57 2dg7 h VAL 90 Cb 0.30 2.09 -0.02 0.00 -1.52 0.00 0.00 31.29 32.15 2dg7 h VAL 90 CO -0.00 0.60 0.04 0.61 0.02 0.00 0.00 177.57 178.84 2dg7 n GLY 91 N 0.27 3.25 0.28 2.17 0.00 -1.11 -4.65 105.19 105.40 2dg7 n GLY 91 Ca -0.02 -0.96 0.02 0.00 0.00 0.00 0.00 46.02 45.07 2dg7 n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dg7 h ALA 92 N 3.51 0.57 0.23 4.61 0.00 -0.91 -0.93 119.26 126.35 2dg7 h ALA 92 Ca 0.04 0.27 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 2dg7 h ALA 92 Cb 1.97 0.52 0.00 0.00 0.00 0.00 0.00 17.79 20.28 2dg7 h ALA 92 CO 0.49 -0.42 -0.11 1.96 0.00 0.00 0.00 179.25 181.17 2dg7 h GLN 93 N 0.03 -0.30 -0.23 0.00 1.08 -1.87 -3.15 115.11 110.66 2dg7 h GLN 93 Ca 0.37 0.02 0.03 0.00 -1.45 0.00 0.00 58.65 57.62 2dg7 h GLN 93 Cb 0.60 0.07 -0.05 0.00 -0.05 0.00 0.00 27.48 28.04 2dg7 h GLN 93 CO -0.73 -0.17 -0.37 1.25 -0.95 0.00 0.00 178.83 177.86 2dg7 h LEU 94 N -0.35 -1.22 -2.97 1.46 5.85 -1.55 -1.36 115.31 115.17 2dg7 h LEU 94 Ca -0.03 0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 2dg7 h LEU 94 Cb 0.27 0.49 -0.00 0.00 0.37 0.00 0.00 40.66 41.79 2dg7 h LEU 94 CO 0.05 -0.28 0.01 1.33 -0.34 0.00 0.00 178.44 179.21 2dg7 n VAL 95 N -4.47 1.97 -0.01 1.05 0.24 -0.68 -3.97 118.33 112.46 2dg7 n VAL 95 Ca -0.03 -0.50 -0.05 0.00 -2.04 0.00 0.00 64.34 61.72 2dg7 n VAL 95 Cb 0.23 -1.47 -0.02 0.00 -1.47 0.00 0.00 33.84 31.11 2dg7 n VAL 95 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dg7 n ALA 96 N 1.43 2.56 -3.57 2.33 0.00 -0.51 -4.71 120.51 118.04 2dg7 n ALA 96 Ca 0.01 -0.22 -0.35 0.00 0.00 0.00 0.00 53.44 52.87 2dg7 n ALA 96 Cb 0.50 0.32 -0.14 0.00 0.00 0.00 0.00 19.45 20.14 2dg7 n ALA 96 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2dg7 s GLN 97 N -2.15 3.03 0.00 0.00 -1.52 -1.25 -4.95 119.66 112.82 2dg7 s GLN 97 Ca -0.08 -0.86 0.07 0.00 -1.95 0.00 0.00 55.36 52.54 2dg7 s GLN 97 Cb 0.02 -3.05 0.34 0.00 -0.22 0.00 0.00 33.01 30.09 2dg7 s GLN 97 CO 0.10 -0.35 1.06 1.33 -0.25 0.00 0.00 175.29 177.18 2dg7 n VAL 98 N 4.74 0.86 -1.52 1.09 0.24 -1.26 -4.59 118.33 117.89 2dg7 n VAL 98 Ca -0.17 0.22 -0.47 0.00 -2.04 0.00 0.00 64.34 61.88 2dg7 n VAL 98 Cb 0.48 -1.11 -0.05 0.00 -1.47 0.00 0.00 33.84 31.69 2dg7 n VAL 98 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 2dg7 n GLU 99 N -1.28 1.51 -0.05 7.34 4.07 -1.26 -1.42 120.64 129.56 2dg7 n GLU 99 Ca 0.03 0.41 0.00 0.00 -0.06 0.00 0.00 57.16 57.54 2dg7 n GLU 99 Cb 0.05 -2.85 0.00 0.00 -0.06 0.00 0.00 31.44 28.59 2dg7 n GLU 99 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2dg7 n GLY 100 N 6.17 2.73 0.11 8.31 0.00 -1.26 -4.89 105.19 116.36 2dg7 n GLY 100 Ca 0.36 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.29 2dg7 n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dg7 h ALA 101 N 0.00 0.21 -0.74 4.61 0.00 -1.49 -1.58 119.26 120.27 2dg7 h ALA 101 Ca 0.00 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 2dg7 h ALA 101 Cb 0.00 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2dg7 h ALA 101 CO 0.00 -0.38 0.28 0.00 0.00 0.00 0.00 179.25 179.15 2dg7 h ALA 102 N 1.15 0.96 0.14 0.00 0.00 -1.91 -2.12 119.26 117.48 2dg7 h ALA 102 Ca 0.09 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2dg7 h ALA 102 Cb 0.08 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 2dg7 h ALA 102 CO -0.12 0.60 -0.09 1.96 0.00 0.00 0.00 179.25 181.61 2dg7 h GLN 103 N 1.08 -0.22 -0.52 0.00 4.20 -1.84 -1.13 115.11 116.68 2dg7 h GLN 103 Ca 0.24 0.02 0.07 0.00 0.06 0.00 0.00 58.65 59.04 2dg7 h GLN 103 Cb 0.24 0.05 -0.06 0.00 0.30 0.00 0.00 27.48 28.01 2dg7 h GLN 103 CO -0.02 -0.15 0.19 -0.09 -0.67 0.00 0.00 178.83 178.10 2dg7 h ARG 104 N -0.23 0.36 -0.57 1.46 2.43 -1.19 -1.76 114.38 114.88 2dg7 h ARG 104 Ca -0.01 -0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.17 2dg7 h ARG 104 Cb 0.19 -0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 29.62 2dg7 h ARG 104 CO 0.01 0.24 0.34 -0.09 -1.51 0.00 0.00 179.97 178.96 2dg7 h ARG 105 N 0.37 0.65 -0.73 0.20 9.65 -1.11 -1.53 114.38 121.89 2dg7 h ARG 105 Ca 0.25 -0.04 -0.02 0.00 -1.10 0.00 0.00 59.98 59.07 2dg7 h ARG 105 Cb 0.26 -0.15 -0.03 0.00 -1.39 0.00 0.00 29.97 28.67 2dg7 h ARG 105 CO -0.25 0.43 0.37 0.00 2.80 0.00 0.00 179.97 183.32 2dg7 h ALA 106 N 1.26 0.93 -0.44 2.80 0.00 -0.57 -0.55 119.26 122.69 2dg7 h ALA 106 Ca 0.23 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 2dg7 h ALA 106 Cb 0.05 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 2dg7 h ALA 106 CO -0.11 0.47 0.01 0.28 0.00 0.00 0.00 179.25 179.90 2dg7 h VAL 107 N 1.01 1.26 -0.30 0.00 2.07 -0.95 -2.54 116.25 116.80 2dg7 h VAL 107 Ca 0.25 -1.02 -0.07 0.00 0.82 0.00 0.00 66.70 66.68 2dg7 h VAL 107 Cb 0.08 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 2dg7 h VAL 107 CO -0.04 0.35 -0.07 0.40 0.02 0.00 0.00 177.57 178.23 2dg7 h ILE 108 N 0.61 1.28 0.00 4.57 2.04 -1.10 -2.92 117.51 121.99 2dg7 h ILE 108 Ca 0.13 -1.11 -0.01 0.00 1.00 0.00 0.00 64.86 64.86 2dg7 h ILE 108 Cb 0.48 1.40 -0.00 0.00 -0.74 0.00 0.00 36.82 37.95 2dg7 h ILE 108 CO 0.02 0.35 -0.07 0.44 0.00 0.00 0.00 178.15 178.90 2dg7 h ASP 109 N 0.34 0.00 0.47 1.72 3.32 -1.08 -2.04 116.42 119.15 2dg7 h ASP 109 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 2dg7 h ASP 109 Cb 0.56 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.11 2dg7 h ASP 109 CO 0.03 0.07 -0.30 0.00 -1.72 0.00 0.00 179.24 177.32 2dg7 n ALA 110 N -2.28 3.12 -4.01 3.45 0.00 -0.96 -4.80 120.51 115.03 2dg7 n ALA 110 Ca -0.02 -0.31 -0.30 0.00 0.00 0.00 0.00 53.44 52.80 2dg7 n ALA 110 Cb 0.18 -1.21 -0.16 0.00 0.00 0.00 0.00 19.45 18.25 2dg7 n ALA 110 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2dg7 s SER 111 N -2.78 2.95 0.38 0.00 0.15 -0.77 -5.01 113.70 108.63 2dg7 s SER 111 Ca 0.18 -0.63 0.05 0.00 0.70 0.00 0.00 55.95 56.25 2dg7 s SER 111 Cb 0.19 -1.20 0.76 0.00 -1.71 0.00 0.00 66.02 64.06 2dg7 s SER 111 CO 0.59 -0.09 2.04 1.55 1.20 0.00 0.00 173.24 178.53 2dg7 h PRO 112 N 8.02 0.67 -0.40 5.44 0.13 -1.87 -1.44 132.00 142.55 2dg7 h PRO 112 Ca -0.35 -0.04 -0.13 0.00 -0.87 0.00 0.00 66.00 64.61 2dg7 h PRO 112 Cb 1.12 -0.15 -0.01 0.00 0.13 0.00 0.00 31.00 32.09 2dg7 h PRO 112 CO 0.51 0.45 -0.27 1.49 -0.23 0.00 0.00 178.00 179.94 2dg7 h GLU 113 N 0.69 0.86 -0.14 0.86 4.81 -1.95 -1.92 114.58 117.79 2dg7 h GLU 113 Ca 0.19 -0.38 -0.17 0.00 -0.13 0.00 0.00 59.36 58.87 2dg7 h GLU 113 Cb -0.06 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.29 2dg7 h GLU 113 CO -0.04 1.03 -0.63 -0.07 -0.73 0.00 0.00 179.01 178.56 2dg7 h LEU 114 N 0.73 0.58 -0.11 1.64 3.38 -1.73 -1.48 115.31 118.33 2dg7 h LEU 114 Ca 0.09 -0.34 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 2dg7 h LEU 114 Cb 0.82 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 2dg7 h LEU 114 