#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3orc n GLN 3 N 0.00 0.46 -3.33 3.49 0.00 -1.26 -4.82 117.38 111.92 3orc n GLN 3 Ca 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 57.00 57.02 3orc n GLN 3 Cb 0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 30.24 30.17 3orc n GLN 3 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.06 177.56 3orc s ARG 4 N -0.18 0.52 0.14 3.69 3.52 -1.26 -2.14 118.95 123.23 3orc s ARG 4 Ca 0.00 1.08 -0.01 0.00 -0.13 0.00 0.00 55.73 56.67 3orc s ARG 4 Cb 0.00 0.62 -0.04 0.00 -1.56 0.00 0.00 34.95 33.97 3orc s ARG 4 CO 0.00 -0.40 0.06 0.42 -0.81 0.00 0.00 175.30 174.57 3orc s ILE 5 N 2.85 0.11 0.82 4.11 1.09 -0.21 -4.96 121.20 125.01 3orc s ILE 5 Ca 0.08 -1.92 -0.12 0.00 -1.10 0.00 0.00 60.65 57.60 3orc s ILE 5 Cb -0.13 -2.10 0.09 0.00 -1.06 0.00 0.00 42.46 39.26 3orc s ILE 5 CO -0.19 -0.41 1.10 -0.89 -0.10 0.00 0.00 174.94 174.44 3orc s THR 6 N -4.05 2.92 0.01 2.92 2.01 -1.26 0.64 115.64 118.83 3orc s THR 6 Ca 0.26 0.30 -0.21 0.00 0.31 0.00 0.00 61.69 62.34 3orc s THR 6 Cb 0.07 -2.99 -0.12 0.00 0.01 0.00 0.00 72.50 69.48 3orc s THR 6 CO 0.03 -0.39 1.01 0.25 -0.69 0.00 0.00 174.62 174.83 3orc h LEU 7 N -1.21 -0.65 -0.99 4.42 5.85 -1.74 -2.16 115.31 118.83 3orc h LEU 7 Ca -0.48 0.02 0.35 0.00 0.84 0.00 0.00 57.88 58.62 3orc h LEU 7 Cb 1.27 0.17 -0.17 0.00 0.37 0.00 0.00 40.66 42.30 3orc h LEU 7 CO 0.58 -0.34 0.37 0.50 -0.34 0.00 0.00 178.44 179.22 3orc h LYS 8 N -1.03 0.06 0.66 1.25 3.64 -1.93 0.97 116.57 120.18 3orc h LYS 8 Ca -0.08 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.27 3orc h LYS 8 Cb 0.59 -0.01 0.01 0.00 -0.41 0.00 0.00 32.23 32.40 3orc h LYS 8 CO 0.13 0.04 -0.31 -0.44 -2.27 0.00 0.00 179.45 176.59 3orc h ASP 9 N 0.06 -0.75 -1.35 4.20 5.19 -1.94 0.23 116.42 122.06 3orc h ASP 9 Ca 0.74 0.03 0.39 0.00 -0.62 0.00 0.00 57.03 57.57 3orc h ASP 9 Cb 1.79 0.19 -0.07 0.00 0.18 0.00 0.00 39.33 41.43 3orc h ASP 9 CO -0.79 -0.39 0.95 0.22 -3.12 0.00 0.00 179.24 176.10 3orc h TYR 10 N -1.16 0.17 0.23 4.55 3.20 0.88 0.88 116.97 125.72 3orc h TYR 10 Ca -0.09 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.78 3orc h TYR 10 Cb 0.67 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.90 3orc h TYR 10 CO 0.01 -0.02 -0.11 0.00 -1.64 0.00 0.00 178.16 176.40 3orc h ALA 11 N 1.38 -0.95 -0.96 1.82 0.00 0.12 -0.97 119.26 119.70 3orc h ALA 11 Ca 0.68 -0.07 0.31 0.00 0.00 0.00 0.00 54.91 55.84 3orc h ALA 11 Cb 2.51 0.12 -0.16 