#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x0o s ALA 2 N 0.00 3.22 0.00 4.61 0.00 -1.26 -4.87 121.76 123.46 1x0o s ALA 2 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 51.96 52.05 1x0o s ALA 2 Cb 0.00 -2.91 0.00 0.00 0.00 0.00 0.00 23.12 20.21 1x0o s ALA 2 CO 0.00 0.09 0.00 -0.12 0.00 0.00 0.00 175.76 175.73 1x0o n MET 3 N -0.89 0.00 -3.42 0.00 1.56 -1.26 -4.90 117.12 108.22 1x0o n MET 3 Ca 0.05 0.00 -0.44 0.00 -0.27 0.00 0.00 57.70 57.04 1x0o n MET 3 Cb 0.54 0.00 -0.06 0.00 2.15 0.00 0.00 33.22 35.85 1x0o n MET 3 CO 0.00 0.00 0.00 0.34 -0.73 0.00 0.00 175.97 175.58 1x0o s ASP 4 N 0.09 6.03 -0.43 6.12 2.15 -1.26 -4.92 116.67 124.45 1x0o s ASP 4 Ca 0.00 -1.96 0.08 0.00 0.43 0.00 0.00 52.55 51.10 1x0o s ASP 4 Cb 0.00 -2.12 0.26 0.00 -0.30 0.00 0.00 42.92 40.76 1x0o s ASP 4 CO 0.00 -0.75 0.72 -0.46 -0.17 0.00 0.00 175.17 174.51 1x0o n ASN 5 N 4.94 -1.03 -2.87 -0.34 6.94 -1.26 -5.13 115.26 116.52 1x0o n ASN 5 Ca -0.08 -3.03 -0.06 0.00 -0.02 0.00 0.00 54.58 51.39 1x0o n ASN 5 Cb 0.41 0.43 0.02 0.00 -2.36 0.00 0.00 39.78 38.28 1x0o n ASN 5 CO 0.00 0.00 0.00 1.33 -1.03 0.00 0.00 177.26 177.56 1x0o n VAL 6 N 1.28 0.00 -3.33 3.53 0.24 -1.26 -4.71 118.33 114.07 1x0o n VAL 6 Ca 0.16 -0.57 -0.17 0.00 -2.04 0.00 0.00 64.34 61.73 1x0o n VAL 6 Cb 0.59 -0.92 0.08 0.00 -1.47 0.00 0.00 33.84 32.12 1x0o n VAL 6 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1x0o s GLN 8 N -5.49 1.80 0.86 0.00 -1.52 -1.26 -5.12 119.66 108.94 1x0o s GLN 8 Ca 0.15 -1.16 -0.11 0.00 -1.95 0.00 0.00 55.36 52.28 1x0o s GLN 8 Cb -0.07 -2.11 0.12 0.00 -0.22 0.00 0.00 33.01 30.73 1x0o s GLN 8 CO 0.65 0.49 1.17 -2.14 -0.25 0.00 0.00 175.29 175.20 1x0o s PRO 9 N -2.05 1.31 -0.03 2.91 0.02 -1.26 -4.81 135.00 131.08 1x0o s PRO 9 Ca 0.17 1.63 0.01 0.00 0.02 0.00 0.00 61.00 62.83 1x0o s PRO 9 Cb -0.11 -1.75 0.08 0.00 0.02 0.00 0.00 34.50 32.74 1x0o s PRO 9 CO 0.09 -2.43 0.80 2.41 -0.33 0.00 0.00 177.00 177.54 1x0o n THR 10 N -3.82 0.64 -4.65 0.99 -1.04 -1.26 -4.36 114.28 100.77 1x0o n THR 10 Ca 0.12 -0.17 -0.24 0.00 -2.04 0.00 0.00 64.05 61.72 1x0o n THR 10 Cb 0.51 -0.64 -0.16 0.00 -1.82 0.00 0.00 70.33 68.22 1x0o n THR 10 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1x0o s GLU 11 N -0.89 1.59 -0.00 -2.82 -6.30 -1.26 -2.25 118.70 106.76 1x0o s GLU 11 Ca 0.06 -0.48 0.00 0.00 -2.50 0.00 0.00 54.97 52.06 1x0o s GLU 11 Cb 0.05 -1.37 0.00 0.00 0.00 0.00 0.00 34.13 32.81 1x0o s GLU 11 CO 0.02 0.14 -0.01 -0.59 0.02 0.00 0.00 175.26 174.83 1x0o s PHE 12 N 0.30 0.13 0.02 5.30 -0.71 -0.38 -4.85 117.98 117.77 1x0o s PHE 12 Ca -0.08 -0.02 -0.07 0.00 -1.04 0.00 0.00 56.93 55.72 1x0o s PHE 12 Cb -0.12 -0.10 -0.05 0.00 -1.21 0.00 0.00 43.02 41.54 1x0o s PHE 12 CO 0.02 -0.01 0.29 -1.50 -1.34 0.00 0.00 175.22 172.68 1x0o s ILE 13 N 0.06 5.27 -0.05 -4.49 2.07 -1.26 -1.16 121.20 121.64 1x0o s ILE 13 Ca -0.00 0.24 -0.07 0.00 -1.41 0.00 0.00 60.65 59.40 1x0o s ILE 13 Cb -0.02 -3.58 0.01 0.00 0.13 0.00 0.00 42.46 39.01 1x0o s ILE 13 CO -0.00 0.37 0.18 -0.55 -1.91 0.00 0.00 174.94 173.02 1x0o s SER 14 N -1.67 -0.13 -0.15 4.50 0.15 -0.04 -1.85 113.70 114.51 1x0o s SER 14 Ca 0.28 0.19 -0.04 0.00 0.70 0.00 0.00 55.95 57.08 1x0o s SER 14 Cb -0.13 0.33 -0.03 0.00 -1.71 0.00 0.00 66.02 64.47 1x0o s SER 14 CO 0.16 -0.17 -0.02 -0.13 1.20 0.00 0.00 173.24 174.28 1x0o s ARG 15 N -0.38 3.63 0.06 5.44 0.52 -0.04 -0.16 118.95 128.01 1x0o s ARG 15 Ca -0.05 -0.48 0.00 0.00 -0.52 0.00 0.00 55.73 54.68 1x0o s ARG 15 Cb -0.03 -2.94 -0.04 0.00 0.52 0.00 0.00 34.95 32.47 1x0o s ARG 15 CO 0.01 0.30 -0.04 -3.38 0.02 0.00 0.00 175.30 172.21 1x0o s HIS 16 N 0.21 0.59 0.53 -0.53 -3.43 0.20 -1.55 115.29 111.31 1x0o s HIS 16 Ca -0.01 -0.91 -0.21 0.00 -0.80 0.00 0.00 55.06 53.13 1x0o s HIS 16 Cb -0.14 -0.40 -0.06 0.00 -1.43 0.00 0.00 32.58 30.56 1x0o s HIS 16 CO 0.02 -0.27 1.20 1.21 -2.00 0.00 0.00 174.74 174.91 1x0o s ASN 17 