#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2orc s GLU 2 N 0.00 1.99 -0.70 2.12 2.12 -1.26 -5.00 118.70 117.97 2orc s GLU 2 Ca 0.00 0.81 0.05 0.00 0.36 0.00 0.00 54.97 56.19 2orc s GLU 2 Cb 0.00 -1.89 0.21 0.00 0.26 0.00 0.00 34.13 32.71 2orc s GLU 2 CO 0.00 -1.73 0.64 1.04 -0.54 0.00 0.00 175.26 174.67 2orc n GLN 3 N -3.54 2.24 -2.42 4.30 6.02 -1.26 -5.01 117.38 117.71 2orc n GLN 3 Ca 0.07 -4.58 -0.38 0.00 -0.01 0.00 0.00 57.00 52.10 2orc n GLN 3 Cb 0.55 -2.29 -0.02 0.00 1.02 0.00 0.00 30.24 29.50 2orc n GLN 3 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 2orc s ARG 4 N -1.94 3.47 0.53 -1.09 3.52 -1.26 -1.44 118.95 120.73 2orc s ARG 4 Ca 0.32 -1.49 -0.09 0.00 -0.13 0.00 0.00 55.73 54.34 2orc s ARG 4 Cb 0.04 -5.40 0.12 0.00 -1.56 0.00 0.00 34.95 28.16 2orc s ARG 4 CO -0.09 -2.71 0.64 1.51 -0.81 0.00 0.00 175.30 173.84 2orc n ILE 5 N 6.93 0.00 -2.48 4.11 0.13 0.20 -4.78 119.36 123.47 2orc n ILE 5 Ca 0.44 -0.43 -0.22 0.00 -1.10 0.00 0.00 62.75 61.44 2orc n ILE 5 Cb 0.47 -1.59 0.12 0.00 -0.84 0.00 0.00 39.64 37.80 2orc n ILE 5 CO 0.00 0.00 0.00 0.41 2.80 0.00 0.00 176.55 179.76 2orc n THR 6 N -3.12 0.00 -0.08 9.51 -1.04 -1.26 -1.90 114.28 116.39 2orc n THR 6 Ca 0.08 -1.35 -0.23 0.00 -2.04 0.00 0.00 64.05 60.51 2orc n THR 6 Cb 0.29 -1.02 -0.12 0.00 -1.82 0.00 0.00 70.33 67.66 2orc n THR 6 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2orc n LEU 7 N 0.00 2.20 -0.03 -4.42 7.94 -1.26 -3.83 117.00 117.60 2orc n LEU 7 Ca 0.15 0.30 -0.02 0.00 -1.11 0.00 0.00 56.01 55.33 2orc n LEU 7 Cb 0.53 -0.99 -0.01 0.00 0.53 0.00 0.00 43.42 43.49 2orc n LEU 7 CO 0.36 0.55 -0.14 0.50 -1.11 0.00 0.00 177.39 177.56 2orc h LYS 8 N -0.59 0.00 -0.83 1.96 3.11 -1.96 -3.16 116.57 115.10 2orc h LYS 8 Ca -0.45 0.00 0.20 0.00 -2.81 0.00 0.00 60.65 57.60 2orc h LYS 8 Cb 1.62 0.00 -0.14 0.00 -1.00 0.00 0.00 32.23 32.71 2orc h LYS 8 CO -0.14 0.00 0.05 0.22 -2.81 0.00 0.00 179.45 176.76 2orc h ASP 9 N -0.43 -0.32 0.28 4.20 3.58 -1.99 0.85 116.42 122.59 2orc h ASP 9 Ca 0.00 0.21 -0.00 0.00 0.42 0.00 0.00 57.03 57.66 2orc h ASP 9 Cb 0.21 0.36 -0.02 0.00 1.72 0.00 0.00 39.33 41.59 2orc h ASP 9 CO 0.00 -0.21 -0.39 0.22 -2.88 0.00 0.00 179.24 175.98 2orc h TYR 10 N 0.11 -1.11 -0.06 0.28 3.20 -1.75 0.16 116.97 117.80 2orc h TYR 10 Ca 0.47 0.02 0.02 0.00 3.14 0.00 0.00 58.73 62.38 2orc h TYR 10 Cb 0.88 0.45 -0.00 0.00 1.54 0.00 0.00 36.73 39.60 2orc h TYR 10 CO -0.42 -0.50 0.42 0.00 -1.64 0.00 0.00 178.16 176.03 2orc h ALA 11 N -0.99 1.51 -0.01 1.82 0.00 -1.02 0.10 119.26 120.67 2orc h ALA 11 Ca -0.03 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2orc h ALA 11 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2orc