0.00 0.00 0.00 0.00 17.79 20.26 3orc h ALA 11 CO -0.11 -0.93 0.37 0.52 0.00 0.00 0.00 179.25 179.10 3orc h MET 12 N -0.34 0.15 0.00 0.00 2.86 0.40 0.73 114.93 118.73 3orc h MET 12 Ca -0.03 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 3orc h MET 12 Cb 0.23 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.86 3orc h MET 12 CO 0.05 0.10 0.00 0.54 1.06 0.00 0.00 176.91 178.66 3orc n ARG 13 N -5.23 0.00 -0.09 1.72 3.00 0.09 -4.32 116.66 111.83 3orc n ARG 13 Ca 0.29 0.17 0.05 0.00 -0.01 0.00 0.00 57.85 58.36 3orc n ARG 13 Cb 0.93 -1.02 0.19 0.00 0.00 0.00 0.00 32.46 32.57 3orc n ARG 13 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 3orc n PHE 14 N -1.02 0.23 -1.47 -1.55 3.01 -0.38 -5.05 117.46 111.23 3orc n PHE 14 Ca 0.00 -0.12 0.00 0.00 1.01 0.00 0.00 57.45 58.34 3orc n PHE 14 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 3orc n PHE 14 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3orc n GLY 15 N 0.87 -4.63 0.66 1.37 0.00 0.25 -3.76 105.19 99.96 3orc n GLY 15 Ca 0.09 -0.61 0.51 0.00 0.00 0.00 0.00 46.02 46.01 3orc n GLY 15 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3orc h GLN 16 N 2.12 0.00 0.44 1.61 4.20 -1.92 0.25 115.11 121.81 3orc h GLN 16 Ca 0.00 -0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 3orc h GLN 16 Cb 0.00 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 3orc h GLN 16 CO 0.00 0.00 -0.21 1.15 -0.67 0.00 0.00 178.83 179.10 3orc h THR 17 N 0.00 0.00 -0.85 -0.54 2.02 -1.96 -2.21 112.91 109.37 3orc h THR 17 Ca 0.93 -0.30 0.16 0.00 0.77 0.00 0.00 66.41 67.97 3orc h THR 17 Cb 3.57 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 69.88 3orc h THR 17 CO -0.11 0.00 0.42 0.50 0.37 0.00 0.00 175.52 176.70 3orc h LYS 18 N -0.89 0.54 0.05 6.66 3.64 -0.64 -2.22 116.57 123.70 3orc h LYS 18 Ca -0.06 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 3orc h LYS 18 Cb 0.45 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 3orc h LYS 18 CO 0.10 0.36 -0.09 1.15 -2.27 0.00 0.00 179.45 178.69 3orc h THR 19 N 0.55 0.00 -0.50 1.00 2.02 -1.33 -2.44 112.91 112.22 3orc h THR 19 Ca 0.48 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.71 3orc h THR 19 Cb 0.75 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 67.10 3orc h THR 19 CO -0.41 0.00 -0.30 0.00 0.37 0.00 0.00 175.52 175.19 3orc n ALA 20 N -2.47 -0.32 0.00 6.16 0.00 -0.83 0.39 120.51 123.44 3orc n ALA 20 Ca -0.02 0.43 -0.11 0.00 0.00 0.00 0.00 53.44 53.74 3orc