N -2.65 5.64 0.59 7.38 3.84 0.79 -0.33 114.94 130.19 1x0o s ASN 17 Ca 0.04 2.38 0.29 0.00 0.21 0.00 0.00 52.86 55.78 1x0o s ASN 17 Cb 0.03 -2.60 1.46 0.00 -0.55 0.00 0.00 41.25 39.59 1x0o s ASN 17 CO -0.07 -1.28 1.88 0.16 -2.79 0.00 0.00 177.10 175.00 1x0o h ILE 18 N 1.38 0.37 0.00 -5.21 3.07 -1.88 0.60 117.51 115.83 1x0o h ILE 18 Ca -0.50 0.00 0.00 0.00 1.55 0.00 0.00 64.86 65.91 1x0o h ILE 18 Cb 1.27 0.59 0.00 0.00 -0.27 0.00 0.00 36.82 38.42 1x0o h ILE 18 CO 0.58 0.00 0.00 -0.62 -1.05 0.00 0.00 178.15 177.06 1x0o n GLU 19 N -3.74 0.18 0.00 0.16 1.02 -1.26 -4.86 120.64 112.13 1x0o n GLU 19 Ca 0.10 0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.26 1x0o n GLU 19 Cb 0.72 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.64 1x0o n GLU 19 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1x0o n GLY 20 N 1.22 1.21 3.60 0.62 0.00 0.21 -4.90 105.19 107.14 1x0o n GLY 20 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1x0o n GLY 20 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x0o s ILE 21 N -2.00 5.00 0.20 -0.61 -1.09 -1.02 -0.40 121.20 121.28 1x0o s ILE 21 Ca 0.00 0.83 -0.32 0.00 -2.23 0.00 0.00 60.65 58.93 1x0o s ILE 21 Cb 0.00 -3.92 -0.11 0.00 -1.58 0.00 0.00 42.46 36.85 1x0o s ILE 21 CO 0.00 -0.05 1.64 -0.36 -1.23 0.00 0.00 174.94 174.94 1x0o s PHE 22 N 2.46 2.96 -0.08 3.97 0.08 -0.56 -0.15 117.98 126.66 1x0o s PHE 22 Ca 0.23 0.52 0.00 0.00 0.12 0.00 0.00 56.93 57.80 1x0o s PHE 22 Cb -0.15 -4.04 -0.05 0.00 -0.57 0.00 0.00 43.02 38.21 1x0o s PHE 22 CO 0.11 -3.83 -0.07 2.41 -0.10 0.00 0.00 175.22 173.73 1x0o n THR 23 N 3.77 0.44 -3.74 0.64 -1.04 -0.64 -2.54 114.28 111.18 1x0o n THR 23 Ca 0.14 -0.17 -0.12 0.00 -2.04 0.00 0.00 64.05 61.86 1x0o n THR 23 Cb 0.37 -0.80 -0.12 0.00 -1.82 0.00 0.00 70.33 67.95 1x0o n THR 23 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 1x0o s PHE 24 N -2.15 -0.36 -0.03 -1.42 5.36 -0.59 -4.97 117.98 113.81 1x0o s PHE 24 Ca -0.10 0.85 0.04 0.00 -0.96 0.00 0.00 56.93 56.75 1x0o s PHE 24 Cb 0.03 0.10 -0.00 0.00 -0.34 0.00 0.00 43.02 42.81 1x0o s PHE 24 CO 0.18 -0.22 -0.13 0.08 -1.46 0.00 0.00 175.22 173.67 1x0o s VAL 25 N 0.86 1.08 0.46 3.12 1.01 -1.26 -0.86 120.40 124.81 1x0o s VAL 25 Ca -0.06 -0.54 -0.21 0.00 0.00 0.00 0.00 61.98 61.17 1x0o s VAL 25 Cb -0.07 -0.93 -0.09 0.00 0.00 0.00 0.00 36.38 35.29 1x0o s VAL 25 CO -0.06 0.32 1.02 -0.62 0.00 0.00 0.00 175.10 175.76 1x0o s ASP 26 N -0.00 6.52 0.52 3.32 -1.08 -0.77 -4.80 116.67 120.39 1x0o s ASP 26 Ca -0.01 1.91 0.32 0.00 -0.52 0.00 0.00 52.55 54.24 1x0o s ASP 26 Cb -0.09 -2.56 1.72 0.00 -1.46 0.00 0.00 42.92 40.53 1x0o s ASP 26 CO 0.01 -0.65 1.96 0.45 0.52 0.00 0.00 175.17 177.45 1x0o h HIS 27 N 1.79 0.00 0.00 -5.34 3.86 -1.92 -0.76 115.15 112.78 1x0o h HIS 27 Ca -0.49 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.72 1x0o h HIS 27 Cb 1.21 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.68 1x0o h HIS 27 CO 0.58 0.00 0.00 0.54 0.86 0.00 0.00 177.93 179.91 1x0o n ARG 28 N -2.68 0.15 -0.28 2.45 1.74 -1.26 -3.01 116.66 113.77 1x0o n ARG 28 Ca -0.02 0.61 0.08 0.00 -0.77 0.00 0.00 57.85 57.75 1x0o n ARG 28 Cb 0.14 -1.95 0.23 0.00 -1.02 0.00 0.00 32.46 29.86 1x0o n ARG 28 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1x0o h VAL 30 N 0.43 0.95 0.02 0.00 -1.51 -1.16 0.16 116.25 115.14 1x0o h VAL 30 Ca 0.47 -0.84 -0.00 0.00 -1.23 0.00 0.00 66.70 65.09 1x0o h VAL 30 Cb 0.78 1.48 0.00 0.00 -2.13 0.00 0.00 31.29 31.42 1x0o h VAL 30 CO -0.46 0.22 -0.01 0.00 -1.23 0.00 0.00 177.57 176.09 1x0o h ALA 31 N 1.77 -0.03 0.18 5.19 0.00 -1.28 -1.49 119.26 123.59 1x0o h ALA 31 Ca -0.00 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 1x0o h ALA 31 Cb 0.47 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1x0o h ALA 31 CO 0.03 -0.08 -0.09 1.15 0.00 0.00 0.00 179.25 180.27 1x0o h THR 32 N -0.92 0.90 0.00 0.00 2.02 -1.25 -3.38 112.91 110.28 1x0o h