#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gml s LEU 2 N 0.00 4.27 -0.27 0.64 1.98 -1.26 -4.94 118.68 119.10 2gml s LEU 2 Ca 0.00 1.25 0.02 0.00 -2.89 0.00 0.00 54.13 52.51 2gml s LEU 2 Cb 0.00 -3.21 0.07 0.00 0.66 0.00 0.00 46.19 43.71 2gml s LEU 2 CO 0.00 -0.24 -0.06 -0.69 -1.89 0.00 0.00 176.35 173.47 2gml s VAL 3 N 1.30 1.97 -0.19 1.68 1.01 -1.26 -5.04 120.40 119.88 2gml s VAL 3 Ca 0.40 -1.64 -0.01 0.00 0.00 0.00 0.00 61.98 60.73 2gml s VAL 3 Cb -0.18 -2.20 0.05 0.00 0.00 0.00 0.00 36.38 34.06 2gml s VAL 3 CO 0.18 -0.17 -0.02 -0.22 0.00 0.00 0.00 175.10 174.87 2gml s LEU 4 N 1.16 1.64 0.36 3.92 2.96 -1.26 -1.96 118.68 125.50 2gml s LEU 4 Ca -0.04 -0.83 0.06 0.00 -0.22 0.00 0.00 54.13 53.09 2gml s LEU 4 Cb -0.19 -0.83 -0.07 0.00 0.50 0.00 0.00 46.19 45.59 2gml s LEU 4 CO -0.06 -0.25 0.01 0.27 -1.32 0.00 0.00 176.35 175.00 2gml s ILE 5 N 1.68 1.67 -0.14 6.68 -4.36 0.81 -2.54 121.20 124.99 2gml s ILE 5 Ca -0.01 -2.03 0.00 0.00 -0.26 0.00 0.00 60.65 58.35 2gml s ILE 5 Cb -0.17 -2.83 0.02 0.00 1.25 0.00 0.00 42.46 40.74 2gml s ILE 5 CO -0.07 -0.05 -0.13 0.00 0.24 0.00 0.00 174.94 174.93 2gml s ALA 6 N -2.96 1.74 -0.08 2.27 0.00 -0.72 -1.42 121.76 120.58 2gml s ALA 6 Ca 0.35 -0.82 -0.01 0.00 0.00 0.00 0.00 51.96 51.48 2gml s ALA 6 Cb 0.08 -1.02 -0.03 0.00 0.00 0.00 0.00 23.12 22.15 2gml s ALA 6 CO 0.16 -0.39 -0.03 -1.17 0.00 0.00 0.00 175.76 174.33 2gml s LEU 7 N 1.54 3.39 -0.93 0.00 2.96 0.19 -2.71 118.68 123.12 2gml s LEU 7 Ca 0.05 0.06 -0.15 0.00 -0.22 0.00 0.00 54.13 53.87 2gml s LEU 7 Cb -0.13 -1.76 0.19 0.00 0.50 0.00 0.00 46.19 44.99 2gml s LEU 7 CO -0.10 0.36 1.00 0.21 -1.32 0.00 0.00 176.35 176.50 2gml s ASN 8 N -0.80 6.81 0.15 3.68 3.84 -0.57 -1.56 114.94 126.49 2gml s ASN 8 Ca 0.12 -2.60 -0.31 0.00 0.21 0.00 0.00 52.86 50.27 2gml s ASN 8 Cb -0.11 -2.29 -0.10 0.00 -0.55 0.00 0.00 41.25 38.20 2gml s ASN 8 CO 0.02 -0.73 1.54 -0.75 -2.79 0.00 0.00 177.10 174.40 2gml s LYS 9 N 1.00 4.23 0.73 0.43 2.20 0.36 -0.78 119.74 127.91 2gml s LYS 9 Ca 0.27 2.31 -0.11 0.00 -0.36 0.00 0.00 55.97 58.08 2gml s LYS 9 Cb -0.07 -3.21 0.03 0.00 -1.51 0.00 0.00 37.83 33.06 2gml s LYS 9 CO -0.08 -0.59 1.08 -2.14 -0.36 0.00 0.00 175.35 173.26 2gml s PRO 10 N 1.27 2.70 0.40 4.03 0.02 -1.26 -1.42 135.00 140.73 2gml s PRO 10 Ca 0.69 0.63 -0.24 0.00 0.02 0.00 0.00 61.00 62.10 2gml s PRO 10 Cb -0.42 -1.99 -0.09 0.00 0.02 0.00 0.00 34.50 32.02 2gml s PRO 10 CO 0.31 -1.19 1.08 0.08 -0.33 0.00 0.00 177.00 176.95 2gml s VAL 11 N -3.22 3.59 0.00 3.83 1.01 -1.26 -3.75 120.40 120.60 2gml s VAL 11 Ca 0.59 1.25 0.00 0.00 0.00 0.00 0.00 61.98 63.82 2gml s VAL 11 Cb -0.13 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.59 2gml s VAL 11 CO 0.53 0.04 0.00 0.61 0.00 0.00 0.00 175.10 176.28 2gml n GLY 12 N 0.44 2.40 3.63 4.51 0.00 -0.49 -5.06 105.19 110.62 2gml n GLY 12 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 2gml n GLY 12 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2gml s ILE 13 N -2.43 4.34 0.35 -0.61 -4.36 -1.25 -4.86 121.20 112.38 2gml s ILE 13 Ca 0.00 -0.22 -0.00 0.00 -0.26 0.00 0.00 60.65 60.17 2gml s ILE 13 Cb 0.00 -2.88 -0.03 0.00 1.25 0.00 0.00 42.46 40.80 2gml s ILE 13 CO 0.00 0.55 0.56 0.68 0.24 0.00 0.00 174.94 176.97 2gml s VAL 14 N -0.30 5.09 -0.78 8.37 -7.23 0.18 -4.56 120.40 121.17 2gml s VAL 14 Ca 0.07 -0.39 -0.13 0.00 -1.81 0.00 0.00 61.98 59.71 2gml s VAL 14 Cb -0.12 -3.85 0.20 0.00 0.56 0.00 0.00 36.38 33.17 2gml s VAL 14 CO 0.02 -0.56 0.71 -0.44 -0.31 0.00 0.00 175.10 174.52 2gml s SER 15 N -3.98 6.58 -0.28 4.85 0.01 -1.26 0.80 113.70 120.41 2gml s SER 15 Ca 0.41 -2.61 -0.20 0.00 1.31 0.00 0.00 55.95 54.86 2gml s SER 15 Cb -0.10 -2.18 0.12 0.00 0.21 0.00 0.00 66.02 64.08 2gml s SER 15 CO 0.36 -0.59 0.94 0.28 0.41 0.00 0.00 173.24 174.64 2gml s THR 16 N 0.30 0.00 -0.52 1.44 -1.32 -1.26 -4.94 115.64 109.34 2gml s THR 16 Ca 0.16 0.00 0.05 0.00 -1.21 0.00 0.00 61.69 60.69 2gml s THR 16 Cb -0.13 -1.00 0.38 0.00 -1.51 0.00 0.00 72.50 70.24 2gml s THR 16 CO -0.07 0.00 1.03 0.41 -2.21 0.00 0.00 174.62 173.78 2gml n THR 17 N 3.23 2.76 -1.90 5.08 -1.04 -1.26 -4.57 114.28 116.59 2gml n THR 17 Ca -0.16 -5.28 0.00 0.00 -2.04 0.00 0.00 64.05 56.56 2gml n THR 17 Cb 0.57 -1.34 0.00 0.00 -1.82 0.00 0.00 70.33 67.74 2gml n THR 17 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2gml n GLU 18 N -0.36 0.00 0.00 -2.82 4.71 -1.26 -5.06 120.64 115.86 2gml n GLU 18 Ca 0.35 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.50 2gml n GLU 18 Cb 0.52 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.95 2gml n GLU 18 CO 0.00 0.00 0.00 -0.40 0.09 0.00 0.00 177.13 176.82 2gml n ASP 19 N 0.00 0.00 -2.02 1.62 5.68 -1.26 -1.94 116.55 118.63 2gml n ASP 19 Ca 0.00 0.00 -0.25 0.00 -0.50 0.00 0.00 54.79 54.04 2gml n ASP 19 Cb 0.00 0.00 0.05 0.00 -1.14 0.00 0.00 41.12 40.03 2gml n ASP 19 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2gml n GLY 20 N 0.00 6.18 5.97 6.12 0.00 -1.26 -5.03 105.19 117.18 2gml n GLY 20 Ca 0.00 -2.48 0.00 0.00 0.00 0.00 0.00 46.02 43.54 2gml n GLY 20 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2gml n GLU 21 N -0.79 0.00 0.00 1.61 4.07 -0.82 -4.82 120.64 119.89 2gml n GLU 21 Ca 0.47 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.57 2gml n GLU 21 Cb 0.89 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 32.27 2gml n GLU 21 CO 0.00 0.00 0.00 2.89 -0.06 0.00 0.00 177.13 179.96 2gml n ARG 22 N 0.00 0.00 -3.05 5.31 -4.01 -1.26 -3.26 116.66 110.39 2gml n ARG 22 Ca 0.00 0.00 -0.28 0.00 -1.04 0.00 0.00 57.85 56.53 2gml n ARG 22 Cb 0.00 0.00 -0.05 0.00 -3.04 0.00 0.00 32.46 29.37 2gml n ARG 22 CO 0.00 0.00 0.00 -0.25 -3.04 0.00 0.00 177.63 174.34 2gml n ASP 23 N 10.78 4.53 -4.84 2.89 8.00 -1.26 -5.07 116.55 131.56 2gml n ASP 23 Ca 0.00 -3.62 -0.35 0.00 0.71 0.00 0.00 54.79 51.53 2gml n ASP 23 Cb 0.00 -0.64 -0.06 0.00 -0.02 0.00 0.00 41.12 40.40 2gml n ASP 23 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2gml s ASN 24 N -3.05 6.83 0.27 -2.24 4.22 -1.20 0.49 114.94 120.24 2gml s ASN 24 Ca 0.46 1.07 -0.01 0.00 -2.14 0.00 0.00 52.86 52.24 2gml s ASN 24 Cb 0.23 -2.28 0.58 0.00 1.28 0.00 0.00 41.25 41.06 2gml s ASN 24 CO -0.10 0.12 1.70 -0.29 -2.04 0.00 0.00 177.10 176.49 2gml h ILE 25 N 2.86 0.54 -0.11 0.54 2.10 0.14 -2.65 117.51 120.93 2gml h ILE 25 Ca -0.49 -0.13 0.04 0.00 1.08 0.00 0.00 64.86 65.36 2gml h ILE 25 Cb 1.19 0.12 -0.05 0.00 -1.09 0.00 0.00 36.82 36.99 2gml h ILE 25 CO 0.66 0.07 -0.22 0.58 -1.08 0.00 0.00 178.15 178.15 2gml h VAL 26 N 0.38 0.46 -0.70 2.19 2.07 -1.86 -0.29 116.25 118.51 2gml h VAL 26 Ca 0.48 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.98 2gml h VAL 26 Cb 0.84 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 31.04 2gml h VAL 26 CO -0.49 0.00 0.34 0.44 0.02 0.00 0.00 177.57 177.87 2gml h ASP 27 N -0.29 0.92 -0.74 0.57 5.19 -1.88 -2.75 116.42 117.43 2gml h ASP 27 Ca 0.09 -0.13 -0.01 0.00 -0.62 0.00 0.00 57.03 56.36 2gml h ASP 27 Cb 0.43 -0.24 -0.03 0.00 0.18 0.00 0.00 39.33 39.67 2gml h ASP 27 CO -0.28 0.79 0.41 0.15 -3.12 0.00 0.00 179.24 177.19 2gml h PHE 28 N 0.98 1.02 0.00 4.55 3.04 -1.10 -1.40 116.94 124.02 2gml h PHE 28 Ca 0.24 -0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.16 2gml h PHE 28 Cb 0.12 -0.33 0.00 0.00 2.56 0.00 0.00 35.95 38.30 2gml h PHE 28 CO 0.01 0.72 0.00 1.55 -2.02 0.00 0.00 178.31 178.56 2gml n VAL 29 N -4.46 0.03 -0.84 1.41 3.14 -0.16 -4.94 118.33 112.51 2gml n VAL 29 Ca 0.07 0.01 0.00 0.00 -2.96 0.00 0.00 64.34 61.45 2gml n VAL 29 Cb 0.09 -0.54 0.00 0.00 -1.06 0.00 0.00 33.84 32.33 2gml n VAL 29 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 2gml n ASN 30 N -1.11 0.00 -4.78 6.55 5.15 -0.53 -4.89 115.26 115.65 2gml n ASN 30 Ca 0.19 0.00 -0.36 0.00 -0.60 0.00 0.00 54.58 53.81 2gml n ASN 30 Cb 0.15 0.00 -0.07 0.00 -0.53 0.00 0.00 39.78 39.33 2gml n ASN 30 CO 0.00 0.00 0.00 -2.28 1.40 0.00 0.00 177.26 176.38 2gml s HIS 31 N -0.22 3.47 0.65 1.20 2.46 -1.26 -4.98 115.29 116.61 2gml s HIS 31 Ca 0.00 0.39 0.26 0.00 0.47 0.00 0.00 55.06 56.19 2gml s HIS 31 Cb 0.00 -2.07 1.41 0.00 -0.13 0.00 0.00 32.58 31.78 2gml s HIS 31 CO 0.00 0.45 1.80 0.66 -2.47 0.00 0.00 174.74 175.18 2gml h SER 32 N 6.05 0.00 -3.55 9.88 4.64 -2.00 -3.40 113.55 125.17 2gml h SER 32 Ca -0.46 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.19 2gml h SER 32 Cb 1.18 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.09 2gml h SER 32 CO 0.69 0.00 -0.78 -0.54 -0.87 0.00 0.00 176.83 175.33 2gml s LYS 33 N -4.17 1.86 0.27 4.77 3.01 -1.26 -5.09 119.74 119.12 2gml s LYS 33 Ca -0.03 -1.20 -0.31 0.00 -1.01 0.00 0.00 55.97 53.43 2gml s LYS 33 Cb 0.09 -2.13 -0.13 0.00 -1.01 0.00 0.00 37.83 34.65 2gml s LYS 33 CO 0.29 0.47 1.47 0.54 0.51 0.00 0.00 175.35 178.63 2gml n ARG 34 N 0.62 2.28 -3.95 1.68 1.74 -1.26 -5.00 116.66 112.76 2gml n ARG 34 Ca -0.14 0.81 -0.08 0.00 -0.77 0.00 0.00 57.85 57.66 2gml n ARG 34 Cb 0.53 -2.51 -0.08 0.00 -1.02 0.00 0.00 32.46 29.38 2gml n ARG 34 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2gml s VAL 35 N -0.11 0.16 -0.04 1.55 1.01 -1.26 -4.32 120.40 117.39 2gml s VAL 35 Ca 0.66 -1.43 -0.09 0.00 0.00 0.00 0.00 61.98 61.12 2gml s VAL 35 Cb -0.59 -1.46 0.01 0.00 0.00 0.00 0.00 36.38 34.35 2gml s VAL 35 CO 0.50 -0.74 0.21 -0.36 0.00 0.00 0.00 175.10 174.71 2gml s PHE 36 N -3.89 -0.13 0.75 5.22 0.40 -0.18 -4.90 117.98 115.25 2gml s PHE 36 Ca 0.07 0.29 -0.15 0.00 -0.60 0.00 0.00 56.93 56.54 2gml s PHE 36 Cb 0.06 0.04 0.04 0.00 0.51 0.00 0.00 43.02 43.67 2gml s PHE 36 CO -0.10 -0.22 1.14 -2.30 0.70 0.00 0.00 175.22 174.44 2gml n PRO 37 N 2.17 0.45 -3.77 0.24 -0.02 -1.26 -2.44 135.00 130.37 2gml n PRO 37 Ca -0.18 0.22 -0.36 0.00 -2.02 0.00 0.00 63.50 61.17 2gml n PRO 37 Cb 0.57 -2.38 -0.11 0.00 -0.02 0.00 0.00 33.50 31.56 2gml n PRO 37 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2gml s ILE 38 N -1.89 3.37 0.00 4.25 1.01 0.55 -4.87 121.20 123.63 2gml s ILE 38 Ca 0.75 -2.49 0.00 0.00 0.00 0.00 0.00 60.65 58.91 2gml s ILE 38 Cb -0.32 -3.27 0.00 0.00 0.01 0.00 0.00 42.46 38.87 2gml s ILE 38 CO 0.49 -0.77 0.00 0.61 0.00 0.00 0.00 174.94 175.27 2gml n GLY 39 N 4.07 -2.23 3.18 6.18 0.00 -1.26 -4.53 105.19 110.60 2gml n GLY 39 Ca 0.02 -1.95 -0.26 0.00 0.00 0.00 0.00 46.02 43.83 2gml n GLY 39 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gml s ARG 40 N -0.21 1.67 -0.26 1.61 3.00 -1.26 -5.00 118.95 118.50 2gml s ARG 40 Ca 0.00 -0.68 -0.01 0.00 0.00 0.00 0.00 55.73 55.05 2gml s ARG 40 Cb 0.00 -1.55 0.08 0.00 0.00 0.00 0.00 34.95 33.47 2gml s ARG 40 CO 0.00 0.37 0.03 -1.17 0.00 0.00 0.00 175.30 174.53 2gml s LEU 41 N -0.31 2.20 0.75 2.53 0.20 -1.26 -5.07 118.68 117.71 2gml s LEU 41 Ca 0.04 -1.31 -0.16 0.00 0.69 0.00 0.00 54.13 53.40 2gml s LEU 41 Cb -0.09 -0.93 -0.14 0.00 -0.43 0.00 0.00 46.19 44.61 2gml s LEU 41 CO 0.00 -0.33 -0.52 0.47 -0.29 0.00 0.00 176.35 175.69 2gml n ASP 42 N 4.82 -4.72 -0.23 3.68 8.00 -1.26 -4.51 116.55 122.33 2gml n ASP 42 Ca -0.06 0.31 0.00 0.00 0.71 0.00 0.00 54.79 55.75 2gml n ASP 42 Cb 0.44 -0.71 0.24 0.00 -0.02 0.00 0.00 41.12 41.06 2gml n ASP 42 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 2gml h LYS 43 N -0.59 1.01 0.00 -1.24 3.64 -1.96 -1.79 116.57 115.63 2gml h LYS 43 Ca -0.39 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 2gml h LYS 43 Cb 1.22 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 2gml h LYS 43 CO 0.27 0.67 -0.08 -0.40 -2.27 0.00 0.00 179.45 177.64 2gml n ASP 44 N -4.42 0.63 -4.71 