#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hms s GLN 8 N 0.00 3.89 -0.08 1.64 0.74 -1.26 -4.84 119.66 119.75 2hms s GLN 8 Ca 0.00 -0.14 0.04 0.00 0.05 0.00 0.00 55.36 55.31 2hms s GLN 8 Cb 0.00 -3.32 0.00 0.00 1.10 0.00 0.00 33.01 30.79 2hms s GLN 8 CO 0.00 0.50 -0.21 -0.06 -0.55 0.00 0.00 175.29 174.97 2hms s PHE 9 N -0.22 2.21 -0.03 1.67 0.08 -1.24 -2.19 117.98 118.26 2hms s PHE 9 Ca 0.12 -0.81 0.04 0.00 0.12 0.00 0.00 56.93 56.40 2hms s PHE 9 Cb -0.12 -1.49 -0.01 0.00 -0.57 0.00 0.00 43.02 40.84 2hms s PHE 9 CO 0.01 -0.32 -0.16 0.00 -0.10 0.00 0.00 175.22 174.66 2hms s ALA 10 N 0.26 1.35 -0.10 5.36 0.00 -0.16 -1.65 121.76 126.82 2hms s ALA 10 Ca -0.13 -0.65 -0.01 0.00 0.00 0.00 0.00 51.96 51.17 2hms s ALA 10 Cb -0.16 -0.40 0.03 0.00 0.00 0.00 0.00 23.12 22.59 2hms s ALA 10 CO 0.06 0.29 -0.06 0.08 0.00 0.00 0.00 175.76 176.13 2hms s VAL 11 N -0.16 0.89 -0.31 0.00 1.01 0.50 -0.13 120.40 122.21 2hms s VAL 11 Ca 0.01 -0.21 -0.08 0.00 0.00 0.00 0.00 61.98 61.71 2hms s VAL 11 Cb -0.08 -0.94 0.01 0.00 0.00 0.00 0.00 36.38 35.37 2hms s VAL 11 CO 0.01 0.35 0.11 -0.63 0.00 0.00 0.00 175.10 174.93 2hms s ILE 12 N 1.73 4.11 0.00 2.22 1.01 0.30 -1.03 121.20 129.53 2hms s ILE 12 Ca 0.04 -0.71 0.00 0.00 0.00 0.00 0.00 60.65 59.99 2hms s ILE 12 Cb -0.13 -3.15 0.00 0.00 0.01 0.00 0.00 42.46 39.19 2hms s ILE 12 CO -0.07 0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.50 2hms n GLY 13 N 4.89 0.84 1.97 6.18 0.00 -0.60 0.11 105.19 118.59 2hms n GLY 13 Ca -0.14 -0.60 -0.10 0.00 0.00 0.00 0.00 46.02 45.18 2hms n GLY 13 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2hms n LEU 14 N 0.00 4.97 0.00 0.99 4.77 -1.25 -3.78 117.00 122.69 2hms n LEU 14 Ca 0.00 -2.95 0.00 0.00 -0.03 0.00 0.00 56.01 53.03 2hms n LEU 14 Cb 0.00 -1.31 0.00 0.00 -2.33 0.00 0.00 43.42 39.78 2hms n LEU 14 CO 0.00 1.51 0.00 0.61 -1.33 0.00 0.00 177.39 178.18 2hms n GLY 15 N 2.42 -0.19 0.15 -0.72 0.00 -1.26 -4.23 105.19 101.36 2hms n GLY 15 Ca 0.36 -1.71 -0.07 0.00 0.00 0.00 0.00 46.02 44.60 2hms n GLY 15 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2hms h ARG 16 N 0.00 0.29 0.37 1.61 3.08 -1.93 0.48 114.38 118.27 2hms h ARG 16 Ca 0.00 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 2hms h ARG 16 Cb 0.00 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 29.99 2hms h ARG 16 CO 0.00 0.19 -0.18 0.35 -1.07 0.00 0.00 179.97 179.26 2hms h PHE 17 N 0.30 -0.46 -0.45 3.04 3.57 -1.91 -2.25 116.94 118.78 2hms h PHE 17 Ca 0.15 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.69 2hms h PHE 17 Cb 0.09 0.15 -0.05 0.00 2.79 0.00 0.00 35.95 38.94 2hms h PHE 17 CO -0.12 -0.28 0.17 0.78 -2.23 0.00 0.00 178.31 176.62 2hms h GLY 18 N -0.61 0.59 0.07 2.40 0.00 -1.65 -1.72 103.07 102.15 2hms h GLY 18 Ca -0.05 -0.10 0.08 0.00 0.00 0.00 0.00 47.33 47.27 2hms h GLY 18 CO 0.08 0.03 -0.17 -1.33 0.00 0.00 0.00 176.54 175.15 2hms h GLY 19 N 0.34 0.15 0.95 4.60 0.00 -0.11 -0.15 103.07 108.85 2hms h GLY 19 Ca 0.21 0.22 0.07 0.00 0.00 0.00 0.00 47.33 47.82 2hms h GLY 19 CO -0.21 -0.19 0.53 0.23 0.00 0.00 0.00 176.54 176.91 2hms h SER 20 N -0.09 0.77 0.03 0.19 0.87 -0.95 -1.71 113.55 112.66 2hms h SER 20 Ca 0.20 0.01 -0.15 0.00 -1.23 0.00 0.00 61.79 60.61 2hms h SER 20 Cb 0.39 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.18 2hms h SER 20 CO -0.46 0.50 -0.50 -0.29 -0.53 0.00 0.00 176.83 175.55 2hms h ILE 21 N 0.88 1.32 -0.17 2.23 -0.00 -0.19 -2.28 117.51 119.29 2hms h ILE 21 Ca 0.35 -1.72 -0.16 0.00 -0.00 0.00 0.00 64.86 63.33 2hms h ILE 21 Cb 0.24 1.71 -0.01 0.00 -0.00 0.00 0.00 36.82 38.76 2hms h ILE 21 CO -0.12 0.53 -0.56 0.58 -0.00 0.00 0.00 178.15 178.58 2hms h VAL 22 N 0.42 1.33 -0.46 2.19 2.07 -0.33 -2.88 116.25 118.58 2hms h VAL 22 Ca 0.02 -1.83 -0.12 0.00 0.82 0.00 0.00 66.70 65.59 2hms h VAL 22 Cb 1.02 1.80 -0.01 0.00 -1.52 0.00 0.00 31.29 32.58 2hms h VAL 22 CO 0.09 0.57 -0.18 0.50 0.02 0.00 0.00 177.57 178.57 2hms h LYS 23 N 0.41 0.94 -0.07 1.57 3.11 -1.22 -2.32 116.57 118.98 2hms h LYS 23 Ca 0.00 -0.39 -0.02 0.00 -2.81 0.00 0.00 60.65 57.44 2hms h LYS 23 Cb 1.11 -0.04 -0.00 0.00 -1.00 0.00 0.00 32.23 32.30 2hms h LYS 23 CO 0.10 1.05 -0.02 0.93 -2.81 0.00 0.00 179.45 178.70 2hms h GLU 24 N 0.78 0.14 -0.95 1.90 4.39 -1.44 -0.46 114.58 118.95 2hms h GLU 24 Ca 0.11 -0.06 0.12 0.00 0.34 0.00 0.00 59.36 59.87 2hms h GLU 24 Cb 0.75 -0.01 -0.08 0.00 -0.10 0.00 0.00 28.75 29.32 2hms h GLU 24 CO 0.06 0.49 0.60 -0.07 -1.16 0.00 0.00 179.01 178.93 2hms h LEU 25 N -0.21 0.83 -0.32 1.33 3.38 -1.54 0.28 115.31 