n ALA 20 Cb 0.08 -0.03 -0.04 0.00 0.00 0.00 0.00 19.45 19.46 3orc n ALA 20 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 3orc h LYS 21 N 0.00 -0.39 -0.68 0.00 2.10 -1.46 0.61 116.57 116.74 3orc h LYS 21 Ca 0.08 0.03 0.13 0.00 -2.00 0.00 0.00 60.65 58.89 3orc h LYS 21 Cb 0.21 0.09 -0.09 0.00 -0.90 0.00 0.00 32.23 31.53 3orc h LYS 21 CO -0.47 -0.26 0.21 -0.44 -2.00 0.00 0.00 179.45 176.49 3orc h ASP 22 N -0.41 0.14 0.27 7.07 3.32 0.45 0.31 116.42 127.56 3orc h ASP 22 Ca 0.09 0.11 -0.15 0.00 0.02 0.00 0.00 57.03 57.11 3orc h ASP 22 Cb 0.56 0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.22 3orc h ASP 22 CO -0.35 0.05 -0.58 -0.07 -1.72 0.00 0.00 179.24 176.57 3orc h LEU 23 N 0.35 0.36 -0.62 1.55 3.38 0.14 -3.47 115.31 117.00 3orc h LEU 23 Ca 0.37 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 58.14 3orc h LEU 23 Cb 0.56 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.20 3orc h LEU 23 CO -0.41 0.86 0.00 0.61 0.09 0.00 0.00 178.44 179.59 3orc n GLY 24 N 0.23 0.95 3.51 0.83 0.00 0.20 -4.87 105.19 106.04 3orc n GLY 24 Ca -0.03 -0.40 -0.25 0.00 0.00 0.00 0.00 46.02 45.35 3orc n GLY 24 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3orc s VAL 25 N -2.57 0.65 -0.07 1.61 -7.23 -0.93 -5.02 120.40 106.84 3orc s VAL 25 Ca 0.00 -2.00 -0.24 0.00 -1.81 0.00 0.00 61.98 57.93 3orc s VAL 25 Cb 0.00 -2.39 -0.03 0.00 0.56 0.00 0.00 36.38 34.51 3orc s VAL 25 CO 0.00 0.00 0.72 -0.31 -0.31 0.00 0.00 175.10 175.20 3orc s TYR 26 N -3.23 3.57 0.18 2.82 1.51 -1.26 -4.40 117.35 116.55 3orc s TYR 26 Ca 0.25 1.27 0.01 0.00 -1.01 0.00 0.00 57.07 57.59 3orc s TYR 26 Cb 0.03 -2.83 0.46 0.00 -0.11 0.00 0.00 41.96 39.51 3orc s TYR 26 CO 0.14 0.06 0.93 1.04 -1.11 0.00 0.00 175.55 176.61 3orc n GLN 27 N 3.89 -0.05 0.14 -0.62 1.13 -1.26 0.41 117.38 121.02 3orc n GLN 27 Ca -0.01 0.89 0.03 0.00 -1.94 0.00 0.00 57.00 55.98 3orc n GLN 27 Cb 0.51 -1.41 0.43 0.00 0.11 0.00 0.00 30.24 29.88 3orc n GLN 27 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 3orc h SER 28 N 0.00 0.19 -0.68 1.08 0.87 -1.95 -2.24 113.55 110.81 3orc h SER 28 Ca 0.36 -0.03 0.12 0.00 -1.23 0.00 0.00 61.79 61.01 3orc h SER 28 Cb 0.75 -0.05 -0.09 0.00 -0.44 0.00 0.00 62.40 62.57 3orc h SER 28 CO -0.56 0.32 0.25 0.00 -0.53 0.00 0.00 176.83 176.31 3orc h ALA 29 N 1.70 0.91 -0.46 6.23 0.00 0.78 -2.59 119.26 125.83 3orc h ALA 29 Ca 0.04 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3orc h ALA 29 Cb 0.31 