4.20 5.75 -1.26 -1.40 116.55 115.34 2gml n ASP 44 Ca 0.08 0.49 -0.26 0.00 -0.01 0.00 0.00 54.79 55.10 2gml n ASP 44 Cb 0.03 -0.61 0.10 0.00 -1.03 0.00 0.00 41.12 39.61 2gml n ASP 44 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 2gml s SER 45 N -4.15 4.40 0.29 -1.12 0.01 -0.67 -4.59 113.70 107.87 2gml s SER 45 Ca 0.11 0.16 -0.17 0.00 1.31 0.00 0.00 55.95 57.36 2gml s SER 45 Cb 0.14 -0.64 0.02 0.00 0.21 0.00 0.00 66.02 65.75 2gml s SER 45 CO 0.60 -1.85 0.64 0.00 0.41 0.00 0.00 173.24 173.04 2gml s GLN 46 N -5.30 1.78 0.00 12.44 -2.07 -0.54 -4.23 119.66 121.74 2gml s GLN 46 Ca 0.64 -1.17 0.00 0.00 -1.82 0.00 0.00 55.36 53.01 2gml s GLN 46 Cb -0.08 0.56 0.00 0.00 -1.09 0.00 0.00 33.01 32.40 2gml s GLN 46 CO 0.46 -0.79 0.00 0.41 -1.32 0.00 0.00 175.29 174.04 2gml n GLY 47 N -0.45 -0.77 3.72 2.60 0.00 -0.51 -0.33 105.19 109.45 2gml n GLY 47 Ca -0.04 -2.16 -0.42 0.00 0.00 0.00 0.00 46.02 43.41 2gml n GLY 47 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2gml s LEU 48 N 0.00 4.37 -0.12 0.99 0.20 0.21 -0.49 118.68 123.84 2gml s LEU 48 Ca 0.00 2.89 -0.15 0.00 0.69 0.00 0.00 54.13 57.56 2gml s LEU 48 Cb 0.00 -3.60 0.04 0.00 -0.43 0.00 0.00 46.19 42.19 2gml s LEU 48 CO 0.00 -0.97 0.40 -0.51 -0.29 0.00 0.00 176.35 174.97 2gml s ILE 49 N 1.06 0.01 -0.02 6.68 2.07 -0.60 -4.88 121.20 125.52 2gml s ILE 49 Ca 0.74 -0.08 -0.09 0.00 -1.41 0.00 0.00 60.65 59.80 2gml s ILE 49 Cb -0.50 -0.59 -0.05 0.00 0.13 0.00 0.00 42.46 41.45 2gml s ILE 49 CO 0.34 -0.05 0.29 -0.36 -1.91 0.00 0.00 174.94 173.25 2gml s PHE 50 N -0.11 3.62 -0.06 3.50 2.99 -1.26 -0.64 117.98 126.03 2gml s PHE 50 Ca -0.03 0.70 0.02 0.00 0.00 0.00 0.00 56.93 57.62 2gml s PHE 50 Cb -0.03 -2.08 0.02 0.00 0.00 0.00 0.00 43.02 40.93 2gml s PHE 50 CO 0.02 0.64 -0.09 -0.51 -0.00 0.00 0.00 175.22 175.27 2gml s LEU 51 N -1.42 1.53 0.28 -0.37 1.43 -0.51 -0.33 118.68 119.30 2gml s LEU 51 Ca 0.24 -0.24 0.02 0.00 -1.03 0.00 0.00 54.13 53.12 2gml s LEU 51 Cb -0.14 -0.69 -0.05 0.00 0.03 0.00 0.00 46.19 45.35 2gml s LEU 51 CO 0.13 0.00 0.10 0.28 0.23 0.00 0.00 176.35 177.09 2gml s THR 52 N 0.76 0.60 -2.02 5.49 -1.32 -1.02 -0.13 115.64 117.99 2gml s THR 52 Ca -0.13 -2.00 0.21 0.00 -1.21 0.00 0.00 61.69 58.56 2gml s THR 52 Cb -0.15 -2.63 0.02 0.00 -1.51 0.00 0.00 72.50 68.23 2gml s THR 52 CO 0.02 0.00 1.05 -0.46 -2.21 0.00 0.00 174.62 173.03 2gml n ASN 53 N -0.59 2.07 -4.28 8.08 6.94 -0.83 -1.01 115.26 125.63 2gml n ASN 53 Ca -0.00 -1.53 -0.39 0.00 -0.02 0.00 0.00 54.58 52.63 2gml n ASN 53 Cb 0.66 0.41 -0.11 0.00 -2.36 0.00 0.00 39.78 38.38 2gml n ASN 53 CO 0.00 0.00 0.00 -1.00 -1.03 0.00 0.00 177.26 175.23 2gml s HIS 54 N -2.26 3.30 0.53 -2.53 3.76 -1.26 -4.91 115.29 111.92 2gml s HIS 54 Ca 0.18 -1.42 0.35 0.00 -0.15 0.00 0.00 55.06 54.03 2gml s HIS 54 Cb 0.17 -2.60 1.92 0.00 1.11 0.00 0.00 32.58 33.18 2gml s HIS 54 CO 0.49 -0.77 2.23 0.78 -0.85 0.00 0.00 174.74 176.63 2gml h GLY 55 N 8.32 0.00 1.95 -2.22 0.00 -1.99 -1.49 103.07 107.65 2gml h GLY 55 Ca -0.23 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.03 2gml h GLY 55 CO 0.68 0.00 -0.37 1.29 0.00 0.00 0.00 176.54 178.14 2gml h ASP 56 N 0.00 0.00 0.41 0.19 3.04 -2.00 -2.92 116.42 115.13 2gml h ASP 56 Ca -0.00 0.00 -0.18 0.00 -3.24 0.00 0.00 57.03 53.61 2gml h ASP 56 Cb 0.13 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.41 2gml h ASP 56 CO 0.00 0.32 -0.77 0.25 -2.04 0.00 0.00 179.24 177.01 2gml h LEU 57 N 0.00 0.35 -0.42 0.15 6.46 -1.71 -2.65 115.31 117.49 2gml h LEU 57 Ca -0.01 -0.25 0.07 0.00 -0.12 0.00 0.00 57.88 57.57 2gml h LEU 57 Cb 1.25 -0.10 -0.06 0.00 -0.73 0.00 0.00 40.66 41.02 2gml h LEU 57 CO 0.04 0.99 0.09 0.58 -0.62 0.00 0.00 178.44 179.52 2gml h VAL 58 N 0.19 0.78 -0.33 1.05 2.07 -1.29 -0.63 116.25 118.08 2gml h VAL 58 Ca -0.03 -0.08 -0.10 0.00 0.82 0.00 0.00 66.70 67.31 2gml h VAL 58 Cb 1.35 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 2gml h VAL 58 CO 0.12 0.04 -0.21 0.78 0.02 0.00 0.00 177.57 178.33 2gml h ASN 59 N 0.22 0.63 0.73 0.57 2.35 -1.38 -1.35 115.58 117.36 2gml h ASN 59 Ca 0.21 -0.21 -0.20 0.00 -0.55 0.00 0.00 56.30 55.55 2gml h ASN 59 Cb 0.25 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 2gml h ASN 59 CO -0.27 0.83 -0.92 0.11 -1.65 0.00 0.00 177.43 175.53 2gml h LYS 60 N 0.56 0.11 0.19 0.81 1.57 -1.09 -2.71 116.57 116.02 2gml h LYS 60 Ca 0.08 -0.14 -0.27 0.00 -1.87 0.00 0.00 60.65 58.46 2gml h LYS 60 Cb 0.66 0.05 0.03 0.00 0.08 0.00 0.00 32.23 33.04 2gml h LYS 60 CO 0.05 0.95 -1.19 0.82 -0.57 0.00 0.00 179.45 179.51 2gml h ILE 61 N 0.05 1.35 -0.18 1.86 2.04 -1.13 -2.07 117.51 119.44 2gml h ILE 61 Ca -0.04 -2.59 0.05 0.00 1.00 0.00 0.00 64.86 63.28 2gml h ILE 61 Cb 1.59 3.08 -0.05 0.00 -0.74 0.00 0.00 36.82 40.70 2gml h ILE 61 CO 0.13 0.76 -0.17 0.25 0.00 0.00 0.00 178.15 179.13 2gml h LEU 62 N -0.13 -0.54 0.01 1.44 6.46 -1.33 0.15 115.31 121.39 2gml h LEU 62 Ca -0.21 0.10 0.02 0.00 -0.12 0.00 0.00 57.88 57.67 2gml h LEU 62 Cb 1.90 0.26 -0.03 0.00 -0.73 0.00 0.00 40.66 42.06 2gml h LEU 62 CO 0.20 -0.21 -0.16 0.03 -0.62 0.00 0.00 178.44 177.68 2gml h ARG 63 N -0.19 -0.26 0.09 1.25 2.47 -1.55 -2.13 114.38 114.07 2gml h ARG 63 Ca 0.11 0.02 0.02 0.00 -1.26 0.00 0.00 59.98 58.87 2gml h ARG 63 Cb 0.36 0.06 -0.05 0.00 -1.65 0.00 0.00 29.97 28.69 2gml h ARG 63 CO -0.29 -0.17 -0.39 0.00 0.56 0.00 0.00 179.97 179.68 2gml h ALA 64 N 0.65 -0.67 -1.24 0.04 0.00 -0.89 -1.31 119.26 115.84 2gml h ALA 64 Ca 0.05 -0.06 0.36 0.00 0.00 0.00 0.00 54.91 55.26 2gml h ALA 64 Cb 0.33 0.66 -0.09 0.00 0.00 0.00 0.00 17.79 18.69 2gml h ALA 64 CO -0.14 -0.94 0.84 0.78 0.00 0.00 0.00 179.25 179.78 2gml h GLY 65 N -0.61 0.79 0.10 0.00 0.00 -0.35 0.11 103.07 103.12 2gml h GLY 65 Ca 0.03 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.26 