#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ojr n GLN 2 N 0.00 -0.72 -1.78 0.03 10.64 -1.26 -4.89 117.38 119.40 1ojr n GLN 2 Ca 0.00 -0.19 -0.37 0.00 -1.83 0.00 0.00 57.00 54.60 1ojr n GLN 2 Cb 0.00 -1.46 0.05 0.00 -0.86 0.00 0.00 30.24 27.97 1ojr n GLN 2 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.06 176.44 1ojr s ASN 3 N -1.55 4.94 0.53 2.61 3.84 -1.26 -4.89 114.94 119.16 1ojr s ASN 3 Ca 0.49 2.67 0.25 0.00 0.21 0.00 0.00 52.86 56.48 1ojr s ASN 3 Cb -0.09 -2.62 1.49 0.00 -0.55 0.00 0.00 41.25 39.48 1ojr s ASN 3 CO 0.69 -1.78 2.13 -0.29 -2.79 0.00 0.00 177.10 175.05 1ojr h ILE 4 N 0.97 0.68 0.00 -5.21 2.10 -1.92 -1.29 117.51 112.84 1ojr h ILE 4 Ca -0.51 -0.33 -0.01 0.00 1.08 0.00 0.00 64.86 65.10 1ojr h ILE 4 Cb 1.32 1.20 -0.00 0.00 -1.09 0.00 0.00 36.82 38.24 1ojr h ILE 4 CO 0.55 0.08 -0.04 0.71 -1.08 0.00 0.00 178.15 178.37 1ojr h THR 5 N 0.00 0.76 -0.06 2.19 1.35 -2.00 -0.51 112.91 114.64 1ojr h THR 5 Ca -0.00 -0.16 0.00 0.00 -0.55 0.00 0.00 66.41 65.70 1ojr h THR 5 Cb 0.19 1.09 0.00 0.00 -1.73 0.00 0.00 68.15 67.70 1ojr h THR 5 CO 0.01 0.04 0.00 0.00 -0.25 0.00 0.00 175.52 175.32 1ojr n GLN 6 N -4.10 1.79 -1.24 4.72 1.13 -0.49 -4.09 117.38 115.10 1ojr n GLN 6 Ca -0.03 -1.15 -0.32 0.00 -1.94 0.00 0.00 57.00 53.55 1ojr n GLN 6 Cb 0.13 -1.46 0.11 0.00 0.11 0.00 0.00 30.24 29.12 1ojr n GLN 6 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1ojr s SER 7 N -1.89 4.05 0.40 1.08 1.04 -0.20 -4.80 113.70 113.38 1ojr s SER 7 Ca 0.36 2.13 0.06 0.00 0.48 0.00 0.00 55.95 58.98 1ojr s SER 7 Cb 0.20 -2.56 0.82 0.00 0.10 0.00 0.00 66.02 64.58 1ojr s SER 7 CO 0.31 -2.35 2.05 4.11 0.98 0.00 0.00 173.24 178.34 1ojr h TRP 8 N -0.87 0.57 0.19 5.02 5.08 -1.92 -1.00 115.95 123.03 1ojr h TRP 8 Ca -0.45 0.01 -0.31 0.00 1.08 0.00 0.00 58.89 59.22 1ojr h TRP 8 Cb 1.27 -0.19 0.03 0.00 -3.00 0.00 0.00 29.16 27.26 1ojr h TRP 8 CO 0.52 0.36 -1.37 0.27 -1.28 0.00 0.00 178.44 176.94 1ojr h PHE 9 N 0.62 0.85 -0.21 0.12 -5.15 -1.91 0.28 116.94 111.53 1ojr h PHE 9 Ca 0.17 -0.60 -0.05 0.00 -0.20 0.00 0.00 57.97 57.29 1ojr h PHE 9 Cb -0.06 -0.04 -0.01 0.00 0.22 0.00 0.00 35.95 36.06 1ojr h PHE 9 CO -0.00 1.46 -0.07 0.28 -2.00 0.00 0.00 178.31 177.98 1ojr h VAL 10 N 0.15 1.30 -0.88 0.88 2.07 -1.77 -1.09 116.25 116.91 1ojr h VAL 10 Ca -0.21 -1.10 0.01 0.00 0.82 0.00 0.00 66.70 66.22 1ojr h VAL 10 Cb 2.06 1.59 -0.04 0.00 -1.52 0.00 0.00 31.29 33.38 1ojr h VAL 10 CO 0.25 0.33 0.58 1.56 0.02 0.00 0.00 177.57 180.32 1ojr h GLN 11 N 0.12 1.14 -0.65 1.57 1.08 -1.22 -1.19 115.11 115.96 1ojr h GLN 11 Ca 0.05 -0.07 -0.08 0.00 -1.45 0.00 0.00 58.65 57.10 1ojr h GLN 11 Cb 0.55 -0.26 -0.02 0.00 -0.05 0.00 0.00 27.48 27.69 1ojr h GLN 11 CO 0.03 0.76 0.08 0.78 -0.95 0.00 0.00 178.83 179.52 1ojr h GLY 12 N 1.18 1.18 1.05 3.46 0.00 -0.78 -0.13 103.07 109.02 1ojr h GLY 12 Ca 0.33 -0.80 -0.08 0.00 0.00 0.00 0.00 47.33 46.78 1ojr h GLY 12 CO -0.08 0.74 0.10 -0.33 0.00 0.00 0.00 176.54 176.97 1ojr h MET 13 N 1.01 1.05 -0.39 4.80 2.86 -0.68 -1.17 114.93 122.41 1ojr h MET 13 Ca 0.19 -0.28 -0.01 0.00 -2.06 0.00 0.00 59.70 57.54 1ojr h MET 13 Cb 0.47 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.99 1ojr h MET 13 CO 0.02 0.98 0.21 0.82 1.06 0.00 0.00 176.91 179.99 1ojr h ILE 14 N 0.96 1.15 -0.34 -1.22 2.04 -0.97 -1.97 117.51 117.17 1ojr h ILE 14 Ca 0.19 -0.39 -0.01 0.00 1.00 0.00 0.00 64.86 65.65 1ojr h ILE 14 Cb 0.44 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.20 1ojr h ILE 14 CO 0.01 0.15 0.16 0.50 0.00 0.00 0.00 178.15 178.98 1ojr h LYS 15 N 0.49 0.49 -0.25 2.37 3.64 -0.71 -0.84 116.57 121.76 1ojr h LYS 15 Ca 0.14 -0.07 -0.05 0.00 -1.27 0.00 0.00 60.65 59.40 1ojr h LYS 15 Cb 0.06 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 1ojr h LYS 15 CO -0.02 0.45 -0.02 0.00 -2.27 0.00 0.00 179.45 177.58 1ojr h ALA 16 N 1.02 0.34 -0.45 5.00 0.00 -1.15 0.31 119.26 124.32 1ojr h ALA 16 Ca 0.12 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.66 1ojr h ALA 16 Cb 0.12 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1ojr h ALA 16 CO -0.01 0.10 -0.21 1.79 0.00 0.00 0.00 179.25 180.92 1ojr h THR 17 N 0.23 1.27 -0.34 0.00 1.35 -1.34 -1.49 112.91 112.58 1ojr h THR 17 Ca 0.07 -1.36 -0.07 0.00 -0.55 0.00 0.00 66.41 64.50 1ojr h THR 17 Cb 0.46 1.14 -0.01 0.00 -1.73 0.00 0.00 68.15 68.01 1ojr h THR 17 CO 0.02 0.46 -0.07 0.74 -0.25 0.00 0.00 175.52 176.42 1ojr h THR 18 N 0.79 1.28 -0.77 6.82 2.02 -1.06 -0.65 112.91 121.33 1ojr h THR 18 Ca 0.11 -1.12 0.01 0.00 0.77 0.00 0.00 66.41 66.18 1ojr h THR 18 Cb 0.76 1.30 -0.04 0.00 -1.74 0.00 0.00 68.15 68.44 1ojr h THR 18 CO 0.06 0.37 0.51 0.44 0.37 0.00 0.00 175.52 177.26 1ojr h ASP 19 N 0.44 0.90 -0.46 4.18 3.32 -0.85 -0.51 116.42 123.44 1ojr h ASP 19 Ca 0.09 -0.03 -0.11 0.00 0.02 0.00 0.00 57.03 56.99 1ojr h ASP 19 Cb 0.57 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.87 1ojr h ASP 19 CO 0.03 0.66 -0.14 0.00 -1.72 0.00 0.00 179.24 178.06 1ojr h ALA 20 N 1.28 0.81 -0.29 3.45 0.00 -1.13 -1.28 119.26 122.09 1ojr h ALA 20 Ca 0.28 -0.36 0.04 0.00 0.00 0.00 0.00 54.91 54.88 1ojr h ALA 20 Cb -0.11 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.46 1ojr h ALA 20 CO -0.06 0.66 0.05 2.35 0.00 0.00 0.00 179.25 182.25 1ojr h TRP 21 N 0.84 0.09 0.00 0.00 2.91 -0.67 -2.43 115.95 116.69 1ojr h TRP 21 Ca 0.13 0.02 -0.04 0.00 1.13 0.00 0.00 58.89 60.12 1ojr h TRP 21 Cb 0.69 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 29.34 1ojr h TRP 21 CO 0.04 0.02 -0.19 -0.07 -1.03 0.00 0.00 178.44 177.21 1ojr h LEU 22 N 0.16 0.00 -0.41 0.65 3.38 -0.74 -1.59 115.31 116.76 1ojr h LEU 22 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1ojr h LEU 22 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1ojr h LEU 22 CO -0.18 0.19 0.00 0.29 0.09 0.00 0.00 178.44 178.83 1ojr n LYS 23 N -4.05 0.15 -1.30 1.13 4.76 -0.52 -4.90 118.16 113.44 1ojr n LYS 23 Ca -0.02 0.33 0.00 0.00 -2.87 0.00 0.00 58.31 55.75 1ojr n LYS 23 Cb 0.27 -1.76 0.00 0.00 -1.84 0.00 0.00 35.03 31.70 1ojr n LYS 23 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ojr n GLY 24 N 0.25 0.46 0.73 0.72 0.00 -0.60 -4.96 105.19 101.79 1ojr n GLY 24 Ca 0.03 -0.93 0.12 0.00 0.00 0.00 0.00 46.02 45.24 1ojr n GLY 24 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1ojr n TRP 25 N -3.26 0.00 -3.08 1.61 8.01 -0.96 -4.69 117.44 115.06 1ojr n TRP 25 Ca 0.00 0.00 -0.16 0.00 -1.31 0.00 0.00 57.50 56.03 1ojr n TRP 25 Cb 0.19 -0.01 -0.01 0.00 -2.01 0.00 0.00 31.31 29.48 1ojr n TRP 25 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 1ojr n ASP 26 N 0.70 0.01 -4.75 -0.99 9.92 -1.26 -0.38 116.55 119.80 1ojr n ASP 26 Ca 0.13 -3.14 -0.38 0.00 -0.53 0.00 0.00 54.79 50.86 1ojr n ASP 26 Cb 0.52 -0.01 0.04 0.00 -0.64 0.00 0.00 41.12 41.03 1ojr n ASP 26 CO 0.00 0.00 0.00 -1.83 0.13 0.00 0.00 177.20 175.50 1ojr s GLU 27 N -1.68 3.14 5.77 -1.24 1.03 -1.26 -4.59 118.70 119.86 1ojr s GLU 27 Ca 0.36 2.24 0.00 0.00 0.03 0.00 0.00 54.97 57.60 1ojr s GLU 27 Cb 0.32 -2.26 0.00 0.00 -0.80 0.00 0.00 34.13 31.39 1ojr s GLU 27 CO -0.08 -1.20 0.00 -2.13 -1.33 0.00 0.00 175.26 170.52 1ojr n ARG 28 N -1.03 0.00 -0.62 -4.83 0.63 -1.26 -0.56 116.66 108.99 1ojr n ARG 28 Ca 0.10 0.00 0.09 0.00 -0.92 0.00 0.00 57.85 57.12 1ojr n ARG 28 Cb 0.45 0.00 0.35 0.00 0.45 0.00 0.00 32.46 33.71 1ojr n ARG 28 CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 1ojr n ASN 29 N 3.73 4.68 -4.75 6.15 6.94 -1.26 -4.09 115.26 126.67 1ojr n ASN 29 Ca 0.00 -2.46 -0.41 0.00 -0.02 0.00 0.00 54.58 51.69 1ojr n ASN 29 Cb 0.00 -0.58 -0.02 0.00 -2.36 0.00 0.00 39.78 36.82 1ojr n ASN 29 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 1ojr s GLY 30 N -0.86 2.32 0.00 4.83 0.00 0.27 -4.79 107.32 109.09 1ojr s GLY 30 Ca 0.50 1.34 0.00 0.00 0.00 0.00 0.00 44.72 46.56 1ojr s GLY 30 CO 0.23 2.30 0.00 0.61 0.00 0.00 0.00 173.10 176.24 1ojr n GLY 31 N 2.18 0.96 3.48 0.20 0.00 -1.26 -4.56 105.19 106.19 1ojr n GLY 31 Ca 0.07 -1.77 -0.13 0.00 0.00 0.00 0.00 46.02 44.19 1ojr n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ojr s ASN 32 N -1.03 -0.54 -0.11 1.61 2.20 -0.50 -4.97 114.94 111.60 1ojr s ASN 32 Ca 0.00 0.26 -0.06 0.00 -0.94 0.00 0.00 52.86 52.12 1ojr s ASN 32 Cb 0.00 0.51 0.04 0.00 -2.00 0.00 0.00 41.25 39.80 1ojr s ASN 32 CO 0.00 -0.73 0.26 -0.22 -2.94 0.00 0.00 177.10 173.48 1ojr s LEU 33 N -2.04 0.48 -0.01 3.54 2.96 -1.26 -0.64 118.68 121.71 1ojr s LEU 33 Ca -0.02 0.56 0.02 0.00 -0.22 0.00 0.00 54.13 54.47 1ojr s LEU 33 Cb -0.01 0.82 -0.01 0.00 0.50 0.00 0.00 46.19 47.50 1ojr s LEU 33 CO -0.04 -0.15 -0.08 0.42 -1.32 0.00 0.00 176.35 175.19 1ojr s THR 34 N 1.06 0.60 -0.09 3.68 -4.23 -0.58 -1.83 115.64 114.24 1ojr s THR 34 Ca -0.08 -0.32 0.00 0.00 -1.18 0.00 0.00 61.69 60.12 1ojr s THR 34 Cb -0.09 -0.50 0.02 0.00 1.34 0.00 0.00 72.50 73.27 1ojr s THR 34 CO -0.07 0.17 -0.08 -0.22 -0.54 0.00 0.00 174.62 173.88 1ojr s LEU 35 N -0.15 1.24 -0.11 4.79 2.96 -0.10 -1.64 118.68 125.67 1ojr s LEU 35 Ca 0.03 -0.27 -0.29 0.00 -0.22 0.00 0.00 54.13 53.38 1ojr s LEU 35 Cb -0.03 -0.77 -0.01 0.00 0.50 0.00 0.00 46.19 45.87 1ojr s LEU 35 CO -0.00 -0.09 0.98 -0.60 -1.32 0.00 0.00 176.35 175.32 1ojr s ARG 36 N 1.45 4.40 0.50 1.98 3.52 0.98 -0.85 118.95 130.94 1ojr s ARG 36 Ca -0.00 1.33 0.06 0.00 -0.13 0.00 0.00 55.73 56.99 1ojr s ARG 36 Cb -0.13 -3.55 0.02 0.00 -1.56 0.00 0.00 34.95 29.73 1ojr s ARG 36 CO -0.05 -0.31 0.38 -0.51 -0.81 0.00 0.00 175.30 174.01 1ojr s LEU 37 N 2.01 2.92 0.20 -0.88 1.43 0.01 -4.92 118.68 119.45 1ojr s LEU 37 Ca 0.47 -1.10 0.07 0.00 -1.03 0.00 0.00 54.13 52.54 1ojr s LEU 37 Cb -0.18 -1.43 -0.04 0.00 0.03 0.00 0.00 46.19 44.57 1ojr s LEU 37 CO 0.17 -0.95 0.06 -1.81 0.23 0.00 0.00 176.35 174.06 1ojr s ASP 38 N -4.22 5.01 0.31 2.29 -0.00 -1.26 -4.25 116.67 114.55 1ojr s ASP 38 Ca 0.39 -0.36 0.03 0.00 -0.00 0.00 0.00 52.55 52.60 1ojr s ASP 38 Cb -0.02 -1.14 0.61 0.00 -0.00 0.00 0.00 42.92 42.37 1ojr s ASP 38 CO 0.23 0.05 1.88 0.44 -0.00 0.00 0.00 175.17 177.77 1ojr h ASP 39 N 2.28 0.85 0.08 0.27 3.32 -1.94 -0.77 116.42 120.51 1ojr h ASP 39 Ca -0.47 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 56.60 1ojr h ASP 39 Cb 1.22 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 40.61 1ojr h ASP 39 CO 0.60 0.50 -0.04 0.00 -1.72 0.00 0.00 179.24 178.58 1ojr h ALA 40 N 1.54 1.61 -0.48 3.45 0.00 -2.00 0.26 119.26 123.64 1ojr h ALA 40 Ca 0.43 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 55.18 1ojr h ALA 40 Cb 0.39 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1ojr h ALA 40 CO -0.19 0.05 -0.20 -0.44 0.00 0.00 0.00 179.25 178.47 1ojr h ASP 41 N 0.00 1.00 0.13 0.00 3.32 -1.54 -3.35 116.42 115.98 1ojr h ASP 41 Ca -0.00 -0.39 -0.12 0.00 0.02 0.00 0.00 57.03 56.54 1ojr h ASP 41 Cb 0.09 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 1ojr h ASP 41 CO 0.01 1.17 -2.00 2.30 -1.72 0.00 0.00 179.24 178.99 1ojr n ILE 42 N -4.14 0.55 -0.30 0.35 -5.35 -0.85 -4.55 119.36 105.06 1ojr n ILE 42 Ca -0.00 -0.62 0.10 0.00 -0.27 0.00 0.00 62.75 61.96 1ojr n ILE 42 Cb 0.45 -0.22 0.26 0.00 -1.74 0.00 0.00 39.64 38.39 1ojr n ILE 42 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ojr h ALA 43 N 1.66 1.35 0.00 -1.28 0.00 -1.10 0.39 119.26 120.29 1ojr h ALA 43 Ca -0.17 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1ojr h ALA 43 Cb 1.41 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.27 1ojr h ALA 43 CO 0.01 -0.21 0.00 -1.35 0.00 0.00 0.00 179.25 177.70 1ojr h PRO 44 N 0.51 0.00 -0.61 0.00 0.11 -1.80 -2.63 132.00 127.58 1ojr h PRO 44 Ca 0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.62 1ojr h PRO 44 Cb 0.85 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.96 1ojr h PRO 44 CO -0.44 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.01 1ojr n TYR 45 N -2.98 1.75 -0.29 0.65 4.02 0.13 -3.40 117.16 117.04 1ojr n TYR 45 Ca -0.02 -0.67 0.25 0.00 -0.01 0.00 0.00 57.90 57.44 1ojr n TYR 45 Cb 0.11 -0.37 0.57 0.00 -0.02 0.00 0.00 39.34 39.63 1ojr n TYR 45 CO 0.00 0.00 0.00 1.12 -1.01 0.00 0.00 176.86 176.97 1ojr h HIS 46 N 3.99 0.45 0.00 -0.72 2.07 -1.53 0.11 115.15 119.51 1ojr h HIS 46 Ca 0.00 0.02 -0.00 0.00 -2.85 0.00 0.00 60.37 57.53 1ojr h HIS 46 Cb 1.70 -0.13 -0.00 0.00 2.57 0.00 0.00 27.41 31.54 1ojr h HIS 46 CO 0.91 0.06 -0.02 -0.44 -3.07 0.00 0.00 177.93 175.38 1ojr h ASP 47 N 0.29 0.00 0.33 3.10 3.32 -1.88 -2.34 116.42 119.24 1ojr h ASP 47 Ca 0.54 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.59 1ojr h ASP 47 Cb 1.58 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.13 1ojr h ASP 47 CO -0.19 0.02 -0.38 0.59 -1.72 0.00 0.00 179.24 177.55 1ojr n ASN 48 N -3.16 0.84 -4.79 6.45 5.03 0.36 -4.95 115.26 115.05 1ojr n ASN 48 Ca -0.01 -0.66 -0.31 0.00 0.87 0.00 0.00 54.58 54.46 1ojr n ASN 48 Cb 0.19 0.22 0.07 0.00 -1.02 0.00 0.00 39.78 39.24 1ojr n ASN 48 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 1ojr s PHE 49 N -2.71 2.77 0.42 3.10 0.08 -0.88 -4.90 117.98 115.85 1ojr s PHE 49 Ca 0.18 1.51 -0.26 0.00 0.12 0.00 0.00 56.93 58.48 1ojr s PHE 49 Cb 0.18 -3.01 -0.09 0.00 -0.57 0.00 0.00 43.02 39.53 1ojr s PHE 49 CO 0.60 -1.57 1.42 -1.01 -0.10 0.00 0.00 175.22 174.56 1ojr s HIS 50 N -2.85 2.57 0.31 0.36 3.76 0.45 -4.91 115.29 114.98 1ojr s HIS 50 Ca 0.61 1.26 0.02 0.00 -0.15 0.00 0.00 55.06 56.81 1ojr s HIS 50 Cb -0.17 -3.90 0.50 0.00 1.11 0.00 0.00 32.58 30.13 1ojr s HIS 50 CO 0.53 -2.78 1.83 1.96 -0.85 0.00 0.00 174.74 175.43 1ojr h GLN 51 N 2.61 0.61 -2.54 1.40 1.08 -1.94 -3.34 115.11 113.00 1ojr h GLN 51 Ca -0.51 -0.14 -0.60 0.00 -1.45 0.00 0.00 58.65 55.95 1ojr h GLN 51 Cb 1.25 -0.08 -0.39 0.00 -0.05 0.00 0.00 27.48 28.21 1ojr h GLN 51 CO 0.62 0.64 -0.86 1.04 -0.95 0.00 0.00 178.83 179.32 1ojr n GLN 52 N -4.25 0.77 -1.63 1.46 6.02 -1.26 -5.11 117.38 113.38 1ojr n GLN 52 Ca 0.02 -3.60 -0.47 0.00 -0.01 0.00 0.00 57.00 52.93 1ojr n GLN 52 Cb 0.27 -1.83 -0.04 0.00 1.02 0.00 0.00 30.24 29.66 1ojr n GLN 52 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 1ojr n PRO 53 N 2.42 1.67 -2.29 -1.09 -0.02 -1.26 -4.95 135.00 129.48 1ojr n PRO 53 Ca 0.27 0.60 -0.37 0.00 -2.02 0.00 0.00 63.50 61.98 1ojr n PRO 53 Cb 0.44 -2.24 -0.01 0.00 -0.02 0.00 0.00 33.50 31.68 1ojr n PRO 53 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1ojr s ARG 54 N 0.06 3.75 -0.10 -0.52 0.52 -1.25 -4.69 118.95 116.72 1ojr s ARG 54 Ca 0.75 1.72 -0.01 0.00 -0.52 0.00 0.00 55.73 57.67 1ojr s ARG 54 Cb -0.77 -2.36 -0.03 0.00 0.52 0.00 0.00 34.95 32.32 1ojr s ARG 54 CO 0.47 -0.55 -0.05 -0.47 0.02 0.00 0.00 175.30 174.72 1ojr s TYR 55 N -1.60 3.00 -0.02 -0.53 5.04 -1.26 -0.52 117.35 121.46 1ojr s TYR 55 Ca 0.64 -0.05 0.00 0.00 -2.44 0.00 0.00 57.07 55.22 1ojr s TYR 55 Cb -0.27 -1.80 0.02 0.00 0.35 0.00 0.00 41.96 40.26 1ojr s TYR 55 CO 0.33 0.24 -0.00 0.42 -1.34 0.00 0.00 175.55 175.19 1ojr s ILE 56 N -0.46 0.13 0.61 3.14 1.01 -0.53 -5.00 121.20 120.11 1ojr s ILE 56 Ca 0.07 0.04 -0.15 0.00 0.00 0.00 0.00 60.65 60.61 1ojr s ILE 56 Cb -0.12 -0.19 -0.03 0.00 0.01 0.00 0.00 42.46 42.13 1ojr s ILE 56 CO 0.02 0.10 1.05 -2.16 0.00 0.00 0.00 174.94 173.95 1ojr s PRO 57 N 0.60 3.25 0.58 2.79 0.04 -1.26 -1.09 135.00 139.90 1ojr s PRO 57 Ca -0.06 1.13 -0.07 0.00 0.04 0.00 0.00 61.00 62.05 1ojr s PRO 57 Cb -0.08 -2.03 -0.01 0.00 0.04 0.00 0.00 34.50 32.42 1ojr s PRO 57 CO -0.01 -0.86 0.90 -0.51 0.04 0.00 0.00 177.00 176.57 1ojr s LEU 58 N -4.74 3.29 0.49 -3.56 1.43 -0.29 -4.86 118.68 110.45 1ojr s LEU 58 Ca 0.62 0.87 0.28 0.00 -1.03 0.00 0.00 54.13 54.87 1ojr s LEU 58 Cb -0.15 -3.75 0.84 0.00 0.03 0.00 0.00 46.19 43.17 1ojr s LEU 58 CO 0.41 -0.96 1.79 0.77 0.23 0.00 0.00 176.35 178.60 1ojr h SER 59 N -0.14 0.00 -5.03 2.29 4.64 -1.97 -3.46 113.55 109.88 1ojr h SER 59 Ca -0.46 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.80 1ojr h SER 59 Cb 1.24 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.17 1ojr h SER 59 CO 0.61 0.01 0.01 0.00 -0.87 0.00 0.00 176.83 176.60 1ojr s GLN 60 N -3.44 1.03 0.30 4.77 -2.07 -1.26 -5.14 119.66 113.86 1ojr s GLN 60 Ca 0.04 -0.32 -0.29 0.00 -1.82 0.00 0.00 55.36 52.96 1ojr s GLN 60 Cb 0.07 0.47 -0.11 0.00 -1.09 0.00 0.00 33.01 32.35 1ojr s GLN 60 CO 0.61 -0.38 1.46 -2.14 -1.32 0.00 0.00 175.29 173.52 1ojr s PRO 61 N -2.68 4.22 -0.46 9.60 0.02 -1.26 -4.87 135.00 139.57 1ojr s PRO 61 Ca -0.04 2.40 0.07 0.00 0.02 0.00 0.00 61.00 63.46 1ojr s PRO 61 Cb -0.00 -3.05 0.25 0.00 0.02 0.00 0.00 34.50 31.72 1ojr s PRO 61 CO -0.04 -0.44 0.59 -1.33 -0.33 0.00 0.00 177.00 175.45 1ojr n MET 62 N 1.56 1.25 0.13 5.54 2.81 0.38 -4.97 117.12 123.82 1ojr n MET 62 Ca 0.04 -3.64 0.17 0.00 -1.81 0.00 0.00 57.70 52.46 1ojr n MET 62 Cb 0.40 -1.52 0.73 0.00 -0.71 0.00 0.00 33.22 32.12 1ojr n MET 62 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 1ojr h PRO 63 N 4.02 0.00 0.00 0.03 0.13 -1.76 -0.17 132.00 134.26 1ojr h PRO 63 Ca 0.11 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.22 1ojr h PRO 63 Cb 0.82 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.95 1ojr h PRO 63 CO 0.57 0.00 -0.06 1.25 -0.23 0.00 0.00 178.00 179.53 1ojr h LEU 64 N 0.00 0.00 -2.20 1.56 5.85 -1.93 -2.09 115.31 116.50 1ojr h LEU 64 Ca 0.14 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.86 1ojr h LEU 64 Cb 0.63 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.66 1ojr h LEU 64 CO -0.00 0.06 0.00 0.18 -0.34 0.00 0.00 178.44 178.34 1ojr n LEU 65 N -3.67 3.22 -4.61 2.25 4.77 -0.08 -4.98 117.00 113.90 1ojr n LEU 65 Ca -0.02 -1.57 -0.48 0.00 -0.03 0.00 0.00 56.01 53.91 1ojr n LEU 65 Cb 0.16 -0.37 -0.04 0.00 -2.33 0.00 0.00 43.42 40.84 1ojr n LEU 65 CO 0.28 0.79 0.83 0.00 -1.33 0.00 0.00 177.39 177.95 1ojr n ALA 66 N 1.27 -0.20 -1.33 -1.18 0.00 -0.79 -1.48 120.51 116.81 1ojr n ALA 66 Ca 0.20 0.45 -0.11 0.00 0.00 0.00 0.00 53.44 53.98 1ojr n ALA 66 Cb 0.52 -2.11 -0.05 0.00 0.00 0.00 0.00 19.45 17.81 1ojr n ALA 66 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ojr n ASN 67 N 2.14 -5.27 -4.70 0.00 3.02 -0.47 -4.96 115.26 105.01 1ojr n ASN 67 Ca 0.14 0.28 -0.37 0.00 -0.03 0.00 0.00 54.58 54.61 1ojr n ASN 67 Cb 0.26 -3.76 -0.08 0.00 -0.61 0.00 0.00 39.78 35.59 1ojr n ASN 67 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1ojr s THR 68 N -2.11 5.31 0.21 3.41 2.01 -0.55 -4.77 115.64 119.14 1ojr s THR 68 Ca 0.00 0.47 -0.15 0.00 0.31 0.00 0.00 61.69 62.32 1ojr s THR 68 Cb 0.00 -3.61 -0.08 0.00 0.01 0.00 0.00 72.50 68.83 1ojr s THR 68 CO 0.00 0.36 0.62 -2.16 -0.69 0.00 0.00 174.62 172.75 1ojr s PRO 69 N 0.72 4.03 0.04 4.92 0.04 -1.26 -1.25 135.00 142.24 1ojr s PRO 69 Ca 0.14 0.58 0.00 0.00 0.04 0.00 0.00 61.00 61.77 1ojr s PRO 69 Cb -0.13 -2.80 -0.03 0.00 0.04 0.00 0.00 34.50 31.58 1ojr s PRO 69 CO 0.04 0.38 -0.04 -0.06 0.04 0.00 0.00 177.00 177.36 1ojr s PHE 70 N -1.61 0.44 -0.10 0.56 0.40 0.32 -0.81 117.98 117.18 1ojr s PHE 70 Ca 0.43 -0.71 -0.01 0.00 -0.60 0.00 0.00 56.93 56.04 1ojr s PHE 70 Cb -0.14 -0.30 -0.03 0.00 0.51 0.00 0.00 43.02 43.06 1ojr s PHE 70 CO 0.20 -0.23 -0.07 -1.50 0.70 0.00 0.00 175.22 174.32 1ojr s ILE 71 N -2.32 3.63 0.05 0.64 2.07 -0.03 -0.83 121.20 124.42 1ojr s ILE 71 Ca -0.06 -0.48 -0.00 0.00 -1.41 0.00 0.00 60.65 58.69 1ojr s ILE 71 Cb -0.04 -2.52 -0.03 0.00 0.13 0.00 0.00 42.46 40.00 1ojr s ILE 71 CO -0.04 0.55 -0.04 0.68 -1.91 0.00 0.00 174.94 174.19 1ojr s VAL 72 N -0.26 0.26 0.38 4.00 -7.23 0.07 -0.93 120.40 116.69 1ojr s VAL 72 Ca 0.03 -1.57 -0.10 0.00 -1.81 0.00 0.00 61.98 58.54 1ojr s VAL 72 Cb -0.13 -1.18 -0.06 0.00 0.56 0.00 0.00 36.38 35.57 1ojr s VAL 72 CO 0.03 -0.83 0.73 0.42 -0.31 0.00 0.00 175.10 175.13 1ojr s THR 73 N -3.16 4.82 0.37 5.32 -4.23 -0.76 -0.99 115.64 117.02 1ojr s THR 73 Ca 0.01 0.55 -0.03 0.00 -1.18 0.00 0.00 61.69 61.04 1ojr s THR 73 Cb 0.02 -3.72 -0.04 0.00 1.34 0.00 0.00 72.50 70.10 1ojr s THR 73 CO -0.07 -0.46 0.63 -0.83 -0.54 0.00 0.00 174.62 173.35 1ojr s GLY 74 N -3.09 1.58 0.18 3.99 0.00 -0.20 -1.19 107.32 108.59 1ojr s GLY 74 Ca 0.50 -0.64 -0.31 0.00 0.00 0.00 0.00 44.72 44.27 1ojr s GLY 74 CO 0.30 -0.53 1.45 -0.45 0.00 0.00 0.00 173.10 173.88 1ojr s SER 75 N -3.74 6.70 0.00 1.64 0.15 0.62 -2.50 113.70 116.58 1ojr s SER 75 Ca 0.44 2.53 0.00 0.00 0.70 0.00 0.00 55.95 59.62 1ojr s SER 75 Cb -0.10 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.61 1ojr s SER 75 CO 0.36 -0.71 0.00 0.61 1.20 0.00 0.00 173.24 174.70 1ojr n GLY 76 N 3.09 0.75 3.86 9.45 0.00 -1.26 -4.77 105.19 116.31 1ojr n GLY 76 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 1ojr n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ojr s LYS 77 N -0.23 3.93 -0.18 1.61 -0.14 -1.04 -4.74 119.74 118.94 1ojr s LYS 77 Ca 0.00 0.59 -0.11 0.00 -1.36 0.00 0.00 55.97 55.09 1ojr s LYS 77 Cb 0.00 -2.43 -0.05 0.00 -1.68 0.00 0.00 37.83 33.67 1ojr s LYS 77 CO 0.00 0.12 0.19 -0.06 -0.76 0.00 0.00 175.35 174.84 1ojr s PHE 78 N -2.07 3.43 0.36 3.18 0.40 -1.26 -4.34 117.98 117.68 1ojr s PHE 78 Ca 0.53 0.43 0.10 0.00 -0.60 0.00 0.00 56.93 57.39 1ojr s PHE 78 Cb -0.10 -2.22 0.87 0.00 0.51 0.00 0.00 43.02 42.07 1ojr s PHE 78 CO 0.21 0.28 1.85 0.74 0.70 0.00 0.00 175.22 179.00 1ojr h PHE 79 N 6.63 0.79 -0.11 0.36 -1.00 -1.81 -0.84 116.94 120.96 1ojr h PHE 79 Ca -0.41 0.02 0.03 0.00 2.81 0.00 0.00 57.97 60.42 1ojr h PHE 79 Cb 1.16 -0.25 -0.00 0.00 3.61 0.00 0.00 35.95 40.47 1ojr h PHE 79 CO 0.59 0.26 0.09 -0.09 -1.61 0.00 0.00 178.31 177.55 1ojr h ARG 80 N 0.64 0.00 0.00 1.51 1.12 -1.84 -2.70 114.38 113.11 1ojr h ARG 80 Ca 0.47 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 59.34 1ojr h ARG 80 Cb 0.86 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.82 1ojr h ARG 80 CO -0.23 0.00 -0.69 0.09 -3.11 0.00 0.00 179.97 176.03 1ojr n ASN 81 N -4.25 0.64 -0.24 -3.80 3.02 -0.33 -4.36 115.26 105.94 1ojr n ASN 81 Ca -0.00 -0.40 0.01 0.00 -0.03 0.00 0.00 54.58 54.16 1ojr n ASN 81 Cb 0.21 0.50 0.14 0.00 -0.61 0.00 0.00 39.78 40.01 1ojr n ASN 81 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1ojr h VAL 82 N 0.00 0.84 0.00 2.41 2.07 -1.45 -0.38 116.25 119.75 1ojr h VAL 82 Ca 0.00 -0.20 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 1ojr h VAL 82 Cb 0.54 0.20 -0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1ojr h VAL 82 CO 0.00 0.11 -0.16 0.06 0.02 0.00 0.00 177.57 177.60 1ojr h GLN 83 N 0.59 0.00 0.01 1.57 3.07 -1.79 -2.23 115.11 116.34 1ojr h GLN 83 Ca 0.35 0.00 -0.22 0.00 0.09 0.00 0.00 58.65 58.87 1ojr h GLN 83 Cb 0.37 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 27.90 1ojr h GLN 83 CO -0.27 0.16 -1.09 -0.07 0.09 0.00 0.00 178.83 177.65 1ojr h LEU 84 N 0.00 0.04 -5.22 0.06 3.38 -1.34 -3.42 115.31 108.80 1ojr h LEU 84 Ca -0.00 -0.04 -0.21 0.00 0.09 0.00 0.00 57.88 57.72 1ojr h LEU 84 Cb 0.39 -0.01 -0.19 0.00 0.09 0.00 0.00 40.66 40.94 1ojr h LEU 84 CO 0.02 1.03 -0.56 -0.62 0.09 0.00 0.00 178.44 178.40 1ojr s ASP 85 N -6.69 -1.03 0.22 -0.43 3.68 -0.88 -5.03 116.67 106.52 1ojr s ASP 85 Ca -0.00 -1.92 -0.07 0.00 2.13 0.00 0.00 52.55 52.69 1ojr s ASP 85 Cb 0.10 1.56 0.33 0.00 -1.45 0.00 0.00 42.92 43.45 1ojr s ASP 85 CO 0.83 -0.07 1.78 -0.65 0.13 0.00 0.00 175.17 177.19 1ojr h PRO 86 N 5.14 0.60 0.00 4.34 0.11 -1.66 -2.18 132.00 138.35 1ojr h PRO 86 Ca 0.09 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.13 1ojr h PRO 86 Cb 1.08 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.05 1ojr h PRO 86 CO 0.06 0.40 -0.18 0.00 -0.21 0.00 0.00 178.00 178.07 1ojr h ALA 87 N 1.42 1.17 0.03 -0.75 0.00 -1.88 0.28 119.26 119.53 1ojr h ALA 87 Ca 0.35 -0.16 -0.22 0.00 0.00 0.00 0.00 54.91 54.87 1ojr h ALA 87 Cb 0.35 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1ojr h ALA 87 CO -0.26 0.23 -1.01 0.00 0.00 0.00 0.00 179.25 178.21 1ojr h ALA 88 N 1.82 0.36 0.00 0.00 0.00 -1.77 0.87 119.26 120.54 1ojr h ALA 88 Ca -0.00 -0.85 0.00 0.00 0.00 0.00 0.00 54.91 54.05 1ojr h ALA 88 Cb 0.53 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1ojr h ALA 88 CO 0.02 1.11 -1.18 0.09 0.00 0.00 0.00 179.25 179.29 1ojr n ASN 89 N -3.47 1.18 -4.39 0.00 3.02 -0.99 -4.34 115.26 106.28 1ojr n ASN 89 Ca -0.03 -0.40 -0.22 0.00 -0.03 0.00 0.00 54.58 53.90 1ojr n ASN 89 Cb 0.92 1.34 -0.11 0.00 -0.61 0.00 0.00 39.78 41.33 1ojr n ASN 89 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ojr s LEU 90 N -3.36 2.52 0.00 3.41 1.43 0.05 -1.03 118.68 121.70 1ojr s LEU 90 Ca -0.00 -0.96 -0.05 0.00 -1.03 0.00 0.00 54.13 52.09 1ojr s LEU 90 Cb 0.10 -0.90 -0.00 0.00 0.03 0.00 0.00 46.19 45.41 1ojr s LEU 90 CO 0.59 -0.03 0.09 -0.83 0.23 0.00 0.00 176.35 176.40 1ojr s GLY 91 N -3.11 0.09 -0.24 -3.19 0.00 -0.16 -0.84 107.32 99.87 1ojr s GLY 91 Ca 0.23 -0.22 -0.09 0.00 0.00 0.00 0.00 44.72 44.63 1ojr s GLY 91 CO 0.10 -0.34 0.11 -0.42 0.00 0.00 0.00 173.10 172.55 1ojr s ILE 92 N -1.30 4.84 0.14 0.90 1.01 0.18 -0.75 121.20 126.21 1ojr s ILE 92 Ca -0.14 -0.00 0.11 0.00 0.00 0.00 0.00 60.65 60.62 1ojr s ILE 92 Cb -0.08 -3.25 -0.04 0.00 0.01 0.00 0.00 42.46 39.10 1ojr s ILE 92 CO 0.01 0.35 -0.26 0.68 0.00 0.00 0.00 174.94 175.72 1ojr s VAL 93 N 1.24 2.23 -0.12 2.92 -7.23 -0.01 -0.28 120.40 119.16 1ojr s VAL 93 Ca 0.06 -1.78 0.00 0.00 -1.81 0.00 0.00 61.98 58.45 1ojr s VAL 93 Cb -0.14 -1.98 0.02 0.00 0.56 0.00 0.00 36.38 34.83 1ojr s VAL 93 CO 0.05 0.05 -0.10 -0.75 -0.31 0.00 0.00 175.10 174.04 1ojr s LYS 94 N -2.12 1.81 0.31 4.82 2.20 -0.08 -0.52 119.74 126.16 1ojr s LYS 94 Ca 0.14 -0.38 -0.29 0.00 -0.36 0.00 0.00 55.97 55.09 1ojr s LYS 94 Cb -0.10 -1.74 -0.10 0.00 -1.51 0.00 0.00 37.83 34.38 1ojr s LYS 94 CO 0.06 -0.22 1.22 0.08 -0.36 0.00 0.00 175.35 176.14 1ojr s VAL 95 N 1.51 3.03 1.13 4.02 1.01 -0.38 -1.20 120.40 129.53 1ojr s VAL 95 Ca 0.03 1.04 -0.19 0.00 0.00 0.00 0.00 61.98 62.86 1ojr s VAL 95 Cb -0.13 -3.66 0.27 0.00 0.00 0.00 0.00 36.38 32.86 1ojr s VAL 95 CO -0.07 0.25 1.20 1.51 0.00 0.00 0.00 175.10 177.98 1ojr s ASP 96 N -0.62 1.55 0.44 3.32 1.47 0.44 -1.37 116.67 121.90 1ojr s ASP 96 Ca 0.47 0.42 0.30 0.00 1.18 0.00 0.00 52.55 54.93 1ojr s ASP 96 Cb -0.37 -0.53 1.38 0.00 -0.34 0.00 0.00 42.92 43.06 1ojr s ASP 96 CO 0.48 -3.71 1.91 0.28 0.68 0.00 0.00 175.17 174.80 1ojr h SER 97 N -2.31 0.00 -0.14 2.11 0.02 -1.93 -2.13 113.55 109.18 1ojr h SER 97 Ca -0.44 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 1ojr h SER 97 Cb 1.