CO 0.07 1.07 0.06 1.56 0.09 0.00 0.00 178.44 181.29 2dg7 h GLN 115 N 0.37 0.15 -0.71 1.13 4.20 -1.13 0.49 115.11 119.60 2dg7 h GLN 115 Ca -0.01 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.67 2dg7 h GLN 115 Cb 1.19 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.91 2dg7 h GLN 115 CO 0.12 0.18 0.38 0.93 -0.67 0.00 0.00 178.83 179.77 2dg7 h GLU 116 N 0.08 0.99 -0.92 1.46 5.08 -1.34 -1.49 114.58 118.44 2dg7 h GLU 116 Ca 0.04 -0.11 0.06 0.00 -1.00 0.00 0.00 59.36 58.35 2dg7 h GLU 116 Cb 0.08 -0.20 -0.06 0.00 0.50 0.00 0.00 28.75 29.07 2dg7 h GLU 116 CO -0.01 0.73 0.58 -0.09 -1.00 0.00 0.00 179.01 179.23 2dg7 h ARG 117 N 1.00 1.03 -0.17 2.33 9.65 -0.41 -1.44 114.38 126.36 2dg7 h ARG 117 Ca 0.25 -0.06 -0.13 0.00 -1.10 0.00 0.00 59.98 58.94 2dg7 h ARG 117 Cb 0.04 -0.23 0.00 0.00 -1.39 0.00 0.00 29.97 28.39 2dg7 h ARG 117 CO -0.04 0.68 -0.41 1.49 2.80 0.00 0.00 179.97 184.49 2dg7 h GLU 118 N 1.06 0.57 -0.98 0.20 4.81 0.04 -2.97 114.58 117.31 2dg7 h GLU 118 Ca 0.40 -0.39 0.04 0.00 -0.13 0.00 0.00 59.36 59.28 2dg7 h GLU 118 Cb 0.16 0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.54 2dg7 h GLU 118 CO -0.17 1.01 0.64 0.00 -0.73 0.00 0.00 179.01 179.76 2dg7 h ARG 119 N 0.22 1.19 -0.61 1.92 3.08 -0.94 0.26 114.38 119.49 2dg7 h ARG 119 Ca -0.00 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 2dg7 h ARG 119 Cb 1.02 -0.27 -0.03 0.00 0.08 0.00 0.00 29.97 30.77 2dg7 h ARG 119 CO 0.09 0.79 0.28 1.15 -1.07 0.00 0.00 179.97 181.20 2dg7 h THR 120 N 1.23 1.21 -0.18 2.04 2.02 -1.27 0.10 112.91 118.05 2dg7 h THR 120 Ca 0.40 -0.60 -0.05 0.00 0.77 0.00 0.00 66.41 66.92 2dg7 h THR 120 Cb 0.03 0.44 -0.00 0.00 -1.74 0.00 0.00 68.15 66.88 2dg7 h THR 120 CO -0.13 0.25 -0.08 0.11 0.37 0.00 0.00 175.52 176.04 2dg7 h LYS 121 N 0.87 0.38 -0.91 6.66 6.56 -1.02 -2.48 116.57 126.63 2dg7 h LYS 121 Ca 0.21 -0.16 -0.00 0.00 -1.06 0.00 0.00 60.65 59.64 2dg7 h LYS 121 Cb 0.12 -0.01 -0.04 0.00 -0.57 0.00 0.00 32.23 31.72 2dg7 h LYS 121 CO -0.03 0.67 0.57 0.77 -2.06 0.00 0.00 179.45 179.37 2dg7 h SER 122 N 0.07 1.08 -0.65 0.86 0.02 -0.55 -1.80 113.55 112.58 2dg7 h SER 122 Ca 0.04 -0.05 -0.05 0.00 -0.84 0.00 0.00 61.79 60.89 2dg7 h SER 122 Cb 0.55 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.79 2dg7 h SER 122 CO 0.03 0.82 0.23 0.00 -1.14 0.00 0.00 176.83 176.76 2dg7 h ALA 123 N 1.37 0.85 -0.28 3.77 0.00 -0.92 -0.52 119.26 123.53 2dg7 h ALA 123 Ca 0.33 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 2dg7 h ALA 123 Cb -0.08 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 2dg7 h ALA 123 CO -0.06 0.50 -0.17 0.00 0.00 0.00 0.00 179.25 179.51 2dg7 h ALA 124 N 1.09 1.18 -0.14 0.00 0.00 -0.96 -0.29 119.26 120.13 2dg7 h ALA 124 Ca 0.21 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 2dg7 h ALA 124 Cb 0.26 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2dg7 h ALA 124 CO -0.01 0.52 -0.22 0.82 0.00 0.00 0.00 179.25 180.36 2dg7 h ILE 125 N 0.45 1.36 -0.87 0.00 2.04 -1.03 -1.91 117.51 117.56 2dg7 h ILE 125 Ca 0.08 -1.46 0.04 0.00 1.00 0.00 0.00 64.86 64.53 2dg7 h ILE 125 Cb 0.56 1.97 -0.06 0.00 -0.74 0.00 0.00 36.82 38.55 2dg7 h ILE 125 CO 0.04 0.43 0.56 -1.28 0.00 0.00 0.00 178.15 177.89 2dg7 h SER 126 N 0.02 0.91 -0.43 1.72 0.87 -0.88 -0.57 113.55 115.19 2dg7 h SER 126 Ca 0.01 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.47 2dg7 h SER 126 