#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d3o n ASN -1 N 0.00 0.00 -0.34 -3.46 2.85 -1.26 -4.93 115.26 108.11 3d3o n ASN -1 Ca 0.00 -1.55 0.21 0.00 -0.11 0.00 0.00 54.58 53.13 3d3o n ASN -1 Cb 0.00 -0.11 0.44 0.00 1.24 0.00 0.00 39.78 41.35 3d3o n ASN -1 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3d3o h ALA 0 N 0.00 1.93 -0.03 5.20 0.00 -1.96 -2.73 119.26 121.67 3d3o h ALA 0 Ca 0.00 0.13 -0.19 0.00 0.00 0.00 0.00 54.91 54.85 3d3o h ALA 0 Cb 1.22 0.06 0.01 0.00 0.00 0.00 0.00 17.79 19.09 3d3o h ALA 0 CO 0.00 -0.44 -0.72 -0.07 0.00 0.00 0.00 179.25 178.02 3d3o h LEU 1 N 0.47 0.68 -0.73 0.00 3.38 -1.99 -1.40 115.31 115.72 3d3o h LEU 1 Ca 0.67 -0.73 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 3d3o h LEU 1 Cb 1.44 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.95 3d3o h LEU 1 CO -0.48 1.31 0.26 -0.26 0.09 0.00 0.00 178.44 179.36 3d3o h PHE 2 N 0.12 1.14 -0.66 1.13 0.04 -1.96 0.30 116.94 117.05 3d3o h PHE 2 Ca -0.08 -0.10 -0.07 0.00 2.80 0.00 0.00 57.97 60.52 3d3o h PHE 2 Cb 1.40 -0.34 -0.03 0.00 2.20 0.00 0.00 35.95 39.19 3d3o h PHE 2 CO 0.12 0.89 0.14 0.77 -0.60 0.00 0.00 178.31 179.64 3d3o h SER 3 N 1.06 0.99 -0.68 2.17 0.02 -1.47 -1.24 113.55 114.41 3d3o h SER 3 Ca 0.24 -0.21 -0.08 0.00 -0.84 0.00 0.00 61.79 60.90 3d3o h SER 3 Cb 0.25 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.51 3d3o h SER 3 CO -0.01 0.97 0.13 0.28 -1.14 0.00 0.00 176.83 177.05 3d3o h SER 4 N 1.00 1.07 -0.21 3.07 0.02 -0.90 -1.68 113.55 115.91 3d3o h SER 4 Ca 0.21 -0.25 -0.03 0.00 -0.84 0.00 0.00 61.79 60.88 3d3o h SER 4 Cb 0.37 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 3d3o h SER 4 CO 0.00 1.05 0.03 -0.09 -1.14 0.00 0.00 176.83 176.69 3d3o h ARG 5 N 1.05 0.36 -0.47 3.45 2.43 -0.75 0.43 114.38 120.88 3d3o h ARG 5 Ca 0.21 -0.10 0.09 0.00 -0.81 0.00 0.00 59.98 59.38 3d3o h ARG 5 Cb 0.43 -0.04 -0.09 0.00 -0.42 0.00 0.00 29.97 29.84 3d3o h ARG 5 CO 0.01 0.50 -0.16 -0.44 -1.51 0.00 0.00 179.97 178.38 3d3o h ASP 6 N 0.15 -0.56 0.03 -3.80 3.32 -1.02 0.13 116.42 114.68 3d3o h ASP 6 Ca 0.07 0.15 -0.00 0.00 0.02 0.00 0.00 57.03 57.27 3d3o h ASP 6 Cb 0.32 0.34 0.00 0.00 0.22 0.00 0.00 39.33 40.21 3d3o h ASP 6 CO 0.00 -0.19 -0.01 0.40 -1.72 0.00 0.00 179.24 177.72 3d3o h ILE 7 N -0.05 1.05 -0.73 0.35 2.04 -0.93 -2.25 117.51 116.99 3d3o h ILE 7 Ca 0.22 -0.25 0.10 0.00 1.00 0.00 0.00 64.86 65.94 3d3o h ILE 7 Cb 0.39 1.21 -0.07 0.00 -0.74 0.00 0.00 36.82 37.62 3d3o h ILE 7 CO -0.51 0.06 0.37 0.25 0.00 0.00 0.00 178.15 178.32 3d3o h LEU 8 N -0.15 0.48 -0.67 1.44 5.85 -0.74 0.24 115.31 121.76 3d3o h LEU 8 Ca -0.00 0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 3d3o h LEU 8 Cb 0.13 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.11 3d3o h LEU 8 CO 0.01 0.27 0.42 -0.33 -0.34 0.00 0.00 178.44 178.47 3d3o h GLU 9 N 0.62 0.91 -0.44 1.25 5.08 -0.69 0.13 114.58 121.43 3d3o h GLU 9 Ca 0.36 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.60 3d3o h GLU 9 Cb 0.39 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 3d3o h GLU 9 CO -0.27 0.63 0.09 0.28 -1.00 0.00 0.00 179.01 178.74 3d3o h VAL 10 N 0.92 1.24 -0.62 3.13 2.07 -0.84 -2.05 116.25 120.09 3d3o h VAL 10 Ca 0.24 -0.85 -0.06 0.00 0.82 0.00 0.00 66.70 66.85 3d3o h VAL 10 Cb -0.05 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 30.64 3d3o h VAL 10 CO -0.05 0.30 0.16 0.25 0.02 0.00 0.00 177.57 178.25 3d3o h LEU 11 N 0.58 0.94 -1.38 2.57 5.85 -0.66 -1.72 115.31 121.49 3d3o h LEU 11 Ca 0.14 -0.23 0.04 0.00 0.84 0.00 0.00 57.88 58.67 3d3o h LEU 11 Cb 0.35 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.09 3d3o h LEU 11 CO 0.01 0.92 0.45 1.56 -0.34 0.00 0.00 178.44 181.04 3d3o h GLN 12 N 0.91 0.77 -0.60 1.25 4.20 -0.70 -1.95 115.11 118.99 3d3o h GLN 12 Ca 0.20 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.78 3d3o h GLN 12 Cb 0.35 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.93 3d3o h GLN 12 CO 0.00 0.51 0.05 -0.44 -0.67 0.00 0.00 178.83 178.28 3d3o h ASP 13 N 0.80 0.97 0.63 1.46 5.19 -0.58 -2.94 116.42 121.94 3d3o h ASP 13 Ca 0.28 -0.24 -0.14 0.00 -0.62 0.00 0.00 57.03 56.31 3d3o h ASP 13 Cb 0.12 -0.26 -0.02 0.00 0.18 0.00 0.00 39.33 39.35 3d3o h ASP 13 CO -0.08 0.99 -0.65 0.40 -3.12 0.00 0.00 179.24 176.78 3d3o h ILE 14 N 0.93 1.46 0.00 0.35 2.04 -1.12 -1.48 117.51 119.70 3d3o h ILE 14 Ca 0.18 -2.22 0.00 0.00 1.00 0.00 0.00 64.86 63.82 3d3o h ILE 14 Cb 0.47 2.19 0.00 0.00 -0.74 0.00 0.00 36.82 38.75 3d3o h ILE 14 CO 0.02 0.64 0.00 1.57 0.00 0.00 0.00 178.15 180.38 3d3o n HIS 15 N -3.77 0.00 0.00 1.37 -0.00 -0.76 -1.09 115.22 110.97 3d3o n HIS 15 Ca -0.01 -0.15 0.00 0.00 0.46 0.00 0.00 57.72 58.01 3d3o n HIS 15 Cb 0.65 -0.13 0.00 0.00 -0.12 0.00 0.00 29.99 30.39 3d3o n HIS 15 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 3d3o n GLU 17 N 0.60 0.00 -0.03 1.57 1.02 -0.56 -0.38 120.64 122.86 3d3o n GLU 17 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3d3o n GLU 17 Cb 0.19 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.51 3d3o n GLU 17 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3d3o n THR 18 N 0.00 0.40 -0.38 2.62 -2.24 -0.25 -4.99 114.28 109.44 3d3o n THR 18 Ca 0.00 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 3d3o n THR 18 Cb 0.00 -0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.01 3d3o n THR 18 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d3o n GLY 19 N 2.00 1.28 3.80 3.38 0.00 0.48 -4.99 105.19 111.15 3d3o n GLY 19 Ca -0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 3d3o n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3d3o s GLU 20 N -0.18 1.81 0.06 1.61 0.41 -1.26 -2.25 118.70 118.90 