2gml h GLY 65 CO -0.25 -0.16 0.00 0.70 0.00 0.00 0.00 176.54 176.84 2gml n ASN 66 N -4.46 0.00 -0.20 0.19 3.02 -0.50 -1.91 115.26 111.40 2gml n ASN 66 Ca 0.30 -1.56 0.01 0.00 -0.03 0.00 0.00 54.58 53.30 2gml n ASN 66 Cb 1.23 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 40.42 2gml n ASN 66 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2gml n ASP 67 N -0.55 0.42 -4.19 6.41 9.92 0.38 -4.81 116.55 124.13 2gml n ASP 67 Ca 0.02 -1.69 -0.16 0.00 -0.53 0.00 0.00 54.79 52.43 2gml n ASP 67 Cb 0.01 -0.12 -0.10 0.00 -0.64 0.00 0.00 41.12 40.27 2gml n ASP 67 CO 0.00 0.00 0.00 -1.00 0.13 0.00 0.00 177.20 176.33 2gml s HIS 68 N -0.37 1.46 0.71 1.24 0.09 -0.80 -5.09 115.29 112.54 2gml s HIS 68 Ca 0.03 -1.29 -0.11 0.00 -0.00 0.00 0.00 55.06 53.70 2gml s HIS 68 Cb 0.03 -0.80 0.02 0.00 -0.00 0.00 0.00 32.58 31.82 2gml s HIS 68 CO 0.00 -0.47 1.07 -1.21 -0.00 0.00 0.00 174.74 174.13 2gml s GLU 69 N -4.00 2.78 -0.09 1.40 2.02 -1.26 -4.41 118.70 115.14 2gml s GLU 69 Ca 0.38 0.94 -0.12 0.00 0.02 0.00 0.00 54.97 56.19 2gml s GLU 69 Cb 0.07 -1.97 0.03 0.00 0.10 0.00 0.00 34.13 32.35 2gml s GLU 69 CO 0.14 -1.21 0.32 0.15 0.02 0.00 0.00 175.26 174.68 2gml s LYS 70 N -5.04 0.45 -0.05 1.61 1.02 0.41 -4.57 119.74 113.57 2gml s LYS 70 Ca 0.59 0.27 0.06 0.00 0.02 0.00 0.00 55.97 56.90 2gml s LYS 70 Cb -0.14 0.21 -0.01 0.00 -0.52 0.00 0.00 37.83 37.37 2gml s LYS 70 CO 0.55 -0.08 -0.22 -2.00 -0.92 0.00 0.00 175.35 172.68 2gml s GLU 71 N -0.24 2.25 0.16 1.68 2.12 0.10 -0.96 118.70 123.82 2gml s GLU 71 Ca -0.04 -0.81 0.07 0.00 0.36 0.00 0.00 54.97 54.55 2gml s GLU 71 Cb -0.03 -1.94 -0.04 0.00 0.26 0.00 0.00 34.13 32.38 2gml s GLU 71 CO 0.01 0.35 -0.14 0.71 -0.54 0.00 0.00 175.26 175.65 2gml s TYR 72 N -0.14 1.56 -0.28 5.30 1.51 0.28 -0.59 117.35 125.00 2gml s TYR 72 Ca -0.02 -0.58 0.01 0.00 -1.01 0.00 0.00 57.07 55.47 2gml s TYR 72 Cb -0.13 -0.77 0.08 0.00 -0.11 0.00 0.00 41.96 41.03 2gml s TYR 72 CO 0.03 0.25 0.00 -1.17 -1.11 0.00 0.00 175.55 173.55 2gml s LEU 73 N -2.94 3.14 -0.05 -1.29 2.96 -0.21 -0.30 118.68 120.00 2gml s LEU 73 Ca 0.16 -1.54 -0.03 0.00 -0.22 0.00 0.00 54.13 52.50 2gml s LEU 73 Cb -0.02 -1.26 -0.04 0.00 0.50 0.00 0.00 46.19 45.37 2gml s LEU 73 CO 0.05 -0.31 0.12 -0.69 -1.32 0.00 0.00 176.35 174.20 2gml s VAL 74 N 1.29 5.12 -0.17 1.68 1.01 0.13 -2.37 120.40 127.09 2gml s VAL 74 Ca 0.02 -0.13 0.01 0.00 0.00 0.00 0.00 61.98 61.87 2gml s VAL 74 Cb -0.19 -3.30 0.02 0.00 0.00 0.00 0.00 36.38 32.92 2gml s VAL 74 CO -0.10 0.45 -0.17 -0.89 0.00 0.00 0.00 175.10 174.39 2gml s THR 75 N -1.15 1.87 0.66 3.92 2.01 0.30 -0.89 115.64 122.38 2gml s THR 75 Ca 0.21 -0.86 0.03 0.00 0.31 0.00 0.00 61.69 61.37 2gml s THR 75 Cb -0.12 -1.73 0.11 0.00 0.01 0.00 0.00 72.50 70.77 2gml s THR 75 CO 0.11 0.47 0.92 0.68 -0.69 0.00 0.00 174.62 176.11 2gml s VAL 76 N 1.36 2.16 -0.23 3.82 -7.23 0.19 0.13 120.40 120.60 2gml s VAL 76 Ca 0.04 -0.74 0.02 0.00 -1.81 0.00 0.00 61.98 59.49 2gml s VAL 76 Cb -0.13 -2.42 -0.19 0.00 0.56 0.00 0.00 36.38 34.19 2gml s VAL 76 CO -0.12 0.00 -0.10 -0.90 -0.31 0.00 0.00 175.10 173.67 2gml n ASP 77 N -2.61 1.85 -4.97 4.85 5.68 -1.09 -4.68 116.55 115.58 2gml n ASP 77 Ca 0.15 -0.07 -0.21 0.00 -0.50 0.00 0.00 54.79 54.16 2gml n ASP 77 Cb 0.61 -0.38 0.03 0.00 -1.14 0.00 0.00 41.12 40.24 2gml n ASP 77 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 2gml s LYS 78 N -2.53 2.67 0.91 0.11 1.02 -1.26 -5.07 119.74 115.59 2gml s LYS 78 Ca -0.31 -0.77 -0.11 0.00 0.02 0.00 0.00 55.97 54.80 2gml s LYS 78 Cb 0.08 -2.53 0.14 0.00 -0.52 0.00 0.00 37.83 35.00 2gml s LYS 78 CO 0.65 -0.59 1.09 -2.14 -0.92 0.00 0.00 175.35 173.44 2gml s PRO 79 N -4.68 1.15 -0.28 -1.68 0.02 -1.26 -4.80 135.00 123.47 2gml s PRO 79 Ca 0.55 0.89 -0.15 0.00 0.02 0.00 0.00 61.00 62.31 2gml s PRO 79 Cb -0.10 -1.79 -0.03 0.00 0.02 0.00 0.00 34.50 32.59 2gml s PRO 79 CO 0.38 -2.34 0.38 0.42 -0.33 0.00 0.00 177.00 175.51 2gml s ILE 80 N -2.88 5.17 0.16 2.83 1.01 -0.68 -5.02 121.20 121.79 2gml s ILE 80 Ca 0.64 0.53 0.03 0.00 0.00 0.00 0.00 60.65 61.85 2gml s ILE 80 Cb -0.19 -3.72 -0.04 0.00 0.01 0.00 0.00 42.46 38.53 2gml s ILE 80 CO 0.57 0.13 0.26 0.42 0.00 0.00 0.00 174.94 176.32 2gml s THR 81 N 2.08 5.14 0.18 2.92 -4.23 -1.26 -4.99 115.64 115.47 2gml s THR 81 Ca 0.15 -0.81 0.33 0.00 -1.18 0.00 0.00 61.69 60.18 2gml s THR 81 Cb -0.16 -3.66 0.34 0.00 1.34 0.00 0.00 72.50 70.36 2gml s THR 81 CO 0.10 -0.13 2.01 1.05 -0.54 0.00 0.00 174.62 177.11 2gml h GLU 82 N 2.07 0.00 0.15 3.99 9.09 -1.98 -1.72 114.58 126.18 2gml h GLU 82 Ca -0.49 0.00 -0.20 0.00 0.05 0.00 0.00 59.36 58.73 2gml h GLU 82 Cb 1.20 0.00 0.02 0.00 -1.65 0.00 0.00 28.75 28.32 2gml h GLU 82 CO 0.67 0.00 -0.86 1.05 0.05 0.00 0.00 179.01 179.92 2gml h GLU 83 N 0.00 0.31 -0.85 1.06 -0.00 -1.97 -0.71 114.58 112.42 2gml h GLU 83 Ca 0.00 -0.54 0.01 0.00 -0.00 0.00 0.00 59.36 58.84 2gml h GLU 83 Cb 0.10 0.20 -0.04 0.00 -0.00 0.00 0.00 28.75 29.00 2gml h GLU 83 CO 0.00 1.26 0.56 0.35 -0.00 0.00 0.00 179.01 181.18 2gml h PHE 84 N -0.34 1.07 0.00 2.06 3.57 -1.74 0.46 116.94 122.02 2gml h PHE 84 Ca -0.15 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.26 2gml h PHE 84 Cb 1.68 -0.36 -0.02 0.00 2.79 0.00 0.00 35.95 40.04 2gml h PHE 84 CO 0.19 0.66 -0.53 0.82 -2.23 0.00 0.00 178.31 177.23 2gml h ILE 85 N 1.14 0.92 -0.02 1.41 1.08 -1.47 -3.27 117.51 117.29 2gml h ILE 85 Ca 0.32 -2.26 -0.13 0.00 -0.39 0.00 0.00 64.86 62.39 2gml h ILE 85 Cb -0.11 2.43 0.01 0.00 -3.07 0.00 0.00 36.82 36.08 2gml h ILE 85 CO -0.08 0.52 -0.51 0.08 -0.69 0.00 0.00 178.15 177.47 2gml h ARG 86 N 0.00 0.38 -2.01 2.37 -0.00 -0.37 -3.18 114.38 111.57 2gml h ARG 86 Ca -0.01 -0.38 -0.00 0.00 -0.00 0.00 0.00 59.98 59.59 2gml h ARG 