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3orc h ALA 29 CO 0.02 -0.22 0.00 -0.89 0.00 0.00 0.00 179.25 178.16 3orc n ILE 30 N -5.02 0.00 -0.29 0.00 5.41 -0.86 -1.89 119.36 116.72 3orc n ILE 30 Ca 0.12 1.30 0.26 0.00 1.00 0.00 0.00 62.75 65.43 3orc n ILE 30 Cb 0.35 -2.28 0.60 0.00 -0.71 0.00 0.00 39.64 37.59 3orc n ILE 30 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 176.55 175.42 3orc h ASN 31 N 0.00 0.27 -0.10 4.38 -0.73 -1.57 1.38 115.58 119.21 3orc h ASN 31 Ca 0.00 0.05 -0.01 0.00 1.87 0.00 0.00 56.30 58.21 3orc h ASN 31 Cb 0.00 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 38.59 3orc h ASN 31 CO 0.00 0.06 0.03 0.50 -0.37 0.00 0.00 177.43 177.65 3orc h LYS 32 N 0.25 0.16 -0.08 6.67 3.64 -1.53 1.43 116.57 127.11 3orc h LYS 32 Ca 0.54 -0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.93 3orc h LYS 32 Cb 1.66 -0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 33.40 3orc h LYS 32 CO -0.17 0.33 -0.34 0.00 -2.27 0.00 0.00 179.45 177.00 3orc h ALA 33 N 0.82 -0.45 -0.28 5.00 0.00 0.24 0.28 119.26 124.86 3orc h ALA 33 Ca 0.03 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.97 3orc h ALA 33 Cb 0.24 0.63 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 3orc h ALA 33 CO 0.00 -0.84 0.11 0.82 0.00 0.00 0.00 179.25 179.34 3orc h ILE 34 N -0.45 0.94 -0.33 0.00 2.04 -0.36 -0.73 117.51 118.62 3orc h ILE 34 Ca 0.08 -0.08 0.10 0.00 1.00 0.00 0.00 64.86 65.95 3orc h ILE 34 Cb 0.57 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 3orc h ILE 34 CO -0.33 0.04 0.43 0.45 0.00 0.00 0.00 178.15 178.74 3orc h HIS 35 N 0.24 0.00 -0.02 1.37 3.86 0.40 1.88 115.15 122.88 3orc h HIS 35 Ca 0.12 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.33 3orc h HIS 35 Cb 0.08 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.55 3orc h HIS 35 CO -0.12 0.00 -0.23 0.00 0.86 0.00 0.00 177.93 178.43 3orc n ALA 36 N -2.25 3.02 -3.34 2.45 0.00 0.79 -5.02 120.51 116.16 3orc n ALA 36 Ca 0.05 -0.59 -0.24 0.00 0.00 0.00 0.00 53.44 52.67 3orc n ALA 36 Cb 0.58 -0.91 0.02 0.00 0.00 0.00 0.00 19.45 19.14 3orc n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3orc n GLY 37 N 1.35 -0.66 3.58 0.00 0.00 0.64 -5.01 105.19 105.10 3orc n GLY 37 Ca 0.13 1.01 -0.34 0.00 0.00 0.00 0.00 46.02 46.82 3orc n GLY 37 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3orc s ARG 38 N -3.02 2.88 -0.88 1.61 0.52 -1.22 -5.05 118.95 113.79 3orc s ARG 38 Ca 0.24 -0.54 -0.25 0.00 -0.52 0.00 0.00 