THR 32 Ca -0.00 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.82 1x0o h THR 32 Cb 0.72 1.12 0.00 0.00 -1.74 0.00 0.00 68.15 68.25 1x0o h THR 32 CO 0.01 0.08 -0.00 1.33 0.37 0.00 0.00 175.52 177.31 1x0o n VAL 33 N -5.12 0.62 0.00 3.16 0.24 0.02 -4.97 118.33 112.29 1x0o n VAL 33 Ca -0.09 -0.62 0.00 0.00 -2.04 0.00 0.00 64.34 61.59 1x0o n VAL 33 Cb 0.18 0.69 0.00 0.00 -1.47 0.00 0.00 33.84 33.23 1x0o n VAL 33 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1x0o n GLY 34 N -0.31 2.30 3.77 7.63 0.00 -0.56 -1.14 105.19 116.88 1x0o n GLY 34 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1x0o n GLY 34 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1x0o s TYR 35 N -0.09 3.22 0.30 1.61 2.02 -1.25 -4.57 117.35 118.58 1x0o s TYR 35 Ca 0.00 1.57 -0.20 0.00 -0.37 0.00 0.00 57.07 58.08 1x0o s TYR 35 Cb 0.00 -3.40 -0.09 0.00 -0.40 0.00 0.00 41.96 38.07 1x0o s TYR 35 CO 0.00 -1.17 0.80 -0.65 -1.57 0.00 0.00 175.55 172.96 1x0o s GLN 36 N -1.98 4.25 0.31 -0.62 -1.52 -1.26 -1.47 119.66 117.36 1x0o s GLN 36 Ca 0.52 0.94 0.06 0.00 -1.95 0.00 0.00 55.36 54.93 1x0o s GLN 36 Cb -0.32 -2.65 0.84 0.00 -0.22 0.00 0.00 33.01 30.65 1x0o s GLN 36 CO 0.41 0.25 1.66 -1.35 -0.25 0.00 0.00 175.29 176.02 1x0o h PRO 37 N 2.87 0.27 -0.93 2.91 0.11 -1.87 0.94 132.00 136.31 1x0o h PRO 37 Ca -0.48 -0.02 0.08 0.00 0.11 0.00 0.00 66.00 65.69 1x0o h PRO 37 Cb 1.19 -0.06 -0.07 0.00 0.11 0.00 0.00 31.00 32.16 1x0o h PRO 37 CO 0.65 0.18 0.58 1.96 -0.21 0.00 0.00 178.00 181.16 1x0o h GLN 38 N 0.28 0.99 0.00 1.05 1.08 -1.93 -2.55 115.11 114.04 1x0o h GLN 38 Ca 0.61 -0.06 -0.02 0.00 -1.45 0.00 0.00 58.65 57.73 1x0o h GLN 38 Cb 1.28 -0.22 -0.00 0.00 -0.05 0.00 0.00 27.48 28.49 1x0o h GLN 38 CO -0.62 0.66 -0.11 0.93 -0.95 0.00 0.00 178.83 178.74 1x0o h GLU 39 N 1.02 0.00 0.02 1.46 4.39 -1.18 -2.24 114.58 118.05 1x0o h GLU 39 Ca 0.42 0.00 -0.29 0.00 0.34 0.00 0.00 59.36 59.83 1x0o h GLU 39 Cb 0.26 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.86 1x0o h GLU 39 CO -0.20 0.11 -1.67 -0.07 -1.16 0.00 0.00 179.01 176.01 1x0o h LEU 40 N 0.00 0.05 -9.05 1.33 3.38 -1.51 -3.45 115.31 106.07 1x0o h LEU 40 Ca -0.00 -0.11 -0.57 0.00 0.09 0.00 0.00 57.88 57.28 1x0o h LEU 40 Cb 0.23 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 1x0o h LEU 40 CO 0.01 1.10 1.39 -0.76 0.09 0.00 0.00 178.44 180.27 1x0o s LEU 41 N -6.26 3.69 0.00 1.67 1.43 -0.84 -1.05 118.68 117.31 1x0o s LEU 41 Ca -0.06 1.96 0.00 0.00 -1.03 0.00 0.00 54.13 55.00 1x0o s LEU 41 Cb 0.08 -3.52 0.00 0.00 0.03 0.00 0.00 46.19 42.78 1x0o s LEU 41 CO 0.82 -1.69 0.00 0.61 0.23 0.00 0.00 176.35 176.32 1x0o n GLY 42 N 5.38 0.67 3.59 -3.19 0.00 -1.05 -5.01 105.19 105.59 1x0o n GLY 42 Ca 0.26 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.03 1x0o n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x0o s LYS 43 N -0.55 1.95 0.18 1.61 1.02 -0.22 -4.91 119.74 118.81 1x0o s LYS 43 Ca 0.00 -1.86 -0.18 0.00 0.02 0.00 0.00 55.97 53.95 1x0o s LYS 43 Cb 0.00 -1.81 -0.08 0.00 -0.52 0.00 0.00 37.83 35.43 1x0o s LYS 43 CO 0.00 0.12 0.65 1.21 -0.92 0.00 0.00 175.35 176.41 1x0o s ASN 44 N -3.67 6.99 0.30 2.83 3.84 -1.26 -1.49 114.94 122.47 1x0o s ASN 44 Ca 0.34 1.29 0.00 0.00 0.21 0.00 0.00 52.86 54.70 1x0o s ASN 44 Cb 0.02 -2.37 0.52 0.00 -0.55 0.00 0.00 41.25 38.87 1x0o s ASN 44 CO 0.18 0.09 1.92 -0.29 -2.79 0.00 0.00 177.10 176.20 1x0o h ILE 45 N 2.86 1.08 -0.01 -5.21 2.10 -1.08 -2.03 117.51 115.22 1x0o h ILE 45 Ca -0.48 -0.36 -0.00 0.00 1.08 0.00 0.00 64.86 65.10 1x0o h ILE 45 Cb 1.20 -0.05 -0.00 0.00 -1.09 0.00 0.00 36.82 36.87 1x0o h ILE 45 CO 0.65 0.19 0.00 0.58 -1.08 0.00 0.00 178.15 178.49 1x0o h VAL 46 N 1.04 1.01 0.00 2.19 2.07 -1.93 0.12 116.25 120.74 1x0o h VAL 46 Ca 0.38 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.88 1x0o h VAL 46 Cb 0.17 1.