119.06 2hms h LEU 25 Ca 0.02 0.04 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 2hms h LEU 25 Cb 0.44 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 2hms h LEU 25 CO 0.01 0.45 -0.19 -0.74 0.09 0.00 0.00 178.44 178.06 2hms h HIS 26 N 0.89 0.80 0.00 1.13 2.76 -1.26 0.92 115.15 120.40 2hms h HIS 26 Ca 0.46 -0.21 -0.04 0.00 -2.20 0.00 0.00 60.37 58.38 2hms h HIS 26 Cb 0.52 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 29.30 2hms h HIS 26 CO -0.00 0.92 -0.19 -0.09 -1.30 0.00 0.00 177.93 177.27 2hms h ARG 27 N 0.45 0.00 -0.15 5.26 2.43 0.67 0.79 114.38 123.83 2hms h ARG 27 Ca 0.07 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 2hms h ARG 27 Cb 0.73 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.28 2hms h ARG 27 CO 0.05 0.19 0.00 -1.33 -1.51 0.00 0.00 179.97 177.37 2hms n MET 28 N -3.98 1.60 -3.00 0.20 2.81 0.81 -4.93 117.12 110.63 2hms n MET 28 Ca -0.02 -0.91 -0.12 0.00 -1.81 0.00 0.00 57.70 54.84 2hms n MET 28 Cb 0.27 -1.36 0.06 0.00 -0.71 0.00 0.00 33.22 31.48 2hms n MET 28 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2hms n GLY 29 N 1.05 -0.09 3.51 3.03 0.00 0.27 -5.05 105.19 107.92 2hms n GLY 29 Ca 0.15 -0.09 -0.24 0.00 0.00 0.00 0.00 46.02 45.84 2hms n GLY 29 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2hms s HIS 30 N -3.24 2.42 -0.10 1.61 3.76 0.29 -5.01 115.29 115.03 2hms s HIS 30 Ca 0.07 -0.30 -0.21 0.00 -0.15 0.00 0.00 55.06 54.47 2hms s HIS 30 Cb -0.03 -1.09 -0.04 0.00 1.11 0.00 0.00 32.58 32.53 2hms s HIS 30 CO 0.49 0.65 0.58 -1.21 -0.85 0.00 0.00 174.74 174.40 2hms s GLU 31 N -3.37 4.38 0.04 1.40 2.02 -1.26 -4.29 118.70 117.62 2hms s GLU 31 Ca 0.29 0.65 0.04 0.00 0.02 0.00 0.00 54.97 55.97 2hms s GLU 31 Cb -0.06 -3.45 -0.02 0.00 0.10 0.00 0.00 34.13 30.70 2hms s GLU 31 CO 0.15 0.10 -0.13 0.08 0.02 0.00 0.00 175.26 175.49 2hms s VAL 32 N 0.74 1.03 -0.34 2.63 1.01 -1.26 -3.63 120.40 120.58 2hms s VAL 32 Ca 0.31 -0.96 -0.07 0.00 0.00 0.00 0.00 61.98 61.27 2hms s VAL 32 Cb -0.16 -0.94 0.04 0.00 0.00 0.00 0.00 36.38 35.32 2hms s VAL 32 CO 0.14 -0.01 0.12 -0.22 0.00 0.00 0.00 175.10 175.12 2hms s LEU 33 N -1.10 4.38 -0.33 3.92 0.20 -0.66 -1.89 118.68 123.20 2hms s LEU 33 Ca 0.01 -1.15 -0.11 0.00 0.69 0.00 0.00 54.13 53.56 2hms s LEU 33 Cb -0.08 -1.88 -0.01 0.00 -0.43 0.00 0.00 46.19 43.79 2hms s LEU 33 CO 0.01 -0.34 0.20 0.00 -0.29 0.00 0.00 176.35 175.93 2hms s ALA 34 N 1.41 3.40 0.12 5.97 0.00 -0.91 -0.37 121.76 131.39 2hms s ALA 34 Ca -0.01 -1.38 0.09 0.00 0.00 0.00 0.00 51.96 50.66 2hms s ALA 34 Cb -0.20 -2.54 -0.04 0.00 0.00 0.00 0.00 23.12 20.35 2hms s ALA 34 CO 0.03 -0.93 -0.16 0.14 0.00 0.00 0.00 175.76 174.84 2hms s VAL 35 N 1.67 2.98 -0.11 0.00 -7.23 -0.20 -0.71 120.40 116.79 2hms s VAL 35 Ca 0.05 -1.47 -0.30 0.00 -1.81 0.00 0.00 61.98 58.45 2hms s VAL 35 Cb -0.17 -2.38 0.11 0.00 0.56 0.00 0.00 36.38 34.50 2hms s VAL 35 CO 0.09 0.08 0.90 -0.62 -0.31 0.00 0.00 175.10 175.24 2hms s ASP 36 N -2.22 -0.45 -0.01 4.85 3.68 -0.94 -1.56 116.67 120.02 2hms s ASP 36 Ca 0.19 0.44 -0.18 0.00 2.13 0.00 0.00 52.55 55.13 2hms s ASP 36 Cb -0.10 0.38 -0.10 0.00 -1.45 0.00 0.00 42.92 41.64 2hms s ASP 36 CO 0.11 -0.45 0.81 0.16 0.13 0.00 0.00 175.17 175.93 2hms h ILE 37 N 2.61 0.00 -3.20 4.11 3.07 -1.74 -0.54 117.51 121.82 2hms h ILE 37 Ca -0.21 -0.42 -0.55 0.00 1.55 0.00 0.00 64.86 65.23 2hms h ILE 37 Cb 1.17 0.00 -0.02 0.00 -0.27 0.00 0.00 36.82 37.70 2hms h ILE 37 CO 0.33 0.00 0.59 0.54 -1.05 0.00 0.00 178.15 178.56 2hms s ASN 38 N -4.51 7.15 0.00 2.16 2.20 -1.26 -4.35 114.94 116.34 2hms s ASN 38 Ca -0.10 1.77 0.07 0.00 -0.94 0.00 0.00 52.86 53.67 2hms s ASN 38 Cb 0.01 -2.56 0.41 0.00 -2.00 0.00 0.00 41.25 37.10 2hms s ASN 38 CO 0.29 -0.48 0.95 -1.84 -2.94 0.00 0.00 177.10 173.08 2hms n GLU 39 N 4.68 0.19 0.21 3.55 0.28 -1.26 -2.94 120.64 125.34 2hms n GLU 39 Ca 0.09 0.07 -0.08 0.00 -0.16 0.00 0.00 57.16 57.08 2hms n GLU 39 Cb 0.48 -1.50 -0.04 0.00 1.43 0.00 0.00 31.44 31.81 2hms n GLU 39 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 2hms h GLU 40 N 0.00 -0.52 -0.20 3.44 4.39 -1.96 -2.73 114.58 116.99 2hms h GLU 40 Ca 0.00 0.04 0.05 0.00 0.34 0.00 0.00 59.36 59.78 2hms h GLU 40 Cb 0.02 0.12 -0.05 0.00 -0.10 0.00 0.00 28.75 28.74 2hms h GLU 40 CO 0.00 -0.35 -0.11 0.87 -1.16 0.00 0.00 179.01 178.26 2hms h LYS 41 N -0.57 -0.10 -0.94 2.33 6.56 -1.93 -1.90 116.57 120.02 2hms h LYS 41 Ca -0.06 0.01 0.27 0.00 -1.06 0.00 0.00 60.65 59.81 2hms h LYS 41 Cb 0.42 0.02 -0.04 0.00 -0.57 0.00 0.00 32.23 32.06 2hms h LYS 41 CO 0.09 -0.07 0.68 