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.80 1ojr h SER 97 CO 0.32 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.48 1ojr n ASP 98 N -2.68 2.47 -1.86 3.07 8.00 -1.26 -4.76 116.55 119.54 1ojr n ASP 98 Ca 0.00 -1.71 -0.14 0.00 0.71 0.00 0.00 54.79 53.65 1ojr n ASP 98 Cb 0.20 -0.09 0.01 0.00 -0.02 0.00 0.00 41.12 41.23 1ojr n ASP 98 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ojr n GLY 99 N 0.79 -0.14 0.01 0.44 0.00 -0.99 -4.12 105.19 101.18 1ojr n GLY 99 Ca 0.10 -0.24 0.11 0.00 0.00 0.00 0.00 46.02 45.99 1ojr n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ojr n ALA 100 N -2.42 3.49 -3.37 4.61 0.00 -1.26 -0.47 120.51 121.09 1ojr n ALA 100 Ca -0.11 -0.53 0.07 0.00 0.00 0.00 0.00 53.44 52.86 1ojr n ALA 100 Cb 0.60 -0.78 0.00 0.00 0.00 0.00 0.00 19.45 19.27 1ojr n ALA 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ojr n GLY 101 N 1.35 0.41 3.24 0.00 0.00 -1.26 -1.14 105.19 107.79 1ojr n GLY 101 Ca -0.01 -0.90 -0.10 0.00 0.00 0.00 0.00 46.02 45.02 1ojr n GLY 101 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ojr s TYR 102 N -2.45 0.01 -0.05 1.61 1.13 -0.25 -0.42 117.35 116.93 1ojr s TYR 102 Ca 0.11 -0.36 -0.02 0.00 -1.41 0.00 0.00 57.07 55.39 1ojr s TYR 102 Cb -0.00 0.05 -0.04 0.00 -1.10 0.00 0.00 41.96 40.88 1ojr s TYR 102 CO -0.01 -0.58 0.07 -1.01 -2.51 0.00 0.00 175.55 171.51 1ojr s HIS 103 N -3.61 3.30 -0.71 -3.49 3.76 -0.34 -1.45 115.29 112.75 1ojr s HIS 103 Ca 0.03 0.26 -0.19 0.00 -0.15 0.00 0.00 55.06 55.01 1ojr s HIS 103 Cb 0.03 -1.79 0.12 0.00 1.11 0.00 0.00 32.58 32.05 1ojr s HIS 103 CO -0.10 0.56 0.84 0.42 -0.85 0.00 0.00 174.74 175.61 1ojr s ILE 104 N -1.07 4.84 0.27 0.60 1.01 0.32 -0.90 121.20 126.26 1ojr s ILE 104 Ca 0.18 -1.24 0.08 0.00 0.00 0.00 0.00 60.65 59.68 1ojr s ILE 104 Cb -0.12 -4.58 -0.02 0.00 0.01 0.00 0.00 42.46 37.75 1ojr s ILE 104 CO 0.08 -1.25 1.61 -0.07 0.00 0.00 0.00 174.94 175.32 1ojr h LEU 105 N 9.97 0.12 -7.24 2.97 3.38 -0.96 -3.33 115.31 120.22 1ojr h LEU 105 Ca -0.14 -0.07 -0.09 0.00 0.09 0.00 0.00 57.88 57.67 1ojr h LEU 105 Cb 1.06 -0.04 -0.21 0.00 0.09 0.00 0.00 40.66 41.57 1ojr h LEU 105 CO 1.07 0.67 -0.07 0.86 0.09 0.00 0.00 178.44 181.06 1ojr s TRP 106 N -3.75 -0.48 0.00 1.13 -0.00 -1.14 -0.41 118.94 114.29 1ojr s TRP 106 Ca -0.03 0.98 0.00 0.00 -0.00 0.00 0.00 56.10 57.05 1ojr s TRP 106 Cb 0.13 0.22 0.00 0.00 -0.00 0.00 0.00 33.47 33.82 1ojr s TRP 106 CO 0.77 -0.40 0.00 0.41 -0.00 0.00 0.00 176.95 177.73 1ojr n GLY 107 N 1.81 -1.04 4.07 5.86 0.00 -1.26 -0.65 105.19 113.98 1ojr n GLY 107 Ca -0.17 -1.22 -0.30 0.00 0.00 0.00 0.00 46.02 44.33 1ojr n GLY 107 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ojr n LEU 108 N 0.00 -1.64 -4.65 0.99 4.77 0.28 -4.89 117.00 111.86 1ojr n LEU 108 Ca 0.00 -1.13 -0.29 0.00 -0.03 0.00 0.00 56.01 54.56 1ojr n LEU 108 Cb 0.00 -1.96 0.18 0.00 -2.33 0.00 0.00 43.42 39.31 1ojr n LEU 108 CO 0.00 0.49 0.63 0.42 -1.33 0.00 0.00 177.39 177.59 1ojr s THR 109 N -4.03 2.27 -1.39 -5.08 -4.23 -1.12 -2.98 115.64 99.08 1ojr s THR 109 Ca 0.09 0.09 -0.05 0.00 -1.18 0.00 0.00 61.69 60.64 1ojr s THR 109 Cb -0.04 -2.46 0.03 0.00 1.34 0.00 0.00 72.50 71.37 1ojr s THR 109 CO 0.93 -0.11 0.77 0.59 -0.54 0.00 0.00 174.62 176.26 1ojr n ASN 110 N -4.24 -2.30 -2.01 3.99 3.02 -1.26 -2.25 115.26 110.21 1ojr n ASN 110 Ca 0.06 -0.83 -0.21 0.00 -0.03 0.00 0.00 54.58 53.58 1ojr n ASN 110 Cb 0.56 -3.90 -0.05 0.00 -0.61 0.00 0.00 39.78 35.78 1ojr n ASN 110 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1ojr n GLU 111 N -4.42 -1.56 -1.55 3.52 -0.58 -1.26 -4.98 120.64 109.82 1ojr n GLU 111 Ca -0.19 1.11 -0.32 0.00 -0.42 0.00 0.00 57.16 57.34 1ojr n GLU 111 Cb 0.63 -5.63 0.06 0.00 -0.57 0.00 0.00 31.44 25.93 1ojr n GLU 111 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ojr s ALA 112 N -2.91 2.40 0.22 0.62 0.00 -0.95 -5.06 121.76 116.06 1ojr s ALA 112 Ca 0.00 0.40 0.05 0.00 0.00 0.00 0.00 51.96 52.41 1ojr s ALA 112 Cb 0.00 -3.29 -0.05 0.00 0.00 0.00 0.00 23.12 19.78 1ojr s ALA 112 CO 0.00 -1.47 -0.05 0.14 0.00 0.00 0.00 175.76 174.39 1ojr s VAL 113 N -2.61 1.21 0.92 0.00 -7.23 -1.26 -4.80 120.40 106.63 1ojr s VAL 113 Ca 0.64 -2.07 -0.11 0.00 -1.81 0.00 0.00 61.98 58.64 1ojr s VAL 113 Cb -0.19 -2.22 0.15 0.00 0.56 0.00 0.00 36.38 34.68 1ojr s VAL 113 CO 0.48 -0.44 1.12 -2.84 -0.31 0.00 0.00 175.10 173.11 1ojr s PRO 114 N -3.80 0.98 0.27 4.82 0.02 -1.26 -0.27 135.00 135.76 1ojr s PRO 114 Ca 0.25 1.32 -0.26 0.00 0.02 0.00 0.00 61.00 62.34 1ojr s PRO 114 Cb 0.04 -1.74 -0.16 0.00 0.02 0.00 0.00 34.50 32.66 1ojr s PRO 114 CO 0.07 -2.58 0.40 -2.37 -0.33 0.00 0.00 177.00 172.19 1ojr n THR 115 N -4.18 1.57 0.56 0.99 5.66 -0.34 -3.46 114.28 115.09 1ojr n THR 115 Ca 0.10 -0.50 0.07 0.00 -3.05 0.00 0.00 64.05 60.66 1ojr n THR 115 Cb 0.53 -0.04 0.32 0.00 -1.55 0.00 0.00 70.33 69.59 1ojr n THR 115 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1ojr n SER 116 N 2.07 0.00 -1.89 1.09 3.41 -1.26 -1.65 113.62 115.39 1ojr n SER 116 Ca 0.16 0.28 -0.01 0.00 -0.26 0.00 0.00 58.87 59.03 1ojr n SER 116 Cb 0.30 -0.38 0.32 0.00 -0.26 0.00 0.00 64.21 64.19 1ojr n SER 116 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1ojr n GLU 117 N -1.38 4.00 -0.35 4.33 -0.58 -1.26 -4.57 120.64 120.82 1ojr n GLU 117 Ca 0.05 -2.89 0.11 0.00 -0.42 0.00 0.00 57.16 54.01 1ojr n GLU 117 Cb 0.13 -2.19 0.31 0.00 -0.57 0.00 0.00 31.44 29.12 1ojr n GLU 117 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1ojr h LEU 118 N 3.01 0.81 -0.01 -4.62 5.85 -1.65 -0.84 115.31 117.86 1ojr h LEU 118 Ca 0.15 0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.96 1ojr h LEU 118 Cb 2.11 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 43.04 1ojr h LEU 118 CO 0.61 0.35 -0.07 -0.65 -0.34 0.00 0.00 178.44 178.35 1ojr h PRO 119 N 0.83 -0.11 -0.82 5.25 0.11 -1.87 0.22 132.00 135.61 1ojr h PRO 119 Ca 0.54 0.01 0.07 0.00 0.11 0.00 0.00 66.00 66.72 1ojr h PRO 119 Cb 0.75 0.02 -0.06 0.00 0.11 0.00 0.00 31.00 31.83 1ojr h PRO 119 CO -0.32 -0.07 0.49 0.00 -0.21 0.00 0.00 178.00 177.89 1ojr h ALA 120 N 0.89 1.13 0.66 -0.75 0.00 -1.54 -0.26 119.26 119.39 1ojr h ALA 120 Ca 0.03 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1ojr h ALA 120 Cb 0.15 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 17.76 1ojr h ALA 120 CO -0.08 0.19 -0.32 0.45 0.00 0.00 0.00 179.25 179.49 1ojr h HIS 121 N 0.88 -0.82 -0.48 0.00 3.86 -0.75 -2.20 115.15 115.63 1ojr h HIS 121 Ca 0.37 -0.02 -0.10 0.00 -1.16 0.00 0.00 60.37 59.46 1ojr h HIS 121 Cb 0.22 0.27 -0.02 0.00 1.06 0.00 0.00 27.41 28.94 1ojr h HIS 121 CO -0.05 -0.49 -0.10 0.74 0.86 0.00 0.00 177.93 178.90 1ojr h PHE 122 N -1.19 0.97 -0.63 2.45 0.05 -0.51 0.51 116.94 118.58 1ojr h PHE 122 Ca -0.09 -0.18 -0.08 0.00 3.82 0.00 0.00 57.97 61.44 1ojr h PHE 122 Cb 0.70 -0.25 -0.03 0.00 2.00 0.00 0.00 35.95 38.38 1ojr h PHE 122 CO 0.00 0.92 0.10 -0.07 -0.18 0.00 0.00 178.31 179.08 1ojr h LEU 123 N 0.79 1.00 -0.51 1.54 3.38 -1.16 -1.63 115.31 118.72 1ojr h LEU 123 Ca 0.13 -0.23 -0.10 0.00 0.09 0.00 0.00 57.88 57.77 1ojr h LEU 123 Cb 0.61 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 1ojr h LEU 123 CO 0.04 0.99 -0.08 0.28 0.09 0.00 0.00 178.44 179.76 1ojr h SER 124 N 0.98 0.96 -0.55 -0.43 0.02 -0.94 -2.19 113.55 111.40 1ojr h SER 124 Ca 0.19 -0.34 0.07 0.00 -0.84 0.00 0.00 61.79 60.87 1ojr h SER 124 Cb 0.43 -0.26 -0.06 0.00 0.14 0.00 0.00 62.40 62.65 1ojr h SER 124 CO 0.01 1.08 0.21 0.45 -1.14 0.00 0.00 176.83 177.44 1ojr h HIS 125 N 0.82 0.38 -0.27 3.45 3.86 -0.68 0.10 115.15 122.82 1ojr h HIS 125 Ca 0.13 0.03 0.04 0.00 -1.16 0.00 0.00 60.37 59.41 1ojr h HIS 125 Cb 0.64 -0.09 -0.03 0.00 1.06 0.00 0.00 27.41 28.98 1ojr h HIS 125 CO 0.05 0.13 0.06 0.00 0.86 0.00 0.00 177.93 179.02 1ojr h GLU 127 N 0.17 0.50 -0.12 0.00 4.39 -0.97 -2.57 114.58 115.99 1ojr h GLU 127 Ca 0.12 -0.22 -0.15 0.00 0.34 0.00 0.00 59.36 59.45 1ojr h GLU 127 Cb 0.12 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.75 1ojr h GLU 127 CO -0.16 0.77 -0.59 0.00 -1.16 0.00 0.00 179.01 177.88 1ojr h ARG 128 N 0.43 0.38 -0.51 2.33 2.47 -0.43 -0.08 114.38 118.98 1ojr h ARG 128 Ca 0.05 -0.25 0.03 0.00 -1.26 0.00 0.00 59.98 58.55 1ojr h ARG 128 Cb 0.79 0.03 -0.04 0.00 -1.65 0.00 0.00 29.97 29.11 1ojr h ARG 128 CO 0.06 0.86 0.29 0.82 0.56 0.00 0.00 179.97 182.56 1ojr h ILE 129 N 0.29 1.02 -0.30 2.04 2.04 -0.48 -0.72 117.51 121.40 1ojr h ILE 129 Ca -0.00 -0.20 -0.06 0.00 1.00 0.00 0.00 64.86 65.60 1ojr h ILE 129 Cb 1.11 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.58 1ojr h ILE 129 CO 0.10 0.11 -0.04 0.11 0.00 0.00 0.00 178.15 178.42 1ojr h LYS 130 N 0.58 0.56 0.00 2.37 1.57 -1.23 0.13 116.57 120.53 1ojr h LYS 130 Ca 0.21 -0.20 -0.04 0.00 -1.87 0.00 0.00 60.65 58.75 1ojr h LYS 130 Cb 0.05 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 1ojr h LYS 130 CO -0.11 0.73 -0.20 0.00 -0.57 0.00 0.00 179.45 179.30 1ojr h ALA 131 N 0.81 1.07 0.00 3.86 0.00 -0.77 -3.23 119.26 121.01 1ojr h ALA 131 Ca 0.08 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1ojr h ALA 131 Cb 0.51 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1ojr h ALA 131 CO 0.02 0.25 -0.00 0.25 0.00 0.00 0.00 179.25 179.77 1ojr n THR 132 N -3.44 1.59 -3.96 0.00 -2.24 -0.30 -4.99 114.28 100.95 1ojr n THR 132 Ca -0.00 -1.85 -0.28 0.00 -2.27 0.00 0.00 64.05 59.64 1ojr n THR 132 Cb 0.39 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.62 1ojr n THR 132 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1ojr n ASN 133 N -1.13 -2.15 0.00 3.42 3.02 -0.67 -2.07 115.26 115.69 1ojr n ASN 133 Ca 0.11 -0.92 0.00 0.00 -0.03 0.00 0.00 54.58 53.74 1ojr n ASN 133 Cb 0.51 -3.36 0.00 0.00 -0.61 0.00 0.00 39.78 36.33 1ojr n ASN 133 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ojr n GLY 134 N -1.72 0.67 0.18 7.41 0.00 0.35 -4.93 105.19 107.15 1ojr n GLY 134 Ca -0.14 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.67 1ojr n GLY 134 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1ojr h LYS 135 N 1.69 0.61 -6.73 1.61 1.63 -1.68 -3.45 116.57 110.24 1ojr h LYS 135 Ca 0.00 -0.70 -0.51 0.00 -0.85 0.00 0.00 60.65 58.58 1ojr h LYS 135 Cb 0.00 0.21 0.02 0.00 -0.60 0.00 0.00 32.23 31.87 1ojr h LYS 135 CO 0.00 1.29 0.53 -0.51 -3.45 0.00 0.00 179.45 177.32 1ojr s ASP 136 N -7.20 7.12 0.00 4.20 1.11 -1.26 -4.25 116.67 116.40 1ojr s ASP 136 Ca -0.11 2.28 0.00 0.00 0.18 0.00 0.00 52.55 54.91 1ojr s ASP 136 Cb 0.06 -2.62 0.00 0.00 1.07 0.00 0.00 42.92 41.43 1ojr s ASP 136 CO 0.90 -0.30 0.10 0.54 1.18 0.00 0.00 175.17 177.59 1ojr n ARG 137 N 1.90 0.05 -4.57 8.23 1.74 0.01 -4.64 116.66 119.38 1ojr n ARG 137 Ca 0.02 -0.10 -0.22 0.00 -0.77 0.00 0.00 57.85 56.78 1ojr n ARG 137 Cb 0.44 -0.55 -0.15 0.00 -1.02 0.00 0.00 32.46 31.18 1ojr n ARG 137 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1ojr s VAL 138 N -0.04 1.02 -0.13 1.55 1.01 -0.39 -0.01 120.40 123.42 1ojr s VAL 138 Ca 0.00 -0.52 0.02 0.00 0.00 0.00 0.00 61.98 61.48 1ojr s VAL 138 Cb 0.00 -0.88 0.01 0.00 0.00 0.00 0.00 36.38 35.51 1ojr s VAL 138 CO 0.00 0.30 -0.19 -0.63 0.00 0.00 0.00 175.10 174.58 1ojr s ILE 139 N -0.03 1.83 -0.07 2.22 -1.09 -0.65 -2.46 121.20 120.95 1ojr s ILE 139 Ca -0.00 -0.83 0.04 0.00 -2.23 0.00 0.00 60.65 57.62 1ojr s ILE 139 Cb -0.08 -1.64 0.00 0.00 -1.58 0.00 0.00 42.46 39.16 1ojr s ILE 139 CO 0.00 0.51 -0.18 -0.32 -1.23 0.00 0.00 174.94 173.72 1ojr s MET 140 N 0.97 2.16 -0.09 2.79 -2.45 -0.20 -1.53 119.30 120.95 1ojr s MET 140 Ca -0.05 -0.64 0.04 0.00 -1.25 0.00 0.00 55.69 53.79 1ojr s MET 140 Cb -0.15 -1.76 -0.00 0.00 1.25 0.00 0.00 34.83 34.17 1ojr s MET 140 CO -0.03 0.17 -0.23 -1.58 1.05 0.00 0.00 175.02 174.39 1ojr s HIS 141 N 0.31 2.42 0.21 4.11 2.46 0.19 -0.37 115.29 124.62 1ojr s HIS 141 Ca -0.12 -0.93 -0.07 0.00 0.47 0.00 0.00 55.06 54.41 1ojr s HIS 141 Cb -0.15 -1.62 -0.02 0.00 -0.13 0.00 0.00 32.58 30.66 1ojr s HIS 141 CO 0.05 -0.36 0.30 0.00 -2.47 0.00 0.00 174.74 172.26 1ojr n HIS 143 N -0.29 2.33 -1.89 0.00 8.25 0.49 -1.76 115.22 122.35 1ojr n HIS 143 Ca -0.02 -2.60 -0.43 0.00 -0.26 0.00 0.00 57.72 54.41 1ojr n HIS 143 Cb 0.64 -1.22 -0.03 0.00 1.12 0.00 0.00 29.99 30.49 1ojr n HIS 143 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ojr s ALA 144 N -3.04 3.13 0.12 -1.41 0.00 -1.26 -4.45 121.76 114.85 1ojr s ALA 144 Ca 0.32 0.68 -0.22 0.00 0.00 0.00 0.00 51.96 52.74 1ojr s ALA 144 Cb 0.07 -3.93 -0.05 0.00 0.00 0.00 0.00 23.12 19.21 1ojr s ALA 144 CO 0.07 -2.19 1.69 1.15 0.00 0.00 0.00 175.76 176.48 1ojr h THR 145 N 6.40 0.71 -0.30 0.00 2.02 -1.92 -1.31 112.91 118.52 1ojr h THR 145 Ca -0.38 0.00 -0.17 0.00 0.77 0.00 0.00 66.41 66.63 1ojr h THR 145 Cb 1.19 0.71 -0.00 0.00 -1.74 0.00 0.00 68.15 68.31 1ojr h THR 145 CO 0.98 0.00 -0.49 0.78 0.37 0.00 0.00 175.52 177.17 1ojr h ASN 146 N -0.14 0.90 -0.75 4.18 2.35 -1.90 -1.58 115.58 118.64 1ojr h ASN 146 Ca 0.07 -0.45 0.03 0.00 -0.55 0.00 0.00 56.30 55.40 1ojr h ASN 146 Cb 0.24 -0.26 -0.05 0.00 0.05 0.00 0.00 38.32 38.31 1ojr h ASN 146 CO -0.17 1.23 0.48 -0.07 -1.65 0.00 0.00 177.43 177.24 1ojr h LEU 147 N 0.64 0.78 -0.14 1.61 3.38 -1.80 -0.39 115.31 119.40 1ojr h LEU 147 Ca 0.03 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1ojr h LEU 147 Cb 1.07 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 1ojr h LEU 147 CO 0.11 0.54 0.09 0.40 0.09 0.00 0.00 178.44 179.66 1ojr h ILE 148 N 0.92 1.06 -0.86 1.22 2.04 -1.01 -2.65 117.51 118.24 1ojr h ILE 148 Ca 0.30 -0.15 0.06 0.00 1.00 0.00 0.00 64.86 66.08 1ojr h ILE 148 Cb 0.02 0.91 -0.06 0.00 -0.74 0.00 0.00 36.82 36.95 1ojr h ILE 148 CO -0.11 0.06 0.53 0.00 0.00 0.00 0.00 178.15 178.62 1ojr h ALA 149 N 1.02 1.18 0.00 1.87 0.00 -0.85 -1.36 119.26 121.12 1ojr h ALA 149 Ca 0.05 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1ojr h ALA 149 Cb 0.02 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1ojr h ALA 149 CO -0.01 0.27 -0.13 -0.07 0.00 0.00 0.00 179.25 179.32 1ojr h LEU 150 N 0.97 0.00 -0.62 0.00 3.38 -0.77 -1.99 115.31 116.28 1ojr h LEU 150 Ca 0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.35 1ojr h LEU 150 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1ojr h LEU 150 CO -0.17 0.13 0.00 0.35 0.09 0.00 0.00 178.44 178.83 1ojr n THR 151 N -4.09 1.04 0.69 0.22 -2.24 -0.51 -0.90 114.28 108.48 1ojr n THR 151 Ca -0.02 0.37 0.12 0.00 -2.27 0.00 0.00 64.05 62.24 1ojr n THR 151 Cb 0.21 -1.28 0.16 0.00 -2.10 0.00 0.00 70.33 67.32 1ojr n THR 151 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1ojr n TYR 152 N -2.00 0.33 0.00 4.78 4.02 -0.75 -4.61 117.16 118.93 1ojr n TYR 152 Ca 0.01 0.10 0.00 0.00 -0.01 0.00 0.00 57.90 58.00 1ojr n TYR 152 Cb 0.15 -0.49 0.00 0.00 -0.02 0.00 0.00 39.34 38.98 1ojr n TYR 152 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 176.86 177.18 1ojr n VAL 153 N -1.90 0.00 -3.10 -0.72 0.24 -0.68 -5.05 118.33 107.11 1ojr n VAL 153 Ca 0.04 0.00 -0.30 0.00 -2.04 0.00 0.00 64.34 62.03 1ojr n VAL 153 Cb 0.41 -0.80 -0.04 0.00 -1.47 0.00 0.00 33.84 31.94 1ojr n VAL 153 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1ojr s LEU 154 N -3.89 3.97 0.23 1.34 1.43 -0.08 -5.03 118.68 116.66 1ojr s LEU 154 Ca 0.00 1.01 -0.32 0.00 -1.03 0.00 0.00 54.13 53.79 1ojr s LEU 154 Cb 0.00 -3.84 -0.12 0.00 0.03 0.00 0.00 46.19 42.26 1ojr s LEU 154 CO 0.00 -0.27 1.69 -0.62 0.23 0.00 0.00 176.35 177.38 1ojr n GLU 155 N -0.91 2.76 -2.01 1.70 1.02 -1.26 -4.81 120.64 117.13 1ojr n GLU 155 Ca 0.01 0.99 -0.42 0.00 -0.02 0.00 0.00 57.16 57.72 1ojr n GLU 155 Cb 0.54 -2.82 0.00 0.00 -0.02 0.00 0.00 31.44 29.13 1ojr n GLU 155 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1ojr n ASN 156 N 3.48 4.35 -3.89 1.62 5.03 -1.26 -4.38 115.26 120.22 1ojr n ASN 156 Ca 0.14 -2.93 -0.17 0.00 0.87 0.00 0.00 54.58 52.49 1ojr n ASN 156 Cb 0.35 -1.61 -0.16 0.00 -1.02 0.00 0.00 39.78 37.35 1ojr n ASN 156 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1ojr s ASP 157 N 2.56 0.59 0.16 6.41 -1.08 -1.26 -4.97 116.67 119.09 1ojr s ASP 157 Ca 0.45 -0.07 -0.16 0.00 -0.52 0.00 0.00 52.55 52.25 1ojr s ASP 157 Cb 0.11 -0.23 0.10 0.00 -1.46 0.00 0.00 42.92 41.44 1ojr s ASP 157 CO -0.05 -0.03 1.71 0.74 0.52 0.00 0.00 175.17 178.06 1ojr h THR 158 N 5.80 0.74 -0.16 1.71 2.02 -1.88 -0.38 112.91 120.76 1ojr h THR 158 Ca -0.36 -0.04 -0.01 0.00 0.77 0.00 0.00 66.41 66.76 1ojr h THR 158 Cb 1.16 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 68.16 1ojr h THR 158 CO 0.49 0.02 0.05 0.00 0.37 0.00 0.00 175.52 176.45 1ojr h ALA 159 N 1.32 0.21 -0.17 6.16 0.00 -1.90 -0.61 119.26 124.27 1ojr h ALA 159 Ca 0.19 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1ojr h ALA 159 Cb 0.25 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1ojr h ALA 159 CO -0.29 -0.18 0.03 0.28 0.00 0.00 0.00 179.25 179.09 1ojr h VAL 160 N 0.09 1.22 -0.36 0.00 2.07 -1.84 -0.98 116.25 116.45 1ojr h VAL 160 Ca 0.05 -0.70 -0.04 0.00 0.82 0.00 0.00 66.70 66.83 1ojr h VAL 160 Cb 0.21 1.35 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 1ojr h VAL 160 CO -0.00 0.21 0.08 0.15 0.02 0.00 0.00 177.57 178.03 1ojr h PHE 161 N 0.08 0.61 -0.20 1.57 3.04 -1.07 -1.32 116.94 119.66 1ojr h PHE 161 Ca 0.05 -0.08 0.03 0.00 3.98 0.00 0.00 57.97 61.96 1ojr h PHE 161 Cb 0.30 -0.17 -0.03 0.00 2.56 0.00 0.00 35.95 38.60 1ojr h PHE 161 CO 0.02 0.62 -0.01 1.15 -2.02 0.00 0.00 178.31 178.07 1ojr h THR 162 N 0.43 0.85 -0.63 4.41 2.02 -1.07 -1.45 112.91 117.48 1ojr h THR 162 Ca 0.11 -0.02 -0.00 0.00 0.77 0.00 0.00 66.41 67.27 1ojr h THR 162 Cb 0.32 0.79 -0.03 0.00 -1.74 0.00 0.00 68.15 67.49 1ojr h THR 162 CO 0.00 0.01 0.39 -0.09 0.37 0.00 0.00 175.52 176.20 1ojr h ARG 163 N 0.06 0.85 -0.50 6.66 9.65 -0.95 0.58 114.38 130.72 1ojr h ARG 163 Ca 0.09 -0.07 -0.03 0.00 -1.10 0.00 0.00 59.98 58.87 1ojr h ARG 163 Cb 0.12 -0.18 -0.02 0.00 -1.39 0.00 0.00 29.97 28.50 1ojr h ARG 163 CO -0.16 0.59 0.20 1.96 2.80 0.00 0.00 179.97 185.35 1ojr h GLN 164 N 0.85 0.76 -0.73 0.20 1.08 -1.05 -1.59 115.11 114.63 1ojr h GLN 164 Ca 0.23 -0.14 -0.06 0.00 -1.45 0.00 0.00 58.65 57.22 1ojr h GLN 164 Cb -0.05 -0.12 -0.03 0.00 -0.05 0.00 0.00 27.48 27.23 1ojr h GLN 164 CO -0.04 0.68 0.21 -0.07 -0.95 0.00 0.00 178.83 178.66 1ojr h LEU 165 N 0.68 1.07 -1.12 1.46 3.38 -0.87 -1.55 115.31 118.35 1ojr h LEU 165 Ca 0.17 -0.21 0.03 0.00 0.09 0.00 0.00 57.88 57.96 1ojr h LEU 165 Cb 0.21 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.63 1ojr h LEU 165 CO -0.01 1.00 0.60 -0.50 0.09 0.00 0.00 178.44 179.61 1ojr h TRP 166 N 1.09 1.11 0.00 1.13 6.55 -0.70 -2.59 115.95 122.54 1ojr h TRP 166 Ca 0.23 0.03 -0.08 0.00 0.95 0.00 0.00 58.89 60.02 1ojr h TRP 166 Cb 0.32 -0.37 -0.01 0.00 -0.86 0.00 0.00 29.16 28.24 1ojr h TRP 166 CO 0.03 0.66 -0.37 0.93 -1.05 0.00 0.00 178.44 178.63 1ojr h GLU 167 N 1.16 0.00 0.00 0.49 5.08 -0.40 -3.26 114.58 