h ALA 11 CO -0.11 -0.45 -0.03 1.98 0.00 0.00 0.00 179.25 180.64 2orc h MET 12 N 0.00 0.03 -0.42 0.00 1.85 0.16 0.17 114.93 116.73 2orc h MET 12 Ca 0.03 -0.02 -0.02 0.00 -0.61 0.00 0.00 59.70 59.07 2orc h MET 12 Cb 0.87 0.00 -0.02 0.00 0.43 0.00 0.00 31.60 32.89 2orc h MET 12 CO -0.00 0.66 0.17 -0.09 -0.40 0.00 0.00 176.91 177.25 2orc h ARG 13 N -0.58 0.58 0.00 0.39 9.65 -0.19 -3.39 114.38 120.84 2orc h ARG 13 Ca -0.00 -0.07 0.00 0.00 -1.10 0.00 0.00 59.98 58.81 2orc h ARG 13 Cb 0.66 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 29.13 2orc h ARG 13 CO 0.01 0.48 0.00 1.19 2.80 0.00 0.00 179.97 184.45 2orc n PHE 14 N -4.38 0.00 -3.60 2.20 3.01 -0.97 -5.13 117.46 108.59 2orc n PHE 14 Ca 0.03 0.00 -0.08 0.00 1.01 0.00 0.00 57.45 58.41 2orc n PHE 14 Cb 0.14 0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.56 2orc n PHE 14 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2orc s GLY 15 N -0.82 -0.17 0.31 1.37 0.00 0.60 -4.99 107.32 103.62 2orc s GLY 15 Ca 0.00 2.25 0.09 0.00 0.00 0.00 0.00 44.72 47.06 2orc s GLY 15 CO 0.00 1.05 1.71 1.46 0.00 0.00 0.00 173.10 177.32 2orc h GLN 16 N 2.42 0.10 0.00 2.90 4.20 -1.91 -2.43 115.11 120.39 2orc h GLN 16 Ca -0.15 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.51 2orc h GLN 16 Cb 1.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.95 2orc h GLN 16 CO 0.29 0.54 -0.27 -2.37 -0.67 0.00 0.00 178.83 176.34 2orc n THR 17 N -3.99 0.47 -0.07 -0.54 5.66 -1.26 -2.66 114.28 111.89 2orc n THR 17 Ca -0.02 -0.27 -0.12 0.00 -3.05 0.00 0.00 64.05 60.60 2orc n THR 17 Cb 0.50 -0.37 -0.09 0.00 -1.55 0.00 0.00 70.33 68.81 2orc n THR 17 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 175.07 172.13 2orc h LYS 18 N 0.00 0.00 -0.12 1.09 1.57 -1.84 -2.05 116.57 115.21 2orc h LYS 18 Ca 0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 2orc h LYS 18 Cb 0.73 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.03 2orc h LYS 18 CO 0.00 0.71 -0.01 0.00 -0.57 0.00 0.00 179.45 179.57 2orc h THR 19 N -1.00 1.09 -0.08 -0.16 1.03 -1.57 -0.31 112.91 111.91 2orc h THR 19 Ca -0.06 -0.36 -0.06 0.00 -0.01 0.00 0.00 66.41 65.92 2orc h THR 19 Cb 0.79 1.01 0.00 0.00 -1.07 0.00 0.00 68.15 68.89 2orc h THR 19 CO -0.04 0.12 -0.17 0.00 -0.01 0.00 0.00 175.52 175.42 2orc h ALA 20 N 1.82 0.12 0.00 0.00 0.00 -1.60 -2.85 119.26 116.75 2orc h ALA 20 Ca 0.04 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2orc h ALA 20 Cb 0.14 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2orc h ALA 20 CO 0.00 0.05 0.00 0.87 0.00 0.00 0.00 179.25 180.17 2orc h LYS 21 N -0.23 0.00 0.12 0.00 1.79 -0.93 -2.60 116.57 114.73 2orc h LYS 21 Ca -0.00 0.00 -0.27 0.00 -2.18 0.00 0.00 60.65 58.20 