86 Cb 1.39 0.10 -0.00 0.00 -0.00 0.00 0.00 29.97 31.46 2gml h ARG 86 CO 0.07 1.05 -0.00 0.41 -0.00 0.00 0.00 179.97 181.50 2gml n GLY 87 N 1.00 1.87 0.00 0.08 0.00 0.16 -3.88 105.19 104.42 2gml n GLY 87 Ca -0.10 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2gml n GLY 87 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2gml n SER 89 N 1.70 0.00 -3.81 1.61 2.88 -1.20 -4.71 113.62 110.08 2gml n SER 89 Ca 0.01 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.39 2gml n SER 89 Cb 0.35 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.65 2gml n SER 89 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2gml s ALA 90 N 0.00 0.24 -0.44 -1.46 0.00 -1.25 -4.75 121.76 114.10 2gml s ALA 90 Ca 0.00 0.18 -0.36 0.00 0.00 0.00 0.00 51.96 51.78 2gml s ALA 90 Cb 0.00 -0.27 -0.16 0.00 0.00 0.00 0.00 23.12 22.69 2gml s ALA 90 CO 0.00 -0.07 1.80 0.41 0.00 0.00 0.00 175.76 177.91 2gml n GLY 91 N 4.04 -0.14 3.49 0.00 0.00 -1.26 -4.93 105.19 106.39 2gml n GLY 91 Ca -0.26 0.93 -0.24 0.00 0.00 0.00 0.00 46.02 46.45 2gml n GLY 91 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2gml s VAL 92 N 5.13 2.60 -0.93 1.61 -7.23 -0.48 -4.70 120.40 116.41 2gml s VAL 92 Ca 1.00 -2.31 -0.26 0.00 -1.81 0.00 0.00 61.98 58.61 2gml s VAL 92 Cb -1.23 -2.36 -0.15 0.00 0.56 0.00 0.00 36.38 33.20 2gml s VAL 92 CO 0.54 -0.37 2.22 -2.84 -0.31 0.00 0.00 175.10 174.34 2gml s PRO 93 N -3.46 1.65 -0.01 4.82 0.02 -1.26 -2.52 135.00 134.24 2gml s PRO 93 Ca 0.29 -0.03 0.05 0.00 0.02 0.00 0.00 61.00 61.33 2gml s PRO 93 Cb -0.05 -4.92 -0.01 0.00 0.02 0.00 0.00 34.50 29.53 2gml s PRO 93 CO 0.15 -4.62 -0.16 0.96 -0.33 0.00 0.00 177.00 173.00 2gml s ILE 94 N 14.64 1.22 -0.67 2.83 -4.36 0.31 -4.89 121.20 130.28 2gml s ILE 94 Ca 0.84 -0.66 -0.15 0.00 -0.26 0.00 0.00 60.65 60.42 2gml s ILE 94 Cb -0.09 -1.02 0.02 0.00 1.25 0.00 0.00 42.46 42.63 2gml s ILE 94 CO 0.10 0.35 0.40 0.18 0.24 0.00 0.00 174.94 176.21 2gml n LEU 95 N 2.70 -0.36 -3.94 0.37 4.77 -1.26 0.14 117.00 119.41 2gml n LEU 95 Ca -0.14 -0.74 -0.32 0.00 -0.03 0.00 0.00 56.01 54.78 2gml n LEU 95 Cb 0.55 -0.96 -0.01 0.00 -2.33 0.00 0.00 43.42 40.66 2gml n LEU 95 CO 0.24 0.43 -0.01 0.61 -1.33 0.00 0.00 177.39 177.34 2gml n GLY 96 N -1.52 -0.47 3.61 -0.72 0.00 -1.26 -4.92 105.19 99.92 2gml n GLY 96 Ca -0.11 0.13 -0.01 0.00 0.00 0.00 0.00 46.02 46.03 2gml n GLY 96 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2gml s THR 97 N -3.17 -0.84 0.00 2.61 -1.32 0.37 -5.03 115.64 108.26 2gml s THR 97 Ca 0.64 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 61.12 2gml s THR 97 Cb -0.35 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.64 2gml s THR 97 CO 0.79 0.00 0.99 1.33 -2.21 0.00 0.00 174.62 175.52 2gml n VAL 98 N 5.28 0.99 -1.37 5.08 0.24 -1.23 -0.53 118.33 126.79 2gml n VAL 98 Ca -0.12 -0.08 0.00 0.00 -2.04 0.00 0.00 64.34 62.10 2gml n VAL 98 Cb 0.50 -1.01 0.00 0.00 -1.47 0.00 0.00 33.84 31.86 2gml n VAL 98 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 2gml n THR 99 N 0.78 -4.72 0.00 3.34 5.66 -1.05 -1.38 114.28 116.91 2gml n THR 99 Ca 0.00 2.07 0.00 0.00 -3.05 0.00 0.00 64.05 63.07 2gml n THR 99 Cb 0.42 -2.85 0.00 0.00 -1.55 0.00 0.00 70.33 66.35 2gml n THR 99 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2gml n LYS 100 N -0.90 1.22 -3.75 1.09 5.02 -1.26 -4.49 118.16 115.09 2gml n LYS 100 Ca 0.00 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.13 2gml n LYS 100 Cb 0.00 0.00 -0.16 0.00 -0.02 0.00 0.00 35.03 34.85 2gml n LYS 100 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2gml s LYS 101 N 0.00 -0.04 0.31 1.97 -0.14 -1.26 -4.14 119.74 116.45 2gml s LYS 101 Ca 0.00 0.24 0.05 0.00 -1.36 0.00 0.00 55.97 54.90 2gml s LYS 101 Cb 0.00 -0.29 -0.03 0.00 -1.68 0.00 0.00 37.83 35.84 2gml s LYS 101 CO 0.00 -0.20 0.29 0.00 -0.76 0.00 0.00 175.35 174.68 2gml s LYS 103 N -3.48 3.09 0.12 0.00 -0.14 -0.73 -4.83 119.74 113.78 2gml s LYS 103 Ca 0.39 -0.77 0.07 0.00 -1.36 0.00 0.00 55.97 54.30 2gml s LYS 103 Cb 0.03 -2.45 -0.04 0.00 -1.68 0.00 0.00 37.83 33.68 2gml s LYS 103 CO 0.25 0.27 -0.06 0.08 -0.76 0.00 0.00 175.35 175.13 2gml s VAL 104 N 0.17 3.58 -0.20 3.17 1.01 -1.26 -1.77 120.40 125.09 2gml s VAL 104 Ca -0.10 -1.28 -0.12 0.00 0.00 0.00 0.00 61.98 60.48 2gml s VAL 104 Cb -0.16 -2.72 0.06 0.00 0.00 0.00 0.00 36.38 33.57 2gml s VAL 104 CO 0.06 0.04 0.49 -0.75 0.00 0.00 0.00 175.10 174.94 2gml s LYS 105 N -2.45 0.49 0.04 2.72 2.20 -0.40 -4.99 119.74 117.35 2gml s LYS 105 Ca 0.24 0.88 -0.30 0.00 -0.36 0.00 0.00 55.97 56.43 2gml s LYS 105 Cb -0.11 0.06 -0.04 0.00 -1.51 0.00 0.00 37.83 36.23 2gml s LYS 105 CO 0.16 -0.14 1.00 0.21 -0.36 0.00 0.00 175.35 176.21 2gml s LYS 106 N 1.31 4.58 -0.19 4.03 2.20 -1.26 0.03 119.74 130.44 2gml s LYS 106 Ca -0.08 1.46 0.00 0.00 -0.36 0.00 0.00 55.97 56.99 2gml s LYS 106 Cb -0.07 -3.43 -0.12 0.00 -1.51 0.00 0.00 37.83 32.71 2gml s LYS 106 CO -0.13 0.00 -0.17 0.39 -0.36 0.00 0.00 175.35 175.08 2gml n GLU 107 N 3.59 0.47 -3.83 4.03 -0.58 0.21 -4.86 120.64 119.66 2gml n GLU 107 Ca 0.05 0.12 -0.07 0.00 -0.42 0.00 0.00 57.16 56.83 2gml n GLU 107 Cb 0.50 -1.36 -0.02 0.00 -0.57 0.00 0.00 31.44 29.99 2gml n GLU 107 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2gml s ALA 108 N -2.38 -1.21 0.29 0.62 0.00 -0.06 -4.95 121.76 114.08 2gml s ALA 108 Ca -0.26 -0.27 0.02 0.00 0.00 0.00 0.00 51.96 51.45 2gml s ALA 108 Cb 0.07 0.86 0.72 0.00 0.00 0.00 0.00 23.12 24.77 2gml s ALA 108 CO 0.43 -1.01 1.45 -2.30 0.00 0.00 0.00 175.76 174.33 2gml n PRO 109 N -0.45 -0.07 -0.17 0.00 -0.02 -1.26 -0.85 135.00 132.18 2gml n PRO 109 Ca -0.05 1.39 0.06 0.00 -2.02 0.00 0.00 63.50 62.88 2gml n PRO 109 Cb 0.60 -2.21 0.15 0.00 -0.02 0.00 0.00 33.50 32.01 2gml n PRO 109 