117.65 1ojr h GLU 167 Ca 0.35 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.71 1ojr h GLU 167 Cb -0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.23 1ojr h GLU 167 CO -0.10 0.37 0.00 0.41 -1.00 0.00 0.00 179.01 178.69 1ojr n GLY 168 N 0.02 -1.21 3.64 -3.84 0.00 -0.67 -4.53 105.19 98.60 1ojr n GLY 168 Ca -0.01 -0.09 -0.05 0.00 0.00 0.00 0.00 46.02 45.88 1ojr n GLY 168 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ojr s SER 169 N -2.87 -0.61 0.26 1.61 0.01 -1.23 -4.57 113.70 106.30 1ojr s SER 169 Ca 0.14 1.00 -0.02 0.00 1.31 0.00 0.00 55.95 58.39 1ojr s SER 169 Cb 0.15 1.22 0.50 0.00 0.21 0.00 0.00 66.02 68.10 1ojr s SER 169 CO 0.40 -0.16 1.77 0.74 0.41 0.00 0.00 173.24 176.40 1ojr h THR 170 N 4.80 0.76 0.00 1.44 2.02 -1.84 -1.56 112.91 118.53 1ojr h THR 170 Ca -0.29 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 66.67 1ojr h THR 170 Cb 1.20 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.67 1ojr h THR 170 CO 0.17 0.12 0.00 1.05 0.37 0.00 0.00 175.52 177.23 1ojr h GLU 171 N 0.65 0.00 -0.48 6.66 4.11 -1.97 -3.33 114.58 120.21 1ojr h GLU 171 Ca 0.45 0.00 0.04 0.00 0.07 0.00 0.00 59.36 59.92 1ojr h GLU 171 Cb 0.59 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.80 1ojr h GLU 171 CO -0.34 0.00 0.24 0.00 0.07 0.00 0.00 179.01 178.98 1ojr h LEU 173 N 0.46 0.49 -0.34 0.00 5.85 -1.80 0.11 115.31 120.10 1ojr h LEU 173 Ca 0.21 -0.01 -0.20 0.00 0.84 0.00 0.00 57.88 58.72 1ojr h LEU 173 Cb 0.13 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 1ojr h LEU 173 CO -0.16 0.36 -0.77 0.58 -0.34 0.00 0.00 178.44 178.11 1ojr h VAL 174 N 0.58 1.37 0.18 1.05 2.07 -1.47 -1.80 116.25 118.24 1ojr h VAL 174 Ca 0.16 -2.18 -0.30 0.00 0.82 0.00 0.00 66.70 65.19 1ojr h VAL 174 Cb -0.06 2.16 0.02 0.00 -1.52 0.00 0.00 31.29 31.88 1ojr h VAL 174 CO -0.03 0.66 -1.35 0.58 0.02 0.00 0.00 177.57 177.44 1ojr h VAL 175 N 0.29 1.40 -2.05 2.57 2.07 -0.60 -3.39 116.25 116.54 1ojr h VAL 175 Ca -0.04 -2.91 -0.56 0.00 0.82 0.00 0.00 66.70 64.00 1ojr h VAL 175 Cb 1.37 2.98 -0.40 0.00 -1.52 0.00 0.00 31.29 33.72 1ojr h VAL 175 CO 0.14 0.86 -1.00 2.22 0.02 0.00 0.00 177.57 179.81 1ojr n PHE 176 N -3.61 0.68 0.26 1.57 -1.74 0.34 -4.94 117.46 110.02 1ojr n PHE 176 Ca -0.12 -3.73 0.12 0.00 -0.56 0.00 0.00 57.45 53.16 1ojr n PHE 176 Cb 1.06 -0.41 0.72 0.00 1.52 0.00 0.00 39.48 42.37 1ojr n PHE 176 CO 0.00 0.00 0.00 -1.00 -0.56 0.00 0.00 176.76 175.20 1ojr h PRO 177 N 3.90 0.00 0.00 3.97 0.13 -1.51 -1.05 132.00 137.43 1ojr h PRO 177 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1ojr h PRO 177 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1ojr h PRO 177 CO 0.56 0.12 0.00 -0.25 -0.23 0.00 0.00 178.00 178.19 1ojr n ASP 178 N -3.70 0.00 0.00 1.44 10.43 -1.26 -0.65 116.55 122.80 1ojr n ASP 178 Ca -0.02 0.18 0.00 0.00 2.57 0.00 0.00 54.79 57.52 1ojr n ASP 178 Cb 0.23 -0.38 0.00 0.00 1.84 0.00 0.00 41.12 42.81 1ojr n ASP 178 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1ojr n GLY 179 N 1.04 -1.89 2.99 0.44 0.00 -0.40 -4.69 105.19 102.68 1ojr n GLY 179 Ca 0.10 -1.49 -0.29 0.00 0.00 0.00 0.00 46.02 44.33 1ojr n GLY 179 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ojr s VAL 180 N 0.00 1.46 0.35 1.61 1.01 -1.26 -4.11 120.40 119.46 1ojr s VAL 180 Ca 0.00 -0.57 -0.22 0.00 0.00 0.00 0.00 61.98 61.19 1ojr s VAL 180 Cb 0.00 -1.39 -0.10 0.00 0.00 0.00 0.00 36.38 34.89 1ojr s VAL 180 CO 0.00 0.43 0.89 -0.83 0.00 0.00 0.00 175.10 175.59 1ojr s GLY 181 N 1.53 2.55 -0.07 4.51 0.00 -0.24 -4.54 107.32 111.05 1ojr s GLY 181 Ca 0.05 0.36 0.01 0.00 0.00 0.00 0.00 44.72 45.14 1ojr s GLY 181 CO -0.10 0.69 -0.08 -0.42 0.00 0.00 0.00 173.10 173.20 1ojr s ILE 182 N -1.88 0.86 0.55 0.90 1.01 -1.26 -0.27 121.20 121.10 1ojr s ILE 182 Ca 0.55 -0.27 -0.06 0.00 0.00 0.00 0.00 60.65 60.87 1ojr s ILE 182 Cb -0.13 -0.86 -0.02 0.00 0.01 0.00 0.00 42.46 41.47 1ojr s ILE 182 CO 0.18 0.31 0.86 -0.76 0.00 0.00 0.00 174.94 175.54 1ojr s LEU 183 N 1.15 3.40 0.79 2.97 1.43 -0.78 -4.82 118.68 122.82 1ojr s LEU 183 Ca -0.06 0.88 -0.10 0.00 -1.03 0.00 0.00 54.13 53.81 1ojr s LEU 183 Cb -0.14 -3.78 0.07 0.00 0.03 0.00 0.00 46.19 42.36 1ojr s LEU 183 CO -0.01 -0.84 1.10 -2.16 0.23 0.00 0.00 176.35 174.66 1ojr s PRO 184 N -4.90 2.11 0.31 1.29 0.04 -1.26 -4.32 135.00 128.26 1ojr s PRO 184 Ca 0.51 1.19 -0.29 0.00 0.04 0.00 0.00 61.00 62.45 1ojr s PRO 184 Cb -0.10 -1.88 -0.12 0.00 0.04 0.00 0.00 34.50 32.44 1ojr s PRO 184 CO 0.46 -1.75 1.43 1.87 0.04 0.00 0.00 177.00 179.04 1ojr n TRP 185 N -3.60 2.53 -3.95 0.56 -0.00 -1.26 -4.71 117.44 107.01 1ojr n TRP 185 Ca 0.09 0.43 -0.09 0.00 -0.00 0.00 0.00 57.50 57.93 1ojr n TRP 185 Cb 0.53 -2.49 -0.10 0.00 -0.00 0.00 0.00 31.31 29.25 1ojr n TRP 185 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 177.69 176.05 1ojr s MET 186 N -1.25 0.54 0.13 5.87 -1.94 -1.26 -5.08 119.30 116.30 1ojr s MET 186 Ca 0.60 -0.77 -0.31 0.00 -1.71 0.00 0.00 55.69 53.50 1ojr s MET 186 Cb -0.55 0.21 -0.10 0.00 2.01 0.00 0.00 34.83 36.40 1ojr s MET 186 CO 0.56 -0.13 1.69 0.08 -0.01 0.00 0.00 175.02 177.21 1ojr s VAL 187 N -2.52 2.66 0.71 -6.03 1.01 -1.26 -4.98 120.40 109.99 1ojr s VAL 187 Ca -0.06 0.30 -0.11 0.00 0.00 0.00 0.00 61.98 62.11 1ojr s VAL 187 Cb -0.02 -3.19 0.01 0.00 0.00 0.00 0.00 36.38 33.18 1ojr s VAL 187 CO -0.04 0.01 1.09 -2.16 0.00 0.00 0.00 175.10 173.99 1ojr s PRO 188 N 2.08 2.87 -0.09 2.72 0.04 -1.26 -4.27 135.00 137.08 1ojr s PRO 188 Ca 0.75 0.55 0.00 0.00 0.04 0.00 0.00 61.00 62.34 1ojr s PRO 188 Cb -0.44 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.09 1ojr s PRO 188 CO 0.33 -1.05 0.00 0.41 0.04 0.00 0.00 177.00 176.73 1ojr n GLY 189 N -2.79 0.47 3.69 0.56 0.00 -1.26 -5.04 105.19 100.82 1ojr n GLY 189 Ca 0.07 -0.79 -0.24 0.00 0.00 0.00 0.00 46.02 45.06 1ojr n GLY 189 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ojr s THR 190 N -2.02 2.87 0.21 2.61 -4.23 -1.26 -4.88 115.64 108.94 1ojr s THR 190 Ca 0.00 -1.81 -0.07 0.00 -1.18 0.00 0.00 61.69 58.63 1ojr s THR 190 Cb 0.00 -2.90 0.10 0.00 1.34 0.00 0.00 72.50 71.04 1ojr s THR 190 CO 0.00 -0.19 1.71 0.44 -0.54 0.00 0.00 174.62 176.04 1ojr h ASP 191 N 1.66 0.99 -0.21 3.99 3.45 -1.96 -2.56 116.42 121.78 1ojr h ASP 191 Ca -0.43 -0.24 0.00 0.00 0.43 0.00 0.00 57.03 56.79 1ojr h ASP 191 Cb 1.25 -0.26 -0.01 0.00 -0.56 0.00 0.00 39.33 39.75 1ojr h ASP 191 CO 0.65 1.00 0.14 0.00 -1.57 0.00 0.00 179.24 179.45 1ojr h ALA 192 N 1.11 0.27 -0.10 3.45 0.00 -1.95 0.47 119.26 122.51 1ojr h ALA 192 Ca 0.19 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 1ojr h ALA 192 Cb 0.45 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1ojr h ALA 192 CO 0.01 -0.26 -0.39 0.97 0.00 0.00 0.00 179.25 179.59 1ojr h ILE 193 N 0.28 1.30 -0.31 0.00 2.10 -1.81 -0.75 117.51 118.32 1ojr h ILE 193 Ca 0.08 -1.45 -0.03 0.00 1.08 0.00 0.00 64.86 64.54 1ojr h ILE 193 Cb -0.02 1.65 -0.01 0.00 -1.09 0.00 0.00 36.82 37.35 1ojr h ILE 193 CO -0.03 0.43 0.07 1.23 -1.08 0.00 0.00 178.15 178.77 1ojr h GLY 194 N 1.18 0.54 1.00 8.18 0.00 -1.02 -0.99 103.07 111.97 1ojr h GLY 194 Ca 0.02 -0.34 -0.05 0.00 0.00 0.00 0.00 47.33 46.96 1ojr h GLY 194 CO 0.06 0.32 0.16 -1.61 0.00 0.00 0.00 176.54 175.46 1ojr h GLN 195 N 0.33 0.88 -0.75 4.80 5.75 -0.68 -1.00 115.11 124.44 1ojr h GLN 195 Ca 0.10 -0.20 -0.05 0.00 -0.15 0.00 0.00 58.65 58.35 1ojr h GLN 195 Cb 0.31 -0.12 -0.03 0.00 1.07 0.00 0.00 27.48 28.70 1ojr h GLN 195 CO 0.00 0.81 0.27 0.00 -2.65 0.00 0.00 178.83 177.27 1ojr h ALA 196 N 1.03 1.07 -0.26 3.38 0.00 -1.04 -1.21 119.26 122.24 1ojr h ALA 196 Ca 0.18 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1ojr h ALA 196 Cb 0.31 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1ojr h ALA 196 CO -0.00 0.65 -0.01 1.15 0.00 0.00 0.00 179.25 181.04 1ojr h THR 197 N 1.10 1.26 -0.66 0.00 2.02 -1.01 -2.69 112.91 112.93 1ojr h THR 197 Ca 0.25 -0.93 -0.01 0.00 0.77 0.00 0.00 66.41 66.49 1ojr h THR 197 Cb 0.24 1.36 -0.03 0.00 -1.74 0.00 0.00 68.15 67.98 1ojr h THR 197 CO -0.02 0.29 0.36 0.00 0.37 0.00 0.00 175.52 176.53 1ojr h ALA 198 N 0.81 1.40 -0.57 6.16 0.00 -0.89 -0.36 119.26 125.81 1ojr h ALA 198 Ca 0.07 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1ojr h ALA 198 Cb 0.43 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1ojr h ALA 198 CO 0.01 0.50 0.29 1.96 0.00 0.00 0.00 179.25 182.01 1ojr h GLN 199 N 0.92 0.81 -0.31 0.00 1.08 -1.12 -2.35 115.11 114.14 1ojr h GLN 199 Ca 0.23 -0.11 -0.06 0.00 -1.45 0.00 0.00 58.65 57.26 1ojr h GLN 199 Cb 0.02 -0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 27.28 1ojr h GLN 199 CO -0.04 0.65 -0.08 0.93 -0.95 0.00 0.00 178.83 179.34 1ojr h GLU 200 N 0.77 0.51 0.00 1.46 4.39 -1.03 -2.27 114.58 118.41 1ojr h GLU 200 Ca 0.20 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.77 1ojr h GLU 200 Cb 0.09 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 1ojr h GLU 200 CO -0.03 0.59 0.00 0.52 -1.16 0.00 0.00 179.01 178.94 1ojr h MET 201 N 0.48 0.00 0.00 2.33 2.86 -0.55 -1.51 114.93 118.53 1ojr h MET 201 Ca 0.09 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.69 1ojr h MET 201 Cb 0.43 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.09 1ojr h MET 201 CO 0.02 0.00 -0.22 1.96 1.06 0.00 0.00 176.91 179.74 1ojr h GLN 202 N 0.00 0.00 0.00 1.72 4.20 -1.15 -3.32 115.11 116.56 1ojr h GLN 202 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1ojr h GLN 202 Cb 0.