0.28 -2.06 0.00 0.00 179.45 178.37 2hms h VAL 42 N -0.10 0.53 0.00 0.50 2.07 -1.60 0.15 116.25 117.80 2hms h VAL 42 Ca 0.11 -0.00 -0.26 0.00 0.82 0.00 0.00 66.70 67.37 2hms h VAL 42 Cb 0.27 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.52 2hms h VAL 42 CO -0.26 0.00 -1.64 0.59 0.02 0.00 0.00 177.57 176.28 2hms n ASN 43 N -4.26 0.85 0.27 0.57 3.02 -0.92 -3.08 115.26 111.70 2hms n ASN 43 Ca 0.20 0.39 0.17 0.00 -0.03 0.00 0.00 54.58 55.31 2hms n ASN 43 Cb 1.00 0.03 0.70 0.00 -0.61 0.00 0.00 39.78 40.91 2hms n ASN 43 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2hms h ALA 44 N 1.12 1.00 -0.16 5.41 0.00 0.03 -2.82 119.26 123.84 2hms h ALA 44 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2hms h ALA 44 Cb 1.90 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.69 2hms h ALA 44 CO 0.07 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.98 2hms n TYR 45 N -2.99 0.21 -0.24 0.00 4.02 -0.59 -4.65 117.16 112.92 2hms n TYR 45 Ca 0.00 -0.31 -0.00 0.00 -0.01 0.00 0.00 57.90 57.59 2hms n TYR 45 Cb 0.28 -0.02 0.12 0.00 -0.02 0.00 0.00 39.34 39.70 2hms n TYR 45 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2hms h ALA 46 N 1.52 0.94 -0.08 -0.72 0.00 -1.42 -1.46 119.26 118.05 2hms h ALA 46 Ca 0.00 0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.77 2hms h ALA 46 Cb 0.54 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2hms h ALA 46 CO 0.00 0.01 -0.69 0.66 0.00 0.00 0.00 179.25 179.22 2hms h SER 47 N 0.65 0.42 -0.15 0.00 4.64 -1.83 -3.17 113.55 114.11 2hms h SER 47 Ca 0.33 -0.27 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2hms h SER 47 Cb 0.28 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 2hms h SER 47 CO -0.23 0.98 0.00 -1.22 -0.87 0.00 0.00 176.83 175.50 2hms n TYR 48 N -3.84 0.20 -4.34 4.77 4.02 -0.84 -4.87 117.16 112.26 2hms n TYR 48 Ca -0.04 -0.10 -0.17 0.00 -0.01 0.00 0.00 57.90 57.58 2hms n TYR 48 Cb 0.68 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.90 2hms n TYR 48 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2hms s ALA 49 N -1.80 1.85 -0.86 -0.72 0.00 -0.61 -4.50 121.76 115.12 2hms s ALA 49 Ca 0.25 -1.77 0.25 0.00 0.00 0.00 0.00 51.96 50.69 2hms s ALA 49 Cb 0.13 0.44 0.45 0.00 0.00 0.00 0.00 23.12 24.14 2hms s ALA 49 CO 0.19 -0.22 1.38 2.41 0.00 0.00 0.00 175.76 179.52 2hms n THR 50 N -0.42 0.12 -2.84 0.00 -1.04 -0.79 -4.74 114.28 104.56 2hms n THR 50 Ca -0.05 -0.10 0.02 0.00 -2.04 0.00 0.00 64.05 61.87 2hms n THR 50 Cb 0.64 0.10 0.00 0.00 -1.82 0.00 0.00 70.33 69.25 2hms n THR 50 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 2hms s HIS 51 N -3.06 -0.56 0.09 -1.42 2.46 -0.97 -4.93 115.29 106.90 2hms s HIS 51 Ca 0.09 0.09 -0.25 0.00 0.47 0.00 0.00 55.06 55.47 2hms s HIS 51 Cb 0.16 0.10 -0.06 0.00 -0.13 0.00 0.00 32.58 32.65 2hms s HIS 51 CO 0.71 -0.38 0.75 0.00 -2.47 0.00 0.00 174.74 173.35 2hms s ALA 52 N 1.98 3.42 -0.01 1.58 0.00 -1.26 -2.14 121.76 125.33 2hms s ALA 52 Ca 0.15 0.29 0.00 0.00 0.00 0.00 0.00 51.96 52.40 2hms s ALA 52 Cb 0.02 -2.95 0.01 0.00 0.00 0.00 0.00 23.12 20.20 2hms s ALA 52 CO -0.14 0.18 -0.01 0.08 0.00 0.00 0.00 175.76 175.87 2hms s VAL 53 N -0.54 0.10 -0.10 0.00 1.01 0.11 -4.95 120.40 116.04 2hms s VAL 53 Ca 0.37 0.00 -0.23 0.00 0.00 0.00 0.00 61.98 62.12 2hms s VAL 53 Cb -0.21 -0.13 -0.03 0.00 0.00 0.00 0.00 36.38 36.00 2hms s VAL 53 CO 0.24 0.06 0.68 -0.63 0.00 0.00 0.00 175.10 175.45 2hms s ILE 54 N 0.29 5.04 -0.04 2.22 1.09 -1.26 -2.21 121.20 126.34 2hms s ILE 54 Ca -0.03 1.38 -0.31 0.00 -1.10 0.00 0.00 60.65 60.60 2hms s ILE 54 Cb -0.04 -4.02 0.12 0.00 -1.06 0.00 0.00 42.46 37.46 2hms s ILE 54 CO -0.01 0.22 1.21 0.00 -0.10 0.00 0.00 174.94 176.26 2hms s ALA 55 N 1.02 -2.10 -0.32 9.38 0.00 -0.21 -4.91 121.76 124.61 2hms s ALA 55 Ca 0.35 0.87 -0.02 0.00 0.00 0.00 0.00 51.96 53.16 2hms s ALA 55 Cb -0.17 0.27 0.06 0.00 0.00 0.00 0.00 23.12 23.28 2hms s ALA 55 CO 0.16 -0.92 0.05 1.21 0.00 0.00 0.00 175.76 176.26 2hms s ASN 56 N -2.75 5.00 0.65 0.00 3.84 -1.26 -2.13 114.94 118.30 2hms s ASN 56 Ca 0.12 -1.41 0.35 0.00 0.21 0.00 0.00 52.86 52.14 2hms s ASN 56 Cb 0.02 -1.75 1.95 0.00 -0.55 0.00 0.00 41.25 40.93 2hms s ASN 56 CO -0.04 -0.32 2.14 0.00 -2.79 0.00 0.00 177.10 176.10 2hms h ALA 57 N 8.02 1.33 -0.03 1.71 0.00 -1.96 -1.99 119.26 126.34 2hms h ALA 57 Ca -0.19 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2hms h ALA 57 Cb 1.