3d3o s GLU 20 Ca 0.00 0.53 -0.31 0.00 -0.41 0.00 0.00 54.97 54.79 3d3o s GLU 20 Cb 0.00 -1.90 -0.07 0.00 -1.78 0.00 0.00 34.13 30.39 3d3o s GLU 20 CO 0.00 -1.79 1.40 0.99 -0.49 0.00 0.00 175.26 175.37 3d3o s THR 21 N -3.19 3.50 0.13 3.63 2.01 -1.05 -4.04 115.64 116.62 3d3o s THR 21 Ca 0.62 1.01 0.09 0.00 0.31 0.00 0.00 61.69 63.71 3d3o s THR 21 Cb -0.14 -3.65 -0.04 0.00 0.01 0.00 0.00 72.50 68.68 3d3o s THR 21 CO 0.54 0.04 -0.20 0.68 -0.69 0.00 0.00 174.62 174.99 3d3o s VAL 22 N 1.69 1.83 0.05 3.82 -7.23 -0.65 -0.64 120.40 119.26 3d3o s VAL 22 Ca 0.64 -1.73 -0.20 0.00 -1.81 0.00 0.00 61.98 58.88 3d3o s VAL 22 Cb -0.34 -1.73 0.04 0.00 0.56 0.00 0.00 36.38 34.91 3d3o s VAL 22 CO 0.29 -0.15 0.46 0.00 -0.31 0.00 0.00 175.10 175.39 3d3o s ALA 23 N -1.53 -1.16 -0.15 1.32 0.00 -0.29 -1.24 121.76 118.71 3d3o s ALA 23 Ca 0.11 0.43 -0.04 0.00 0.00 0.00 0.00 51.96 52.46 3d3o s ALA 23 Cb -0.08 0.38 -0.03 0.00 0.00 0.00 0.00 23.12 23.39 3d3o s ALA 23 CO 0.06 -0.49 -0.01 0.42 0.00 0.00 0.00 175.76 175.74 3d3o s ILE 24 N -2.52 4.17 0.03 0.00 -1.09 -0.04 -1.00 121.20 120.75 3d3o s ILE 24 Ca -0.05 -0.26 -0.00 0.00 -2.23 0.00 0.00 60.65 58.10 3d3o s ILE 24 Cb -0.01 -2.83 -0.03 0.00 -1.58 0.00 0.00 42.46 38.01 3d3o s ILE 24 CO -0.03 0.50 -0.03 0.00 -1.23 0.00 0.00 174.94 174.15 3d3o s ALA 25 N 0.21 0.31 0.34 9.38 0.00 -0.51 -0.01 121.76 131.49 3d3o s ALA 25 Ca -0.00 -0.87 0.06 0.00 0.00 0.00 0.00 51.96 51.14 3d3o s ALA 25 Cb -0.13 0.20 -0.02 0.00 0.00 0.00 0.00 23.12 23.17 3d3o s ALA 25 CO 0.02 -0.25 0.21 -2.37 0.00 0.00 0.00 175.76 173.37 3d3o n THR 26 N 0.92 0.00 -4.03 0.00 5.66 -0.50 0.09 114.28 116.42 3d3o n THR 26 Ca -0.19 -2.28 -0.32 0.00 -3.05 0.00 0.00 64.05 58.21 3d3o n THR 26 Cb 0.58 1.00 -0.06 0.00 -1.55 0.00 0.00 70.33 70.30 3d3o n THR 26 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 175.07 170.43 3d3o s LYS 27 N -3.36 3.12 -0.36 1.09 -2.85 -1.26 -0.73 119.74 115.39 3d3o s LYS 27 Ca 0.30 -0.52 0.02 0.00 -1.00 0.00 0.00 55.97 54.77 3d3o s LYS 27 Cb 0.01 -2.88 0.11 0.00 -2.06 0.00 0.00 37.83 33.01 3d3o s LYS 27 CO 0.21 0.62 0.11 1.21 0.10 0.00 0.00 175.35 177.61 3d3o s ASN 28 N -2.08 4.28 1.86 0.03 2.47 0.44 -4.87 114.94 117.06 3d3o s ASN 28 Ca 0.27 -2.10 0.00 0.00 0.42 0.00 0.00 52.86 51.45 3d3o s ASN 28 Cb -0.12 -1.25 0.00 0.00 -1.45 0.00 0.00 41.25 38.43 3d3o s ASN 28 CO 0.19 -0.36 0.00 -0.67 -3.72 0.00 0.00 177.10 172.54 3d3o n ASP 29 N 4.28 0.00 -0.93 -4.21 2.03 -1.26 -1.07 116.55 115.39 3d3o n ASP 29 Ca 0.02 0.00 0.08 0.00 0.52 0.00 0.00 54.79 55.41 3d3o n ASP 29 Cb 0.40 0.00 0.25 0.00 -0.72 0.00 0.00 41.12 41.05 3d3o n ASP 29 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 3d3o n ILE 30 N 0.00 1.93 -4.29 5.18 -5.35 -1.26 -4.99 119.36 110.58 3d3o n ILE 30 Ca 0.00 -1.57 -0.28 0.00 -0.27 0.00 0.00 62.75 60.63 3d3o n ILE 30 Cb 0.00 -0.02 -0.10 0.00 -1.74 0.00 0.00 39.64 37.77 3d3o n ILE 30 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 3d3o s TYR 31 N -2.26 2.60 0.11 4.28 2.02 -0.23 -0.66 117.35 123.21 3d3o s TYR 31 Ca 0.38 -0.23 -0.22 0.00 -0.37 0.00 0.00 57.07 56.63 3d3o s TYR 31 Cb 0.28 -1.33 -0.07 0.00 -0.40 0.00 0.00 41.96 40.44 3d3o s TYR 31 CO 0.12 0.45 0.67 -1.17 -1.57 0.00 0.00 175.55 174.05 3d3o s LEU 32 N -2.43 4.55 -0.20 -1.29 2.96 0.01 -0.42 118.68 121.86 3d3o s LEU 32 Ca 0.21 1.44 -0.03 0.00 -0.22 0.00 0.00 54.13 55.53 3d3o s LEU 32 Cb -0.10 -3.09 0.06 0.00 0.50 0.00 0.00 46.19 43.57 3d3o s LEU 32 CO 0.13 0.23 0.04 -1.58 -1.32 0.00 0.00 176.35 173.85 3d3o s GLN 33 N -1.07 0.61 0.16 1.98 2.00 0.09 -4.57 119.66 118.87 3d3o s GLN 33 Ca 0.32 -0.42 -0.31 0.00 -2.00 0.00 0.00 55.36 52.96 3d3o s GLN 33 Cb -0.21 -2.09 -0.08 0.00 0.80 0.00 0.00 33.01 31.43 3d3o s GLN 33 CO 0.22 -0.66 1.33 0.71 -0.50 0.00 0.00 175.29 176.40 3d3o s TYR 34 N 1.87 3.26 -0.16 1.67 2.02 -1.26 -1.41 117.35 123.34 3d3o s TYR 34 Ca -0.00 1.13 0.09 0.00 -0.37 0.00 0.00 57.07 57.91 3d3o s TYR 34 Cb -0.17 -3.62 -0.23 0.00 -0.40 0.00 0.00 41.96 37.54 3d3o s TYR 34 CO -0.09 -2.04 0.21 -0.89 -1.57 0.00 0.00 175.55 171.17 3d3o n ILE 35 N 3.17 1.53 -3.63 2.71 5.41 0.99 -4.94 119.36 124.61 3d3o n ILE 35 Ca 0.08 -0.75 -0.12 0.00 1.00 0.00 0.00 62.75 62.97 3d3o n ILE 35 Cb 0.43 -1.03 -0.07 0.00 -0.71 0.00 0.00 39.64 38.26 3d3o n ILE 35 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 176.55 174.97 3d3o s GLN 36 N -2.54 0.74 -0.04 0.38 2.00 -1.14 -5.00 119.66 114.07 3d3o s GLN 36 Ca -0.16 0.95 0.02 0.00 -2.00 0.00 0.00 55.36 54.17 3d3o s GLN 36 Cb 0.07 0.32 0.01 0.00 0.80 0.00 0.00 33.01 34.22 3d3o s GLN 36 CO 0.77 -0.10 -0.08 0.42 -0.50 0.00 0.00 175.29 175.80 3d3o s ILE 37 N 0.58 0.78 -0.17 -2.34 1.01 -1.26 -0.86 121.20 118.93 3d3o s ILE 37 Ca -0.01 -0.31 -0.01 0.00 0.00 0.00 0.00 60.65 60.32 3d3o s ILE 37 Cb -0.05 -0.73 -0.00 0.00 0.01 0.00 0.00 42.46 41.69 3d3o s ILE 37 CO -0.04 0.26 -0.13 -0.63 0.00 0.00 0.00 174.94 174.40 3d3o s ILE 38 N 0.54 2.77 0.39 2.92 1.01 -0.37 -5.02 121.20 123.44 3d3o s ILE 38 Ca -0.09 -0.72 -0.26 0.00 0.00 0.00 0.00 60.65 59.58 3d3o s ILE 38 Cb -0.12 -2.19 -0.09 0.00 0.01 0.00 0.00 42.46 40.07 3d3o s ILE 38 CO 0.01 0.50 1.22 -1.83 0.00 0.00 0.00 174.94 174.84 3d3o s GLU 39 N 1.01 4.07 0.82 2.79 1.03 -1.26 -1.64 118.70 125.52 3d3o s GLU 39 Ca -0.01 1.97 -0.12 0.00 0.03 0.00 0.00 54.97 56.83 3d3o s GLU 39 Cb -0.15 -2.76 0.09 0.00 -0.80 0.00 0.00 34.13 30.51 3d3o s GLU 39 CO -0.03 -0.34 1.16 0.45 -1.33 0.00 0.00 175.26 175.18 3d3o s SER 40 N -0.94 3.68 0.00 0.83 0.15 -1.26 -4.74 113.70 111.42 3d3o s SER 40 Ca 0.56 2.21 0.19 0.00 0.70 0.00 0.00 55.95 59.60 3d3o s SER 40 Cb -0.34 -2.57 0.20 0.00 -1.71 0.00 0.00 66.02 61.60 3d3o s SER 