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 1x0o h VAL 46 CO -0.14 0.01 0.00 -0.33 0.02 0.00 0.00 177.57 177.13 1x0o h GLU 47 N 0.01 0.00 -0.13 1.57 5.08 -1.76 -1.21 114.58 118.14 1x0o h GLU 47 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1x0o h GLU 47 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1x0o h GLU 47 CO -0.00 0.00 0.00 1.19 -1.00 0.00 0.00 179.01 179.20 1x0o n PHE 48 N -3.02 0.31 -3.93 4.33 3.72 0.37 -5.01 117.46 114.23 1x0o n PHE 48 Ca -0.01 -0.72 -0.32 0.00 -0.05 0.00 0.00 57.45 56.35 1x0o n PHE 48 Cb 0.18 -0.13 -0.05 0.00 -0.94 0.00 0.00 39.48 38.55 1x0o n PHE 48 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1x0o n HIS 50 N 0.63 1.70 -0.23 0.00 -0.00 0.65 -4.75 115.22 113.21 1x0o n HIS 50 Ca -0.08 0.56 0.20 0.00 0.46 0.00 0.00 57.72 58.86 1x0o n HIS 50 Cb 0.52 -2.38 0.53 0.00 -0.12 0.00 0.00 29.99 28.54 1x0o n HIS 50 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1x0o h PRO 51 N 5.20 0.35 -0.00 1.57 0.11 -1.92 0.54 132.00 137.85 1x0o h PRO 51 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1x0o h PRO 51 Cb 1.32 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1x0o h PRO 51 CO 0.82 0.23 -0.15 0.39 -0.21 0.00 0.00 178.00 179.09 1x0o n GLU 52 N -4.49 0.38 0.00 1.05 -0.58 -1.26 -3.51 120.64 112.22 1x0o n GLU 52 Ca 0.19 -0.12 0.04 0.00 -0.42 0.00 0.00 57.16 56.86 1x0o n GLU 52 Cb 0.72 -1.50 -0.04 0.00 -0.57 0.00 0.00 31.44 30.05 1x0o n GLU 52 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1x0o n ASP 53 N -1.21 0.59 0.03 1.62 9.92 0.17 -4.53 116.55 123.15 1x0o n ASP 53 Ca 0.11 -0.79 -0.02 0.00 -0.53 0.00 0.00 54.79 53.56 1x0o n ASP 53 Cb 0.30 0.89 0.25 0.00 -0.64 0.00 0.00 41.12 41.92 1x0o n ASP 53 CO 0.00 0.00 0.00 1.56 0.13 0.00 0.00 177.20 178.89 1x0o h GLN 54 N 0.23 0.45 0.06 -1.24 4.20 -1.19 0.12 115.11 117.73 1x0o h GLN 54 Ca 0.00 -0.14 -0.26 0.00 0.06 0.00 0.00 58.65 58.31 1x0o h GLN 54 Cb 0.24 -0.04 0.01 0.00 0.30 0.00 0.00 27.48 27.99 1x0o h GLN 54 CO 0.00 0.62 -1.10 0.37 -0.67 0.00 0.00 178.83 178.05 1x0o h GLN 55 N 0.41 0.48 -0.22 1.46 -0.00 -1.80 -2.31 115.11 113.13 1x0o h GLN 55 Ca 0.07 -0.59 0.01 0.00 -0.00 0.00 0.00 58.65 58.13 1x0o h GLN 55 Cb 0.56 0.19 -0.01 0.00 0.00 0.00 0.00 27.48 28.21 1x0o h GLN 55 CO 0.04 1.23 0.13 1.25 0.00 0.00 0.00 178.83 181.48 1x0o h LEU 56 N 0.23 0.22 -1.32 -2.39 5.85 -1.63 -1.90 115.31 114.36 1x0o h LEU 56 Ca -0.13 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.56 1x0o h LEU 56 Cb 1.76 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.73 1x0o h LEU 56 CO 0.20 0.16 0.08 -0.07 -0.34 0.00 0.00 178.44 178.47 1x0o h LEU 57 N 0.27 0.49 0.19 2.25 3.38 -0.83 -0.95 115.31 120.12 1x0o h LEU 57 Ca 0.09 -0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.00 1x0o h LEU 57 Cb -0.01 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 1x0o h LEU 57 CO -0.04 0.51 -0.28 -0.09 0.09 0.00 0.00 178.44 178.63 1x0o h ARG 58 N 0.53 -0.52 -0.46 1.13 2.43 -0.77 0.13 114.38 116.85 1x0o h ARG 58 Ca 0.12 0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 59.19 1x0o h ARG 58 Cb 0.22 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.87 1x0o h ARG 58 CO -0.00 -0.34 -0.26 0.22 -1.51 0.00 0.00 179.97 178.07 1x0o h ASP 59 N -0.54 1.02 -0.30 -3.80 3.58 -1.09 -2.49 116.42 112.81 1x0o h ASP 59 Ca 0.01 -0.41 -0.07 0.00 0.42 0.00 0.00 57.03 56.98 1x0o h ASP 59 Cb 0.53 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 41.29 1x0o h ASP 59 CO -0.11 1.21 -0.10 0.77 -2.88 0.00 0.00 179.24 178.13 1x0o h SER 60 N 0.84 0.60 -0.65 2.28 4.64 -1.09 0.14 113.55 120.31 1x0o h SER 60 Ca 0.10 -0.38 0.02 0.00 -0.47 0.00 0.00 61.79 61.06 1x0o h SER 60 Cb 0.85 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 62.74 1x0o h SER 60 CO 0.08 0.85 0.43 -0.26 -0.87 0.00 0.00 176.83 177.05 1x0o h PHE 61 N 0.35 0.78 -0.28 4.77 0.04 -0.98 0.09 116.94 121.71 1x0o h PHE 61 Ca 0.07 0.02 -0.11 0.00 2.80 0.00 0.00 57.97 60.75 1x0o h PHE 61 Cb 0.60 -0.26 -0.01 0.00 