55.73 54.66 3orc s ARG 38 Cb -0.04 -2.64 0.00 0.00 0.52 0.00 0.00 34.95 32.79 3orc s ARG 38 CO 0.84 0.61 1.67 0.15 0.02 0.00 0.00 175.30 178.60 3orc s LYS 39 N -0.67 3.00 0.06 3.54 1.02 -1.26 -4.91 119.74 120.52 3orc s LYS 39 Ca 0.10 -0.43 0.09 0.00 0.02 0.00 0.00 55.97 55.76 3orc s LYS 39 Cb -0.11 -4.94 -0.03 0.00 -0.52 0.00 0.00 37.83 32.23 3orc s LYS 39 CO 0.02 -2.71 -0.25 0.42 -0.92 0.00 0.00 175.35 171.90 3orc s ILE 40 N 7.60 2.07 0.11 2.17 1.09 -1.26 -0.62 121.20 132.36 3orc s ILE 40 Ca 0.57 -1.41 0.04 0.00 -1.10 0.00 0.00 60.65 58.75 3orc s ILE 40 Cb -0.05 -1.78 -0.04 0.00 -1.06 0.00 0.00 42.46 39.52 3orc s ILE 40 CO 0.02 0.30 -0.11 -0.36 -0.10 0.00 0.00 174.94 174.68 3orc s PHE 41 N -0.84 1.18 0.03 3.97 0.40 -0.60 -1.95 117.98 120.18 3orc s PHE 41 Ca 0.11 -0.63 0.04 0.00 -0.60 0.00 0.00 56.93 55.86 3orc s PHE 41 Cb -0.10 -0.63 -0.02 0.00 0.51 0.00 0.00 43.02 42.78 3orc s PHE 41 CO 0.03 0.05 -0.12 -0.51 0.70 0.00 0.00 175.22 175.36 3orc s LEU 42 N -2.49 2.14 0.23 -0.37 1.02 0.21 -1.46 118.68 117.97 3orc s LEU 42 Ca 0.07 -0.40 0.10 0.00 0.02 0.00 0.00 54.13 53.92 3orc s LEU 42 Cb -0.03 -0.53 -0.04 0.00 0.02 0.00 0.00 46.19 45.60 3orc s LEU 42 CO 0.01 0.03 -0.10 -0.89 0.02 0.00 0.00 176.35 175.42 3orc s THR 43 N -0.76 3.06 -0.41 5.49 2.01 0.21 -1.04 115.64 124.21 3orc s THR 43 Ca 0.01 -1.95 0.03 0.00 0.31 0.00 0.00 61.69 60.09 3orc s THR 43 Cb -0.07 -2.57 0.12 0.00 0.01 0.00 0.00 72.50 69.98 3orc s THR 43 CO 0.01 -0.27 0.16 -0.63 -0.69 0.00 0.00 174.62 173.20 3orc s ILE 44 N -2.10 1.96 0.11 1.82 1.09 -0.91 -2.30 121.20 120.87 3orc s ILE 44 Ca 0.28 -2.52 -0.34 0.00 -1.10 0.00 0.00 60.65 56.97 3orc s ILE 44 Cb -0.07 -2.41 -0.13 0.00 -1.06 0.00 0.00 42.46 38.79 3orc s ILE 44 CO 0.16 -0.73 1.67 0.59 -0.10 0.00 0.00 174.94 176.54 3orc n ASN 45 N 3.87 3.33 -0.43 3.58 3.02 0.11 -4.74 115.26 124.00 3orc n ASN 45 Ca 0.04 1.05 0.32 0.00 -0.03 0.00 0.00 54.58 55.97 3orc n ASN 45 Cb 0.37 -1.44 0.51 0.00 -0.61 0.00 0.00 39.78 38.61 3orc n ASN 45 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3orc n ALA 46 N 4.31 1.15 0.88 5.41 0.00 -1.26 0.26 120.51 131.26 3orc n ALA 46 Ca 0.18 0.44 -0.01 0.00 0.00 0.00 0.00 53.44 54.05 3orc n ALA 46 Cb 0.30 -0.72 0.01 0.00 0.00 0.00 0.00 19.45 19.05 3orc n ALA 46 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3orc n ASP 47 N -3.36 2.77 -0.68 0.00 5.75 -1.26 -4.79 116.55 114.98 3orc n ASP 47 Ca 0.28 -2.08 -0.08 0.00 -0.01 0.00 0.00 54.79 