40 CO 0.43 -2.60 1.15 1.33 1.20 0.00 0.00 173.24 174.75 3d3o n VAL 41 N -3.50 0.12 -2.11 4.45 0.24 -0.96 -4.93 118.33 111.65 3d3o n VAL 41 Ca 0.12 -0.56 -0.33 0.00 -2.04 0.00 0.00 64.34 61.53 3d3o n VAL 41 Cb 0.51 1.29 0.00 0.00 -1.47 0.00 0.00 33.84 34.18 3d3o n VAL 41 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 3d3o s HIS 42 N -1.53 3.01 0.07 6.34 3.76 -1.26 -4.98 115.29 120.71 3d3o s HIS 42 Ca 0.25 1.51 -0.29 0.00 -0.15 0.00 0.00 55.06 56.38 3d3o s HIS 42 Cb 0.17 -3.00 -0.18 0.00 1.11 0.00 0.00 32.58 30.68 3d3o s HIS 42 CO 0.24 -1.06 1.61 0.00 -0.85 0.00 0.00 174.74 174.69 3d3o h ALA 43 N 0.56 -0.60 -2.26 -1.40 0.00 -1.99 -3.37 119.26 110.21 3d3o h ALA 43 Ca -0.47 -0.14 -0.63 0.00 0.00 0.00 0.00 54.91 53.67 3d3o h ALA 43 Cb 1.22 0.23 -0.13 0.00 0.00 0.00 0.00 17.79 19.11 3d3o h ALA 43 CO 0.58 -0.81 0.19 -1.17 0.00 0.00 0.00 179.25 178.04 3d3o s LEU 44 N -10.03 4.27 0.28 0.00 2.96 -1.26 -5.02 118.68 109.88 3d3o s LEU 44 Ca -0.16 0.09 -0.05 0.00 -0.22 0.00 0.00 54.13 53.78 3d3o s LEU 44 Cb 0.04 -2.83 -0.01 0.00 0.50 0.00 0.00 46.19 43.89 3d3o s LEU 44 CO 0.62 -0.67 0.39 0.00 -1.32 0.00 0.00 176.35 175.37 3d3o s ARG 45 N 2.83 1.62 -0.12 1.98 1.70 -1.26 -4.50 118.95 121.21 3d3o s ARG 45 Ca 0.26 -1.57 -0.30 0.00 -0.47 0.00 0.00 55.73 53.65 3d3o s ARG 45 Cb -0.14 0.41 -0.01 0.00 -0.57 0.00 0.00 34.95 34.64 3d3o s ARG 45 CO 0.16 -0.65 1.06 -0.06 -1.08 0.00 0.00 175.30 174.73 3d3o s PHE 46 N -3.64 3.40 -0.49 5.89 2.99 -1.26 -5.01 117.98 119.86 3d3o s PHE 46 Ca 0.30 1.49 -0.08 0.00 0.00 0.00 0.00 56.93 58.64 3d3o s PHE 46 Cb 0.01 -3.25 0.13 0.00 0.00 0.00 0.00 43.02 39.90 3d3o s PHE 46 CO 0.15 -0.51 0.34 -1.01 -0.00 0.00 0.00 175.22 174.19 3d3o s HIS 47 N 2.30 3.47 -0.20 0.36 3.76 -1.26 -4.68 115.29 119.04 3d3o s HIS 47 Ca 0.49 -2.06 -0.29 0.00 -0.15 0.00 0.00 55.06 53.05 3d3o s HIS 47 Cb -0.19 -3.44 -0.03 0.00 1.11 0.00 0.00 32.58 30.03 3d3o s HIS 47 CO 0.17 -0.98 1.61 0.08 -0.85 0.00 0.00 174.74 174.77 3d3o s VAL 48 N 1.15 3.70 -0.29 -0.90 1.01 -1.26 -4.98 120.40 118.82 3d3o s VAL 48 Ca 0.08 0.79 -0.26 0.00 0.00 0.00 0.00 61.98 62.59 3d3o s VAL 48 Cb -0.24 -3.68 0.01 0.00 0.00 0.00 0.00 36.38 32.46 3d3o s VAL 48 CO -0.02 -0.26 0.90 -0.62 0.00 0.00 0.00 175.10 175.10 3d3o s ASP 49 N 4.10 6.81 0.17 3.32 2.15 -1.26 -4.97 116.67 126.98 3d3o s ASP 49 Ca 0.71 0.90 0.09 0.00 0.43 0.00 0.00 52.55 54.68 3d3o s ASP 49 Cb -0.26 -2.46 -0.08 0.00 -0.30 0.00 0.00 42.92 39.82 3d3o s ASP 49 CO 0.29 -0.68 1.35 -0.33 -0.17 0.00 0.00 175.17 175.63 3d3o h GLU 50 N 7.98 0.00 0.00 4.34 5.08 -2.04 -2.76 114.58 127.18 3d3o h GLU 50 Ca -0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.14 3d3o h GLU 50 Cb 1.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.33 3d3o h GLU 50 CO 0.93 0.87 0.00 -1.71 -1.00 0.00 0.00 179.01 178.11 3d3o n ASN 51 N -3.40 0.56 -4.76 1.42 2.85 -1.26 -4.75 115.26 105.93 3d3o n ASN 51 Ca 0.00 0.71 -0.41 0.00 -0.11 0.00 0.00 54.58 54.77 3d3o n ASN 51 Cb 0.86 -0.80 -0.02 0.00 1.24 0.00 0.00 39.78 41.06 3d3o n ASN 51 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3d3o s ALA 52 N -3.42 3.55 -0.26 5.20 0.00 -1.04 -5.00 121.76 120.79 3d3o s ALA 52 Ca 0.00 1.27 -0.12 0.00 0.00 0.00 0.00 51.96 53.11 3d3o s ALA 52 Cb 0.07 -3.51 -0.05 0.00 0.00 0.00 0.00 23.12 19.64 3d3o s ALA 52 CO 0.26 -0.67 0.23 0.42 0.00 0.00 0.00 175.76 176.01 3d3o s ILE 53 N -0.59 5.29 -0.17 0.00 1.01 -1.26 -5.06 121.20 120.42 3d3o s ILE 53 Ca 0.53 0.30 -0.01 0.00 0.00 0.00 0.00 60.65 61.48 3d3o s ILE 53 Cb -0.40 -3.57 0.05 0.00 0.01 0.00 0.00 42.46 38.54 3d3o s ILE 53 CO 0.48 0.27 -0.02 0.00 0.00 0.00 0.00 174.94 175.67 3d3o s ARG 54 N 1.51 1.14 0.56 2.79 1.70 -1.26 -5.05 118.95 120.34 3d3o s ARG 54 Ca 0.10 -0.48 -0.21 0.00 -0.47 0.00 0.00 55.73 54.67 3d3o s ARG 54 Cb -0.15 -2.00 -0.05 0.00 -0.57 0.00 0.00 34.95 32.19 3d3o s ARG 54 CO 0.08 -0.50 1.26 -2.14 -1.08 0.00 0.00 175.30 172.93 3d3o s PRO 55 N 1.71 3.14 0.56 3.89 0.02 -1.26 -0.81 135.00 142.25 3d3o s PRO 55 Ca -0.00 1.99 0.24 0.00 0.02 0.00 0.00 61.00 63.25 3d3o s PRO 55 Cb -0.16 -2.13 1.58 0.00 0.02 0.00 0.00 34.50 33.80 3d3o s PRO 55 CO -0.07 -1.11 2.20 -0.07 -0.33 0.00 0.00 177.00 177.61 3d3o h LEU 56 N 1.29 0.00 -4.35 -5.54 3.38 -1.21 -3.39 115.31 105.49 3d3o h LEU 56 Ca -0.50 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.42 3d3o h LEU 56 Cb 1.29 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.03 3d3o h LEU 56 CO 0.57 0.00 0.14 0.35 0.09 0.00 0.00 178.44 179.59 3d3o n THR 57 N -4.14 0.88 -0.03 0.22 -2.24 -1.26 -3.26 114.28 104.44 3d3o n THR 57 Ca -0.02 -0.39 -0.01 0.00 -2.27 0.00 0.00 64.05 61.36 3d3o n THR 57 Cb 0.12 -1.50 0.00 0.00 -2.10 0.00 0.00 70.33 66.85 3d3o n THR 57 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3d3o n SER 59 N 2.51 -0.14 0.02 3.42 3.41 -1.26 -4.93 113.62 116.64 3d3o n SER 59 Ca 0.10 0.01 0.03 0.00 -0.26 0.00 0.00 58.87 58.75 3d3o n SER 59 Cb 0.26 -0.02 0.40 0.00 -0.26 0.00 0.00 64.21 64.58 3d3o n SER 59 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3d3o h SER 60 N -0.01 0.44 -0.69 4.04 4.64 -1.89 -0.63 113.55 119.46 3d3o h SER 60 Ca -0.01 -0.03 0.03 0.00 -0.47 0.00 0.00 61.79 61.30 3d3o h SER 60 Cb 0.04 -0.11 -0.04 0.00 -0.31 0.00 0.00 62.40 61.98 3d3o h SER 60 CO 0.01 0.39 0.43 0.78 -0.87 0.00 0.00 176.83 177.57 3d3o h ASN 61 N 0.50 0.70 -0.21 4.97 2.35 -1.92 -2.81 115.58 119.17 3d3o h ASN 61 Ca 0.13 0.00 0.06 0.00 -0.55 0.00 0.00 56.30 55.93 3d3o h ASN 61 Cb 0.07 -0.15 -0.06 0.00 0.05 0.00 0.00 38.32 38.22 3d3o h ASN 61 CO -0.02 0.48 -0.21 1.23 -1.65 0.00 0.00 177.43 177.27 3d3o h GLY 62 N 0.84 -0.11 -1.96 2.83 0.00 -1.27 -1.73 103.07 101.66 3d3o