Cb 0.80 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.55 2dg7 h SER 126 CO 0.05 0.61 -0.13 -0.09 -0.53 0.00 0.00 176.83 176.73 2dg7 h ARG 127 N 1.05 0.90 -0.38 2.24 1.12 -0.99 -1.28 114.38 117.05 2dg7 h ARG 127 Ca 0.36 -0.33 -0.10 0.00 -1.11 0.00 0.00 59.98 58.80 2dg7 h ARG 127 Cb 0.07 -0.06 -0.02 0.00 -0.01 0.00 0.00 29.97 29.95 2dg7 h ARG 127 CO -0.14 0.98 -0.16 0.00 -3.11 0.00 0.00 179.97 177.54 2dg7 h ALA 128 N 1.04 1.00 -0.43 2.80 0.00 -0.68 -2.43 119.26 120.57 2dg7 h ALA 128 Ca 0.12 -0.33 -0.13 0.00 0.00 0.00 0.00 54.91 54.58 2dg7 h ALA 128 Cb 0.66 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2dg7 h ALA 128 CO 0.05 0.59 -0.24 0.28 0.00 0.00 0.00 179.25 179.93 2dg7 h VAL 129 N 0.63 1.27 -0.22 0.00 2.07 -0.83 -2.43 116.25 116.74 2dg7 h VAL 129 Ca 0.10 -1.39 -0.00 0.00 0.82 0.00 0.00 66.70 66.23 2dg7 h VAL 129 Cb 0.63 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 2dg7 h VAL 129 CO 0.04 0.47 0.13 1.56 0.02 0.00 0.00 177.57 179.80 2dg7 h GLN 130 N 0.77 0.30 -0.82 1.57 4.20 -0.98 -0.70 115.11 119.45 2dg7 h GLN 130 Ca 0.10 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 2dg7 h GLN 130 Cb 0.79 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.47 2dg7 h GLN 130 CO 0.07 0.24 0.48 -0.44 -0.67 0.00 0.00 178.83 178.50 2dg7 h ASP 131 N 0.27 0.99 -0.33 1.46 3.32 -1.37 -0.72 116.42 120.05 2dg7 h ASP 131 Ca 0.08 -0.07 -0.08 0.00 0.02 0.00 0.00 57.03 56.98 2dg7 h ASP 131 Cb 0.02 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 2dg7 h ASP 131 CO -0.02 0.78 -0.12 0.00 -1.72 0.00 0.00 179.24 178.16 2dg7 h ALA 132 N 1.39 0.46 -0.44 3.45 0.00 -1.17 -2.11 119.26 120.85 2dg7 h ALA 132 Ca 0.29 -0.32 0.02 0.00 0.00 0.00 0.00 54.91 54.90 2dg7 h ALA 132 Cb -0.02 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2dg7 h ALA 132 CO -0.05 0.34 0.25 -0.07 0.00 0.00 0.00 179.25 179.72 2dg7 h LEU 133 N 0.45 0.41 -1.00 0.00 4.07 -0.70 -2.16 115.31 116.37 2dg7 h LEU 133 Ca 0.08 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 58.04 2dg7 h LEU 133 Cb 0.64 -0.08 -0.04 0.00 1.08 0.00 0.00 40.66 42.26 2dg7 h LEU 133 CO 0.04 0.29 0.55 0.58 -1.08 0.00 0.00 178.44 178.82 2dg7 h VAL 134 N 0.51 1.25 0.00 1.22 2.07 -1.05 0.85 116.25 121.10 2dg7 h VAL 134 Ca 0.18 -0.55 0.00 0.00 0.82 0.00 0.00 66.70 67.15 2dg7 h VAL 134 Cb 0.02 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 29.75 2dg7 h VAL 134 CO -0.09 0.26 0.00 0.54 0.02 0.00 0.00 177.57 178.31 2dg7 n ARG 135 N -4.36 0.12 -0.75 1.57 1.74 -0.80 -1.55 116.66 112.64 2dg7 n ARG 135 Ca 0.10 0.48 0.02 0.00 -0.77 0.00 0.00 57.85 57.68 2dg7 n ARG 135 Cb 0.06 -1.80 0.29 0.00 -1.02 0.00 0.00 32.46 29.99 2dg7 n ARG 135 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2dg7 n ARG 136 N -2.04 3.32 -1.48 5.56 5.12 0.25 -4.95 116.66 122.44 2dg7 n ARG 136 Ca 0.01 -3.02 -0.10 0.00 -1.93 0.00 0.00 57.85 52.81 2dg7 n ARG 136 Cb 0.12 -2.03 -0.03 0.00 -1.16 0.00 0.00 32.46 29.37 2dg7 n ARG 136 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 2dg7 n GLN 137 N -0.32 -0.70 -3.48 5.56 1.13 -0.59 -5.02 117.38 113.96 2dg7 n GLN 137 Ca 0.30 0.76 -0.37 0.00 -1.94 0.00 0.00 57.00 55.75 2dg7 n GLN 137 Cb 1.12 -4.70 -0.07 0.00 0.11 0.00 0.00 30.24 26.70 2dg7 n GLN 137 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2dg7 s VAL 138 N -2.39 5.27 0.52 5.09 1.01 -0.96 -5.02 120.40 123.91 2dg7 s VAL 138 Ca 