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2hms h ALA 57 CO 0.57 -0.20 0.00 0.25 0.00 0.00 0.00 179.25 179.87 2hms n THR 58 N -3.20 0.03 -3.97 0.00 -2.24 -1.26 -4.66 114.28 98.98 2hms n THR 58 Ca -0.01 -0.05 -0.34 0.00 -2.27 0.00 0.00 64.05 61.37 2hms n THR 58 Cb 0.25 -0.18 -0.14 0.00 -2.10 0.00 0.00 70.33 68.16 2hms n THR 58 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2hms s GLU 59 N -1.97 2.43 0.27 -0.78 0.41 -0.75 -4.97 118.70 113.34 2hms s GLU 59 Ca 0.28 -1.25 -0.00 0.00 -0.41 0.00 0.00 54.97 53.59 2hms s GLU 59 Cb 0.13 -3.05 0.61 0.00 -1.78 0.00 0.00 34.13 30.05 2hms s GLU 59 CO 0.22 -0.57 1.69 1.05 -0.49 0.00 0.00 175.26 177.16 2hms h GLU 60 N 7.92 0.33 -0.23 1.61 9.09 -1.87 -1.72 114.58 129.71 2hms h GLU 60 Ca -0.22 -0.02 -0.00 0.00 0.05 0.00 0.00 59.36 59.17 2hms h GLU 60 Cb 1.06 -0.07 -0.01 0.00 -1.65 0.00 0.00 28.75 28.08 2hms h GLU 60 CO 0.51 0.22 0.14 -2.95 0.05 0.00 0.00 179.01 176.98 2hms h ASN 61 N 0.34 0.27 0.23 3.06 -1.07 -1.95 0.10 115.58 116.56 2hms h ASN 61 Ca 0.50 -0.04 -0.02 0.00 0.07 0.00 0.00 56.30 56.81 2hms h ASN 61 Cb 0.91 -0.07 -0.00 0.00 -2.07 0.00 0.00 38.32 37.09 2hms h ASN 61 CO -0.53 0.23 -0.08 -0.33 0.07 0.00 0.00 177.43 176.79 2hms h GLU 62 N 0.29 0.00 -0.00 4.14 5.08 -1.68 0.45 114.58 122.86 2hms h GLU 62 Ca 0.08 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.44 2hms h GLU 62 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 2hms h GLU 62 CO -0.02 0.08 -0.01 1.25 -1.00 0.00 0.00 179.01 179.31 2hms h LEU 63 N 0.00 0.02 -0.69 1.33 5.85 -0.36 -2.22 115.31 119.23 2hms h LEU 63 Ca -0.00 -0.68 -0.12 0.00 0.84 0.00 0.00 57.88 57.92 2hms h LEU 63 Cb 0.22 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 2hms h LEU 63 CO 0.01 0.69 -0.25 -0.07 -0.34 0.00 0.00 178.44 178.49 2hms h LEU 64 N -0.66 0.76 -1.72 2.25 4.07 -0.44 -1.62 115.31 117.95 2hms h LEU 64 Ca -0.00 -0.28 0.00 0.00 0.08 0.00 0.00 57.88 57.68 2hms h LEU 64 Cb 0.69 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 42.22 2hms h LEU 64 CO 0.00 0.98 0.00 0.28 -1.08 0.00 0.00 178.44 178.62 2hms h SER 65 N 0.64 0.00 1.23 -0.43 0.02 -0.99 -0.25 113.55 113.78 2hms h SER 65 Ca 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 2hms h SER 65 Cb 0.76 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.30 2hms h SER 65 CO 0.06 0.00 -0.18 -0.11 -1.14 0.00 0.00 176.83 175.46 2hms n LEU 66 N -2.92 0.68 -0.95 5.07 7.94 -0.63 -4.92 117.00 121.27 2hms n LEU 66 Ca -0.00 0.46 -0.08 0.00 -1.11 0.00 0.00 56.01 55.27 2hms n LEU 66 Cb 0.22 -0.30 -0.00 0.00 0.53 0.00 0.00 43.42 43.87 2hms n LEU 66 CO 0.23 -0.12 -0.10 0.61 -1.11 0.00 0.00 177.39 176.91 2hms n GLY 67 N 1.34 0.04 0.36 -3.96 0.00 -0.11 -4.94 105.19 97.93 2hms n GLY 67 Ca 0.05 -0.54 0.08 0.00 0.00 0.00 0.00 46.02 45.61 2hms n GLY 67 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2hms h ILE 68 N -0.03 0.98 0.00 -0.61 1.08 -1.74 -2.37 117.51 114.82 2hms h ILE 68 Ca -0.19 -0.24 0.00 0.00 -0.39 0.00 0.00 64.86 64.03 2hms h ILE 68 Cb 1.14 0.20 0.00 0.00 -3.07 0.00 0.00 36.82 35.09 2hms h ILE 68 CO 0.23 0.13 0.00 -2.11 -0.69 0.00 0.00 178.15 175.71 2hms n ARG 69 N -4.49 0.58 -0.47 2.37 1.85 -1.26 -2.35 116.66 112.88 2hms n ARG 69 Ca 0.12 0.00 0.10 0.00 -1.00 0.00 0.00 57.85 57.07 2hms n ARG 69 Cb 0.28 -1.18 0.32 0.00 -1.05 0.00 0.00 32.46 30.83 2hms n ARG 69 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2hms n ASN 70 N -0.68 4.23 -4.48 2.89 3.02 -0.89 -4.94 115.26 114.41 2hms n ASN 70 Ca 0.05 -2.25 -0.31 0.00 -0.03 0.00 0.00 54.58 52.04 2hms n ASN 70 Cb 0.02 -0.51 -0.12 0.00 -0.61 0.00 0.00 39.78 38.57 2hms n ASN 70 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2hms s PHE 71 N -1.47 2.62 -0.07 3.10 0.40 -0.99 -4.89 117.98 116.66 2hms s PHE 71 Ca 0.47 -0.22 0.14 0.00 -0.60 0.00 0.00 56.93 56.72 2hms s PHE 71 Cb 0.28 -1.49 -0.20 0.00 0.51 0.00 0.00 43.02 42.13 2hms s PHE 71 CO 0.26 0.28 0.72 -1.91 0.70 0.00 0.00 175.22 175.27 2hms n GLU 72 N 1.52 0.63 -3.90 0.44 2.13 -1.19 -4.53 120.64 115.74 2hms n GLU 72 Ca -0.16 0.27 -0.26 0.00 0.66 0.00 0.00 57.16 57.67 2hms n GLU 72 Cb 0.52 -1.80 -0.17 0.00 0.27 0.00 0.00 31.44 30.26 2hms n GLU 72 CO 0.00 0.00 0.00 0.71 -0.41 0.00 0.00 177.13 177.43 2hms s TYR 73 N -2.72 1.28 -0.18 4.31 1.51 -0.93 -1.27 117.35 119.36 2hms s TYR 73 Ca -0.04 -0.59 0.01 0.00 -1.01 0.00 0.00 57.07 55.44 2hms s TYR 73 Cb 0.08 -1.12 0.03 0.00 -0.11 0.00 0.00 41.96 40.84 2hms s TYR 73 CO 0.82 -0.46 -0.15 0.08 -1.11 0.00 0.00 175.55 174.73 2hms s VAL 74 N 1.72 1.79 -0.29 0.71 1.01 -0.05 -0.99 120.40 124.29 2hms s VAL 74 Ca 0.04 -0.87 -0.13 0.00 0.00 0.00 0.00 61.98 61.03 2hms s VAL 74 Cb -0.13 -1.70 -0.04 0.00 0.00 0.00 0.00 36.38 