2orc h LYS 21 Cb 0.77 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.42 2orc h LYS 21 CO 0.04 0.00 -1.22 -0.44 -1.08 0.00 0.00 179.45 176.75 2orc h ASP 22 N 0.00 0.42 1.37 0.86 3.32 -0.94 -3.28 116.42 118.17 2orc h ASP 22 Ca 0.00 -0.44 -0.12 0.00 0.02 0.00 0.00 57.03 56.48 2orc h ASP 22 Cb 0.41 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 2orc h ASP 22 CO 0.00 1.34 -0.64 -0.07 -1.72 0.00 0.00 179.24 178.15 2orc h LEU 23 N 0.08 0.00 -2.05 1.55 3.38 -1.27 -3.43 115.31 113.57 2orc h LEU 23 Ca -0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.84 2orc h LEU 23 Cb 1.95 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.70 2orc h LEU 23 CO 0.20 0.58 0.00 0.61 0.09 0.00 0.00 178.44 179.92 2orc n GLY 24 N 1.26 0.58 3.37 0.83 0.00 -1.00 -4.76 105.19 105.47 2orc n GLY 24 Ca 0.01 -0.42 -0.15 0.00 0.00 0.00 0.00 46.02 45.46 2orc n GLY 24 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2orc s VAL 25 N -2.68 0.02 1.06 1.61 1.01 -1.23 -4.99 120.40 115.20 2orc s VAL 25 Ca 0.00 -0.20 -0.21 0.00 0.00 0.00 0.00 61.98 61.57 2orc s VAL 25 Cb 0.00 -0.76 -0.01 0.00 0.00 0.00 0.00 36.38 35.61 2orc s VAL 25 CO 0.00 -0.11 -0.48 -1.22 0.00 0.00 0.00 175.10 173.29 2orc n TYR 26 N 1.55 -1.70 0.21 5.22 4.01 -1.26 -4.70 117.16 120.49 2orc n TYR 26 Ca -0.19 0.29 0.12 0.00 -0.16 0.00 0.00 57.90 57.96 2orc n TYR 26 Cb 0.56 -1.52 0.07 0.00 -0.31 0.00 0.00 39.34 38.14 2orc n TYR 26 CO 0.00 0.00 0.00 0.37 -0.46 0.00 0.00 176.86 176.77 2orc h GLN 27 N -1.61 0.00 0.01 -0.72 4.15 -1.99 -3.31 115.11 111.65 2orc h GLN 27 Ca -0.47 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 58.95 2orc h GLN 27 Cb 1.36 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.05 2orc h GLN 27 CO 0.31 0.00 -0.01 0.77 -1.93 0.00 0.00 178.83 177.98 2orc h SER 28 N 0.00 -0.01 -0.52 -0.69 0.02 -2.00 -3.06 113.55 107.28 2orc h SER 28 Ca 0.00 0.00 0.15 0.00 -0.84 0.00 0.00 61.79 61.10 2orc h SER 28 Cb 0.95 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.48 2orc h SER 28 CO 0.00 0.31 0.74 0.00 -1.14 0.00 0.00 176.83 176.74 2orc h ALA 29 N -1.36 2.28 0.45 3.77 0.00 -1.95 -0.66 119.26 121.79 2orc h ALA 29 Ca -0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2orc h ALA 29 Cb 0.01 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2orc h ALA 29 CO 0.00 -1.01 -0.22 0.82 0.00 0.00 0.00 179.25 178.85 2orc h ILE 30 N 0.00 0.00 0.00 0.00 1.08 -1.64 -0.82 117.51 116.13 2orc h ILE 30 Ca 0.25 -0.32 0.00 0.00 -0.39 0.00 0.00 64.86 64.39 2orc h ILE 30 Cb 1.73 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 35.48 2orc h ILE 30 CO -0.00 0.00 0.14 -3.20 -0.69 0.00 0.00 178.15 174.40 2orc n ASN 31 N -4.53 0.33 -0.05 1.72 2.85 -0.29 -0.21 115.26 115.08 2orc n ASN 31 Ca -0.08 0.59 -0.14 0.00 -0.11 0.00 0.00 54.58 54.84 2orc n ASN 31 Cb 0.24 -0.59 -0.14 0.00 1.24 0.00 0.00 39.78 40.53 2orc n ASN 31 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 2orc n LYS 32 N -1.95 0.68 0.00 1.20 5.02 -0.99 -0.91 118.16 121.22 2orc n LYS 32 Ca -0.01 0.20 0.14 0.00 -2.02 0.00 0.00 58.31 56.62 2orc n LYS 32 Cb 0.16 -1.67 0.61 0.00 -0.02 0.00 0.00 35.03 34.12 2orc n LYS 32 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2orc n ALA 33 N -2.84 2.58 -0.04 7.82 0.00 0.42 -2.82 120.51 125.63 2orc n ALA 33 Ca -0.29 -0.16 -0.09 0.00 0.00 0.00 0.00 53.44 52.89 2orc n ALA 33 Cb 1.06 -1.41 -0.03 0.00 0.00 0.00 0.00 19.45 19.07 2orc n ALA 33 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2orc n ILE 34 N -1.37 0.48 -0.36 0.00 5.41 0.71 -4.11 119.36 120.12 2orc n ILE 34 Ca 0.10 -0.13 -0.02 0.00 1.00 0.00 0.00 62.75 63.70 2orc n ILE 34 Cb 0.31 -1.55 0.12 0.00 -0.71 0.00 0.00 39.64 37.80 2orc n ILE 34 CO 0.00 0.00 0.00 -0.74 0.00 0.00 0.00 176.55 175.81 2orc h HIS 35 N -0.29 1.24 -0.41 1.39 2.76 -1.17 -1.35 115.15 117.32 2orc h HIS 35 Ca -0.22 0.02 0.12 0.00 -2.20 0.00 0.00 60.37 58.09 2orc h HIS 35 Cb 1.20 -0.42 -0.02 0.00 1.55 0.00 0.00 27.41 29.73 2orc h HIS 35 CO -0.03 0.79 0.61 0.00 -1.30 0.00 0.00 177.93 178.00 2orc h ALA 36 N 1.37 2.10 -0.03 5.26 0.00 -1.67 -3.44 119.26 122.85 2orc h ALA 36 Ca 0.36 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.25 2orc h ALA 36 Cb -0.13 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.69 2orc h ALA 36 CO -0.07 -0.82 0.00 0.41 0.00 0.00 0.00 179.25 178.77 2orc n GLY 37 N -1.47 1.48 2.28 0.00 0.00 -0.51 -5.08 105.19 101.89 2orc n GLY 37 Ca 0.08 -0.24 -0.21 0.00 0.00 0.00 0.00 46.02 45.65 2orc n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2orc n ARG 38 N -0.90 -3.83 -3.54 1.61 5.12 -1.26 -4.98 116.66 108.88 2orc n ARG 38 Ca 0.00 -1.01 -0.27 0.00 -1.93 0.00 0.00 57.85 54.65 2orc n ARG 38 Cb 0.14 -1.35 -0.10 0.00 -1.16 0.00 0.00 32.46 30.00 2orc n ARG 38 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 2orc n LYS 39 N -4.45 1.39 -4.12 5.56 4.81 -1.26 -5.06 118.16 115.03 2orc n LYS 39 Ca 0.10 -3.99 -0.24 0.00 -0.87 0.00 0.00 58.31 53.31 2orc n LYS 39 Cb 0.41 -1.94 -0.07 0.00 0.02 0.00 0.00 35.03 33.45 2orc n LYS 39 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 2orc s ILE 40 N -1.27 2.59 -0.13 3.15 1.01 -1.26 -2.85 121.20 122.44 2orc s ILE 40 Ca 0.32 -1.72 -0.05 0.00 0.00 0.00 0.00 60.65 59.20 2orc s ILE 40 Cb 0.06 -2.96 0.06 0.00 0.01 0.00 0.00 42.46 39.63 2orc s ILE 40 CO -0.13 -0.09 0.28 -0.36 0.00 0.00 0.00 174.94 174.64 2orc s PHE 41 N -2.53 -0.44 0.09 3.97 0.08 -0.41 -4.23 117.98 