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2gml n PHE 110 N -5.37 0.44 -4.60 6.00 3.01 -1.26 -1.69 117.46 113.99 2gml n PHE 110 Ca 0.22 -0.46 -0.23 0.00 1.01 0.00 0.00 57.45 57.99 2gml n PHE 110 Cb 0.73 -0.02 -0.16 0.00 -0.01 0.00 0.00 39.48 40.02 2gml n PHE 110 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 2gml s VAL 111 N -1.00 1.08 0.02 -4.37 1.01 -0.03 -0.64 120.40 116.48 2gml s VAL 111 Ca 0.23 -0.54 0.01 0.00 0.00 0.00 0.00 61.98 61.68 2gml s VAL 111 Cb 0.12 -0.93 -0.02 0.00 0.00 0.00 0.00 36.38 35.55 2gml s VAL 111 CO 0.16 0.32 -0.05 0.72 0.00 0.00 0.00 175.10 176.25 2gml s PHE 112 N 0.02 0.46 -0.19 5.22 -0.12 -0.06 0.64 117.98 123.95 2gml s PHE 112 Ca -0.01 -0.38 -0.10 0.00 -0.05 0.00 0.00 56.93 56.39 2gml s PHE 112 Cb -0.09 -0.29 -0.05 0.00 -0.63 0.00 0.00 43.02 41.97 2gml s PHE 112 CO 0.01 -0.09 0.13 0.50 -0.05 0.00 0.00 175.22 175.72 2gml s ARG 113 N -1.13 4.12 -0.09 1.99 3.52 0.10 0.21 118.95 127.68 2gml s ARG 113 Ca -0.08 -0.22 0.02 0.00 -0.13 0.00 0.00 55.73 55.32 2gml s ARG 113 Cb -0.08 -3.39 0.01 0.00 -1.56 0.00 0.00 34.95 29.94 2gml s ARG 113 CO -0.00 0.34 -0.13 -1.50 -0.81 0.00 0.00 175.30 173.20 2gml s ILE 114 N 0.24 1.29 -0.28 4.11 2.07 0.59 -1.27 121.20 127.96 2gml s ILE 114 Ca 0.08 -0.53 0.03 0.00 -1.41 0.00 0.00 60.65 58.82 2gml s ILE 114 Cb -0.11 -1.19 0.07 0.00 0.13 0.00 0.00 42.46 41.35 2gml s ILE 114 CO -0.01 0.40 -0.07 0.28 -1.91 0.00 0.00 174.94 173.63 2gml s THR 115 N 0.92 2.30 0.26 4.00 -1.32 -0.73 0.10 115.64 121.18 2gml s THR 115 Ca -0.09 -1.74 0.03 0.00 -1.21 0.00 0.00 61.69 58.68 2gml s THR 115 Cb -0.15 -2.41 -0.01 0.00 -1.51 0.00 0.00 72.50 68.41 2gml s THR 115 CO 0.00 -0.15 0.12 0.00 -2.21 0.00 0.00 174.62 172.38 2gml n LEU 116 N 4.42 0.00 -3.84 9.08 -0.00 -0.14 -1.78 117.00 124.75 2gml n LEU 116 Ca -0.11 -2.10 -0.29 0.00 -0.00 0.00 0.00 56.01 53.51 2gml n LEU 116 Cb 0.42 0.78 -0.13 0.00 -0.00 0.00 0.00 43.42 44.49 2gml n LEU 116 CO 0.22 -0.33 -0.15 -0.69 -0.00 0.00 0.00 177.39 176.44 2gml s VAL 117 N -2.64 2.31 0.86 1.47 1.01 -1.26 -0.44 120.40 121.70 2gml s VAL 117 Ca 0.16 -3.49 -0.13 0.00 0.00 0.00 0.00 61.98 58.53 2gml s VAL 117 Cb 0.01 -2.57 0.08 0.00 0.00 0.00 0.00 36.38 33.90 2gml s VAL 117 CO 0.12 -0.93 0.97 0.00 0.00 0.00 0.00 175.10 175.25 2gml n GLN 118 N 2.74 -0.08 -0.79 2.72 6.02 -1.26 -4.94 117.38 121.78 2gml n GLN 118 Ca 0.13 0.05 -0.04 0.00 -0.01 0.00 0.00 57.00 57.13 2gml n GLN 118 Cb 0.35 -2.25 -0.04 0.00 1.02 0.00 0.00 30.24 29.32 2gml n GLN 118 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2gml n GLY 119 N 0.77 0.62 3.56 1.08 0.00 -1.26 -4.72 105.19 105.24 2gml n GLY 119 Ca 0.11 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.99 2gml n GLY 119 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gml s LEU 120 N 0.00 -0.59 0.27 0.99 1.43 -1.26 -5.10 118.68 114.42 2gml s LEU 120 Ca 0.00 0.79 -0.14 0.00 -1.03 0.00 0.00 54.13 53.75 2gml s LEU 120 Cb 0.00 2.30 -0.08 0.00 0.03 0.00 0.00 46.19 48.44 2gml s LEU 120 CO 0.00 -0.44 0.66 0.20 0.23 0.00 0.00 176.35 177.01 2gml s ASN 121 N -0.75 6.76 0.00 2.29 0.01 -1.26 -3.52 114.94 118.47 2gml s ASN 121 Ca -0.05 1.17 0.00 0.00 -0.71 0.00 0.00 52.86 53.26 2gml s ASN 121 Cb -0.01 -2.33 0.00 0.00 0.41 0.00 0.00 41.25 39.32 2gml s ASN 121 CO 0.05 -0.12 0.00 0.54 -1.51 0.00 0.00 177.10 176.06 2gml n ARG 122 N -0.11 -1.16 -0.33 -0.60 5.12 -1.26 -4.76 116.66 113.56 2gml n ARG 122 Ca 0.01 0.26 0.25 0.00 -1.93 0.00 0.00 57.85 56.45 2gml n ARG 122 Cb 0.53 -4.48 0.47 0.00 -1.16 0.00 0.00 32.46 27.82 2gml n ARG 122 CO 0.00 0.00 0.00 0.37 -1.93 0.00 0.00 177.63 176.07 2gml h GLN 123 N 0.00 0.04 0.26 5.56 4.15 -2.00 0.16 115.11 123.28 2gml h GLN 123 Ca 0.00 -0.00 -0.34 0.00 0.77 0.00 0.00 58.65 59.08 2gml h GLN 123 Cb 0.52 -0.01 0.04 0.00 0.21 0.00 0.00 27.48 28.24 2gml h GLN 123 CO 0.00 0.03 -1.50 0.82 -1.93 0.00 0.00 178.83 176.25 2gml h ILE 124 N 0.04 1.27 -0.23 2.39 2.04 -1.88 -3.23 117.51 117.92 2gml h ILE 124 Ca 0.75 -2.70 -0.01 0.00 1.00 0.00 0.00 64.86 63.90 2gml h ILE 124 Cb 1.84 3.04 -0.01 0.00 -0.74 0.00 0.00 36.82 40.94 2gml h ILE 124 CO -0.80 0.81 0.09 0.03 0.00 0.00 0.00 178.15 178.29 2gml h ARG 125 N 0.15 0.31 -1.22 2.37 3.08 -1.16 -0.56 114.38 117.35 2gml h ARG 125 Ca -0.26 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.76 2gml h ARG 125 Cb 2.17 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 32.16 2gml h ARG 125 CO 0.27 0.26 0.00 0.54 -1.07 0.00 0.00 179.97 179.97 2gml n ARG 126 N -4.45 0.80 0.00 0.04 3.00 0.04 -2.30 116.66 113.79 2gml n ARG 126 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.84 2gml n ARG 126 Cb 0.12 -1.10 0.00 0.00 0.00 0.00 0.00 32.46 31.48 2gml n ARG 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2gml h GLU 129 N 0.00 0.79 -0.71 0.00 5.08 -1.32 0.19 114.58 118.61 2gml h GLU 129 Ca 0.00 -0.26 0.20 0.00 -1.00 0.00 0.00 59.36 58.31 2gml h GLU 129 Cb 0.00 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 2gml h GLU 129 CO 0.00 0.86 0.69 1.25 -1.00 0.00 0.00 179.01 180.81 2gml h HIS 130 N 0.63 0.00 -0.41 4.33 2.76 -1.52 0.68 115.15 121.63 2gml h HIS 130 Ca 0.12 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.29 2gml h HIS 130 Cb 0.51 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.47 2gml h HIS 130 CO 0.04 0.00 0.00 1.19 -1.30 0.00 0.00 177.93 177.86 2gml n PHE 131 N -3.73 0.54 -2.23 5.26 3.01 -0.91 -4.98 117.46 114.41 2gml n PHE 131 Ca 0.14 -0.49 -0.02 0.00 1.01 0.00 0.00 57.45 58.10 2gml n PHE 131 Cb 0.94 -0.02 0.01 0.00 -0.01 0.00 0.00 39.48 40.39 2gml n PHE 131 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2gml n GLY 132 N 0.72 0.49 2.68 1.37 0.00 0.24 -5.03 105.19 105.66 2gml n GLY 132 Ca 0.14 -0.47 -0.22 0.00 0.00 0.00 0.00 46.02 45.46 2gml n GLY 132 