34.52 2hms s VAL 74 CO -0.07 0.40 0.26 -0.63 0.00 0.00 0.00 175.10 175.06 2hms s ILE 75 N 1.38 5.26 -0.55 2.22 1.09 0.82 -1.77 121.20 129.64 2hms s ILE 75 Ca 0.03 0.19 -0.20 0.00 -1.10 0.00 0.00 60.65 59.57 2hms s ILE 75 Cb -0.14 -3.63 0.07 0.00 -1.06 0.00 0.00 42.46 37.70 2hms s ILE 75 CO -0.11 0.15 0.72 -0.69 -0.10 0.00 0.00 174.94 174.91 2hms s VAL 76 N 1.86 4.74 -0.30 2.92 1.01 0.22 -0.54 120.40 130.31 2hms s VAL 76 Ca 0.09 -0.51 0.11 0.00 0.00 0.00 0.00 61.98 61.67 2hms s VAL 76 Cb -0.16 -4.42 0.69 0.00 0.00 0.00 0.00 36.38 32.49 2hms s VAL 76 CO 0.11 -0.99 1.71 0.00 0.00 0.00 0.00 175.10 175.92 2hms n ALA 77 N 6.53 4.29 -2.08 5.51 0.00 0.31 -1.69 120.51 133.38 2hms n ALA 77 Ca -0.06 -2.44 -0.41 0.00 0.00 0.00 0.00 53.44 50.53 2hms n ALA 77 Cb 0.45 -1.10 -0.03 0.00 0.00 0.00 0.00 19.45 18.77 2hms n ALA 77 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2hms s ILE 78 N -3.00 3.65 0.00 0.00 1.01 -1.19 -4.55 121.20 117.11 2hms s ILE 78 Ca 0.52 1.37 0.00 0.00 0.00 0.00 0.00 60.65 62.54 2hms s ILE 78 Cb 0.42 -3.88 0.00 0.00 0.01 0.00 0.00 42.46 39.01 2hms s ILE 78 CO 0.11 0.21 0.00 0.61 0.00 0.00 0.00 174.94 175.88 2hms n GLY 79 N 2.24 -0.04 0.38 6.18 0.00 -1.26 -4.77 105.19 107.93 2hms n GLY 79 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.96 2hms n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hms n ALA 80 N -1.91 -0.59 -1.99 4.61 0.00 -1.26 -3.84 120.51 115.53 2hms n ALA 80 Ca 0.00 0.78 -0.25 0.00 0.00 0.00 0.00 53.44 53.97 2hms n ALA 80 Cb 0.00 -0.09 -0.06 0.00 0.00 0.00 0.00 19.45 19.30 2hms n ALA 80 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2hms s ASN 81 N -5.31 4.89 0.32 0.00 3.84 -1.26 -4.81 114.94 112.62 2hms s ASN 81 Ca -0.11 -0.99 0.03 0.00 0.21 0.00 0.00 52.86 52.00 2hms s ASN 81 Cb 0.10 -2.57 0.62 0.00 -0.55 0.00 0.00 41.25 38.85 2hms s ASN 81 CO 0.57 -3.09 1.92 0.40 -2.79 0.00 0.00 177.10 174.11 2hms h ILE 82 N 6.88 1.03 0.11 -5.21 2.04 -1.94 -1.29 117.51 119.13 2hms h ILE 82 Ca 0.13 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 2hms h ILE 82 Cb 0.98 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.10 2hms h ILE 82 CO 1.19 0.17 -0.05 -0.61 0.00 0.00 0.00 178.15 178.84 2hms h GLN 83 N 0.91 -0.15 -0.45 2.37 4.15 -1.94 0.49 115.11 120.49 2hms h GLN 83 Ca 0.37 0.01 0.04 0.00 0.77 0.00 0.00 58.65 59.85 2hms h GLN 83 Cb 0.28 0.03 -0.04 0.00 0.21 0.00 0.00 27.48 27.96 2hms h GLN 83 CO -0.14 0.07 0.20 0.00 -1.93 0.00 0.00 178.83 177.03 2hms h ALA 84 N 0.53 0.56 -0.07 3.38 0.00 -1.89 0.37 119.26 122.14 2hms h ALA 84 Ca -0.02 0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.95 2hms h ALA 84 Cb 0.28 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2hms h ALA 84 CO 0.03 -0.16 -0.09 1.03 0.00 0.00 0.00 179.25 180.05 2hms h SER 85 N 0.41 -0.28 -0.09 0.00 0.87 -1.10 0.10 113.55 113.46 2hms h SER 85 Ca 0.20 0.05 -0.01 0.00 -1.23 0.00 0.00 61.79 60.80 2hms h SER 85 Cb 0.14 0.13 -0.00 0.00 -0.44 0.00 0.00 62.40 62.23 2hms h SER 85 CO -0.16 -0.13 0.01 0.74 -0.53 0.00 0.00 176.83 176.76 2hms h THR 86 N -0.12 1.22 -0.99 2.23 2.02 -0.45 -2.55 112.91 114.26 2hms h THR 86 Ca 0.06 -0.67 0.05 0.00 0.77 0.00 0.00 66.41 66.62 2hms h THR 86 Cb 0.21 1.49 -0.06 0.00 -1.74 0.00 0.00 68.15 68.05 2hms h THR 86 CO -0.15 0.19 0.64 0.25 0.37 0.00 0.00 175.52 176.83 2hms h LEU 87 N -0.09 1.05 -0.01 2.58 5.85 -0.12 -1.82 115.31 122.76 2hms h LEU 87 Ca 0.03 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 2hms h LEU 87 Cb 0.29 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.09 2hms h LEU 87 CO 0.00 0.70 0.00 0.74 -0.34 0.00 0.00 178.44 179.54 2hms h THR 88 N 1.21 1.07 0.00 1.05 2.02 -0.64 -1.01 112.91 116.61 2hms h THR 88 Ca 0.41 -0.21 -0.04 0.00 0.77 0.00 0.00 66.41 67.34 2hms h THR 88 Cb 0.08 1.20 -0.01 0.00 -1.74 0.00 0.00 68.15 67.68 2hms h THR 88 CO -0.15 0.06 -0.21 0.71 0.37 0.00 0.00 175.52 176.30 2hms h THR 89 N -0.07 0.84 -0.13 3.16 1.35 -1.23 -1.04 112.91 115.79 2hms h THR 89 Ca 0.00 -0.80 -0.02 0.00 -0.55 0.00 0.00 66.41 65.04 2hms h THR 89 Cb 0.09 1.48 -0.01 0.00 -1.73 0.00 0.00 68.15 67.98 2hms h THR 89 CO -0.00 0.20 0.01 0.25 -0.25 0.00 0.00 175.52 175.74 2hms h LEU 90 N 0.00 0.22 -0.16 3.87 5.85 -0.84 -0.02 115.31 124.22 2hms h LEU 90 Ca -0.00 -0.28 -0.00 0.00 0.84 0.00 0.00 57.88 58.44 2hms h LEU 90 Cb 0.46 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 2hms h LEU 90 CO 0.03 0.44 0.09 -0.07 -0.34 0.00 0.00 178.44 178.58 2hms h LEU 91 N -0.01 0.21 -0.83 2.25 3.38 -0.63 -2.55 115.31 117.12 2hms h LEU 91 Ca 0.04 -0.10 0.11 