0.00 0.62 -0.23 0.00 0.00 0.00 0.00 61.98 62.37 2dg7 s VAL 138 Cb 0.00 -3.67 -0.06 0.00 0.00 0.00 0.00 36.38 32.65 2dg7 s VAL 138 CO 0.00 0.34 1.39 1.51 0.00 0.00 0.00 175.10 178.34 2dg7 s ASP 139 N 0.67 5.43 0.20 3.32 -4.77 -1.26 -3.96 116.67 116.30 2dg7 s ASP 139 Ca 0.18 2.83 -0.17 0.00 -3.30 0.00 0.00 52.55 52.09 2dg7 s ASP 139 Cb -0.14 -2.64 0.20 0.00 -1.09 0.00 0.00 42.92 39.25 2dg7 s ASP 139 CO 0.06 -1.47 1.60 0.00 0.70 0.00 0.00 175.17 176.06 2dg7 h ALA 140 N 1.71 0.19 -0.99 2.11 0.00 -1.95 0.24 119.26 120.56 2dg7 h ALA 140 Ca -0.51 0.22 0.04 0.00 0.00 0.00 0.00 54.91 54.65 2dg7 h ALA 140 Cb 1.29 0.67 -0.06 0.00 0.00 0.00 0.00 17.79 19.69 2dg7 h ALA 140 CO 0.58 -0.56 0.65 -0.44 0.00 0.00 0.00 179.25 179.48 2dg7 h ASP 141 N -0.09 1.08 -0.17 0.00 3.32 -2.00 -0.57 116.42 118.00 2dg7 h ASP 141 Ca 0.28 -0.01 -0.22 0.00 0.02 0.00 0.00 57.03 57.10 2dg7 h ASP 141 Cb 0.54 -0.25 0.01 0.00 0.22 0.00 0.00 39.33 39.85 2dg7 h ASP 141 CO -0.70 0.74 -0.76 0.74 -1.72 0.00 0.00 179.24 177.54 2dg7 h THR 142 N 1.25 1.27 -0.82 0.35 2.02 -1.64 -3.02 112.91 112.32 2dg7 h THR 142 Ca 0.39 -1.95 0.05 0.00 0.77 0.00 0.00 66.41 65.68 2dg7 h THR 142 Cb 0.01 1.95 -0.05 0.00 -1.74 0.00 0.00 68.15 68.32 2dg7 h THR 142 CO -0.12 0.62 0.54 0.00 0.37 0.00 0.00 175.52 176.93 2dg7 h ALA 143 N 0.56 1.56 -0.35 6.16 0.00 0.01 -1.17 119.26 126.02 2dg7 h ALA 143 Ca -0.05 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 2dg7 h ALA 143 Cb 1.39 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2dg7 h ALA 143 CO 0.16 0.33 0.05 1.49 0.00 0.00 0.00 179.25 181.28 2dg7 h GLU 144 N 0.95 0.59 -0.58 0.00 4.81 -1.06 -2.03 114.58 117.26 2dg7 h GLU 144 Ca 0.35 -0.16 -0.11 0.00 -0.13 0.00 0.00 59.36 59.31 2dg7 h GLU 144 Cb 0.16 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 2dg7 h GLU 144 CO -0.12 0.67 -0.05 -0.07 -0.73 0.00 0.00 179.01 178.71 2dg7 h LEU 145 N 0.42 1.06 -0.50 1.64 3.38 -1.29 -1.82 115.31 118.20 2dg7 h LEU 145 Ca 0.11 -0.33 -0.05 0.00 0.09 0.00 0.00 57.88 57.70 2dg7 h LEU 145 Cb 0.37 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 2dg7 h LEU 145 CO 0.01 1.13 0.11 0.58 0.09 0.00 0.00 178.44 180.36 2dg7 h VAL 146 N 0.96 1.24 -0.26 1.22 2.07 -1.17 0.35 116.25 120.66 2dg7 h VAL 146 Ca 0.16 -0.87 -0.04 0.00 0.82 0.00 0.00 66.70 66.77 2dg7 h VAL 146 Cb 0.62 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 2dg7 h VAL 146 CO 0.04 0.31 0.01 0.00 0.02 0.00 0.00 177.57 177.96 2dg7 h ALA 147 N 0.99 0.35 -0.56 1.67 0.00 -1.31 -0.43 119.26 119.96 2dg7 h ALA 147 Ca 0.16 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 2dg7 h ALA 147 Cb 0.35 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2dg7 h ALA 147 CO 0.00 0.07 0.12 1.96 0.00 0.00 0.00 179.25 181.41 2dg7 h GLN 148 N 0.24 0.91 -0.48 0.00 1.08 -1.27 -0.95 115.11 114.64 2dg7 h GLN 148 Ca 0.08 -0.23 -0.03 0.00 -1.45 0.00 0.00 58.65 57.02 2dg7 h GLN 148 Cb 0.40 -0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 27.69 2dg7 h GLN 148 CO 0.01 0.86 0.19 1.25 -0.95 0.00 0.00 178.83 180.19 2dg7 h LEU 149 N 0.81 0.67 -0.83 1.46 5.85 -0.84 -1.37 115.31 121.06 2dg7 h LEU 149 Ca 0.17 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 2dg7 h LEU 149 Cb 0.37 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 2dg7 h LEU 149 CO 0.01 0.66 0.40 0.00 -0.34 0.00 0.00 178.44 179.17 2dg7 h ALA 150 N 1.03 1.07 -0.55 1.25 0.00 -0.89 0.23 119.26 121.41 2dg7 h ALA 150 Ca 0.16 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2dg7 h ALA 150 Cb 0.21 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 2dg7 h ALA 150 CO -0.01 0.64 0.35 1.15 0.00 0.00 0.00 179.25 181.38 2dg7 h THR 151 N 1.18 1.15 -0.26 0.00 2.02 -0.79 0.59 112.91 116.80 2dg7 h THR 151 Ca 0.29 -0.30 -0.04 0.00 0.77 0.00 0.00 66.41 67.13 2dg7 h THR 151 Cb 0.12 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 66.89 2dg7 h THR 151 CO -0.04 0.15 0.02 0.58 0.37 0.00 0.00 175.52 176.60 2dg7 h VAL 152 N 0.74 1.25 -0.29 3.16 2.07 -0.79 -1.78 116.25 120.60 2dg7 h VAL 152 Ca 0.20 -0.86 -0.02 0.00 0.82 0.00 0.00 66.70 66.84 2dg7 h VAL 152 Cb -0.06 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 2dg7 h VAL 152 CO -0.04 0.27 0.09 0.00 0.02 0.00 0.00 177.57 177.91 2dg7 h ALA 153 N 0.83 0.38 -0.41 1.67 0.00 -0.75 -1.90 119.26 119.09 2dg7 h ALA 153 Ca 0.08 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 2dg7 h ALA 153 Cb 0.38 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2dg7 h ALA 153 CO 0.01 0.02 -0.08 0.35 0.00 0.00 0.00 179.25 179.55 2dg7 h PHE 154 N 0.31 0.87 -0.44 0.00 3.04 -0.91 -1.29 116.94 118.52 2dg7 h PHE 154 Ca 0.09 -0.18 -0.02 0.00 3.98 0.00 0.00 57.97 61.84 2dg7 h PHE 154 Cb 0.25 -0.21 -0.02 0.00 2.56 0.00 0.00 35.95 38.52 2dg7 h PHE 154 CO 0.01 0.89 0.19 0.78 -2.02 0.00 0.00 178.31 178.16 2dg7 h GLY 155 N 0.59 0.70 0.97 2.40 0.00 -1.30 -0.63 103.07 105.80 2dg7 h GLY 155 Ca 0.11 -0.37 -0.05 0.00 0.00 0.00 0.00 47.33 47.01 2dg7 h GLY 155 CO 0.04 0.35 0.09 1.76 0.00 0.00 0.00 176.54 178.77 2dg7 h SER 156 N 0.57 0.72 -0.62 0.19 0.02 -1.30 -1.94 113.55 111.19 2dg7 h SER 156 Ca 0.15 -0.25 -0.02 0.00 -0.84 0.00 0.00 61.79 60.83 2dg7 h SER 156 Cb 0.17 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.49 2dg7 h SER 156 CO -0.01 0.79 0.32 0.00 -1.14 0.00 0.00 176.83 176.79 2dg7 h ALA 157 N 0.96 0.79 -0.45 3.77 0.00 -1.09 -1.13 119.26 122.12 2dg7 h ALA 157 Ca 0.14 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2dg7 h ALA 157 Cb 0.37 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2dg7 h ALA 157 CO 0.01 0.33 0.29 0.35 0.00 0.00 0.00 179.25 180.23 2dg7 h PHE 158 N 0.84 0.58 -0.40 0.00 3.57 -0.94 0.21 116.94 120.80 2dg7 h PHE 158 Ca 0.22 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.74 2dg7 h PHE 158 Cb 0.07 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 38.59 2dg7 h PHE 158 CO -0.01 0.39 0.24 -0.09 -2.23 0.00 0.00 178.31 176.61 2dg7 h ARG 159 N 0.61 0.48 -0.90 1.11 2.43 -1.01 -0.59 114.38 116.52 2dg7 h ARG 159 Ca 0.17 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.29 2dg7 h ARG 159 Cb -0.04 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 29.36 2dg7 h ARG 159 CO -0.03 0.32 0.50 0.00 -1.51 0.00 0.00 179.97 179.24 2dg7 h ARG 160 N 0.49 1.25 -0.76 0.20 3.08 -0.76 -1.64 114.38 116.24 2dg7 h ARG 160 Ca 0.16 -0.14 0.04 0.00 0.07 0.00 0.00 59.98 60.11 2dg7 h ARG 160 Cb -0.01 -0.25 -0.05 0.00 0.08 0.00 0.00 29.97 29.75 2dg7 h ARG 160 CO -0.07 0.91 0.47 2.35 -1.07 0.00 0.00 179.97 182.56 2dg7 h TRP 161 N 1.25 0.87 -0.27 3.04 7.01 0.26 -1.43 115.95 126.69 2dg7 h TRP 161 Ca 0.32 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.32 2dg7 h TRP 161 Cb 0.02 -0.28 -0.01 0.00 -2.10 0.00 0.00 29.16 26.79 2dg7 h TRP 161 CO 0.01 0.47 0.10 0.82 -2.79 0.00 0.00 178.44 177.04 2dg7 h ILE 162 N 0.88 1.18 0.00 2.65 2.04 -0.48 -2.83 117.51 120.95 2dg7 h ILE 162 Ca 0.32 -0.56 -0.02 0.00 1.00 0.00 0.00 64.86 65.60 2dg7 h ILE 162 Cb 0.09 1.05 -0.00 0.00 -0.74 0.00 0.00 36.82 37.22 2dg7 h ILE 162 CO -0.14 0.19 -0.08 0.44 0.00 0.00 0.00 178.15 178.55 2dg7 h ASP 163 N 0.28 0.00 0.07 1.72 3.32 -0.80 -1.37 116.42 119.64 2dg7 h ASP 163 Ca 0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.14 2dg7 h ASP 163 Cb 0.