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.95 1ojr h GLN 202 CO 0.00 0.22 0.00 1.63 -0.67 0.00 0.00 178.83 180.01 1ojr n LYS 203 N -3.83 6.35 -3.88 1.46 5.02 -0.66 -4.92 118.16 117.70 1ojr n LYS 203 Ca -0.02 -0.03 -0.11 0.00 -2.02 0.00 0.00 58.31 56.13 1ojr n LYS 203 Cb 0.31 -0.52 -0.10 0.00 -0.02 0.00 0.00 35.03 34.70 1ojr n LYS 203 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1ojr s HIS 204 N -0.92 0.06 -0.90 2.13 3.76 -0.66 -4.81 115.29 113.95 1ojr s HIS 204 Ca 0.00 -0.18 0.24 0.00 -0.15 0.00 0.00 55.06 54.97 1ojr s HIS 204 Cb 0.00 -0.06 0.37 0.00 1.11 0.00 0.00 32.58 34.00 1ojr s HIS 204 CO 0.00 -0.29 1.31 -1.13 -0.85 0.00 0.00 174.74 173.79 1ojr n SER 205 N 1.41 0.58 -4.15 1.40 3.41 -1.26 -4.19 113.62 110.82 1ojr n SER 205 Ca -0.23 -0.25 -0.26 0.00 -0.26 0.00 0.00 58.87 57.87 1ojr n SER 205 Cb 0.56 0.36 -0.16 0.00 -0.26 0.00 0.00 64.21 64.71 1ojr n SER 205 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1ojr s LEU 206 N -3.28 1.95 -0.05 1.04 1.43 -1.26 -1.06 118.68 117.46 1ojr s LEU 206 Ca 0.09 -0.35 0.01 0.00 -1.03 0.00 0.00 54.13 52.85 1ojr s LEU 206 Cb 0.16 -0.98 0.02 0.00 0.03 0.00 0.00 46.19 45.43 1ojr s LEU 206 CO 0.73 0.18 -0.04 -0.69 0.23 0.00 0.00 176.35 176.76 1ojr s VAL 207 N -0.09 0.49 -0.09 -1.59 1.01 -0.13 -1.08 120.40 118.90 1ojr s VAL 207 Ca -0.01 -0.08 -0.09 0.00 0.00 0.00 0.00 61.98 61.80 1ojr s VAL 207 Cb -0.10 -0.53 -0.05 0.00 0.00 0.00 0.00 36.38 35.70 1ojr s VAL 207 CO 0.01 0.22 0.22 -0.76 0.00 0.00 0.00 175.10 174.79 1ojr s LEU 208 N 1.04 4.40 -0.39 3.92 1.43 0.63 -0.45 118.68 129.26 1ojr s LEU 208 Ca -0.09 0.59 -0.08 0.00 -1.03 0.00 0.00 54.13 53.52 1ojr s LEU 208 Cb -0.14 -2.22 0.07 0.00 0.03 0.00 0.00 46.19 43.93 1ojr s LEU 208 CO -0.01 0.37 0.21 0.26 0.23 0.00 0.00 176.35 177.41 1ojr s TRP 209 N -0.93 3.35 0.32 0.29 0.52 0.22 -1.87 118.94 120.84 1ojr s TRP 209 Ca 0.17 -1.62 -0.29 0.00 0.02 0.00 0.00 56.10 54.38 1ojr s TRP 209 Cb -0.13 -2.80 -0.12 0.00 -1.15 0.00 0.00 33.47 29.26 1ojr s TRP 209 CO 0.06 -0.83 1.32 -2.30 0.02 0.00 0.00 176.95 175.22 1ojr n PRO 210 N 4.84 2.12 -1.73 4.98 -0.02 -1.26 -1.16 135.00 142.78 1ojr n PRO 210 Ca -0.10 0.75 -0.16 0.00 -2.02 0.00 0.00 63.50 61.96 1ojr n PRO 210 Cb 0.43 -2.34 -0.05 0.00 -0.02 0.00 0.00 33.50 31.52 1ojr n PRO 210 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1ojr n PHE 211 N 0.68 -0.23 0.10 6.00 0.99 -1.26 -4.70 117.46 119.03 1ojr n PHE 211 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.51 1ojr n PHE 211 Cb 0.35 -3.00 0.00 0.00 -1.00 0.00 0.00 39.48 35.83 1ojr n PHE 211 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.76 178.34 1ojr n HIS 212 N -2.96 -2.14 -1.16 1.38 -0.00 -0.70 -5.13 115.22 104.51 1ojr n HIS 212 Ca -0.17 0.45 0.00 0.00 -0.00 0.00 0.00 57.72 58.00 1ojr n HIS 212 Cb 0.57 1.15 0.00 0.00 -0.00 0.00 0.00 29.99 31.72 1ojr n HIS 212 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1ojr n GLY 213 N 0.56 -0.63 3.03 1.57 0.00 -0.31 -4.62 105.19 104.79 1ojr n GLY 213 Ca 0.00 -0.60 -0.10 0.00 0.00 0.00 0.00 46.02 45.32 1ojr n GLY 213 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ojr s VAL 214 N -3.66 0.29 -0.05 1.61 0.11 -0.72 -0.61 120.40 117.37 1ojr s VAL 214 Ca 0.00 -1.09 0.06 0.00 -2.93 0.00 0.00 61.98 58.03 1ojr s VAL 214 Cb 0.00 -0.54 -0.01 0.00 -1.53 0.00 0.00 36.38 34.30 1ojr s VAL 214 CO 0.00 -0.52 -0.24 -0.36 -3.33 0.00 0.00 175.10 170.65 1ojr s PHE 215 N -1.73 2.33 0.11 1.54 0.40 0.41 -2.09 117.98 118.96 1ojr s PHE 215 Ca -0.11 -0.65 0.05 0.00 -0.60 0.00 0.00 56.93 55.63 1ojr s PHE 215 Cb -0.08 -1.53 -0.04 0.00 0.51 0.00 0.00 43.02 41.89 1ojr s PHE 215 CO -0.01 -0.18 -0.13 0.20 0.70 0.00 0.00 175.22 175.80 1ojr s GLY 216 N -0.23 1.00 0.04 4.36 0.00 0.50 -0.96 107.32 112.04 1ojr s GLY 216 Ca -0.01 -1.25 0.05 0.00 0.00 0.00 0.00 44.72 43.51 1ojr s GLY 216 CO 0.03 -1.31 -0.13 -1.35 0.00 0.00 0.00 173.10 170.33 1ojr s SER 217 N -2.43 1.58 0.12 1.64 1.04 -0.22 -1.03 113.70 114.39 1ojr s SER 217 Ca 0.07 -0.48 -0.26 0.00 0.48 0.00 0.00 55.95 55.77 1ojr s SER 217 Cb -0.04 -0.09 0.08 0.00 0.10 0.00 0.00 66.02 66.07 1ojr s SER 217 CO 0.02 0.00 1.05 -0.83 0.98 0.00 0.00 173.24 174.46 1ojr s GLY 218 N -1.23 -0.22 0.33 7.32 0.00 -1.03 -4.82 107.32 107.66 1ojr s GLY 218 Ca 0.00 0.18 0.16 0.00 0.00 0.00 0.00 44.72 45.07 1ojr s GLY 218 CO 0.01 0.44 1.64 -0.56 0.00 0.00 0.00 173.10 174.63 1ojr h PRO 219 N 2.00 0.00 -4.49 2.90 0.13 -1.90 0.44 132.00 131.08 1ojr h PRO 219 Ca -0.26 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.67 1ojr h PRO 219 Cb 1.22 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.20 1ojr h PRO 219 CO 0.28 0.47 -0.65 0.95 -0.23 0.00 0.00 178.00 178.82 1ojr s THR 220 N -3.45 0.21 0.13 1.56 -4.23 -1.26 -4.12 115.64 104.47 1ojr s THR 220 Ca 0.00 -1.92 -0.19 0.00 -1.18 0.00 0.00 61.69 58.40 1ojr s THR 220 Cb 0.11 -2.05 -0.03 0.00 1.34 0.00 0.00 72.50 71.86 1ojr s THR 220 CO 0.72 -0.48 1.73 -0.07 -0.54 0.00 0.00 174.62 175.97 1ojr h LEU 221 N 2.84 -0.05 -0.63 4.79 3.38 -1.96 -1.11 115.31 122.57 1ojr h LEU 221 Ca -0.35 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.65 1ojr h LEU 221 Cb 1.20 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.99 1ojr h LEU 221 CO 0.60 0.00 0.34 0.44 0.09 0.00 0.00 178.44 179.92 1ojr h ASP 222 N 0.09 0.79 0.06 -0.43 3.45 -1.97 0.68 116.42 119.10 1ojr h ASP 222 Ca 0.10 -0.10 -0.09 0.00 0.43 0.00 0.00 57.03 57.37 1ojr h ASP 222 Cb 0.11 -0.20 -0.01 0.00 -0.56 0.00 0.00 39.33 38.67 1ojr h ASP 222 CO -0.15 0.66 -0.29 -0.33 -1.57 0.00 0.00 179.24 177.56 1ojr h GLU 223 N 0.86 0.35 0.04 3.56 4.39 -1.91 0.15 114.58 122.02 1ojr h GLU 223 Ca 0.22 -0.13 -0.17 0.00 0.34 0.00 0.00 59.36 59.62 1ojr h GLU 223 Cb 0.05 -0.02 0.02 0.00 -0.10 0.00 0.00 28.75 28.69 1ojr h GLU 223 CO -0.04 0.61 -0.68 1.15 -1.16 0.00 0.00 179.01 178.90 1ojr h THR 224 N 0.31 1.44 -0.45 1.13 2.02 -0.85 -0.69 112.91 115.83 1ojr h THR 224 Ca 0.04 -2.20 0.02 0.00 0.77 0.00 0.00 66.41 65.05 1ojr h THR 224 Cb 0.67 2.74 -0.03 0.00 -1.74 0.00 0.00 68.15 69.79 1ojr h THR 224 CO 0.05 0.64 0.25 0.15 0.37 0.00 0.00 175.52 176.98 1ojr h PHE 225 N -0.15 0.47 -0.44 3.16 3.57 -0.83 -2.26 116.94 120.46 1ojr h PHE 225 Ca -0.09 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.40 1ojr h PHE 225 Cb 1.41 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.98 1ojr h PHE 225 CO 0.16 0.27 0.18 0.78 -2.23 0.00 0.00 178.31 177.46 1ojr h GLY 226 N 0.51 0.66 0.89 2.40 0.00 -0.66 0.15 103.07 107.03 1ojr h GLY 226 Ca 0.18 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 47.19 1ojr h GLY 226 CO -0.09 0.30 -0.07 -2.00 0.00 0.00 0.00 176.54 174.67 1ojr h LEU 227 N 0.62 -0.18 -0.49 3.11 5.85 -0.78 -0.03 115.31 123.40 1ojr h LEU 227 Ca 0.15 -0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 1ojr h LEU 227 Cb 0.11 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 1ojr h LEU 227 CO -0.02 -0.03 0.19 0.40 -0.34 0.00 0.00 178.44 178.65 1ojr h ILE 228 N -0.32 1.21 -0.71 4.05 2.04 -1.05 -2.17 117.51 120.57 1ojr h ILE 228 Ca -0.02 -0.66 -0.00 0.00 1.00 0.00 0.00 64.86 65.18 1ojr h ILE 228 Cb 0.25 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.02 1ojr h ILE 228 CO 0.03 0.25 0.44 -0.78 0.00 0.00 0.00 178.15 178.09 1ojr h ASP 229 N 0.65 0.84 -0.05 1.72 3.58 -0.63 0.11 116.42 122.64 1ojr h ASP 229 Ca 0.16 -0.04 -0.00 0.00 0.42 0.00 0.00 57.03 57.57 1ojr h ASP 229 Cb 0.20 -0.21 -0.00 0.00 1.72 0.00 0.00 39.33 41.04 1ojr h ASP 229 CO -0.01 0.64 0.01 0.74 -2.88 0.00 0.00 179.24 177.73 1ojr h THR 230 N 0.98 1.19 -0.80 2.25 2.02 -0.76 0.77 112.91 118.56 1ojr h THR 230 Ca 0.26 -0.57 -0.04 0.00 0.77 0.00 0.00 66.41 66.83 1ojr h THR 230 Cb -0.06 1.48 -0.04 0.00 -1.74 0.00 0.00 68.15 67.79 1ojr h THR 230 CO -0.05 0.16 0.35 0.00 0.37 0.00 0.00 175.52 176.34 1ojr h ALA 231 N 0.79 1.11 -0.13 6.16 0.00 -0.93 -1.48 119.26 124.80 1ojr h ALA 231 Ca 0.02 -0.18 -0.14 0.00 0.00 0.00 0.00 54.91 54.61 1ojr h ALA 231 Cb 0.24 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1ojr h ALA 231 CO 0.00 0.65 -0.53 1.49 0.00 0.00 0.00 179.25 180.86 1ojr h GLU 232 N 1.15 0.35 -0.20 0.00 4.57 -0.69 -0.64 114.58 119.11 1ojr h GLU 232 Ca 0.27 -0.21 -0.02 0.00 -1.18 0.00 0.00 59.36 58.22 1ojr h GLU 232 Cb 0.17 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.77 1ojr h GLU 232 CO -0.03 0.79 0.06 -0.22 -1.18 0.00 0.00 179.01 178.44 1ojr h LYS 233 N 0.28 0.31 -0.54 1.92 1.63 -0.53 0.74 116.57 120.38 1ojr h LYS 233 Ca 0.01 -0.07 0.03 0.00 -0.85 0.00 0.00 60.65 59.77 1ojr h LYS 233 Cb 1.02 -0.05 -0.04 0.00 -0.60 0.00 0.00 32.23 32.56 1ojr h LYS 