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2gml s TYR 133 N -3.03 0.23 -0.11 1.61 1.51 0.61 -4.88 117.35 113.29 2gml s TYR 133 Ca 0.01 0.04 -0.23 0.00 -1.01 0.00 0.00 57.07 55.88 2gml s TYR 133 Cb -0.01 -0.60 -0.03 0.00 -0.11 0.00 0.00 41.96 41.22 2gml s TYR 133 CO 0.06 -0.29 0.71 -1.83 -1.11 0.00 0.00 175.55 173.10 2gml s GLU 134 N 2.12 4.37 0.11 -0.62 1.03 -1.26 -2.89 118.70 121.56 2gml s GLU 134 Ca 0.04 0.86 -0.30 0.00 0.03 0.00 0.00 54.97 55.60 2gml s GLU 134 Cb -0.13 -3.50 -0.06 0.00 -0.80 0.00 0.00 34.13 29.64 2gml s GLU 134 CO -0.05 -0.07 1.11 0.08 -1.33 0.00 0.00 175.26 175.00 2gml s VAL 135 N 1.29 4.07 -0.11 1.83 1.01 -1.26 -2.67 120.40 124.56 2gml s VAL 135 Ca 0.36 1.64 0.16 0.00 0.00 0.00 0.00 61.98 64.13 2gml s VAL 135 Cb -0.17 -4.05 -0.23 0.00 0.00 0.00 0.00 36.38 31.93 2gml s VAL 135 CO 0.15 0.21 0.18 2.29 0.00 0.00 0.00 175.10 177.94 2gml n LYS 136 N 3.10 1.02 -3.67 2.72 2.85 0.34 -4.95 118.16 119.57 2gml n LYS 136 Ca 0.05 -0.07 -0.10 0.00 -1.05 0.00 0.00 58.31 57.15 2gml n LYS 136 Cb 0.47 -1.42 -0.10 0.00 -0.65 0.00 0.00 35.03 33.33 2gml n LYS 136 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 2gml s LYS 137 N -2.72 0.31 -0.18 -1.58 2.20 -1.04 -4.98 119.74 111.76 2gml s LYS 137 Ca -0.07 0.94 0.00 0.00 -0.36 0.00 0.00 55.97 56.48 2gml s LYS 137 Cb 0.07 0.20 0.01 0.00 -1.51 0.00 0.00 37.83 36.61 2gml s LYS 137 CO 0.70 -0.23 -0.17 -1.17 -0.36 0.00 0.00 175.35 174.11 2gml s LEU 138 N 2.31 2.30 -0.13 5.43 0.20 -1.26 -0.53 118.68 127.00 2gml s LEU 138 Ca -0.03 -0.58 -0.01 0.00 0.69 0.00 0.00 54.13 54.21 2gml s LEU 138 Cb -0.11 -1.53 0.03 0.00 -0.43 0.00 0.00 46.19 44.15 2gml s LEU 138 CO -0.12 0.02 -0.04 -0.70 -0.29 0.00 0.00 176.35 175.21 2gml s GLU 139 N 1.19 1.24 -0.42 1.98 2.12 -1.00 -1.46 118.70 122.36 2gml s GLU 139 Ca 0.02 -0.29 -0.26 0.00 0.36 0.00 0.00 54.97 54.81 2gml s GLU 139 Cb -0.14 -1.65 0.02 0.00 0.26 0.00 0.00 34.13 32.62 2gml s GLU 139 CO -0.08 -0.36 0.93 0.50 -0.54 0.00 0.00 175.26 175.70 2gml s ARG 140 N 1.75 3.69 0.06 4.30 3.52 0.55 -1.04 118.95 131.77 2gml s ARG 140 Ca 0.03 0.37 0.23 0.00 -0.13 0.00 0.00 55.73 56.23 2gml s ARG 140 Cb -0.14 -3.86 0.14 0.00 -1.56 0.00 0.00 34.95 29.53 2gml s ARG 140 CO -0.07 -1.09 1.11 0.25 -0.81 0.00 0.00 175.30 174.69 2gml n THR 141 N 6.21 0.20 -3.62 4.11 -2.24 0.24 -0.62 114.28 118.57 2gml n THR 141 Ca 0.07 -0.23 -0.12 0.00 -2.27 0.00 0.00 64.05 61.49 2gml n THR 141 Cb 0.48 0.14 -0.07 0.00 -2.10 0.00 0.00 70.33 68.79 2gml n THR 141 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2gml s ARG 142 N -3.18 0.73 0.00 -0.78 3.52 -1.11 -0.71 118.95 117.42 2gml s ARG 142 Ca 0.05 0.73 0.00 0.00 -0.13 0.00 0.00 55.73 56.38 2gml s ARG 142 Cb 0.14 0.35 0.00 0.00 -1.56 0.00 0.00 34.95 33.89 2gml s ARG 142 CO 0.78 -0.11 0.21 -0.89 -0.81 0.00 0.00 175.30 174.47 2gml n ILE 143 N 2.21 0.00 0.00 4.11 5.41 -1.26 0.02 119.36 129.86 2gml n ILE 143 Ca -0.14 -0.24 0.00 0.00 1.00 0.00 0.00 62.75 63.37 2gml n ILE 143 Cb 0.56 1.44 0.00 0.00 -0.71 0.00 0.00 39.64 40.93 2gml n ILE 143 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 2gml n ASN 145 N -0.07 0.00 -4.59 4.38 6.94 -1.26 -4.69 115.26 115.97 2gml n ASN 145 Ca 0.00 0.00 -0.34 0.00 -0.02 0.00 0.00 54.58 54.22 2gml n ASN 145 Cb 0.11 0.00 -0.11 0.00 -2.36 0.00 0.00 39.78 37.42 2gml n ASN 145 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 2gml s VAL 146 N -0.39 3.86 0.22 3.53 1.01 -1.26 -5.03 120.40 122.35 2gml s VAL 146 Ca 0.00 -0.41 0.02 0.00 0.00 0.00 0.00 61.98 61.59 2gml s VAL 146 Cb 0.00 -2.61 -0.05 0.00 0.00 0.00 0.00 36.38 33.72 2gml s VAL 146 CO 0.00 0.59 0.03 -0.94 0.00 0.00 0.00 175.10 174.77 2gml s SER 147 N -0.66 1.48 0.58 3.32 1.04 -1.26 -4.38 113.70 113.82 2gml s SER 147 Ca 0.10 -1.26 0.35 0.00 0.48 0.00 0.00 55.95 55.63 2gml s SER 147 Cb -0.12 0.08 1.77 0.00 0.10 0.00 0.00 66.02 67.86 2gml s SER 147 CO 0.02 -0.59 2.15 -0.07 0.98 0.00 0.00 173.24 175.73 2gml h LEU 148 N 2.51 0.00 -6.49 2.42 3.38 -1.22 -3.45 115.31 112.44 2gml h LEU 148 Ca -0.38 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.01 2gml h LEU 148 Cb 1.22 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.93 2gml h LEU 148 CO 0.63 0.04 1.14 -0.24 0.09 0.00 0.00 178.44 180.10 2gml n SER 149 N -3.28 0.53 0.00 -0.43 2.88 -1.26 -0.19 113.62 111.88 2gml n SER 149 Ca -0.01 0.47 0.00 0.00 -1.33 0.00 0.00 58.87 58.00 2gml n SER 149 Cb 0.20 -0.73 0.00 0.00 -0.75 0.00 0.00 64.21 62.93 2gml n SER 149 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2gml n GLY 150 N 5.93 3.23 3.47 0.46 0.00 -1.26 -5.04 105.19 111.98 2gml n GLY 150 Ca 0.46 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 46.05 2gml n GLY 150 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2gml s ILE 151 N -2.97 4.88 0.96 -0.61 1.01 0.74 -5.06 121.20 120.15 2gml s ILE 151 Ca 0.00 -0.28 -0.11 0.00 0.00 0.00 0.00 60.65 60.26 2gml s ILE 151 Cb 0.00 -4.24 0.17 0.00 0.01 0.00 0.00 42.46 38.40 2gml s ILE 151 CO 0.00 -0.70 1.11 -2.84 0.00 0.00 0.00 174.94 172.50 2gml s PRO 152 N 2.65 0.70 0.46 2.79 0.02 -1.26 -4.85 135.00 135.52 2gml s PRO 152 Ca 0.17 1.26 -0.24 0.00 0.02 0.00 0.00 61.00 62.21 2gml s PRO 152 Cb -0.17 -1.71 -0.08 0.00 0.02 0.00 0.00 34.50 32.55 2gml s PRO 152 CO 0.14 -2.76 1.26 1.28 -0.33 0.00 0.00 177.00 176.59 2gml n LEU 153 N -4.29 4.26 0.00 -5.54 4.77 -1.26 -2.30 117.00 112.63 2gml n LEU 153 Ca 0.09 1.06 0.00 0.00 -0.03 0.00 0.00 56.01 57.12 2gml n LEU 153 Cb 0.53 -1.