114.52 2orc s PHE 41 Ca 0.39 0.98 -0.16 0.00 0.12 0.00 0.00 56.93 58.27 2orc s PHE 41 Cb 0.01 0.02 -0.07 0.00 -0.57 0.00 0.00 43.02 42.42 2orc s PHE 41 CO 0.22 -0.33 0.52 -0.51 -0.10 0.00 0.00 175.22 175.02 2orc s LEU 42 N 2.10 4.43 -0.40 -0.37 1.02 -0.80 0.36 118.68 125.02 2orc s LEU 42 Ca -0.02 1.09 -0.06 0.00 0.02 0.00 0.00 54.13 55.16 2orc s LEU 42 Cb -0.11 -2.99 0.09 0.00 0.02 0.00 0.00 46.19 43.19 2orc s LEU 42 CO -0.09 0.21 0.20 -0.89 0.02 0.00 0.00 176.35 175.80 2orc s THR 43 N -1.27 3.71 -1.50 5.49 2.01 -1.08 -0.63 115.64 122.37 2orc s THR 43 Ca 0.32 -1.63 -0.08 0.00 0.31 0.00 0.00 61.69 60.61 2orc s THR 43 Cb -0.17 -3.34 -0.00 0.00 0.01 0.00 0.00 72.50 69.00 2orc s THR 43 CO 0.18 -0.51 2.73 -0.38 -0.69 0.00 0.00 174.62 175.94 2orc n ILE 44 N 4.76 4.69 -0.26 1.82 5.41 -0.52 -1.10 119.36 134.16 2orc n ILE 44 Ca -0.08 -3.29 0.00 0.00 1.00 0.00 0.00 62.75 60.38 2orc n ILE 44 Cb 0.42 -2.40 0.00 0.00 -0.71 0.00 0.00 39.64 36.95 2orc n ILE 44 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 2orc n ASN 45 N 2.85 0.00 -0.70 4.38 6.94 -1.17 -4.40 115.26 123.16 2orc n ASN 45 Ca 0.72 0.00 -0.08 0.00 -0.02 0.00 0.00 54.58 55.20 2orc n ASN 45 Cb 0.24 0.00 -0.03 0.00 -2.36 0.00 0.00 39.78 37.62 2orc n ASN 45 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2orc n ALA 46 N -3.00 -0.12 0.00 -2.53 0.00 -1.26 -0.82 120.51 112.77 2orc n ALA 46 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.57 2orc n ALA 46 Cb 0.00 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.00 2orc n ALA 46 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2orc n ASP 47 N -0.57 0.00 -0.22 0.00 2.03 -1.26 -4.09 116.55 112.44 2orc n ASP 47 Ca -0.08 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.23 2orc n ASP 47 Cb 0.48 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.88 2orc n ASP 47 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2orc n GLY 48 N 0.00 0.28 3.89 0.27 0.00 -0.94 -5.12 105.19 103.57 2orc n GLY 48 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2orc n GLY 48 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2orc s SER 49 N -0.13 6.29 -0.20 1.61 0.15 -0.00 -4.96 113.70 116.46 2orc s SER 49 Ca 0.00 1.12 -0.03 0.00 0.70 0.00 0.00 55.95 57.74 2orc s SER 49 Cb 0.00 -2.33 -0.01 0.00 -1.71 0.00 0.00 66.02 61.97 2orc s SER 49 CO 0.00 -0.65 -0.06 -0.69 1.20 0.00 0.00 173.24 173.03 2orc s VAL 50 N -2.84 3.29 0.06 4.45 1.01 -1.26 -3.05 120.40 122.07 2orc s VAL 50 Ca 0.51 -0.53 0.00 0.00 0.00 0.00 0.00 61.98 61.96 2orc s VAL 50 Cb -0.10 -2.47 0.00 0.00 0.00 0.00 0.00 36.38 33.81 2orc s VAL 50 CO 0.46 0.45 0.03 -1.22 0.00 0.00 0.00 175.10 174.82 2orc n TYR 51 N 4.51 -0.92 -3.85 5.22 4.02 -0.26 -4.68 117.16 121.21 2orc n TYR 51 Ca -0.18 -0.27 -0.11 0.00 -0.01 0.00 0.00 57.90 57.33 2orc n TYR 51 Cb 0.51 -0.05 -0.09 0.00 -0.02 0.00 0.00 39.34 39.70 2orc n TYR 51 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2orc s ALA 52 N -2.09 -0.36 -0.29 -0.72 0.00 -1.26 -2.64 121.76 114.40 2orc s ALA 52 Ca 0.02 -0.26 0.01 0.00 0.00 0.00 0.00 51.96 51.74 2orc s ALA 52 Cb -0.00 0.26 0.19 0.00 0.00 0.00 0.00 23.12 23.57 2orc s ALA 52 CO 0.01 -0.34 0.58 -2.00 0.00 0.00 0.00 175.76 174.02 2orc s GLU 53 N -2.43 0.55 0.66 0.00 2.56 0.16 -4.04 118.70 116.15 2orc s GLU 53 Ca -0.06 0.83 -0.08 0.00 0.00 0.00 0.00 54.97 55.66 2orc s GLU 53 Cb -0.02 0.41 0.02 0.00 2.00 0.00 0.00 34.13 36.54 2orc s GLU 53 CO -0.03 -0.76 1.00 -1.21 -0.56 0.00 0.00 175.26 173.70 2orc s GLU 54 N 2.83 2.77 -0.09 4.30 2.02 -0.44 -1.29 118.70 128.81 2orc s GLU 54 Ca 0.17 0.14 -0.04 0.00 0.02 0.00 0.00 54.97 55.27 2orc s GLU 54 Cb -0.13 -2.15 0.04 0.00 0.10 0.00 0.00 34.13 31.99 2orc s GLU 54 CO -0.23 -0.93 0.20 0.08 0.02 0.00 0.00 175.26 174.40 2orc s VAL 55 N -3.18 -0.07 -0.33 2.63 1.01 -1.13 -2.60 120.40 116.73 2orc s VAL 55 Ca 0.56 0.18 0.01 0.00 0.00 0.00 0.00 61.98 62.73 2orc s VAL 55 Cb -0.11 -0.31 0.14 0.00 0.00 0.00 0.00 36.38 36.10 2orc s VAL 55 CO 0.48 0.07 0.32 -0.75 0.00 0.00 0.00 175.10 175.22 2orc s LYS 56 N 1.31 0.49 -1.27 2.72 2.20 -0.89 -4.88 119.74 119.41 2orc s LYS 56 Ca -0.08 -0.60 -0.07 0.00 -0.36 0.00 0.00 55.97 54.86 2orc s LYS 56 Cb -0.11 -0.75 0.01 0.00 -1.51 0.00 0.00 37.83 35.46 2orc s LYS 56 CO -0.07 -1.12 1.10 -3.47 -0.36 0.00 0.00 175.35 171.43 2orc n ASP 56 N 4.69 -5.61 0.00 1.43 -0.08 -1.26 -1.40 116.55 114.32 2orc n ASP 56 Ca 0.05 -0.52 0.00 0.00 -1.51 0.00 0.00 54.79 52.81 2orc n ASP 56 Cb 0.45 -4.81 0.00 0.00 2.34 0.00 0.00 41.12 39.10 2orc n ASP 56 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2orc n GLY 56 N -1.83 2.09 3.46 0.27 0.00 -1.26 -4.96 105.19 102.96 2orc n GLY 56 Ca -0.03 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.55 2orc n GLY 56 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2orc s GLU 56 N -0.35 3.74 0.55 1.61 2.12 -0.49 -5.01 118.70 120.87 2orc s GLU 56 Ca 0.00 -1.99 0.02 0.00 0.36 0.00 0.00 54.97 53.36 2orc s GLU 56 Cb 0.00 -4.97 0.04 0.00 0.26 0.00 0.00 34.13 29.46 2orc s GLU 56 CO 0.00 -1.78 0.76 0.14 -0.54 0.00 0.00 175.26 173.85 2orc s VAL 56 N 2.40 2.66 0.04 3.70 -7.23 -1.26 -2.10 120.40 118.61 2orc s VAL 56 Ca 0.36 -0.71 -0.29 0.00 -1.81 0.00 0.00 61.98 59.53 2orc s VAL 56 Cb -0.04 -2.95 0.10 0.00 0.56 0.00 0.00 36.38 34.06 2orc s VAL 56 CO -0.07 0.00 1.19 -1.59 -0.31 0.00 0.00 175.10 174.33 2orc s LYS 56 N -4.73 0.64 0.73 4.82 -2.85 -1.07 -4.93 119.74 