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.75 2dg7 h ASP 163 CO -0.01 0.08 -0.00 0.00 -1.72 0.00 0.00 179.24 177.60 2dg7 n ALA 164 N -2.30 2.66 -2.84 3.45 0.00 -0.59 -4.90 120.51 115.99 2dg7 n ALA 164 Ca -0.02 -0.20 -0.14 0.00 0.00 0.00 0.00 53.44 53.07 2dg7 n ALA 164 Cb 0.19 -1.51 -0.01 0.00 0.00 0.00 0.00 19.45 18.12 2dg7 n ALA 164 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2dg7 n GLU 165 N -1.00 -2.73 -0.33 0.00 1.02 -0.52 -0.59 120.64 116.49 2dg7 n GLU 165 Ca 0.23 0.41 0.00 0.00 -0.02 0.00 0.00 57.16 57.77 2dg7 n GLU 165 Cb 0.13 -5.02 0.00 0.00 -0.02 0.00 0.00 31.44 26.54 2dg7 n GLU 165 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dg7 n GLY 166 N -0.87 0.90 0.02 0.62 0.00 -1.25 -4.91 105.19 99.69 2dg7 n GLY 166 Ca -0.06 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.11 2dg7 n GLY 166 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2dg7 n HIS 167 N -2.00 0.00 -4.56 1.61 8.25 0.25 -4.73 115.22 114.04 2dg7 n HIS 167 Ca 0.00 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.24 2dg7 n HIS 167 Cb 0.00 -0.20 -0.15 0.00 1.12 0.00 0.00 29.99 30.76 2dg7 n HIS 167 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2dg7 s ALA 168 N -2.41 1.07 0.41 -1.41 0.00 -1.26 -5.12 121.76 113.04 2dg7 s ALA 168 Ca 0.33 -0.51 -0.22 0.00 0.00 0.00 0.00 51.96 51.57 2dg7 s ALA 168 Cb 0.21 -0.32 -0.10 0.00 0.00 0.00 0.00 23.12 22.91 2dg7 s ALA 168 CO 0.44 0.23 0.97 0.16 0.00 0.00 0.00 175.76 177.55 2dg7 s ASP 169 N -0.11 6.94 0.41 0.00 1.47 -1.26 -4.93 116.67 119.19 2dg7 s ASP 169 Ca 0.01 1.77 0.14 0.00 1.18 0.00 0.00 52.55 55.65 2dg7 s ASP 169 Cb -0.07 -2.55 0.99 0.00 -0.34 0.00 0.00 42.92 40.95 2dg7 s ASP 169 CO 0.00 -0.36 1.92 0.15 0.68 0.00 0.00 175.17 177.56 2dg7 h PHE 170 N 2.17 0.55 -0.48 2.11 3.57 -1.96 -1.89 116.94 121.00 2dg7 h PHE 170 Ca -0.49 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.07 2dg7 h PHE 170 Cb 1.19 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 39.71 2dg7 h PHE 170 CO 0.61 0.22 0.24 0.78 -2.23 0.00 0.00 178.31 177.94 2dg7 h GLY 171 N 0.48 0.67 1.01 2.40 0.00 -1.95 -0.85 103.07 104.83 2dg7 h GLY 171 Ca 0.36 -0.17 -0.05 0.00 0.00 0.00 0.00 47.33 47.47 2dg7 h GLY 171 CO -0.12 0.11 0.17 1.76 0.00 0.00 0.00 176.54 178.46 2dg7 h SER 172 N 0.48 0.88 -0.95 0.19 0.02 -1.73 0.04 113.55 112.49 2dg7 h SER 172 Ca 0.21 -0.22 0.01 0.00 -0.84 0.00 0.00 61.79 60.96 2dg7 h SER 172 Cb 0.12 -0.23 -0.05 0.00 0.14 0.00 0.00 62.40 62.38 2dg7 h SER 172 CO -0.15 0.87 0.63 0.00 -1.14 0.00 0.00 176.83 177.03 2dg7 h LEU 174 N 1.27 0.98 -0.43 0.00 6.46 -0.79 -1.37 115.31 121.43 2dg7 h LEU 174 Ca 0.35 -0.43 -0.01 0.00 -0.12 0.00 0.00 57.88 57.67 2dg7 h LEU 174 Cb -0.14 -0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 39.50 2dg7 h LEU 174 CO -0.08 1.21 0.23 0.44 -0.62 0.00 0.00 178.44 179.62 2dg7 h ASP 175 N 0.77 0.55 -0.52 1.25 3.45 -0.43 -1.21 116.42 120.26 2dg7 h ASP 175 Ca 0.08 -0.10 -0.02 0.00 0.43 0.00 0.00 57.03 57.42 2dg7 h ASP 175 Cb 0.88 -0.14 -0.02 0.00 -0.56 0.00 0.00 39.33 39.49 2dg7 h ASP 175 CO 0.08 0.49 0.24 0.74 -1.57 0.00 0.00 179.24 179.21 2dg7 h THR 176 N 0.56 1.20 -0.32 0.35 2.02 -0.72 -0.44 112.91 115.57 2dg7 h THR 176 Ca 0.15 -0.60 -0.06 0.00 0.77 0.00 0.00 66.41 66.67 2dg7 h THR 176 Cb 0.07 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 67.10 2dg7 h THR 176 CO -0.02 0.23 -0.05 0.58 0.37 0.00 0.00 175.52 176.64 2dg7 h VAL 177 N 0.70 1.27 -0.22 3.16 2.07 -1.09 -1.20 116.25 120.94 2dg7 h VAL 177 Ca 0.18 -1.06 -0.12 0.00 0.82 0.00 0.00 66.70 66.52 2dg7 h VAL 177 Cb 0.15 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 2dg7 h VAL 177 CO -0.02 0.34 -0.38 0.71 0.02 0.00 0.00 177.57 178.25 2dg7 h THR 178 N 0.38 1.30 -0.13 2.57 1.35 -1.15 0.11 112.91 117.34 2dg7 h THR 178 Ca 0.09 -1.51 -0.14 0.00 -0.55 0.00 0.00 66.41 64.30 2dg7 h THR 178 Cb 0.52 1.54 -0.01 0.00 -1.73 0.00 0.00 68.15 68.47 2dg7 h THR 178 CO 0.03 0.47 -0.52 0.44 -0.25 0.00 0.00 175.52 175.69 2dg7 h ASP 179 N 0.42 0.41 -0.23 5.36 3.32 -1.04 -1.41 116.42 123.25 2dg7 h ASP 179 Ca 0.04 -0.21 -0.10 0.00 0.02 0.00 0.00 57.03 56.78 2dg7 h ASP 179 Cb 0.85 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 40.28 2dg7 h ASP 179 CO 0.07 0.86 -0.24 -0.09 -1.72 0.00 0.00 179.24 178.12 2dg7 h ARG 180 N 0.29 0.57 -0.91 3.56 9.65 -0.83 -1.20 114.38 125.52 2dg7 h ARG 180 Ca 0.01 -0.30 0.02 0.00 -1.10 0.00 0.00 59.98 58.60 2dg7 h ARG 180 Cb 1.01 0.01 -0.05 0.00 -1.39 0.00 0.00 29.97 29.56 2dg7 h ARG 180 CO 0.09 0.90 0.60 -0.07 2.80 0.00 0.00 179.97 184.28 2dg7 h LEU 181 N 0.27 1.02 -0.52 3.80 3.38 -0.67 -1.06 115.31 121.54 2dg7 h LEU 181 Ca 0.04 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.90 2dg7 h LEU 181 Cb 0.79 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 2dg7 h LEU 181 CO 0.06 0.73 -0.01 -0.09 0.09 0.00 0.00 178.44 179.22 2dg7 h ARG 182 N 1.20 0.92 -0.41 1.13 2.43 -1.04 -2.13 114.38 116.47 2dg7 h ARG 182 Ca 0.34 -0.30 -0.07 0.00 -0.81 0.00 0.00 59.98 59.15 2dg7 h ARG 182 Cb -0.09 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.36 2dg7 h ARG 182 CO -0.08 0.95 -0.02 0.00 -1.51 0.00 0.00 179.97 179.31 2dg7 h ALA 183 N 0.94 1.20 -0.25 2.80 0.00 -0.55 -0.87 119.26 122.54 2dg7 h ALA 183 Ca 0.15 -0.25 -0.14 0.00 0.00 0.00 0.00 54.91 54.67 2dg7 h ALA 183 Cb 0.54 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2dg7 h ALA 183 CO 0.03 0.52 -0.43 0.28 0.00 0.00 0.00 179.25 179.65 2dg7 h VAL 184 N 0.63 1.30 0.00 0.00 2.07 -1.04 1.52 116.25 120.73 2dg7 h VAL 184 Ca 0.13 -1.61 -0.16 0.00 0.82 0.00 0.00 66.70 65.87 2dg7 h VAL 184 Cb 0.42 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 31.73 2dg7 h VAL 184 CO 0.02 0.51 -0.78 -0.07 0.02 0.00 0.00 177.57 177.27 2dg7 h LEU 185 N 0.50 0.00 0.00 2.57 4.07 -1.06 -3.36 115.31 118.03 2dg7 h LEU 185 Ca 0.04 0.00 -0.29 0.00 0.08 0.00 0.00 57.88 57.70 2dg7 h LEU 185 Cb 0.95 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 42.64 2dg7 h LEU 185 CO 0.09 0.78 -2.11 0.35 -1.08 0.00 0.00 178.44 176.46 2dg7 n THR 186 N -3.58 1.12 -0.10 0.22 -2.24 -0.36 -5.10 114.28 104.24 2dg7 n THR 186 Ca -0.01 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.28 2dg7 n THR 186 Cb 0.76 -1.04 0.00 0.00 -2.10 0.00 0.00 70.33 67.95 2dg7 n THR 186 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11