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.12 2gml n LEU 153 CO 0.52 -0.75 0.00 0.61 -1.33 0.00 0.00 177.39 176.44 2gml n GLY 154 N 0.85 0.83 3.80 -0.72 0.00 0.04 -4.99 105.19 105.00 2gml n GLY 154 Ca 0.08 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.87 2gml n GLY 154 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2gml s GLU 155 N -0.33 2.40 0.27 1.61 2.02 -0.97 -4.90 118.70 118.80 2gml s GLU 155 Ca 0.00 -1.65 -0.10 0.00 0.02 0.00 0.00 54.97 53.23 2gml s GLU 155 Cb 0.00 -2.20 -0.00 0.00 0.10 0.00 0.00 34.13 32.03 2gml s GLU 155 CO 0.00 -0.12 0.48 1.67 0.02 0.00 0.00 175.26 177.31 2gml s TRP 156 N -2.51 0.53 0.18 1.61 1.48 -1.26 -1.52 118.94 117.44 2gml s TRP 156 Ca 0.44 -0.88 -0.23 0.00 -1.06 0.00 0.00 56.10 54.37 2gml s TRP 156 Cb -0.00 0.14 0.06 0.00 -1.16 0.00 0.00 33.47 32.51 2gml s TRP 156 CO 0.25 -1.05 0.64 -0.98 -4.06 0.00 0.00 176.95 171.76 2gml s ARG 157 N -3.71 1.36 0.73 3.25 1.70 -1.10 -5.00 118.95 116.19 2gml s ARG 157 Ca 0.24 -0.57 -0.11 0.00 -0.47 0.00 0.00 55.73 54.83 2gml s ARG 157 Cb -0.01 0.58 0.03 0.00 -0.57 0.00 0.00 34.95 34.99 2gml s ARG 157 CO 0.12 -0.60 1.07 -0.51 -1.08 0.00 0.00 175.30 174.30 2gml s ASP 158 N -2.77 5.01 0.27 -2.89 1.01 -1.26 -1.76 116.67 114.28 2gml s ASP 158 Ca 0.03 1.61 -0.25 0.00 0.71 0.00 0.00 52.55 54.65 2gml s ASP 158 Cb -0.02 -2.42 -0.09 0.00 1.01 0.00 0.00 42.92 41.39 2gml s ASP 158 CO -0.09 -1.68 0.88 -0.76 0.21 0.00 0.00 175.17 173.73 2gml s LEU 159 N -5.68 4.43 0.71 1.23 1.43 -1.05 -4.81 118.68 114.94 2gml s LEU 159 Ca 0.59 1.75 -0.11 0.00 -1.03 0.00 0.00 54.13 55.33 2gml s LEU 159 Cb -0.15 -3.76 0.02 0.00 0.03 0.00 0.00 46.19 42.33 2gml s LEU 159 CO 0.55 0.03 1.06 0.42 0.23 0.00 0.00 176.35 178.65 2gml s THR 160 N -1.45 3.91 0.52 5.49 -4.23 -1.26 -4.80 115.64 113.82 2gml s THR 160 Ca 0.45 0.62 0.17 0.00 -1.18 0.00 0.00 61.69 61.75 2gml s THR 160 Cb -0.20 -3.34 0.29 0.00 1.34 0.00 0.00 72.50 70.58 2gml s THR 160 CO 0.25 -0.81 2.13 0.44 -0.54 0.00 0.00 174.62 176.09 2gml h ASP 161 N -0.78 0.00 -0.15 3.99 3.32 -1.99 -1.08 116.42 119.74 2gml h ASP 161 Ca -0.44 -0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.61 2gml h ASP 161 Cb 1.22 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.76 2gml h ASP 161 CO 0.57 0.00 0.09 0.44 -1.72 0.00 0.00 179.24 178.61 2gml h ASP 162 N 0.00 0.18 -0.36 6.45 5.19 -2.00 -0.86 116.42 125.03 2gml h ASP 162 Ca 0.04 -0.05 -0.01 0.00 -0.62 0.00 0.00 57.03 56.38 2gml h ASP 162 Cb 0.14 -0.04 -0.02 0.00 0.18 0.00 0.00 39.33 39.59 2gml h ASP 162 CO -0.00 0.18 0.18 -0.33 -3.12 0.00 0.00 179.24 176.14 2gml h GLU 163 N 0.16 0.52 -0.39 3.56 5.08 -1.60 -1.46 114.58 120.46 2gml h GLU 163 Ca 0.05 -0.07 0.06 0.00 -1.00 0.00 0.00 59.36 58.40 2gml h GLU 163 Cb 0.04 -0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.14 2gml h GLU 163 CO -0.01 0.46 0.06 -0.07 -1.00 0.00 0.00 179.01 178.45 2gml h LEU 164 N 0.44 -0.04 -0.14 1.33 3.38 -1.08 0.40 115.31 119.61 2gml h LEU 164 Ca 0.12 0.07 0.03 0.00 0.09 0.00 0.00 57.88 58.19 2gml h LEU 164 Cb 0.11 0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 2gml h LEU 164 CO -0.02 0.02 -0.03 0.40 0.09 0.00 0.00 178.44 178.90 2gml h ILE 165 N 0.17 0.86 -0.45 1.22 2.04 -0.92 0.19 117.51 120.62 2gml h ILE 165 Ca 0.19 -0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.01 2gml h ILE 165 Cb 0.24 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 2gml h ILE 165 CO -0.27 0.00 0.17 0.44 0.00 0.00 0.00 178.15 178.49 2gml h ASP 166 N 0.01 0.64 0.28 1.72 5.19 -0.66 -2.51 116.42 121.09 2gml h ASP 166 Ca 0.07 -0.18 -0.01 0.00 -0.62 0.00 0.00 57.03 56.28 2gml h ASP 166 Cb 0.10 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 39.45 2gml h ASP 166 CO -0.14 0.65 -0.14 0.25 -3.12 0.00 0.00 179.24 176.74 2gml h LEU 167 N 0.59 -0.32 -2.58 1.55 5.85 0.04 -2.74 115.31 117.70 2gml h LEU 167 Ca 0.15 -0.11 0.01 0.00 0.84 0.00 0.00 57.88 58.77 2gml h LEU 167 Cb 0.22 0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.33 2gml h LEU 167 CO -0.01 -0.08 0.08 -0.26 -0.34 0.00 0.00 178.44 177.82 2gml h PHE 168 N -0.56 0.00 0.00 1.25 0.05 -0.64 0.13 116.94 117.17 2gml h PHE 168 Ca -0.04 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.75 2gml h PHE 168 Cb 0.41 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.36 2gml h PHE 168 CO -0.01 0.00 0.00 1.63 -0.18 0.00 0.00 178.31 179.75 2gml n LYS 169 N -3.43 0.09 0.00 1.51 5.02 -0.95 -2.58 118.16 117.83 2gml n LYS 169 Ca -0.02 0.23 0.11 0.00 -2.02 0.00 0.00 58.31 56.61 2gml n LYS 169 Cb 0.16 -1.64 -0.05 0.00 -0.02 0.00 0.00 35.03 33.48 2gml n LYS 169 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2gml n LEU 170 N -1.81 0.72 -4.67 -0.35 4.77 0.44 -4.84 117.00 111.27 2gml n LEU 170 Ca 0.04 -0.26 -0.43 0.00 -0.03 0.00 0.00 56.01 55.33 2gml n LEU 170 Cb 0.27 -0.05 -0.02 0.00 -2.33 0.00 0.00 43.42 41.28 2gml n LEU 170 CO 0.21 0.15 0.94 -0.63 -1.33 0.00 0.00 177.39 176.73 2gml s ILE 171 N -3.11 4.53 -1.13 -0.08 1.01 -1.06 -4.85 121.20 116.50 2gml s ILE 171 Ca 0.05 1.83 -0.05 0.00 0.00 0.00 0.00 60.65 62.48 2gml s ILE 171 Cb 0.16 -4.18 0.27 0.00 0.01 0.00 0.00 42.46 38.72 2gml s ILE 171 CO 0.84 -0.10 1.57 1.21 0.00 0.00 0.00 174.94 178.45 2gml n GLU 172 N 5.94 4.25 0.10 2.79 4.07 -1.26 -4.59 120.64 131.94 2gml n GLU 172 Ca 0.12 -4.31 -0.03 0.00 -0.06 0.00 0.00 57.16 52.88 2gml n GLU 172 Cb 0.46 -2.61 -0.02 0.00 -0.06 0.00 0.00 31.44 29.21 2gml n GLU 172 CO 0.00 0.00 0.00 -2.95 -0.06 0.00 0.00 177.13 174.12 2gml h ASN 173 N 5.55 0.00 -3.06 4.31 -0.00 -1.93 -3.42 115.58 117.03 2gml h ASN 173 Ca 0.25 0.00 -0.40 0.00 -0.00 0.00 0.00 56.30 56.14 2gml h ASN 173 Cb 0.63 0.00 -0.39 0.00 -0.00 0.00 0.00 38.32 38.55 2gml h ASN 173 CO 1.39 0.77 -0.72 -0.94 -0.00 0.00 0.00 177.43 177.94 2gml s SER 174 N -6.63 1.75 0.00 6.14 1.04 -1.26 -5.31 113.70 109.43 2gml s SER 174 Ca 0.02 -0.29 0.06 0.00 0.48 0.00 0.00 55.95 56.22 2gml s SER 174 Cb 0.09 -0.09 0.05 0.00 0.10 0.00 0.00 66.02 66.17 2gml s SER 174 CO 0.78 -0.31 0.68 -0.24 0.98 0.00 0.00 173.24 175.13