52.90 3orc n ASP 47 Cb 1.23 -0.52 -0.03 0.00 -1.03 0.00 0.00 41.12 40.77 3orc n ASP 47 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3orc n GLY 48 N 0.36 0.72 3.73 6.12 0.00 0.74 -4.94 105.19 111.92 3orc n GLY 48 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 3orc n GLY 48 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3orc s SER 49 N -1.96 7.24 0.37 1.61 1.04 -0.38 -4.81 113.70 116.81 3orc s SER 49 Ca 0.00 1.48 0.04 0.00 0.48 0.00 0.00 55.95 57.95 3orc s SER 49 Cb 0.00 -2.50 -0.01 0.00 0.10 0.00 0.00 66.02 63.61 3orc s SER 49 CO 0.00 -0.10 0.54 -0.69 0.98 0.00 0.00 173.24 173.97 3orc s VAL 50 N 0.42 4.18 -0.12 5.02 1.01 -1.26 0.09 120.40 129.75 3orc s VAL 50 Ca 0.43 -0.79 -0.30 0.00 0.00 0.00 0.00 61.98 61.32 3orc s VAL 50 Cb -0.20 -3.49 0.09 0.00 0.00 0.00 0.00 36.38 32.78 3orc s VAL 50 CO 0.24 -0.25 0.82 -0.72 0.00 0.00 0.00 175.10 175.18 3orc s TYR 51 N -2.31 -0.56 0.35 5.22 -0.85 -0.97 -4.95 117.35 113.29 3orc s TYR 51 Ca 0.45 1.02 0.04 0.00 -0.52 0.00 0.00 57.07 58.06 3orc s TYR 51 Cb -0.10 0.41 -0.06 0.00 0.38 0.00 0.00 41.96 42.59 3orc s TYR 51 CO 0.34 -0.47 0.05 0.00 -1.52 0.00 0.00 175.55 173.94 3orc s ALA 52 N -0.95 2.59 -0.29 9.51 0.00 -1.26 -0.62 121.76 130.74 3orc s ALA 52 Ca -0.06 -2.01 -0.16 0.00 0.00 0.00 0.00 51.96 49.73 3orc s ALA 52 Cb -0.01 0.56 0.15 0.00 0.00 0.00 0.00 23.12 23.83 3orc s ALA 52 CO 0.05 -0.27 0.99 -1.83 0.00 0.00 0.00 175.76 174.70 3orc s GLU 53 N -3.85 0.35 -0.06 0.00 -1.05 -0.53 -3.48 118.70 110.07 3orc s GLU 53 Ca 0.35 0.64 -0.06 0.00 -0.15 0.00 0.00 54.97 55.74 3orc s GLU 53 Cb 0.08 0.13 -0.04 0.00 -0.44 0.00 0.00 34.13 33.86 3orc s GLU 53 CO 0.16 -0.08 0.19 -2.00 0.95 0.00 0.00 175.26 174.47 3orc s GLU 54 N 1.49 3.49 -1.03 -4.83 2.12 -0.55 -1.55 118.70 117.84 3orc s GLU 54 Ca -0.08 -0.15 -0.17 0.00 0.36 0.00 0.00 54.97 54.93 3orc s GLU 54 Cb -0.04 -3.15 0.14 0.00 0.26 0.00 0.00 34.13 31.34 3orc s GLU 54 CO -0.15 0.73 1.25 0.08 -0.54 0.00 0.00 175.26 176.63 3orc s VAL 55 N -1.16 4.76 0.00 3.70 1.01 0.21 -1.50 120.40 127.43 3orc s VAL 55 Ca 0.21 -1.87 0.00 0.00 0.00 0.00 0.00 61.98 60.32 3orc s VAL 55 Cb -0.13 -4.84 0.00 0.00 0.00 0.00 0.00 36.38 31.41 3orc s VAL 55 CO 0.10 -1.58 0.36 1.17 0.00 0.00 0.00 175.10 175.16 3orc n LYS 56 N 6.44 0.00 -3.39 2.72 3.00 0.12 -4.76 118.16 122.28 3orc n LYS 56 Ca 0.29 0.03 -0.24 0.00 -0.00 0.00 0.00 58.31 58.38 3orc n LYS 56 Cb 0.47 -0.86 -0.10 0.00 0.00 0.00 0.00 35.03 34.54 