h GLY 62 Ca 0.28 0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.86 3d3o h GLY 62 CO -0.11 -0.18 0.00 0.79 0.00 0.00 0.00 176.54 177.04 3d3o n TRP 63 N -5.35 0.00 -0.34 5.60 8.01 -0.71 -4.57 117.44 120.08 3d3o n TRP 63 Ca -0.01 -0.02 0.00 0.00 -1.31 0.00 0.00 57.50 56.16 3d3o n TRP 63 Cb 0.27 -0.10 0.00 0.00 -2.01 0.00 0.00 31.31 29.46 3d3o n TRP 63 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.69 177.96 3d3o n LEU 65 N 0.97 0.00 0.00 -0.99 4.77 -0.65 -4.75 117.00 116.34 3d3o n LEU 65 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3d3o n LEU 65 Cb 0.02 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 3d3o n LEU 65 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.39 174.52 3d3o n SER 67 N 0.00 0.00 -1.96 -1.43 3.41 -1.26 -5.01 113.62 107.37 3d3o n SER 67 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.46 3d3o n SER 67 Cb 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 63.93 3d3o n SER 67 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3d3o n THR 68 N 0.00 2.77 -3.41 6.66 -2.24 -1.26 -4.92 114.28 111.88 3d3o n THR 68 Ca 0.00 -1.69 -0.19 0.00 -2.27 0.00 0.00 64.05 59.90 3d3o n THR 68 Cb 0.00 -1.52 -0.01 0.00 -2.10 0.00 0.00 70.33 66.70 3d3o n THR 68 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3d3o s ASN 70 N 0.85 5.67 0.16 3.42 2.20 -1.26 -5.13 114.94 120.85 3d3o s ASN 70 Ca 0.36 -0.37 -0.10 0.00 -0.94 0.00 0.00 52.86 51.81 3d3o s ASN 70 Cb 0.24 -0.96 0.01 0.00 -2.00 0.00 0.00 41.25 38.54 3d3o s ASN 70 CO -0.05 -0.53 1.56 0.44 -2.94 0.00 0.00 177.10 175.57 3d3o h ASP 71 N 0.90 1.01 -0.62 3.54 3.32 -2.00 -0.74 116.42 121.83 3d3o h ASP 71 Ca -0.43 -0.38 0.12 0.00 0.02 0.00 0.00 57.03 56.36 3d3o h ASP 71 Cb 1.26 -0.28 -0.12 0.00 0.22 0.00 0.00 39.33 40.42 3d3o h ASP 71 CO 0.52 1.16 -0.17 0.50 -1.72 0.00 0.00 179.24 179.53 3d3o h LYS 72 N 0.86 -0.02 -0.04 3.56 1.63 -2.06 -0.88 116.57 119.62 3d3o h LYS 72 Ca 0.12 0.00 -0.11 0.00 -0.85 0.00 0.00 60.65 59.81 3d3o h LYS 72 Cb 0.75 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.37 3d3o h LYS 72 CO 0.06 -0.01 -0.47 0.00 -3.45 0.00 0.00 179.45 175.58 3d3o h ALA 73 N 1.56 1.14 -0.17 5.00 0.00 -1.86 -2.33 119.26 122.61 3d3o h ALA 73 Ca 0.29 -0.44 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 3d3o h ALA 73 Cb 0.47 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 3d3o h ALA 73 CO -0.64 0.61 -0.26 0.82 0.00 0.00 0.00 179.25 179.78 3d3o h ILE 74 N 0.08 1.35 -0.31 0.00 2.04 -0.25 -2.25 117.51 118.17 3d3o h ILE 74 Ca 0.00 -1.48 0.03 0.00 1.00 0.00 0.00 64.86 64.42 3d3o h ILE 74 Cb 0.87 1.91 -0.03 0.00 -0.74 0.00 0.00 36.82 38.82 3d3o h ILE 74 CO 0.07 0.44 0.11 -0.78 0.00 0.00 0.00 178.15 177.99 3d3o h ASP 75 N 0.10 0.13 -0.94 1.72 3.58 -1.20 0.28 116.42 120.08 3d3o h ASP 75 Ca 0.02 0.03 0.05 0.00 0.42 0.00 0.00 57.03 57.55 3d3o h ASP 75 Cb 0.83 0.02 -0.06 0.00 1.72 0.00 0.00 39.33 41.84 3d3o h ASP 75 CO 0.06 0.11 0.62 0.78 -2.88 0.00 0.00 179.24 177.92 3d3o h ASN 76 N 0.25 0.99 -0.29 2.28 -0.26 -1.43 -1.83 115.58 115.29 3d3o h ASN 76 Ca 0.14 -0.00 -0.08 0.00 -0.56 0.00 0.00 56.30 55.80 3d3o h ASN 76 Cb 0.10 -0.22 -0.01 0.00 -1.06 0.00 0.00 38.32 37.14 3d3o h ASN 76 CO -0.14 0.65 -0.13 0.74 -1.06 0.00 0.00 177.43 177.50 3d3o h THR 77 N 1.13 1.29 -0.13 2.81 2.02 -0.70 0.20 112.91 119.54 3d3o h THR 77 Ca 0.39 -1.21 -0.06 0.00 0.77 0.00 0.00 66.41 66.30 3d3o h THR 77 Cb 0.11 1.46 -0.00 0.00 -1.74 0.00 0.00 68.15 67.98 3d3o h THR 77 CO -0.14 0.39 -0.14 0.58 0.37 0.00 0.00 175.52 176.58 3d3o h VAL 78 N 0.36 1.35 -0.17 3.16 2.07 -0.86 0.16 116.25 122.33 3d3o h VAL 78 Ca 0.07 -1.30 0.05 0.00 0.82 0.00 0.00 66.70 66.33 3d3o h VAL 78 Cb 0.64 1.92 -0.06 0.00 -1.52 0.00 0.00 31.29 32.27 3d3o h VAL 78 CO 0.04 0.38 -0.23 0.03 0.02 0.00 0.00 177.57 177.81 3d3o h ARG 79 N -0.07 -0.26 -0.34 1.57 3.08 -1.33 0.28 114.38 117.31 3d3o h ARG 79 Ca 0.02 0.02 -0.08 0.00 0.07 0.00 0.00 59.98 60.01 3d3o h ARG 79 Cb 0.67 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.76 3d3o h ARG 79 CO 0.03 -0.17 -0.08 0.00 -1.07 0.00 0.00 179.97 178.68 3d3o h ARG 80 N -0.27 0.66 -0.25 0.04 3.08 -0.49 -2.68 114.38 114.47 3d3o h ARG 80 Ca 0.11 -0.25 -0.01 0.00 0.07 0.00 0.00 59.98 59.90 3d3o h ARG 80 Cb 0.44 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 3d3o h ARG 80 CO -0.32 0.83 0.11 0.00 -1.07 0.00 0.00 179.97 179.51 3d3o h ALA 81 N 0.82 1.73 -0.55 0.04 0.00 -0.55 -2.36 119.26 118.39 3d3o h ALA 81 Ca 0.09 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 3d3o h ALA 81 Cb 0.58 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3d3o h ALA 81 CO 0.03 0.22 0.05 -0.91 0.00 0.00 0.00 179.25 178.64 3d3o h ASN 82 N 0.34 0.87 0.20 0.00 2.35 -0.10 -2.07 115.58 117.17 3d3o h ASN 82 Ca 0.09 -0.21 0.00 0.00 -0.55 0.00 0.00 56.30 55.63 3d3o h ASN 82 Cb 0.05 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.19 3d3o h ASN 82 CO -0.01 0.90 0.00 0.71 -1.65 0.00 0.00 177.43 177.38 3d3o h THR 83 N 0.85 0.00 0.01 2.81 1.35 -1.32 -0.19 112.91 116.41 3d3o h THR 83 Ca 0.17 -0.07 -0.42 0.00 -0.55 0.00 0.00 66.41 65.54 3d3o h THR 83 Cb 0.44 0.68 -0.06 0.00 -1.73 0.00 0.00 68.15 67.48 3d3o h THR 83 CO 0.02 0.00 -2.37 -0.38 -0.25 0.00 0.00 175.52 172.54 3d3o n ILE 84 N -2.38 1.53 0.24 6.82 5.41 -1.02 -4.33 119.36 125.62 3d3o n ILE 84 Ca -0.01 -0.40 0.13 0.00 1.00 0.00 0.00 62.75 63.47 3d3o n ILE 84 Cb 0.09 -1.79 0.40 0.00 -0.71 0.00 0.00 39.64 37.63 3d3o n ILE 84 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 3d3o h THR 85 N -0.73 0.15 0.00 1.39 1.35 -1.23 -2.87 112.91 110.98 3d3o h THR 85 Ca -0.63 -0.93 0.00 0.00 -0.55 0.00 0.00 66.41 64.31 3d3o h THR 85 Cb 1.66 1.81 0.00 0.00 -1.73 