2.20 0.00 0.00 35.95 38.48 1x0o h PHE 61 CO 0.05 0.47 -0.28 1.96 -0.60 0.00 0.00 178.31 179.92 1x0o h GLN 62 N 0.82 0.56 0.03 1.51 1.08 -0.90 -2.70 115.11 115.50 1x0o h GLN 62 Ca 0.25 -0.23 0.02 0.00 -1.45 0.00 0.00 58.65 57.24 1x0o h GLN 62 Cb -0.00 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.38 1x0o h GLN 62 CO -0.06 0.78 -0.12 1.96 -0.95 0.00 0.00 178.83 180.44 1x0o h GLN 63 N 0.49 -0.21 -0.07 1.46 1.08 0.12 -0.66 115.11 117.32 1x0o h GLN 63 Ca 0.07 0.01 -0.07 0.00 -1.45 0.00 0.00 58.65 57.21 1x0o h GLN 63 Cb 0.73 0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 28.20 1x0o h GLN 63 CO 0.06 -0.14 -0.27 -0.24 -0.95 0.00 0.00 178.83 177.29 1x0o h VAL 64 N -0.22 1.22 -0.23 -0.54 3.04 -1.33 0.40 116.25 118.59 1x0o h VAL 64 Ca 0.03 -1.05 -0.12 0.00 -1.01 0.00 0.00 66.70 64.56 1x0o h VAL 64 Cb 0.26 1.47 -0.01 0.00 -2.01 0.00 0.00 31.29 31.00 1x0o h VAL 64 CO -0.10 0.31 -0.35 0.58 -1.01 0.00 0.00 177.57 177.00 1x0o h VAL 65 N 0.11 1.29 0.00 1.51 2.07 -1.10 0.16 116.25 120.29 1x0o h VAL 65 Ca 0.02 -1.47 0.00 0.00 0.82 0.00 0.00 66.70 66.07 1x0o h VAL 65 Cb 0.54 1.50 0.00 0.00 -1.52 0.00 0.00 31.29 31.81 1x0o h VAL 65 CO 0.04 0.46 -0.71 0.07 0.02 0.00 0.00 177.57 177.44 1x0o h LYS 66 N 0.42 0.00 0.06 1.57 2.10 -0.56 -3.35 116.57 116.80 1x0o h LYS 66 Ca 0.05 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.69 1x0o h LYS 66 Cb 0.81 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.14 1x0o h LYS 66 CO 0.07 0.00 -0.03 -0.07 -2.00 0.00 0.00 179.45 177.42 1x0o h LEU 67 N 0.00 -0.06 -2.15 7.07 3.38 0.15 -3.50 115.31 120.20 1x0o h LEU 67 Ca 0.00 -0.58 0.01 0.00 0.09 0.00 0.00 57.88 57.40 1x0o h LEU 67 Cb 0.89 0.02 -0.10 0.00 0.09 0.00 0.00 40.66 41.55 1x0o h LEU 67 CO 0.00 0.65 -1.32 0.29 0.09 0.00 0.00 178.44 178.15 1x0o n LYS 68 N -4.77 -3.89 0.00 1.13 5.02 0.52 -4.52 118.16 111.64 1x0o n LYS 68 Ca -0.08 3.01 0.00 0.00 -2.02 0.00 0.00 58.31 59.23 1x0o n LYS 68 Cb 0.31 -4.66 0.00 0.00 -0.02 0.00 0.00 35.03 30.67 1x0o n LYS 68 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1x0o n GLY 69 N 1.33 2.71 3.72 0.72 0.00 -1.26 -5.05 105.19 107.35 1x0o n GLY 69 Ca -0.31 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.33 1x0o n GLY 69 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1x0o s GLN 70 N -0.86 4.35 -0.16 1.61 0.74 -1.26 -4.96 119.66 119.13 1x0o s GLN 70 Ca 0.00 0.52 -0.29 0.00 0.05 0.00 0.00 55.36 55.64 1x0o s GLN 70 Cb 0.00 -3.44 -0.01 0.00 1.10 0.00 0.00 33.01 30.66 1x0o s GLN 70 CO 0.00 0.13 1.18 0.54 -0.55 0.00 0.00 175.29 176.58 1x0o s VAL 71 N 0.70 4.41 -0.02 1.34 0.11 -1.26 -4.64 120.40 121.05 1x0o s VAL 71 Ca 0.28 1.71 0.00 0.00 -2.93 0.00 0.00 61.98 61.04 1x0o s VAL 71 Cb -0.16 -4.10 -0.04 0.00 -1.53 0.00 0.00 36.38 30.55 1x0o s VAL 71 CO 0.11 -0.11 0.04 -0.22 -3.33 0.00 0.00 175.10 171.59 1x0o s LEU 72 N 3.06 3.70 -0.21 2.54 2.96 -0.14 -4.86 118.68 125.73 1x0o s LEU 72 Ca 0.52 0.09 -0.04 0.00 -0.22 0.00 0.00 54.13 54.48 1x0o s LEU 72 Cb -0.20 -2.09 -0.01 0.00 0.50 0.00 0.00 46.19 44.38 1x0o s LEU 72 CO 0.14 0.29 -0.04 -0.44 -1.32 0.00 0.00 176.35 174.99 1x0o s SER 73 N -1.53 4.38 -0.05 3.68 0.01 -1.26 0.06 113.70 118.99 1x0o s SER 73 Ca 0.20 -0.35 0.03 0.00 1.31 0.00 0.00 55.95 57.13 1x0o s SER 73 Cb -0.12 -1.75 0.01 0.00 0.21 0.00 0.00 66.02 64.37 1x0o s SER 73 CO 0.11 0.00 -0.12 0.54 0.41 0.00 0.00 173.24 174.18 1x0o s VAL 74 N 1.34 1.06 -0.20 3.43 0.11 -1.00 -4.98 120.40 120.15 1x0o s VAL 74 Ca 0.04 -0.47 -0.04 0.00 -2.93 0.00 0.00 61.98 58.57 1x0o s VAL 74 Cb -0.14 -0.95 -0.02 0.00 -1.53 0.00 0.00 36.38 33.74 1x0o s VAL 74 CO -0.02 0.33 -0.02 -0.32 -3.33 0.00 0.00 175.10 171.74 1x0o s MET 75 N 0.40 3.55 0.33 1.54 1.75 -1.26 -0.78 119.30 124.83 1x0o s MET 75 Ca -0.09 -0.55 -0.01 0.00 -1.25 0.00 0.00 55.69 53.79 1x0o s MET 75 Cb -0.13 -3.04 -0.00 0.00 2.84 0.00 0.00 34.83 34.50 1x0o s MET 75 CO 0.02 -0.02 0.43 -0.59 -0.65 0.00 0.00 175.02 174.21 1x0o s PHE 76 N 1.06 1.17 -0.30 4.11 -0.71 -0.66 -5.00 117.98 117.66 1x0o s PHE 76 Ca 0.02 -1.35 -0.07 0.00 -1.04 0.00 0.00 56.93 54.49 1x0o s PHE 76 Cb -0.14 -0.20 0.01 0.00 -1.21 0.00 0.00 43.02 41.47 1x0o s PHE 76 CO 0.01 -1.07 0.09 1.03 -1.34 0.00 0.00 175.22 173.94 1x0o s ARG 77 N -3.18 3.06 0.31 1.99 0.52 -1.25 -1.54 118.95 118.85 1x0o s ARG 77 Ca 0.32 -0.88 -0.19 0.00 -0.52 0.00 0.00 55.73 54.46 1x0o s ARG 77 Cb 0.00 -3.40 -0.09 0.00 0.52 0.00 0.00 34.95 31.98 1x0o s ARG 77 CO 0.21 -0.47 0.80 0.12 0.02 0.00 0.00 175.30 175.98 1x0o s PHE 78 N 1.50 3.50 -0.54 -0.53 2.19 -0.11 -0.25 117.98 123.74 1x0o s PHE 78 Ca 0.02 1.42 -0.22 0.00 0.33 0.00 0.00 56.93 58.48 1x0o s PHE 78 Cb -0.17 -2.67 0.05 0.00 -1.31 0.00 0.00 43.02 38.91 1x0o s PHE 78 CO 0.03 0.16 0.84 0.50 1.83 0.00 0.00 175.22 178.58 1x0o s ARG 79 N -2.54 3.26 1.12 10.12 3.52 0.14 -1.91 118.95 132.66 1x0o s ARG 79 Ca 0.51 -0.48 -0.13 0.00 -0.13 0.00 0.00 55.73 55.50 1x0o s ARG 79 Cb -0.13 -4.07 0.23 0.00 -1.56 0.00 0.00 34.95 29.41 1x0o s ARG 79 CO 0.19 -1.40 0.83 0.45 -0.81 0.00 0.00 175.30 174.55 1x0o n SER 80 N 7.04 -1.56 0.00 -2.12 2.88 0.74 -4.78 113.62 115.81 1x0o n SER 80 Ca -0.01 -0.04 0.05 0.00 -1.33 0.00 0.00 58.87 57.54 1x0o n SER 80 Cb 0.47 -1.24 0.23 0.00 -0.75 0.00 0.00 64.21 62.92 1x0o n SER 80 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1x0o n LYS 81 N -4.19 0.02 -0.46 -1.46 3.00 -0.29 -0.25 118.16 114.52 1x0o n LYS 81 Ca 0.04 0.30 0.09 0.00 -0.00 0.00 0.00 58.31 58.74 1x0o n LYS 81 Cb 0.55 -1.50 0.30 0.00 0.00 0.00 0.00 35.03 34.38 1x0o n LYS 81 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1x0o n ASN 82 N -1.48 4.14 -2.47 3.14 3.02 -1.26 -4.91 115.26 115.44 1x0o n ASN 82 Ca 0.03 -2.33 -0.16 0.00 -0.03 0.00 0.00 54.58 52.08 1x0o n ASN 82 Cb 0.12 -0.49 0.04 0.00 -0.61 0.00 0.00 39.78 38.85 1x0o n ASN 82 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1x0o n GLN 83 N 0.91 -4.75 -3.40 3.52 3.00 0.65 -5.02 117.38 112.30 1x0o n GLN 83 Ca 0.22 0.60 -0.25 0.00 -0.01 0.00 0.00 57.00 57.56 1x0o n GLN 83 Cb 0.75 -4.89 -0.02 0.00 0.00 0.00 0.00 30.24 26.08 1x0o n GLN 83 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 1x0o s GLU 84 N -5.70 3.51 -0.69 -1.09 2.02 -1.22 -4.83 118.70 110.70 1x0o s GLU 84 Ca 0.33 -0.28 0.03 0.00 0.02 0.00 0.00 54.97 55.08 1x0o s GLU 84 Cb -0.15 -2.68 0.17 0.00 0.10 0.00 0.00 34.13 31.58 1x0o s GLU 84 CO 0.41 0.18 0.49 -1.58 0.02 0.00 0.00 175.26 174.79 1x0o s TRP 85 N -2.23 3.54 0.49 1.61 0.52 -1.25 -0.19 118.94 121.42 1x0o s TRP 85 Ca 0.40 -3.20 0.00 0.00 0.02 0.00 0.00 56.10 53.33 1x0o s TRP 85 Cb -0.10 -2.88 0.01 0.00 -1.15 0.00 0.00 33.47 29.35 1x0o s TRP 85 CO 0.34 -0.65 0.71 -0.48 0.02 0.00 0.00 176.95 176.90 1x0o s LEU 86 N -1.07 3.52 -0.26 2.99 0.05 -0.80 -4.46 118.68 118.65 1x0o s LEU 86 Ca 0.23 0.23 -0.10 0.00 0.05 0.00 0.00 54.13 54.54 1x0o s LEU 86 Cb -0.11 -3.10 -0.05 0.00 -2.05 0.00 0.00 46.19 40.88 1x0o s LEU 86 CO -0.11 -0.85 0.16 0.26 -0.55 0.00 0.00 176.35 175.26 1x0o s TRP 87 N -2.64 3.24 0.03 3.48 0.52 0.70 -0.94 118.94 123.33 1x0o s TRP 87 Ca 0.51 0.09 0.02 0.00 0.02 0.00 0.00 56.10 56.74 1x0o s TRP 87 Cb -0.10 -2.30 -0.02 0.00 -1.15 0.00 0.00 33.47 29.90 1x0o s TRP 87 CO 0.38 -0.08 -0.07 0.00 0.02 0.00 0.00 176.95 177.20 1x0o s MET 88 N 1.40 0.49 -0.28 4.98 0.23 -0.59 -0.71 119.30 124.82 1x0o s MET 88 Ca 0.07 -0.64 -0.07 0.00 -1.03 0.00 0.00 55.69 54.02 1x0o s MET 88 Cb -0.15 -0.30 -0.01 0.00 -1.53 0.00 0.00 34.83 32.85 1x0o s MET 88 CO 0.07 0.06 0.08 0.50 -2.03 0.00 0.00 175.02 173.70 1x0o s ARG 89 N -1.28 3.38 -0.10 3.16 3.52 -0.55 -1.65 118.95 125.42 1x0o s ARG 89 Ca -0.08 -0.67 -0.15 0.00 -0.13 0.00 0.00 55.73 54.71 1x0o s ARG 89 Cb -0.08 -3.37 -0.05 0.00 -1.56 0.00 0.00 34.95 29.88 1x0o s ARG 89 CO 0.00 -0.33 0.36 0.99 -0.81 0.00 0.00 175.30 175.51 1x0o s THR 90 N 1.57 5.22 -0.35 