3orc n LYS 56 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 3orc s ASP 57 N -2.07 1.97 0.00 3.14 -1.08 -1.26 -4.84 116.67 112.53 3orc s ASP 57 Ca 0.00 -2.15 0.00 0.00 -0.52 0.00 0.00 52.55 49.88 3orc s ASP 57 Cb 0.00 -0.03 0.00 0.00 -1.46 0.00 0.00 42.92 41.43 3orc s ASP 57 CO 0.00 -0.26 0.00 0.61 0.52 0.00 0.00 175.17 176.04 3orc n GLY 58 N 3.84 1.46 3.77 2.66 0.00 -1.26 -4.85 105.19 110.82 3orc n GLY 58 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 3orc n GLY 58 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3orc s GLU 59 N 0.00 4.64 -0.38 1.61 0.41 -1.26 -5.06 118.70 118.66 3orc s GLU 59 Ca 0.00 1.33 -0.10 0.00 -0.41 0.00 0.00 54.97 55.80 3orc s GLU 59 Cb 0.00 -2.97 0.05 0.00 -1.78 0.00 0.00 34.13 29.42 3orc s GLU 59 CO 0.00 0.38 0.21 0.54 -0.49 0.00 0.00 175.26 175.89 3orc s VAL 60 N -1.45 4.33 0.54 2.63 0.11 -1.26 0.12 120.40 125.41 3orc s VAL 60 Ca 0.46 -1.09 0.09 0.00 -2.93 0.00 0.00 61.98 58.51 3orc s VAL 60 Cb -0.21 -3.50 0.07 0.00 -1.53 0.00 0.00 36.38 31.20 3orc s VAL 60 CO 0.26 -0.32 0.74 -0.54 -3.33 0.00 0.00 175.10 171.91 3orc s LYS 61 N 1.49 2.43 0.20 1.54 -0.14 -0.56 -4.94 119.74 119.77 3orc s LYS 61 Ca 0.02 -1.51 -0.02 0.00 -1.36 0.00 0.00 55.97 53.10 3orc s LYS 61 Cb -0.21 -2.67 0.04 0.00 -1.68 0.00 0.00 37.83 33.32 3orc s LYS 61 CO 0.05 -0.72 0.28 -2.30 -0.76 0.00 0.00 175.35 171.89 3orc n PRO 62 N -2.16 0.04 -3.28 -1.68 -0.02 -1.26 -1.48 135.00 125.17 3orc n PRO 62 Ca 0.14 -0.56 0.03 0.00 -2.02 0.00 0.00 63.50 61.09 3orc n PRO 62 Cb 0.61 -0.24 -0.02 0.00 -0.02 0.00 0.00 33.50 33.82 3orc n PRO 62 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 3orc s PHE 63 N -1.15 -1.39 0.78 6.00 2.19 -1.23 -3.81 117.98 119.38 3orc s PHE 63 Ca 0.17 1.71 -0.08 0.00 0.33 0.00 0.00 56.93 59.05 3orc s PHE 63 Cb -0.01 0.58 0.11 0.00 -1.31 0.00 0.00 43.02 42.39 3orc s PHE 63 CO 0.11 -0.74 1.10 -1.25 1.83 0.00 0.00 175.22 176.28 3orc s PRO 64 N 2.86 1.70 0.00 10.12 0.04 -1.26 -4.21 135.00 144.25 3orc s PRO 64 Ca 0.11 -0.40 0.16 0.00 0.04 0.00 0.00 61.00 60.91 3orc s PRO 64 Cb -0.13 -2.09 0.50 0.00 0.04 0.00 0.00 34.50 32.81 3orc s PRO 64 CO -0.19 -1.60 1.39 0.45 0.04 0.00 0.00 177.00 177.08 3orc n SER 65 N -3.16 2.10 0.00 6.66 2.88 -1.26 -5.12 113.62 115.72 3orc n SER 65 Ca 0.11 -1.90 0.00 0.00 -1.33 0.00 0.00 58.87 55.75 3orc n SER 65 Cb 0.60 -0.22 0.00 0.00 -0.75 0.00 0.00 64.21 63.85 3orc n SER 65 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40