0.00 0.00 68.15 69.89 3d3o h THR 85 CO -0.31 0.07 0.00 0.00 -0.25 0.00 0.00 175.52 175.04 3d3o n GLN 86 N -3.15 0.09 0.02 4.72 10.64 -0.10 -1.72 117.38 127.88 3d3o n GLN 86 Ca 0.02 0.11 0.06 0.00 -1.83 0.00 0.00 57.00 55.35 3d3o n GLN 86 Cb 0.44 -1.61 0.26 0.00 -0.86 0.00 0.00 30.24 28.47 3d3o n GLN 86 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 3d3o n LYS 87 N -1.77 0.02 -0.07 2.61 5.02 -1.08 -1.80 118.16 121.08 3d3o n LYS 87 Ca 0.06 0.34 0.09 0.00 -2.02 0.00 0.00 58.31 56.78 3d3o n LYS 87 Cb 0.35 -1.55 0.13 0.00 -0.02 0.00 0.00 35.03 33.94 3d3o n LYS 87 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3d3o n ASP 88 N -1.59 2.32 -0.21 4.39 8.00 -0.70 -4.99 116.55 123.77 3d3o n ASP 88 Ca 0.02 -3.01 -0.03 0.00 0.71 0.00 0.00 54.79 52.49 3d3o n ASP 88 Cb 0.13 -0.40 -0.01 0.00 -0.02 0.00 0.00 41.12 40.82 3d3o n ASP 88 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d3o n GLY 89 N -1.37 0.52 3.58 0.44 0.00 -0.75 -5.02 105.19 102.60 3d3o n GLY 89 Ca 0.15 -0.19 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 3d3o n GLY 89 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3d3o s ILE 90 N -1.80 4.15 -0.30 -0.61 -1.09 -0.81 -4.95 121.20 115.80 3d3o s ILE 90 Ca 0.00 -0.28 -0.10 0.00 -2.23 0.00 0.00 60.65 58.04 3d3o s ILE 90 Cb 0.00 -2.80 0.15 0.00 -1.58 0.00 0.00 42.46 38.24 3d3o s ILE 90 CO 0.00 0.53 0.76 0.00 -1.23 0.00 0.00 174.94 175.00 3d3o s ARG 91 N -0.10 0.47 0.12 2.79 1.70 -1.26 -1.68 118.95 121.00 3d3o s ARG 91 Ca 0.03 1.10 -0.27 0.00 -0.47 0.00 0.00 55.73 56.12 3d3o s ARG 91 Cb -0.13 0.65 -0.07 0.00 -0.57 0.00 0.00 34.95 34.84 3d3o s ARG 91 CO 0.02 -0.25 0.86 -0.06 -1.08 0.00 0.00 175.30 174.79 3d3o s PHE 92 N 2.77 3.84 0.01 5.89 0.08 -1.26 -5.03 117.98 124.28 3d3o s PHE 92 Ca 0.00 1.68 -0.30 0.00 0.12 0.00 0.00 56.93 58.43 3d3o s PHE 92 Cb -0.11 -2.91 -0.04 0.00 -0.57 0.00 0.00 43.02 39.40 3d3o s PHE 92 CO -0.18 0.34 1.11 -1.21 -0.10 0.00 0.00 175.22 175.17 3d3o s GLU 93 N -0.46 4.46 0.21 0.44 0.41 -1.26 -4.91 118.70 117.60 3d3o s GLU 93 Ca 0.41 1.60 -0.17 0.00 -0.41 0.00 0.00 54.97 56.39 3d3o s GLU 93 Cb -0.23 -3.44 0.21 0.00 -1.78 0.00 0.00 34.13 28.90 3d3o s GLU 93 CO 0.27 -0.22 1.58 -0.24 -0.49 0.00 0.00 175.26 176.16 3d3o h VAL 94 N 4.74 0.12 -0.21 2.63 3.04 -1.95 -0.79 116.25 123.84 3d3o h VAL 94 Ca -0.39 0.00 0.02 0.00 -1.01 0.00 0.00 66.70 65.31 3d3o h VAL 94 Cb 1.20 0.12 -0.02 0.00 -2.01 0.00 0.00 31.29 30.58 3d3o h VAL 94 CO 0.80 0.00 -0.12 -0.67 -1.01 0.00 0.00 177.57 176.57 3d3o n ASP 95 N -5.47 -0.22 -4.51 3.17 -0.08 -1.26 -4.44 116.55 103.74 3d3o n ASP 95 Ca 0.08 0.80 -0.27 0.00 -1.51 0.00 0.00 54.79 53.88 3d3o n ASP 95 Cb 0.38 -0.26 -0.07 0.00 2.34 0.00 0.00 41.12 43.51 3d3o n ASP 95 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 3d3o n ASP 96 N -3.34 2.81 0.00 1.67 -0.08 -0.30 -4.72 116.55 112.58 3d3o n ASP 96 Ca 0.00 -2.67 0.00 0.00 -1.51 0.00 0.00 54.79 50.61 3d3o n ASP 96 Cb 0.05 -1.69 0.00 0.00 2.34 0.00 0.00 41.12 41.82 3d3o n ASP 96 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3d3o n ALA 99 N 14.69 0.00 -0.21 -1.67 0.00 -1.26 -4.55 120.51 127.51 3d3o n ALA 99 Ca 0.45 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.86 3d3o n ALA 99 Cb 0.46 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.99 3d3o n ALA 99 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3d3o h ARG 100 N 0.00 0.63 -0.62 0.00 9.65 -1.94 -1.67 114.38 120.43 3d3o h ARG 100 Ca 0.00 -0.04 0.01 0.00 -1.10 0.00 0.00 59.98 58.85 3d3o h ARG 100 Cb 0.00 -0.14 -0.03 0.00 -1.39 0.00 0.00 29.97 28.40 3d3o h ARG 100 CO 0.00 0.42 0.41 0.82 2.80 0.00 0.00 179.97 184.41 3d3o h ILE 101 N 0.65 1.14 -0.67 1.20 2.04 -1.91 -0.94 117.51 119.02 3d3o h ILE 101 Ca 0.27 -0.28 0.00 0.00 1.00 0.00 0.00 64.86 65.85 3d3o h ILE 101 Cb 0.14 0.24 -0.03 0.00 -0.74 0.00 0.00 36.82 36.43 3d3o h ILE 101 CO -0.16 0.15 0.44 0.03 0.00 0.00 0.00 178.15 178.61 3d3o h ARG 102 N 0.82 0.89 -0.52 2.37 3.08 -1.79 -2.13 114.38 117.11 3d3o h ARG 102 Ca 0.24 -0.06 0.01 0.00 0.07 0.00 0.00 59.98 60.24 3d3o h ARG 102 Cb -0.06 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 29.76 3d3o h ARG 102 CO -0.06 0.60 0.33 0.37 -1.07 0.00 0.00 179.97 180.14 3d3o h GLN 103 N 0.91 0.66 -0.40 0.04 4.15 -1.01 -1.76 115.11 117.70 3d3o h GLN 103 Ca 0.25 -0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.61 3d3o h GLN 103 Cb -0.09 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 27.43 3d3o h GLN 103 CO -0.05 0.44 0.17 0.28 -1.93 0.00 0.00 178.83 177.74 3d3o h VAL 104 N 0.68 1.19 -0.82 2.39 2.07 -0.88 0.58 116.25 121.45 3d3o h VAL 104 Ca 0.20 -0.56 0.09 0.00 0.82 0.00 0.00 66.70 67.25 3d3o h VAL 104 Cb -0.05 0.81 -0.07 0.00 -1.52 0.00 0.00 31.29 30.46 3d3o h VAL 104 CO -0.06 0.21 0.48 -0.09 0.02 0.00 0.00 177.57 178.13 3d3o h ARG 105 N 0.51 0.78 0.45 1.57 2.43 -1.28 -1.35 114.38 117.50 3d3o h ARG 105 Ca 0.14 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.24 3d3o h ARG 105 Cb 0.16 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 3d3o h ARG 105 CO -0.01 0.52 -0.22 1.49 -1.51 0.00 0.00 179.97 180.24 3d3o h GLU 106 N 0.80 -0.59 0.00 0.20 4.81 -0.56 -3.32 114.58 115.93 3d3o h GLU 106 Ca 0.39 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.66 3d3o h GLU 106 Cb 0.34 0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.86 3d3o h GLU 106 CO -0.24 -0.39 0.00 -0.56 -0.73 0.00 0.00 179.01 177.09 3d3o h GLN 107 N -0.69 0.00 0.00 1.92 3.07 -0.85 -3.47 115.11 115.09 3d3o h GLN 107 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.68 3d3o h GLN 107 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.03 3d3o h GLN 107 CO 0.10 0.00 0.00 0.41 0.09 