4.11 2.01 0.04 -2.53 115.64 125.70 1x0o s THR 90 Ca 0.05 0.70 -0.22 0.00 0.31 0.00 0.00 61.69 62.52 1x0o s THR 90 Cb -0.16 -3.68 0.01 0.00 0.01 0.00 0.00 72.50 68.68 1x0o s THR 90 CO 0.03 0.44 0.74 -0.44 -0.69 0.00 0.00 174.62 174.71 1x0o s SER 91 N -0.03 6.53 -0.26 3.53 0.01 0.69 -2.38 113.70 121.78 1x0o s SER 91 Ca 0.21 0.33 -0.17 0.00 1.31 0.00 0.00 55.95 57.63 1x0o s SER 91 Cb -0.14 -2.38 -0.03 0.00 0.21 0.00 0.00 66.02 63.68 1x0o s SER 91 CO 0.08 -0.68 0.45 -0.44 0.41 0.00 0.00 173.24 173.07 1x0o s SER 92 N 1.80 6.37 -0.04 2.44 0.01 0.11 -2.36 113.70 122.03 1x0o s SER 92 Ca 0.29 0.43 0.03 0.00 1.31 0.00 0.00 55.95 58.02 1x0o s SER 92 Cb -0.14 -2.25 0.00 0.00 0.21 0.00 0.00 66.02 63.85 1x0o s SER 92 CO 0.16 -0.23 -0.12 0.12 0.41 0.00 0.00 173.24 173.58 1x0o s PHE 93 N 2.14 1.25 -0.43 2.43 5.36 -0.88 -0.96 117.98 126.89 1x0o s PHE 93 Ca 0.19 -0.35 -0.15 0.00 -0.96 0.00 0.00 56.93 55.66 1x0o s PHE 93 Cb -0.16 -0.87 0.03 0.00 -0.34 0.00 0.00 43.02 41.68 1x0o s PHE 93 CO 0.09 -0.14 0.32 0.95 -1.46 0.00 0.00 175.22 174.99 1x0o s THR 94 N 0.19 5.25 -0.30 0.12 -4.23 -1.26 -0.17 115.64 115.24 1x0o s THR 94 Ca -0.04 -0.76 -0.28 0.00 -1.18 0.00 0.00 61.69 59.43 1x0o s THR 94 Cb -0.10 -3.98 0.01 0.00 1.34 0.00 0.00 72.50 69.77 1x0o s THR 94 CO 0.01 -0.38 1.02 0.12 -0.54 0.00 0.00 174.62 174.86 1x0o s PHE 95 N 1.67 3.20 0.01 3.99 5.36 -0.35 -4.43 117.98 127.44 1x0o s PHE 95 Ca 0.05 1.20 0.07 0.00 -0.96 0.00 0.00 56.93 57.28 1x0o s PHE 95 Cb -0.20 -3.53 -0.02 0.00 -0.34 0.00 0.00 43.02 38.93 1x0o s PHE 95 CO 0.09 -0.67 -0.21 -0.65 -1.46 0.00 0.00 175.22 172.32 1x0o s GLN 96 N 3.45 1.52 -0.37 10.12 -0.21 -1.26 -1.53 119.66 131.39 1x0o s GLN 96 Ca 0.43 -0.83 -0.29 0.00 0.02 0.00 0.00 55.36 54.69 1x0o s GLN 96 Cb -0.13 -1.55 -0.00 0.00 1.00 0.00 0.00 33.01 32.32 1x0o s GLN 96 CO 0.13 0.41 1.53 1.21 -2.12 0.00 0.00 175.29 176.45 1x0o s ASN 97 N -0.82 6.23 0.60 5.90 3.84 -0.32 -4.87 114.94 125.50 1x0o s ASN 97 Ca 0.08 1.04 0.39 0.00 0.21 0.00 0.00 52.86 54.58 1x0o s ASN 97 Cb -0.08 -2.54 2.13 0.00 -0.55 0.00 0.00 41.25 40.21 1x0o s ASN 97 CO 0.00 -1.48 2.20 1.55 -2.79 0.00 0.00 177.10 176.58 1x0o h PRO 98 N 11.24 0.00 -0.27 0.43 0.13 -1.94 0.83 132.00 142.42 1x0o h PRO 98 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 1x0o h PRO 98 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1x0o h PRO 98 CO 1.06 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.49 1x0o n TYR 99 N -2.90 0.34 -0.05 1.56 4.02 -1.26 -4.35 117.16 114.52 1x0o n TYR 99 Ca -0.03 -0.17 0.00 0.00 -0.01 0.00 0.00 57.90 57.69 1x0o n TYR 99 Cb 0.09 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.41 1x0o n TYR 99 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1x0o n SER 100 N 1.20 0.00 0.00 7.72 2.88 0.04 -5.02 113.62 120.44 1x0o n SER 100 Ca 0.18 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.72 1x0o n SER 100 Cb 0.54 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.00 1x0o n SER 100 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1x0o n ASP 101 N 0.00 0.00 -4.77 -3.46 8.00 0.27 -4.98 116.55 111.61 1x0o n ASP 101 Ca 0.00 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.13 1x0o n ASP 101 Cb 0.00 -0.32 -0.01 0.00 -0.02 0.00 0.00 41.12 40.77 1x0o n ASP 101 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 1x0o s GLU 102 N 0.00 3.71 -0.38 -1.24 -1.05 -1.25 -4.67 118.70 113.81 1x0o s GLU 102 Ca 0.00 1.81 -0.18 0.00 -0.15 0.00 0.00 54.97 56.45 1x0o s GLU 102 Cb 0.00 -2.39 0.01 0.00 -0.44 0.00 0.00 34.13 31.31 1x0o s GLU 102 CO 0.00 -0.60 0.49 0.42 0.95 0.00 0.00 175.26 176.52 1x0o s ILE 103 N -1.53 5.02 0.12 1.83 1.01 -1.26 -1.17 121.20 125.22 1x0o s ILE 103 Ca 0.64 0.09 -0.13 0.00 0.00 0.00 0.00 60.65 61.25 1x0o s ILE 103 Cb -0.29 -4.00 -0.06 0.00 0.01 0.00 0.00 42.46 38.11 1x0o s ILE 103 CO 0.36 -0.31 1.45 1.05 0.00 0.00 0.00 174.94 177.49 1x0o h GLU 104 N 8.59 