0.00 0.09 0.00 0.00 57.88 58.02 2hms h LEU 91 Cb 0.32 -0.05 -0.08 0.00 0.09 0.00 0.00 40.66 40.94 2hms h LEU 91 CO 0.00 0.25 0.46 -0.07 0.09 0.00 0.00 178.44 179.17 2hms h LEU 92 N 0.15 0.62 -1.37 1.67 3.38 -1.12 0.11 115.31 118.76 2hms h LEU 92 Ca 0.06 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 2hms h LEU 92 Cb 0.09 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2hms h LEU 92 CO -0.01 0.33 0.19 0.50 0.09 0.00 0.00 178.44 179.54 2hms h LYS 93 N 0.73 0.62 -0.10 1.13 1.63 -0.73 -1.70 116.57 118.16 2hms h LYS 93 Ca 0.42 -0.08 -0.07 0.00 -0.85 0.00 0.00 60.65 60.07 2hms h LYS 93 Cb 0.46 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 31.97 2hms h LYS 93 CO -0.28 0.50 -0.20 0.93 -3.45 0.00 0.00 179.45 176.94 2hms h GLU 94 N 0.62 0.31 0.00 1.90 5.08 -0.49 -2.24 114.58 119.76 2hms h GLU 94 Ca 0.15 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2hms h GLU 94 Cb 0.10 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.38 2hms h GLU 94 CO -0.02 0.80 0.05 1.28 -1.00 0.00 0.00 179.01 180.12 2hms n LEU 95 N -4.53 0.00 -2.06 1.33 7.99 0.14 -4.81 117.00 115.06 2hms n LEU 95 Ca -0.07 0.45 -0.11 0.00 -0.01 0.00 0.00 56.01 56.26 2hms n LEU 95 Cb 0.42 -0.45 0.04 0.00 -0.11 0.00 0.00 43.42 43.32 2hms n LEU 95 CO 0.40 -0.45 0.10 0.47 -1.51 0.00 0.00 177.39 176.40 2hms n ASP 96 N -1.45 -3.60 -4.71 -1.43 9.92 -0.68 -4.89 116.55 109.70 2hms n ASP 96 Ca 0.00 -0.27 -0.42 0.00 -0.53 0.00 0.00 54.79 53.56 2hms n ASP 96 Cb 0.05 -2.74 -0.03 0.00 -0.64 0.00 0.00 41.12 37.76 2hms n ASP 96 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2hms s ILE 97 N -3.16 3.50 0.20 0.53 -1.09 -0.93 -4.94 121.20 115.31 2hms s ILE 97 Ca 0.21 1.07 -0.11 0.00 -2.23 0.00 0.00 60.65 59.60 2hms s ILE 97 Cb -0.09 -3.68 0.12 0.00 -1.58 0.00 0.00 42.46 37.23 2hms s ILE 97 CO 0.36 0.08 1.82 -0.65 -1.23 0.00 0.00 174.94 175.31 2hms h PRO 98 N 6.90 0.68 -3.74 2.79 0.11 -1.80 -3.41 132.00 133.53 2hms h PRO 98 Ca -0.42 -0.04 -0.51 0.00 0.11 0.00 0.00 66.00 65.14 2hms h PRO 98 Cb 1.21 -0.15 -0.39 0.00 0.11 0.00 0.00 31.00 31.77 2hms h PRO 98 CO 0.86 0.45 -0.77 -0.80 -0.21 0.00 0.00 178.00 177.52 2hms s ASN 99 N -5.62 2.62 -0.21 -2.05 -0.87 -0.39 -5.00 114.94 103.42 2hms s ASN 99 Ca -0.13 -0.63 0.01 0.00 -1.57 0.00 0.00 52.86 50.54 2hms s ASN 99 Cb 0.15 -0.65 0.04 0.00 -0.02 0.00 0.00 41.25 40.77 2hms s ASN 99 CO 0.76 -0.25 -0.12 -0.51 -2.57 0.00 0.00 177.10 174.40 2hms s ILE 100 N 1.82 1.83 -0.17 0.60 2.07 -1.26 -0.88 121.20 125.21 2hms s ILE 100 Ca 0.01 -1.11 -0.06 0.00 -1.41 0.00 0.00 60.65 58.07 2hms s ILE 100 Cb -0.16 -1.85 -0.04 0.00 0.13 0.00 0.00 42.46 40.54 2hms s ILE 100 CO -0.07 0.21 0.03 0.26 -1.91 0.00 0.00 174.94 173.45 2hms s TRP 101 N 1.32 3.17 -0.02 3.50 0.52 -0.73 -1.21 118.94 125.48 2hms s TRP 101 Ca -0.01 -0.06 0.06 0.00 0.02 0.00 0.00 56.10 56.10 2hms s TRP 101 Cb -0.16 -2.04 -0.01 0.00 -1.15 0.00 0.00 33.47 30.11 2hms s TRP 101 CO -0.09 0.09 -0.19 0.08 0.02 0.00 0.00 176.95 176.86 2hms s VAL 102 N 0.37 1.53 -0.01 4.03 1.01 0.04 -0.61 120.40 126.76 2hms s VAL 102 Ca 0.01 -0.81 -0.30 0.00 0.00 0.00 0.00 61.98 60.87 2hms s VAL 102 Cb -0.13 -1.28 -0.03 0.00 0.00 0.00 0.00 36.38 34.94 2hms s VAL 102 CO 0.01 0.43 1.01 -0.75 0.00 0.00 0.00 175.10 175.81 2hms s LYS 103 N -0.33 4.52 -0.07 2.72 2.20 -0.68 -0.39 119.74 127.71 2hms s LYS 103 Ca 0.04 1.46 0.01 0.00 -0.36 0.00 0.00 55.97 57.12 2hms s LYS 103 Cb -0.09 -3.46 -0.03 0.00 -1.51 0.00 0.00 37.83 32.74 2hms s LYS 103 CO 0.00 -0.12 -0.07 0.00 -0.36 0.00 0.00 175.35 174.80 2hms s ALA 104 N 1.21 2.99 -0.17 3.13 0.00 0.08 -4.88 121.76 124.11 2hms s ALA 104 Ca 0.52 -0.89 0.17 0.00 0.00 0.00 0.00 51.96 51.76 2hms s ALA 104 Cb -0.22 -1.23 0.01 0.00 0.00 0.00 0.00 23.12 21.69 2hms s ALA 104 CO 0.26 0.57 1.22 1.96 0.00 0.00 0.00 175.76 179.78 2hms h GLN 105 N 5.22 0.00 0.00 0.00 1.08 -1.88 -3.42 115.11 116.11 2hms h GLN 105 Ca -0.49 0.00 0.09 0.00 -1.45 0.00 0.00 58.65 56.80 2hms h GLN 105 Cb 1.17 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.59 2hms h GLN 105 CO 0.52 0.35 0.39 0.27 -0.95 0.00 0.00 178.83 179.41 2hms n ASN 106 N -3.06 -1.37 -0.04 1.46 0.23 -1.26 -5.03 115.26 106.19 2hms n ASN 106 Ca -0.02 -1.78 -0.08 0.00 -0.53 0.00 0.00 54.58 52.18 2hms n ASN 106 Cb 0.74 2.25 -0.02 0.00 -2.08 0.00 0.00 39.78 40.66 2hms n ASN 106 CO 0.00 0.00 0.00 0.22 -0.93 0.00 0.00 177.26 176.55 2hms h TYR 107 N 1.73 -0.30 -0.45 -2.53 3.20 -1.98 -0.81 116.97 115.83 2hms h TYR 107 Ca -0.21 0.03 -0.11 0.00 3.14 0.00 0.00 58.73 61.58 2hms h TYR 107 Cb 0.90 0.16 -0.01 0.00 1.54 0.00 0.00 36.73 39.32 2hms h TYR 107 CO 0.00 -0.18 -0.14 1.88 -1.64 0.00 0.00 178.16 178.08 2hms h TYR 108 N -0.11 0.99 -0.92 -3.82 0.05 -1.98 0.13 116.97 111.32 2hms h TYR 108 Ca 0.12 -0.22 0.07 0.00 0.05 0.00 0.00 58.73 58.74 2hms h TYR 108 Cb 0.28 -0.24 -0.06 0.00 1.01 0.00 0.00 36.73 37.72 2hms h TYR 108 CO -0.28 0.99 0.58 1.25 -1.05 0.00 0.00 178.16 179.64 2hms h HIS 109 N 0.71 1.07 -0.32 4.88 2.76 -1.92 -0.71 115.15 121.62 2hms h HIS 109 Ca 0.11 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.30 2hms h HIS 109 Cb 0.69 -0.35 -0.01 0.00 1.55 0.00 0.00 27.41 29.28 2hms h HIS 109 CO 0.05 0.54 0.16 1.25 -1.30 0.00 0.00 177.93 178.63 2hms h HIS 110 N 1.04 0.46 -0.15 5.26 -0.00 -0.65 -2.39 115.15 118.72 2hms h HIS 110 Ca 0.40 -0.02 0.04 0.00 -0.00 0.00 0.00 60.37 60.79 2hms h HIS 110 Cb 0.18 -0.14 -0.04 0.00 -0.00 0.00 0.00 27.41 27.41 2hms h HIS 110 CO -0.02 0.40 -0.08 -0.22 -0.00 0.00 0.00 177.93 178.00 2hms h LYS 111 N 0.38 -0.07 0.00 5.26 1.63 0.71 -2.04 116.57 122.44 2hms h LYS 111 Ca 0.11 0.00 -0.07 0.00 -0.85 0.00 0.00 60.65 59.84 2hms h LYS 111 Cb 0.11 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.74 2hms h LYS 111 CO -0.01 -0.05 -0.35 -0.39 -3.45 0.00 0.00 179.45 175.20 2hms h VAL 112 N -0.07 1.03 -0.45 2.00 -1.51 -1.31 -2.54 116.25 113.39 2hms h VAL 112 Ca 0.09 -1.29 -0.05 0.00 -1.23 0.00 0.00 66.70 64.21 2hms h VAL 112 Cb 0.20 1.74 -0.02 0.00 -2.13 0.00 0.00 31.29 31.08 2hms h VAL 112 CO -0.20 0.34 0.07 -0.07 -1.23 0.00 0.00 177.57 176.48 2hms h LEU 113 N 0.00 0.66 0.31 4.19 3.38 -0.84 0.10 115.31 123.11 2hms h LEU 113 Ca -0.00 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 2hms h LEU 113 Cb 0.72 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.30 2hms h LEU 113 CO 0.05 0.69 -0.15 -0.33 0.09 0.00 0.00 178.44 178.78 2hms h GLU 114 N 0.68 -0.41 -0.85 1.13 5.08 -1.01 -0.57 114.58 118.63 2hms h GLU 114 Ca 0.15 0.03 0.12 0.00 -1.00 0.00 0.00 59.36 58.65 2hms h GLU 114 Cb 0.32 0.09 -0.08 0.00 0.50 0.00 0.00 28.75 29.58 2hms h GLU 114 CO 0.00 -0.15 0.47 0.87 -1.00 0.00 0.00 179.01 179.21 2hms h LYS 115 N -0.62 0.73 0.00 2.33 1.79 -1.26 0.97 116.57 120.51 2hms h LYS 115 Ca -0.04 -0.04 -0.03 0.00 -2.18 0.00 0.00 60.65 58.36 2hms h LYS 115 Cb 0.44 -0.16 -0.00 0.00 -1.58 0.00 0.00 32.23 30.93 2hms h LYS 115 CO 0.07 0.48 -0.13 0.82 -1.08 0.00 0.00 179.45 179.61 2hms h ILE 116 N 0.75 0.57 0.00 1.86 2.04 -0.70 -3.46 117.51 118.56 2hms h ILE 116 Ca 0.43 -0.59 0.00 0.00 1.00 0.00 0.00 64.86 65.70 2hms h ILE 116 Cb 0.48 1.38 0.00 0.00 -0.74 0.00 0.00 36.82 37.95 2hms h ILE 116 CO -0.29 0.13 0.00 0.61 0.00 0.00 0.00 178.15 178.60 2hms n GLY 117 N -0.61 1.47 3.74 5.37 0.00 0.34 -4.92 105.19 110.58 2hms n GLY 117 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 2hms n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hms n ALA 118 N -0.65 1.78 0.04 4.61 0.00 -0.27 -4.94 120.51 121.08 2hms n ALA 118 Ca 0.00 0.31 -0.13 0.00 0.00 0.00 0.00 53.44 53.62 2hms n ALA 118 Cb 0.00 -2.34 -0.14 0.00 0.00 0.00 0.00 19.45 16.98 2hms n ALA 118 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2hms h ASP 119 N 2.52 0.21 -3.18 0.00 3.32 -1.50 -3.45 116.42 114.34 2hms h ASP 119 Ca -0.49 -0.31 -0.18 0.00 0.02 0.00 0.00 57.03 56.08 2hms h ASP 119 Cb 1.27 -0.07 -0.30 0.00 0.22 0.00 0.00 39.33 40.46 2hms h ASP 119 CO 0.62 1.26 -0.45 -0.60 -1.72 0.00 0.00 179.24 178.35 2hms s ARG 120 N -2.63 0.24 -0.19 3.56 3.52 -1.19 -5.01 118.95 117.24 2hms s ARG 120 Ca -0.06 0.65 -0.04 0.00 -0.13 0.00 0.00 55.73 56.15 2hms s ARG 120 Cb 0.08 -0.06 -0.02 0.00 -1.56 0.00 0.00 34.95 33.39 2hms s ARG 120 CO 0.83 -0.19 -0.04 0.42 -0.81 0.00 0.00 175.30 175.51 2hms s ILE 121 N 1.59 3.54 -0.12 4.11 1.01 -1.26 -0.78 121.20 129.29 2hms s ILE 121 Ca -0.07 -0.45 -0.01 0.00 0.00 0.00 0.00 60.65 60.11 2hms s ILE 121 Cb -0.10 -2.58 -0.03 0.00 0.01 0.00 0.00 42.46 39.76 2hms s ILE 121 CO -0.10 0.45 -0.07 -0.63 0.00 0.00 0.00 174.94 174.60 2hms s ILE 122 N 1.06 3.68 -0.71 2.92 1.01 0.48 -4.94 121.20 124.70 2hms s ILE 122 Ca 0.01 -0.46 0.05 0.00 0.00 0.00 0.00 60.65 60.25 2hms s ILE 122 Cb -0.15 -2.56 0.20 0.00 0.01 0.00 0.00 42.46 39.96 2hms s ILE 122 CO 0.00 0.54 0.60 1.41 0.00 0.00 0.00 174.94 177.49 2hms n HIS 123 N 2.99 3.44 -0.27 3.97 8.25 -1.26 -0.75 115.22 131.59 2hms n HIS 123 Ca -0.18 -4.24 -0.00 0.00 -0.26 0.00 0.00 57.72 53.04 2hms n HIS 123 Cb 0.53 -0.66 0.03 0.00 1.12 0.00 0.00 29.99 31.01 2hms n HIS 123 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 2hms n PRO 124 N 