0.00 0.00 178.83 179.43 3d3o n GLY 108 N -0.38 0.50 3.79 0.06 0.00 -0.51 -5.02 105.19 103.64 3d3o n GLY 108 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.95 3d3o n GLY 108 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3d3o s TYR 109 N -2.22 -0.04 0.05 1.61 -0.85 -1.22 -4.27 117.35 110.40 3d3o s TYR 109 Ca 0.00 -0.41 0.02 0.00 -0.52 0.00 0.00 57.07 56.16 3d3o s TYR 109 Cb 0.00 0.60 -0.03 0.00 0.38 0.00 0.00 41.96 42.91 3d3o s TYR 109 CO 0.00 -1.21 -0.08 0.00 -1.52 0.00 0.00 175.55 172.74 3d3o s ALA 110 N -3.84 0.64 0.13 9.51 0.00 -0.42 -4.68 121.76 123.11 3d3o s ALA 110 Ca 0.14 -0.81 -0.05 0.00 0.00 0.00 0.00 51.96 51.25 3d3o s ALA 110 Cb -0.05 0.03 -0.02 0.00 0.00 0.00 0.00 23.12 23.08 3d3o s ALA 110 CO 0.08 -0.01 0.15 -1.54 0.00 0.00 0.00 175.76 174.44 3d3o s SER 111 N -1.64 0.21 -0.12 0.00 1.04 -1.26 -0.82 113.70 111.11 3d3o s SER 111 Ca -0.09 -1.01 -0.24 0.00 0.48 0.00 0.00 55.95 55.09 3d3o s SER 111 Cb -0.10 0.34 0.06 0.00 0.10 0.00 0.00 66.02 66.43 3d3o s SER 111 CO 0.00 -0.78 0.59 0.00 0.98 0.00 0.00 173.24 174.03 3d3o s ALA 112 N -3.99 -1.49 -0.09 5.32 0.00 -0.92 -4.89 121.76 115.70 3d3o s ALA 112 Ca 0.18 1.32 0.03 0.00 0.00 0.00 0.00 51.96 53.49 3d3o s ALA 112 Cb 0.06 -0.41 -0.01 0.00 0.00 0.00 0.00 23.12 22.75 3d3o s ALA 112 CO -0.01 -0.32 -0.18 -1.21 0.00 0.00 0.00 175.76 174.05 3d3o s GLU 113 N -0.58 2.93 -1.95 0.00 2.02 -1.26 -2.02 118.70 117.83 3d3o s GLU 113 Ca -0.07 -0.76 0.00 0.00 0.02 0.00 0.00 54.97 54.16 3d3o s GLU 113 Cb -0.03 -2.42 0.00 0.00 0.10 0.00 0.00 34.13 31.79 3d3o s GLU 113 CO 0.05 0.35 0.00 0.72 0.02 0.00 0.00 175.26 176.40 3d3o n HIS 114 N 3.08 0.00 -3.70 1.61 8.25 0.34 -4.95 115.22 119.85 3d3o n HIS 114 Ca -0.18 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.06 3d3o n HIS 114 Cb 0.52 -3.15 -0.18 0.00 1.12 0.00 0.00 29.99 28.31 3d3o n HIS 114 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3d3o s ILE 115 N -2.66 0.10 -0.99 1.59 1.01 -1.26 -3.56 121.20 115.43 3d3o s ILE 115 Ca 0.00 0.18 0.26 0.00 0.00 0.00 0.00 60.65 61.09 3d3o s ILE 115 Cb 0.00 -0.40 0.22 0.00 0.01 0.00 0.00 42.46 42.29 3d3o s ILE 115 CO 0.00 0.12 1.85 -0.81 0.00 0.00 0.00 174.94 176.09 3d3o n PRO 116 N 5.23 0.00 -4.82 2.79 -0.04 -1.26 -4.53 135.00 132.38 3d3o n PRO 116 Ca -0.05 0.05 -0.27 0.00 -0.04 0.00 0.00 63.50 63.19 3d3o n PRO 116 Cb 0.50 -1.51 -0.16 0.00 -0.04 0.00 0.00 33.50 32.29 3d3o n PRO 116 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3d3o s PHE 117 N -3.00 1.78 0.05 0.54 0.08 -1.23 -5.09 117.98 111.11 3d3o s PHE 117 Ca 0.13 -0.61 -0.34 0.00 0.12 0.00 0.00 56.93 56.22 3d3o s PHE 117 Cb 0.17 -1.23 -0.13 0.00 -0.57 0.00 0.00 43.02 41.26 3d3o s PHE 117 CO 0.49 -0.25 1.70 0.28 -0.10 0.00 0.00 175.22 177.33 3d3o n VAL 118 N 3.46 0.25 -0.16 -0.44 0.31 -1.25 -1.50 118.33 119.00 3d3o n VAL 118 Ca -0.20 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 3d3o n VAL 118 Cb 0.52 -1.65 0.00 0.00 -0.91 0.00 0.00 33.84 31.80 3d3o n VAL 118 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3d3o n GLY 119 N 3.81 0.58 3.93 2.92 0.00 -1.26 -4.99 105.19 110.19 3d3o n GLY 119 Ca 0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.99 3d3o n GLY 119 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3d3o s GLY 120 N -1.28 1.40 -0.02 -0.02 0.00 -0.56 -0.26 107.32 106.58 3d3o s GLY 120 Ca 0.00 -1.20 -0.04 0.00 0.00 0.00 0.00 44.72 43.47 3d3o s GLY 120 CO 0.00 -1.22 0.10 -0.32 0.00 0.00 0.00 173.10 171.66 3d3o s GLY 121 N -3.71 0.00 0.01 0.20 0.00 -0.55 -0.50 107.32 102.77 3d3o s GLY 121 Ca 0.34 0.04 -0.07 0.00 0.00 0.00 0.00 44.72 45.03 3d3o s GLY 121 CO 0.28 -0.03 0.12 -0.51 0.00 0.00 0.00 173.10 172.96 3d3o s THR 122 N -0.60 0.09 -0.06 0.90 -4.23 -0.86 -1.54 115.64 109.34 3d3o s THR 122 Ca -0.07 -0.77 -0.04 0.00 -1.18 0.00 0.00 61.69 59.63 3d3o s THR 122 Cb -0.04 -0.50 0.02 0.00 1.34 0.00 0.00 72.50 73.32 3d3o s THR 122 CO 0.00 -0.42 0.16 -0.63 -0.54 0.00 0.00 174.62 173.19 3d3o s ILE 123 N -1.60 -0.02 0.16 2.99 1.01 -0.65 -2.16 121.20 120.94 3d3o s ILE 123 Ca -0.13 0.07 -0.10 0.00 0.00 0.00 0.00 60.65 60.48 3d3o s ILE 123 Cb -0.07 -0.24 -0.00 0.00 0.01 0.00 0.00 42.46 42.17 3d3o s ILE 123 CO 0.00 0.03 0.31 0.00 0.00 0.00 0.00 174.94 175.28 3d3o s VAL 125 N -3.94 0.69 -0.12 0.00 -7.23 -1.26 -1.31 120.40 107.23 3d3o s VAL 125 Ca 0.14 -1.95 -0.22 0.00 -1.81 0.00 0.00 61.98 58.14 3d3o s VAL 125 Cb 0.03 -1.81 -0.03 0.00 0.56 0.00 0.00 36.38 35.13 3d3o s VAL 125 CO -0.02 -0.76 0.65 -0.22 -0.31 0.00 0.00 175.10 174.45 3d3o s LEU 126 N -3.08 4.25 0.62 1.32 2.96 -1.26 -4.43 118.68 119.06 3d3o s LEU 126 Ca 0.15 1.02 -0.16 0.00 -0.22 0.00 0.00 54.13 54.92 3d3o s LEU 126 Cb 0.05 -2.98 -0.02 0.00 0.50 0.00 0.00 46.19 43.75 3d3o s LEU 126 CO -0.02 -0.16 1.12 -0.76 -1.32 0.00 0.00 176.35 175.20 3d3o s LEU 127 N 1.20 3.51 0.00 -0.68 1.43 -0.08 -4.96 118.68 119.10 3d3o s LEU 127 Ca 0.33 2.07 0.00 0.00 -1.03 0.00 0.00 54.13 55.50 3d3o s LEU 127 Cb -0.17 -4.56 0.00 0.00 0.03 0.00 0.00 46.19 41.49 3d3o s LEU 127 CO 0.14 -1.50 0.29 -2.65 0.23 0.00 0.00 176.35 172.85 3d3o n PRO 128 N -2.05 0.54 -4.13 1.29 -0.02 -1.26 -4.71 135.00 124.66 3d3o n PRO 128 Ca 0.11 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.49 3d3o n PRO 128 Cb 0.52 -1.25 -0.10 0.00 -0.02 0.00 0.00 33.50 32.64 3d3o n PRO 128 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3d3o s THR 130 N -1.06 0.52 -0.14 3.45 -4.23 -1.26 -4.99 115.64 107.92 3d3o s THR 130 Ca 0.00 -1.77 -0.00 0.00 -1.18 0.00 0.00 61.69 58.74 3d3o s THR 130 Cb 0.00 -1.47 0.03 0.00 1.34 0.00 0.00 72.50 72.40 3d3o s THR 130 CO 0.00 -0.85 -0.08 -0.63 -0.54 0.00 0.00 174.62 172.52 3d3o s ILE 131 N -3.40 1.19 -1.34 2.99 1.01 -0.17 -2.41 121.20 119.06 3d3o s ILE 131 Ca 0.07 -0.50 -0.05 0.00 0.00 0.00 0.00 60.65 60.18 3d3o s ILE 131 Cb 0.04 -1.24 0.02 0.00 0.01 0.00 0.00 42.46 41.30 3d3o s ILE 131 CO -0.06 0.30 0.93 0.00 0.00 0.00 0.00 174.94 176.12 3d3o n GLN 132 N 4.88 -6.07 0.00 2.79 6.02 0.21 -1.44 117.38 123.77 3d3o n GLN 132 Ca -0.13 0.71 0.00 0.00 -0.01 0.00 0.00 57.00 57.57 3d3o n GLN 132 Cb 0.49 -5.55 0.00 0.00 1.02 0.00 0.00 30.24 26.20 3d3o n GLN 132 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3d3o n GLY 133 N -1.59 1.72 3.79 1.08 0.00 -1.26 -4.99 105.19 103.94 3d3o n GLY 133 Ca -0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.48 3d3o n GLY 133 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3d3o s GLN 134 N 0.00 4.47 0.76 1.61 -1.52 -0.52 -5.01 119.66 119.45 3d3o s GLN 134 Ca 0.00 1.08 -0.12 0.00 -1.95 0.00 0.00 55.36 54.37 3d3o s GLN 134 Cb 0.00 -3.14 0.05 0.00 -0.22 0.00 0.00 33.01 29.71 3d3o s GLN 134 CO 0.00 0.51 1.11 -1.25 -0.25 0.00 0.00 175.29 175.42 3d3o s PRO 135 N -1.41 2.20 0.04 2.91 0.04 -1.26 -1.00 135.00 136.51 3d3o s PRO 135 Ca 0.38 1.33 0.03 0.00 0.04 0.00 0.00 61.00 62.79 3d3o s PRO 135 Cb -0.21 -1.88 -0.02 0.00 0.04 0.00 0.00 34.50 32.43 3d3o s PRO 135 CO 0.24 -1.71 -0.10 0.08 0.04 0.00 0.00 177.00 175.56 3d3o s VAL 136 N -2.64 0.76 0.00 -0.36 1.01 -1.26 -4.08 120.40 113.82 3d3o s VAL 136 Ca 0.65 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 61.70 3d3o s VAL 136 Cb -0.20 -0.74 0.00 0.00 0.00 0.00 0.00 36.38 35.44 3d3o s VAL 136 CO 0.52 -0.15 0.00 1.07 0.00 0.00 0.00 175.10 176.54 3d3o n THR 137 N 1.85 0.00 0.00 3.92 5.66 0.11 -0.91 114.28 124.92 3d3o n THR 137 Ca -0.19 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.81 3d3o n THR 137 Cb 0.55 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.33 3d3o n THR 137 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3d3o n GLY 139 N 2.81 2.53 3.22 1.09 0.00 -0.17 -1.42 105.19 113.24 3d3o n GLY 139 Ca 0.00 -1.09 -0.19 0.00 0.00 0.00 0.00 46.02 44.74 3d3o n GLY 139 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3d3o s LEU 140 N 0.00 2.34 0.00 0.99 0.05 0.38 -1.14 118.68 121.30 3d3o s LEU 140 Ca 0.00 -0.72 -0.02 0.00 0.05 0.00 0.00 54.13 53.44 3d3o s LEU 140 Cb 0.00 -0.57 -0.01 0.00 -2.05 0.00 0.00 46.19 43.56 3d3o s LEU 140 CO 0.00 -0.09 0.03 -0.83 -0.55 0.00 0.00 176.35 174.91 3d3o s GLY 141 N -2.09 0.09 0.00 -3.48 0.00 0.18 -1.63 107.32 100.39 3d3o s GLY 141 Ca 0.04 -0.20 0.00 0.00 0.00 0.00 0.00 44.72 44.56 3d3o s GLY 141 CO 0.03 -0.27 0.00 0.61 0.00 0.00 0.00 173.10 173.47 3d3o n GLY 142 N 2.17 1.22 3.75 0.20 0.00 -0.59 -2.54 105.19 109.39 3d3o n GLY 142 Ca -0.19 -0.73 -0.41 0.00 0.00 0.00 0.00 46.02 44.69 3d3o n GLY 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d3o s ALA 143 N -1.00 3.49 0.25 4.61 0.00 -1.26 -1.48 121.76 126.38 3d3o s ALA 143 Ca 0.00 1.10 -0.02 0.00 0.00 0.00 0.00 51.96 53.03 3d3o s ALA 143 Cb 0.00 -3.45 0.51 0.00 0.00 0.00 0.00 23.12 20.18 3d3o s ALA 143 CO 0.00 -0.48 1.74 1.25 0.00 0.00 0.00 175.76 178.26 3d3o h LEU 144 N 4.59 0.36 -0.87 0.00 5.85 -0.86 -1.93 115.31 122.46 3d3o h LEU 144 Ca -0.46 0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.33 3d3o h LEU 144 Cb 1.22 0.07 -0.04 0.00 0.37 0.00 0.00 40.66 42.28 3d3o h LEU 144 CO 0.72 0.13 0.34 0.44 -0.34 0.00 0.00 178.44 179.73 3d3o h ASP 145 N 0.49 1.07 -0.05 1.25 3.32 -1.91 0.19 116.42 120.79 3d3o h ASP 145 Ca 0.44 -0.15 -0.10 0.00 0.02 0.00 0.00 57.03 57.24 3d3o h ASP 145 Cb 0.68 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 3d3o h ASP 145 CO -0.40 0.93 -0.29 -0.09 -1.72 0.00 0.00 179.24 177.67 3d3o h ARG 146 N 1.15 0.50 0.03 3.56 2.43 -1.75 -0.55 114.38 119.74 3d3o h ARG 146 Ca 0.27 -0.20 -0.00 0.00 -0.81 0.00 0.00 59.98 59.24 3d3o h ARG 146 Cb 0.17 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 3d3o h ARG 146 CO -0.03 0.74 -0.01 0.82 -1.51 0.00 0.00 179.97 179.98 3d3o h ILE 147 N 0.43 1.37 -0.88 1.20 1.08 -0.96 -2.82 117.51 116.94 3d3o h ILE 147 Ca 0.06 -1.32 0.06 0.00 -0.39 0.00 0.00 64.86 63.26 3d3o h ILE 147 Cb 0.72 2.25 -0.06 0.00 -3.07 0.00 0.00 36.82 36.67 3d3o h ILE 147 CO 0.06 0.33 0.58 0.11 -0.69 0.00 0.00 178.15 178.54 3d3o h LYS 148 N -0.62 1.00 -0.00 2.37 1.57 -0.53 -0.51 116.57 119.84 3d3o h LYS 148 Ca -0.00 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3d3o h LYS 148 Cb 0.58 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.66 3d3o h LYS 148 CO 0.01 0.66 -0.25 0.00 -0.57 0.00 0.00 179.45 179.29 3d3o n GLN 149 N -4.48 0.04 -0.06 3.15 10.64 -0.22 -3.53 117.38 122.92 3d3o n GLN 149 Ca 0.13 -0.01 0.03 0.00 -1.83 0.00 0.00 57.00 55.31 3d3o n GLN 149 Cb 0.17 -1.50 0.06 0.00 -0.86 0.00 0.00 30.24 28.11 3d3o n GLN 149 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 3d3o n ASN 150 N -1.47 2.29 -0.02 2.61 3.02 -0.89 -4.87 115.26 115.92 3d3o n ASN 150 Ca 0.07 -2.21 -0.13 0.00 -0.03 0.00 0.00 54.58 52.28 3d3o n ASN 150 Cb 0.33 -0.13 -0.08 0.00 -0.61 0.00 0.00 39.78 39.30 3d3o n ASN 150 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 3d3o h TYR 151 N 0.42 -1.40 -0.47 3.10 3.20 -1.15 0.67 116.97 121.33 3d3o h TYR 151 Ca 0.00 0.06 0.04 0.00 3.14 0.00 0.00 58.73 61.97 3d3o h TYR 151 Cb 0.65 0.63 -0.04 0.00 1.54 0.00 0.00 36.73 39.52 3d3o h TYR 151 CO 0.06 -0.51 0.23 -0.44 -1.64 0.00 0.00 178.16 175.87 3d3o h ASP 152 N -0.51 0.34 -0.27 -2.11 3.32 -1.88 -0.23 116.42 115.07 3d3o h ASP 152 Ca 0.06 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.14 3d3o h ASP 152 Cb 0.65 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.15 3d3o h ASP 152 CO -0.44 0.24 0.16 -0.09 -1.72 0.00 0.00 179.24 177.38 3d3o