112.35 2orc s LYS 56 Ca 0.58 -0.36 -0.11 0.00 -1.00 0.00 0.00 55.97 55.08 2orc s LYS 56 Cb -0.10 0.21 0.04 0.00 -2.06 0.00 0.00 37.83 35.92 2orc s LYS 56 CO 0.38 -0.29 1.11 -2.14 0.10 0.00 0.00 175.35 174.51 2orc s PRO 57 N -2.64 2.56 -0.30 1.78 0.02 -1.26 -1.32 135.00 133.84 2orc s PRO 57 Ca 0.14 0.30 -0.14 0.00 0.02 0.00 0.00 61.00 61.33 2orc s PRO 57 Cb 0.03 -2.02 0.17 0.00 0.02 0.00 0.00 34.50 32.70 2orc s PRO 57 CO -0.02 -1.20 0.97 0.12 -0.33 0.00 0.00 177.00 176.55 2orc s PHE 58 N -3.40 -0.72 -0.68 6.54 2.19 -1.26 -3.38 117.98 117.28 2orc s PHE 58 Ca 0.59 1.12 -0.25 0.00 0.33 0.00 0.00 56.93 58.72 2orc s PHE 58 Cb -0.11 0.38 0.05 0.00 -1.31 0.00 0.00 43.02 42.03 2orc s PHE 58 CO 0.50 -0.36 1.11 -1.25 1.83 0.00 0.00 175.22 177.05 2orc s PRO 59 N 2.57 3.19 -0.55 10.12 0.05 -1.26 -4.24 135.00 144.87 2orc s PRO 59 Ca -0.01 -0.47 -0.35 0.00 0.05 0.00 0.00 61.00 60.22 2orc s PRO 59 Cb -0.07 -4.18 -0.15 0.00 0.05 0.00 0.00 34.50 30.15 2orc s PRO 59 CO -0.17 -1.92 2.32 -1.13 0.05 0.00 0.00 177.00 176.15 2orc n SER 60 N 8.44 1.41 -0.48 6.66 3.41 -1.22 -4.56 113.62 127.28 2orc n SER 60 Ca 0.00 0.31 0.02 0.00 -0.26 0.00 0.00 58.87 58.94 2orc n SER 60 Cb 0.47 -1.14 -0.00 0.00 -0.26 0.00 0.00 64.21 63.28 2orc n SER 60 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2orc n ASN 61 N 10.16 -2.89 -2.70 4.04 4.13 -1.26 -4.82 115.26 121.92 2orc n ASN 61 Ca 0.50 0.14 -0.06 0.00 1.68 0.00 0.00 54.58 56.83 2orc n ASN 61 Cb 0.16 -0.45 0.09 0.00 -1.54 0.00 0.00 39.78 38.03 2orc n ASN 61 CO 0.00 0.00 0.00 1.17 0.28 0.00 0.00 177.26 178.71 2orc n LYS 62 N -1.14 0.79 -4.50 3.52 0.00 -1.26 -5.06 118.16 110.50 2orc n LYS 62 Ca 0.00 -1.47 -0.33 0.00 0.00 0.00 0.00 58.31 56.50 2orc n LYS 62 Cb 0.06 -0.36 -0.15 0.00 0.00 0.00 0.00 35.03 34.58 2orc n LYS 62 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 2orc s LYS 63 N 0.17 3.17 0.00 1.64 1.02 -1.26 -4.89 119.74 119.59 2orc s LYS 63 Ca 0.18 -0.77 0.00 0.00 0.02 0.00 0.00 55.97 55.40 2orc s LYS 63 Cb 0.29 -2.60 0.00 0.00 -0.52 0.00 0.00 37.83 35.00 2orc s LYS 63 CO -0.08 -0.01 0.00 2.41 -0.92 0.00 0.00 175.35 176.75 2orc n THR 64 N 4.12 0.00 0.00 2.17 -1.04 -1.26 -4.97 114.28 113.30 2orc n THR 64 Ca -0.19 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.82 2orc n THR 64 Cb 0.52 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.03 2orc n THR 64 CO 0.00 0.00 0.00 1.07 -0.64 0.00 0.00 175.07 175.50 2orc n THR 65 N -1.40 0.00 -0.57 12.58 5.66 -1.26 -5.39 114.28 123.90 2orc n THR 65 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2orc n THR 65 Cb 0.00 -0.29 0.00 0.00 -1.55 0.00 0.00 70.33 68.49 2orc n THR 65 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02