0.83 -1.86 2.79 4.11 -1.65 -3.48 114.58 123.91 1x0o h GLU 104 Ca -0.27 -0.43 0.29 0.00 0.07 0.00 0.00 59.36 59.02 1x0o h GLU 104 Cb 1.12 0.01 -0.09 0.00 0.50 0.00 0.00 28.75 30.29 1x0o h GLU 104 CO 0.79 1.07 0.78 1.52 0.07 0.00 0.00 179.01 183.23 1x0o s TYR 105 N -4.40 -0.02 -0.03 2.06 -0.85 -1.22 -4.73 117.35 108.16 1x0o s TYR 105 Ca -0.12 -0.15 -0.03 0.00 -0.52 0.00 0.00 57.07 56.25 1x0o s TYR 105 Cb 0.10 0.58 -0.04 0.00 0.38 0.00 0.00 41.96 42.98 1x0o s TYR 105 CO 0.86 -0.42 0.15 0.42 -1.52 0.00 0.00 175.55 175.04 1x0o s ILE 106 N -2.38 5.30 -0.26 -3.49 1.01 0.55 -1.21 121.20 120.71 1x0o s ILE 106 Ca 0.19 -0.13 -0.03 0.00 0.00 0.00 0.00 60.65 60.68 1x0o s ILE 106 Cb 0.02 -3.42 0.02 0.00 0.01 0.00 0.00 42.46 39.08 1x0o s ILE 106 CO -0.01 0.40 -0.03 -0.63 0.00 0.00 0.00 174.94 174.67 1x0o s ILE 107 N -1.23 3.15 -0.29 2.92 1.01 0.76 -0.63 121.20 126.90 1x0o s ILE 107 Ca 0.23 -0.91 -0.03 0.00 0.00 0.00 0.00 60.65 59.95 1x0o s ILE 107 Cb -0.12 -2.59 0.03 0.00 0.01 0.00 0.00 42.46 39.79 1x0o s ILE 107 CO 0.14 0.19 0.00 0.00 0.00 0.00 0.00 174.94 175.28 1x0o s THR 109 N 1.33 4.94 -0.22 0.00 2.01 -1.00 -0.86 115.64 121.83 1x0o s THR 109 Ca -0.02 1.12 0.00 0.00 0.31 0.00 0.00 61.69 63.10 1x0o s THR 109 Cb -0.18 -3.87 0.06 0.00 0.01 0.00 0.00 72.50 68.52 1x0o s THR 109 CO -0.01 0.46 -0.05 0.20 -0.69 0.00 0.00 174.62 174.53 1x0o s ASN 110 N -0.43 3.67 -0.18 3.53 0.01 -0.31 -0.22 114.94 121.01 1x0o s ASN 110 Ca 0.28 -1.09 -0.05 0.00 -0.71 0.00 0.00 52.86 51.30 1x0o s ASN 110 Cb -0.18 -1.12 -0.03 0.00 0.41 0.00 0.00 41.25 40.34 1x0o s ASN 110 CO 0.16 -0.23 -0.01 -0.89 -1.51 0.00 0.00 177.10 174.62 1x0o s THR 111 N 1.45 4.02 -0.32 1.60 2.01 -1.05 -1.25 115.64 122.10 1x0o s THR 111 Ca -0.05 -0.30 -0.28 0.00 0.31 0.00 0.00 61.69 61.38 1x0o s THR 111 Cb -0.18 -2.80 0.01 0.00 0.01 0.00 0.00 72.50 69.54 1x0o s THR 111 CO -0.07 0.45 1.01 0.21 -0.69 0.00 0.00 174.62 175.54 1x0o s ASN 112 N 0.70 6.87 -0.22 3.53 3.04 -0.96 -1.49 114.94 126.42 1x0o s ASN 112 Ca -0.00 0.96 -0.16 0.00 0.04 0.00 0.00 52.86 53.69 1x0o s ASN 112 Cb -0.14 -2.51 -0.12 0.00 -1.54 0.00 0.00 41.25 36.94 1x0o s ASN 112 CO 0.02 -0.82 -0.14 0.52 -3.04 0.00 0.00 177.10 173.65 1x0o n VAL 113 N 5.79 1.51 -4.28 -5.21 0.31 0.11 -4.98 118.33 111.58 1x0o n VAL 113 Ca 0.10 -0.09 -0.15 0.00 -0.01 0.00 0.00 64.34 64.19 1x0o n VAL 113 Cb 0.47 -2.08 -0.10 0.00 -0.91 0.00 0.00 33.84 31.22 1x0o n VAL 113 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1x0o s LYS 114 N -2.48 1.32 -0.02 5.55 1.02 -0.65 -5.01 119.74 119.47 1x0o s LYS 114 Ca -0.30 -1.70 0.08 0.00 0.02 0.00 0.00 55.97 54.07 1x0o s LYS 114 Cb 0.08 -0.16 0.21 0.00 -0.52 0.00 0.00 37.83 37.44 1x0o s LYS 114 CO 0.47 -0.28 1.16 0.27 -0.92 0.00 0.00 175.35 176.05 1x0o n ASN 115 N -0.39 2.61 -0.56 2.83 0.23 -1.26 -0.22 115.26 118.51 1x0o n ASN 115 Ca -0.01 -2.16 0.00 0.00 -0.53 0.00 0.00 54.58 51.89 1x0o n ASN 115 Cb 0.66 -0.18 0.00 0.00 -2.08 0.00 0.00 39.78 38.18 1x0o n ASN 115 CO 0.00 0.00 0.00 -0.24 -0.93 0.00 0.00 177.26 176.09 1x0o n SER 116 N -0.09 -3.84 -3.38 0.53 2.88 -1.26 -4.37 113.62 104.09 1x0o n SER 116 Ca 0.08 0.42 -0.35 0.00 -1.33 0.00 0.00 58.87 57.70 1x0o n SER 116 Cb 0.41 -0.96 -0.02 0.00 -0.75 0.00 0.00 64.21 62.89 1x0o n SER 116 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1x0o n SER 117 N -0.71 5.80 -0.13 -3.46 3.41 -1.26 -4.60 113.62 112.67 1x0o n SER 117 Ca 0.00 -2.55 -0.09 0.00 -0.26 0.00 0.00 58.87 55.97 1x0o n SER 117 Cb 0.00 -1.36 -0.00 0.00 -0.26 0.00 0.00 64.21 62.58 1x0o n SER 117 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 1x0o h GLN 118 N 6.00 0.56 0.00 4.33 4.15 -1.96 -3.55 115.11 124.63 1x0o h GLN 118 Ca 0.64 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.98 1x0o h GLN 118 Cb 0.36 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.94 1x0o h GLN 118 CO 1.72 0.47 0.00 -0.85 -1.93 0.00 0.00 178.83 178.24