h ARG 153 N 0.46 0.37 0.03 3.56 2.43 -1.73 -0.78 114.38 118.72 3d3o h ARG 153 Ca 0.20 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.33 3d3o h ARG 153 Cb 0.11 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 3d3o h ARG 153 CO -0.15 0.31 -0.01 1.88 -1.51 0.00 0.00 179.97 180.49 3d3o h TYR 154 N 0.33 -0.03 -0.39 2.20 -1.99 -0.56 -1.28 116.97 115.26 3d3o h TYR 154 Ca 0.10 -0.00 0.07 0.00 2.00 0.00 0.00 58.73 60.90 3d3o h TYR 154 Cb 0.04 0.01 -0.07 0.00 2.00 0.00 0.00 36.73 38.71 3d3o h TYR 154 CO -0.04 0.04 -0.03 1.25 -0.00 0.00 0.00 178.16 179.39 3d3o h LEU 155 N -0.10 -0.21 -0.28 3.88 5.85 -0.95 -1.66 115.31 121.85 3d3o h LEU 155 Ca -0.00 0.10 0.06 0.00 0.84 0.00 0.00 57.88 58.87 3d3o h LEU 155 Cb 0.09 0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.24 3d3o h LEU 155 CO 0.01 -0.07 -0.08 -0.08 -0.34 0.00 0.00 178.44 177.88 3d3o h GLU 156 N 0.07 -0.01 -0.95 1.25 4.81 -0.77 -0.67 114.58 118.31 3d3o h GLU 156 Ca 0.19 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.49 3d3o h GLU 156 Cb 0.27 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.59 3d3o h GLU 156 CO -0.34 -0.01 0.62 -0.07 -0.73 0.00 0.00 179.01 178.48 3d3o h LEU 157 N -0.01 0.96 0.04 1.64 3.38 -0.69 -0.49 115.31 120.13 3d3o h LEU 157 Ca 0.14 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 3d3o h LEU 157 Cb 0.22 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.78 3d3o h LEU 157 CO -0.29 0.60 -0.02 -0.07 0.09 0.00 0.00 178.44 178.75 3d3o h LEU 158 N 1.08 -0.04 -1.65 1.67 3.38 -0.28 -1.79 115.31 117.68 3d3o h LEU 158 Ca 0.42 -0.33 0.07 0.00 0.09 0.00 0.00 57.88 58.12 3d3o h LEU 158 Cb 0.22 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 3d3o h LEU 158 CO -0.17 0.31 0.35 -0.07 0.09 0.00 0.00 178.44 178.95 3d3o h LEU 159 N -0.41 0.37 -0.17 1.67 3.38 -0.87 -0.41 115.31 118.87 3d3o h LEU 159 Ca -0.01 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.81 3d3o h LEU 159 Cb 0.37 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 3d3o h LEU 159 CO 0.01 0.24 -0.73 -1.13 0.09 0.00 0.00 178.44 176.92 3d3o h ASN 160 N 0.42 0.00 -0.47 -0.43 -1.24 -0.99 -2.85 115.58 110.02 3d3o h ASN 160 Ca 0.23 0.00 -0.09 0.00 0.71 0.00 0.00 56.30 57.15 3d3o h ASN 160 Cb 0.35 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.38 3d3o h ASN 160 CO -0.06 0.73 -0.03 1.23 -1.29 0.00 0.00 177.43 178.01 3d3o h GLY 161 N 2.97 0.98 0.92 1.57 0.00 -0.19 -1.46 103.07 107.86 3d3o h GLY 161 Ca -0.01 -0.70 0.01 0.00 0.00 0.00 0.00 47.33 46.63 3d3o h GLY 161 CO 0.09 0.65 0.10 -2.08 0.00 0.00 0.00 176.54 175.30 3d3o h VAL 162 N 0.83 1.00 -0.88 4.60 2.07 -1.24 -2.89 116.25 119.73 3d3o h VAL 162 Ca 0.15 -0.07 0.06 0.00 0.82 0.00 0.00 66.70 67.66 3d3o h VAL 162 Cb 0.54 0.77 -0.06 0.00 -1.52 0.00 0.00 31.29 31.02 3d3o h VAL 162 CO 0.03 0.04 0.55 1.56 0.02 0.00 0.00 177.57 179.77 3d3o h GLN 163 N 0.21 0.98 0.00 1.57 1.08 -1.23 -1.49 115.11 116.23 3d3o h GLN 163 Ca 0.08 -0.06 -0.01 0.00 -1.45 0.00 0.00 58.65 57.21 3d3o h GLN 163 Cb 0.02 -0.22 -0.00 0.00 -0.05 0.00 0.00 27.48 27.22 3d3o h GLN 163 CO -0.05 0.65 -0.03 1.96 -0.95 0.00 0.00 178.83 180.41 3d3o h GLN 164 N 1.01 0.00 -0.01 1.46 4.20 -1.11 -3.04 115.11 117.62 3d3o h GLN 164 Ca 0.38 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.09 3d3o h GLN 164 Cb 0.16 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.94 3d3o h GLN 164 CO -0.17 0.03 -0.56 1.28 -0.67 0.00 0.00 178.83 178.74 3d3o n LEU 165 N -3.52 1.74 0.02 1.46 4.77 -0.59 -4.39 117.00 116.49 3d3o n LEU 165 Ca -0.03 -0.70 0.01 0.00 -0.03 0.00 0.00 56.01 55.26 3d3o n LEU 165 Cb 0.13 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.25 3d3o n LEU 165 CO 0.26 0.34 0.54 0.29 -1.33 0.00 0.00 177.39 177.49 3d3o n LYS 166 N -0.35 0.01 0.05 3.23 5.02 -1.03 -0.23 118.16 124.87 3d3o n LYS 166 Ca 0.08 0.27 0.12 0.00 -2.02 0.00 0.00 58.31 56.75 3d3o n LYS 166 Cb 0.41 -1.84 0.05 0.00 -0.02 0.00 0.00 35.03 33.64 3d3o n LYS 166 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 3d3o n LYS 167 N -1.33 0.38 -3.22 1.97 0.00 -1.26 -4.96 118.16 109.74 3d3o n LYS 167 Ca -0.00 0.04 -0.39 0.00 -0.00 0.00 0.00 58.31 57.96 3d3o n LYS 167 Cb 0.30 -1.67 -0.06 0.00 -0.00 0.00 0.00 35.03 33.61 3d3o n LYS 167 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 3d3o s SER 168 N -4.37 6.92 0.60 -5.58 0.01 0.69 -5.06 113.70 106.91 3d3o s SER 168 Ca 0.03 1.10 -0.18 0.00 1.31 0.00 0.00 55.95 58.21 3d3o s SER 168 Cb 0.13 -2.35 -0.03 0.00 0.21 0.00 0.00 66.02 63.98 3d3o s SER 168 CO 0.78 0.08 1.14 -1.81 0.41 0.00 0.00 173.24 173.83 3d3o s ASP 169 N -0.01 5.35 0.51 2.44 1.01 -1.26 -5.02 116.67 119.69 3d3o s ASP 169 Ca 0.30 2.16 -0.18 0.00 0.71 0.00 0.00 52.55 55.55 3d3o s ASP 169 Cb -0.18 -2.57 -0.07 0.00 1.01 0.00 0.00 42.92 41.11 3d3o s ASP 169 CO 0.16 -1.47 1.01 -0.44 0.21 0.00 0.00 175.17 174.64 3d3o s SER 170 N -2.03 6.37 0.01 0.27 0.01 -1.26 -4.85 113.70 112.23 3d3o s SER 170 Ca 0.72 1.75 -0.06 0.00 1.31 0.00 0.00 55.95 59.66 3d3o s SER 170 Cb -0.24 -2.53 -0.00 0.00 0.21 0.00 0.00 66.02 63.45 3d3o s SER 170 CO 0.34 -0.76 0.12 0.72 0.41 0.00 0.00 173.24 174.07 3d3o s PHE 171 N -2.33 0.09 -0.74 2.43 -0.12 -1.01 -4.94 117.98 111.34 3d3o s PHE 171 Ca 0.63 -0.23 0.04 0.00 -0.05 0.00 0.00 56.93 57.31 3d3o s PHE 171 Cb -0.13 -0.07 0.22 0.00 -0.63 0.00 0.00 43.02 42.41 3d3o s PHE 171 CO 0.27 -0.29 0.72 1.58 -0.05 0.00 0.00 175.22 177.45 3d3o n HIS 172 N 1.34 3.52 -1.02 3.49 -0.00 -1.26 0.66 115.22 121.95 3d3o n HIS 172 Ca -0.22 -4.09 0.00 0.00 0.46 0.00 0.00 57.72 53.86 3d3o n HIS 172 Cb 0.56 -0.74 0.00 0.00 -0.12 0.00 0.00 29.99 29.69 3d3o n HIS 172 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84