1.68 -0.16 -0.07 -0.41 -0.02 -1.26 -0.47 135.00 134.30 2hms n PRO 124 Ca 0.23 1.10 -0.14 0.00 -2.02 0.00 0.00 63.50 62.67 2hms n PRO 124 Cb 0.37 -1.63 -0.06 0.00 -0.02 0.00 0.00 33.50 32.15 2hms n PRO 124 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2hms h GLU 125 N 0.00 0.52 0.05 -0.52 4.81 -1.97 -1.82 114.58 115.64 2hms h GLU 125 Ca 0.25 -0.29 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2hms h GLU 125 Cb 0.43 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.83 2hms h GLU 125 CO -0.71 0.88 -0.02 0.87 -0.73 0.00 0.00 179.01 179.30 2hms h LYS 126 N 0.18 -0.06 -0.88 1.92 1.57 -1.69 -1.06 116.57 116.55 2hms h LYS 126 Ca 0.02 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.90 2hms h LYS 126 Cb 0.82 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 33.07 2hms h LYS 126 CO 0.06 0.21 0.52 -0.44 -0.57 0.00 0.00 179.45 179.23 2hms h ASP 127 N -0.33 0.77 -0.40 0.86 5.19 -0.83 -0.08 116.42 121.62 2hms h ASP 127 Ca -0.01 0.04 -0.07 0.00 -0.62 0.00 0.00 57.03 56.37 2hms h ASP 127 Cb 0.29 -0.11 -0.02 0.00 0.18 0.00 0.00 39.33 39.67 2hms h ASP 127 CO 0.01 0.44 -0.00 0.24 -3.12 0.00 0.00 179.24 176.81 2hms h MET 128 N 0.88 0.79 -0.35 3.56 2.86 -1.21 -1.62 114.93 119.85 2hms h MET 128 Ca 0.42 -0.21 0.04 0.00 -2.06 0.00 0.00 59.70 57.88 2hms h MET 128 Cb 0.35 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 31.88 2hms h MET 128 CO -0.24 0.79 0.13 0.78 1.06 0.00 0.00 176.91 179.43 2hms h GLY 129 N 0.97 0.44 1.51 8.32 0.00 0.33 0.47 103.07 115.12 2hms h GLY 129 Ca 0.14 -0.08 -0.13 0.00 0.00 0.00 0.00 47.33 47.27 2hms h GLY 129 CO 0.02 0.04 -0.38 -0.39 0.00 0.00 0.00 176.54 175.83 2hms h VAL 130 N 0.28 1.30 -0.64 4.60 -1.51 -1.10 -1.19 116.25 117.97 2hms h VAL 130 Ca 0.15 -1.52 -0.04 0.00 -1.23 0.00 0.00 66.70 64.06 2hms h VAL 130 Cb 0.12 1.52 -0.03 0.00 -2.13 0.00 0.00 31.29 30.77 2hms h VAL 130 CO -0.15 0.48 0.24 0.50 -1.23 0.00 0.00 177.57 177.40 2hms h LYS 131 N 0.45 0.97 -0.61 5.19 3.11 -0.65 -1.40 116.57 123.64 2hms h LYS 131 Ca 0.04 -0.19 -0.09 0.00 -2.81 0.00 0.00 60.65 57.61 2hms h LYS 131 Cb 0.86 -0.15 -0.02 0.00 -1.00 0.00 0.00 32.23 31.92 2hms h LYS 131 CO 0.07 0.83 0.03 0.82 -2.81 0.00 0.00 179.45 178.40 2hms h ILE 132 N 0.91 1.26 -0.62 2.00 1.08 0.24 -1.81 117.51 120.57 2hms h ILE 132 Ca 0.21 -1.10 -0.07 0.00 -0.39 0.00 0.00 64.86 63.51 2hms h ILE 132 Cb 0.24 0.75 -0.03 0.00 -3.07 0.00 0.00 36.82 34.71 2hms h ILE 132 CO -0.01 0.40 0.11 0.00 -0.69 0.00 0.00 178.15 177.95 2hms h ALA 133 N 1.06 1.01 -0.67 1.87 0.00 -0.92 -0.58 119.26 121.03 2hms h ALA 133 Ca 0.18 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 2hms h ALA 133 Cb 0.51 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2hms h ALA 133 CO 0.02 0.63 0.16 1.96 0.00 0.00 0.00 179.25 182.02 2hms h GLN 134 N 0.95 1.07 -0.13 0.00 4.20 -1.03 -1.57 115.11 118.60 2hms h GLN 134 Ca 0.19 -0.25 -0.06 0.00 0.06 0.00 0.00 58.65 58.59 2hms h GLN 134 Cb 0.40 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 2hms h GLN 134 CO 0.01 0.95 -0.19 1.03 -0.67 0.00 0.00 178.83 179.97 2hms h SER 135 N 1.02 0.20 -0.38 1.46 0.87 -0.76 -2.16 113.55 113.80 2hms h SER 135 Ca 0.21 -0.05 -0.11 0.00 -1.23 0.00 0.00 61.79 60.61 2hms h SER 135 Cb 0.37 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 62.26 2hms h SER 135 CO 0.00 0.41 -0.17 -0.07 -0.53 0.00 0.00 176.83 176.46 2hms h LEU 136 N 0.20 0.87 0.01 2.23 3.38 -0.16 -3.06 115.31 118.78 2hms h LEU 136 Ca 0.04 -0.30 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 2hms h LEU 136 Cb 0.45 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2hms h LEU 136 CO 0.03 1.03 -0.00 0.28 0.09 0.00 0.00 178.44 179.87 2hms h SER 137 N 0.76 -0.01 0.00 -0.43 0.02 -0.98 -3.07 113.55 109.84 2hms h SER 137 Ca 0.11 -0.35 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 2hms h SER 137 Cb 0.70 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.24 2hms h SER 137 CO 0.05 0.35 0.00 0.47 -1.14 0.00 0.00 176.83 176.56 2hms n ASP 138 N -4.92 0.00 -3.22 3.07 9.92 -0.85 -2.52 116.55 118.02 2hms n ASP 138 Ca -0.08 0.00 -0.25 0.00 -0.53 0.00 0.00 54.79 53.93 2hms n ASP 138 Cb 0.19 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 40.61 2hms n ASP 138 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2hms n GLU 139 N -0.80 1.88 -0.62 -1.24 1.02 -1.16 -5.07 120.64 114.64 2hms n GLU 139 Ca 0.00 -4.07 0.00 0.00 -0.02 0.00 0.00 57.16 53.07 2hms n GLU 139 Cb 0.00 -1.85 0.00 0.00 -0.02 0.00 0.00 31.44 29.57 2hms n GLU 139 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40