233 CO 0.09 0.41 0.31 1.03 -3.45 0.00 0.00 179.45 177.84 1ojr h SER 234 N 0.15 0.49 -1.01 4.20 0.87 -1.16 -0.99 113.55 116.11 1ojr h SER 234 Ca 0.06 0.01 0.02 0.00 -1.23 0.00 0.00 61.79 60.65 1ojr h SER 234 Cb 0.23 -0.09 -0.05 0.00 -0.44 0.00 0.00 62.40 62.05 1ojr h SER 234 CO -0.00 0.34 0.67 0.00 -0.53 0.00 0.00 176.83 177.31 1ojr h ALA 235 N 1.25 1.30 -0.55 6.23 0.00 -0.84 0.08 119.26 126.73 1ojr h ALA 235 Ca 0.22 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1ojr h ALA 235 Cb 0.06 -0.39 -0.03 0.00 0.00 0.00 0.00 17.79 17.43 1ojr h ALA 235 CO -0.12 0.64 0.34 0.37 0.00 0.00 0.00 179.25 180.48 1ojr h GLN 236 N 1.34 0.74 -0.31 0.00 4.15 -0.18 0.21 115.11 121.05 1ojr h GLN 236 Ca 0.38 -0.06 -0.00 0.00 0.77 0.00 0.00 58.65 59.74 1ojr h GLN 236 Cb -0.11 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 27.40 1ojr h GLN 236 CO -0.09 0.52 0.18 0.28 -1.93 0.00 0.00 178.83 177.79 1ojr h VAL 237 N 0.74 1.12 -0.63 2.39 2.07 -0.64 -2.50 116.25 118.79 1ojr h VAL 237 Ca 0.20 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 1ojr h VAL 237 Cb -0.04 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.44 1ojr h VAL 237 CO -0.04 0.12 0.38 -0.07 0.02 0.00 0.00 177.57 177.97 1ojr h LEU 238 N 0.40 0.77 -0.87 2.57 3.38 -0.60 -0.46 115.31 120.49 1ojr h LEU 238 Ca 0.11 -0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.03 1ojr h LEU 238 Cb 0.03 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.54 1ojr h LEU 238 CO -0.02 0.61 0.57 0.58 0.09 0.00 0.00 178.44 180.27 1ojr h VAL 239 N 0.86 1.19 -0.12 1.22 2.07 -0.82 0.21 116.25 120.86 1ojr h VAL 239 Ca 0.23 -0.39 -0.00 0.00 0.82 0.00 0.00 66.70 67.35 1ojr h VAL 239 Cb -0.01 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 29.70 1ojr h VAL 239 CO -0.04 0.21 0.06 0.11 0.02 0.00 0.00 177.57 177.93 1ojr h LYS 240 N 1.15 0.17 -0.38 1.57 1.57 -0.96 -1.38 116.57 118.32 1ojr h LYS 240 Ca 0.33 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 59.08 1ojr h LYS 240 Cb -0.09 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 1ojr h LYS 240 CO -0.09 0.21 0.23 0.28 -0.57 0.00 0.00 179.45 179.52 1ojr h VAL 241 N 0.09 1.12 -0.54 0.50 2.07 -0.47 -1.93 116.25 117.10 1ojr h VAL 241 Ca 0.04 -0.27 -0.05 0.00 0.82 0.00 0.00 66.70 67.24 1ojr h VAL 241 Cb 0.09 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 1ojr h VAL 241 CO -0.01 0.12 0.13 1.88 0.02 0.00 0.00 177.57 179.72 1ojr h TYR 242 N 0.50 0.84 0.00 1.57 0.99 -0.56 -0.64 116.97 119.68 1ojr h TYR 242 Ca 0.14 -0.07 -0.00 0.00 2.00 0.00 0.00 58.73 60.79 1ojr h TYR 242 Cb -0.01 -0.25 -0.00 0.00 1.00 0.00 0.00 36.73 37.47 1ojr h TYR 242 CO -0.04 0.71 -0.01 0.77 -0.00 0.00 0.00 178.16 179.59 1ojr h SER 243 N 0.79 0.00 -0.65 3.88 0.02 -0.82 -2.52 113.55 114.25 1ojr h SER 243 Ca 0.18 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 1ojr h SER 243 Cb 0.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.82 1ojr h SER 243 CO -0.00 0.01 0.00 0.23 -1.14 0.00 0.00 176.83 175.92 1ojr n MET 244 N -3.11 2.97 0.00 3.45 2.81 -0.71 -4.92 117.12 117.62 1ojr n MET 244 Ca -0.00 -2.53 0.00 0.00 -1.81 0.00 0.00 57.70 53.36 1ojr n MET 244 Cb 0.24 -1.66 0.00 0.00 -0.71 0.00 0.00 33.22 31.09 1ojr n MET 244 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ojr n GLY 245 N 1.38 0.61 0.00 3.03 0.00 -0.95 -5.01 105.19 104.24 1ojr n GLY 245 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1ojr n GLY 245 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ojr n GLY 246 N -1.54 0.84 3.72 -0.02 0.00 -0.33 -4.97 105.19 102.89 1ojr n GLY 246 Ca 0.00 -1.98 -0.42 0.00 0.00 0.00 0.00 46.02 43.62 1ojr n GLY 246 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ojr s MET 247 N -1.75 4.37 -0.03 1.61 -1.94 -1.26 -4.86 119.30 115.44 1ojr s MET 247 Ca 0.00 2.01 0.18 0.00 -1.71 0.00 0.00 55.69 56.16 1ojr s MET 247 Cb 0.00 -3.25 -0.20 0.00 2.01 0.00 0.00 34.83 33.39 1ojr s MET 247 CO 0.00 -0.33 0.56 1.63 -0.01 0.00 0.00 175.02 176.87 1ojr n LYS 248 N 3.46 0.65 -3.78 2.03 5.02 -1.26 -4.98 118.16 119.30 1ojr n LYS 248 Ca 0.09 0.10 -0.10 0.00 -2.02 0.00 0.00 58.31 56.38 1ojr n LYS 248 Cb 0.43 -1.69 -0.05 0.00 -0.02 0.00 0.00 35.03 33.71 1ojr n LYS 248 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 1ojr s GLN 249 N -2.89 1.25 0.27 1.97 0.00 -1.26 -5.19 119.66 113.81 1ojr s GLN 249 Ca -0.06 -0.92 -0.19 0.00 -0.00 0.00 0.00 55.36 54.19 1ojr s GLN 249 Cb 0.09 0.47 0.07 0.00 0.00 0.00 0.00 33.01 33.63 1ojr s GLN 249 CO 0.83 -0.50 0.94 -0.08 0.00 0.00 0.00 175.29 176.48 1ojr s THR 250 N -3.88 0.00 0.05 3.63 -1.32 -1.26 -5.13 115.64 107.72 1ojr s THR 250 Ca 0.10 -0.76 -0.31 0.00 -1.21 0.00 0.00 61.69 59.51 1ojr s THR 250 Cb 0.01 -2.91 -0.06 0.00 -1.51 0.00 0.00 72.50 68.03 1ojr s THR 250 CO -0.04 0.00 1.33 -0.63 -2.21 0.00 0.00 174.62 173.07 1ojr s ILE 251 N -2.20 3.70 0.63 5.08 1.01 -1.26 -5.01 121.20 123.16 1ojr s ILE 251 Ca 0.19 1.17 -0.06 0.00 0.00 0.00 0.00 60.65 61.95 1ojr s ILE 251 Cb -0.04 -3.75 0.03 0.00 0.01 0.00 0.00 42.46 38.71 1ojr s ILE 251 CO 0.08 0.05 0.94 -0.94 0.00 0.00 0.00 174.94 175.07 1ojr s SER 252 N 1.40 5.28 0.19 3.58 1.04 -1.26 -4.90 113.70 119.03 1ojr s SER 252 Ca 0.62 0.58 -0.12 0.00 0.48 0.00 0.00 55.95 57.51 1ojr s SER 252 Cb -0.32 -1.43 0.14 0.00 0.10 0.00 0.00 66.02 64.50 1ojr s SER 252 CO 0.28 -1.27 1.83 -0.09 0.98 0.00 0.00 173.24 174.97 1ojr h ARG 253 N -0.32 0.72 -0.91 4.02 2.43 -1.95 -0.66 114.38 117.70 1ojr h ARG 253 Ca -0.45 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 58.69 1ojr h ARG 253 Cb 1.28 -0.16 -0.05 0.00 -0.42 0.00 0.00 29.97 30.62 1ojr h ARG 253 CO 0.60 0.47 0.61 1.49 -1.51 0.00 0.00 179.97 181.63 1ojr h GLU 254 N 0.74 1.20 -0.37 0.20 4.81 -1.96 -0.01 114.58 119.18 1ojr h GLU 254 Ca 0.24 -0.07 -0.10 0.00 -0.13 0.00 0.00 59.36 59.30 1ojr h GLU 254 Cb 0.01 -0.27 -0.01 0.00 0.63 0.00 0.00 28.75 29.11 1ojr h GLU 254 CO -0.10 0.79 -0.15 0.93 -0.73 0.00 0.00 179.01 179.76 1ojr h GLU 255 N 1.23 0.76 -0.88 1.92 5.08 -1.76 -1.65 114.58 119.28 1ojr h GLU 255 Ca 0.34 -0.32 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1ojr h GLU 255 Cb -0.13 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.05 1ojr h GLU 255 CO -0.08 0.93 0.53 -0.07 -1.00 0.00 0.00 179.01 179.33 1ojr h LEU 256 N 0.55 1.06 -0.35 1.33 3.38 -0.64 0.25 115.31 120.90 1ojr h LEU 256 Ca 0.09 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1ojr h LEU 256 Cb 0.69 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 1ojr h LEU 256 CO 0.05 0.81 0.16 0.40 0.09 0.00 0.00 178.44 179.95 1ojr h ILE 257 N 1.21 1.17 -0.83 1.22 2.04 -0.85 -0.72 117.51 120.75 1ojr h ILE 257 Ca 0.32 -0.50 -0.02 0.00 1.00 0.00 0.00 64.86 65.66 1ojr h ILE 257 Cb -0.05 0.86 -0.04 0.00 -0.74 0.00 0.00 36.82 36.85 1ojr h ILE 257 CO -0.06 0.18 0.46 0.00 0.00 0.00 0.00 178.15 178.73 1ojr h ALA 258 N 1.01 1.07 -0.30 1.87 0.00 -0.89 -1.05 119.26 120.97 1ojr h ALA 258 Ca 0.12 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ojr h ALA 258 Cb 0.14 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1ojr h ALA 258 CO -0.01 0.57 0.18 1.25 0.00 0.00 0.00 179.25 181.24 1ojr h LEU 259 N 1.16 0.36 -0.73 0.00 5.85 -0.71 -1.62 115.31 119.61 1ojr h LEU 259 Ca 0.29 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.96 1ojr h LEU 259 Cb 0.02 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 1ojr h LEU 259 CO -0.05 0.30 0.43 1.23 -0.34 0.00 0.00 178.44 180.01 1ojr h GLY 260 N 0.38 1.07 0.95 3.75 0.00 -0.76 -2.03 103.07 106.44 1ojr h GLY 260 Ca 0.11 -0.46 -0.02 0.00 0.00 0.00 0.00 47.33 46.96 1ojr h GLY 260 CO -0.02 0.44 0.18 0.50 0.00 0.00 0.00 176.54 177.64 1ojr h LYS 261 N 1.00 0.58 -0.73 4.80 1.79 -1.02 -0.78 116.57 122.20 1ojr h LYS 261 Ca 0.26 -0.09 -0.01 0.00 -2.18 0.00 0.00 60.65 58.63 1ojr h LYS 261 Cb -0.01 -0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 30.50 1ojr h LYS 261 CO -0.05 0.52 0.40 -0.09 -1.08 0.00 0.00 179.45 179.16 1ojr h ARG 262 N 0.50 1.02 -0.24 3.15 9.65 -1.07 -2.85 114.38 124.54 1ojr h ARG 262 Ca 0.13 -0.12 0.00 0.00 -1.10 0.00 0.00 59.98 58.90 1ojr h ARG 262 Cb 0.14 -0.20 0.00 0.00 -1.39 0.00 0.00 29.97 28.52 1ojr h ARG 262 CO -0.02 0.76 0.00 1.19 2.80 0.00 0.00 179.97 184.70 1ojr n PHE 263 N -4.47 0.30 -3.28 2.20 3.01 -0.78 -4.95 117.46 109.48 1ojr n PHE 263 Ca 0.06 -0.15 -0.20 0.00 1.01 0.00 0.00 57.45 58.18 1ojr n PHE 263 Cb 0.09 0.00 0.06 0.00 -0.01 0.00 0.00 39.48 39.62 1ojr n PHE 263 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ojr n GLY 264 N 1.23 -0.32 3.35 1.37 0.00 -0.39 -5.03 105.19 105.41 1ojr n GLY 264 Ca 0.17 0.08 -0.27 0.00 0.00 0.00 0.00 46.02 45.99 1ojr n GLY 264 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ojr s VAL 265 N -3.22 2.06 -0.32 1.61 -7.23 -0.66 -5.05 120.40 107.60 1ojr s VAL 265 Ca 0.43 -1.67 -0.08 0.00 -1.81 0.00 0.00 61.98 58.85 1ojr s VAL 265 Cb -0.19 -1.84 0.01 0.00 0.56 0.00 0.00 36.38 34.93 1ojr s VAL 265 CO 0.53 0.05 0.12 0.42 -0.31 0.00 0.00 175.10 175.91 1ojr s THR 266 N -1.08 4.13 0.39 5.32 -4.23 -1.26 -4.39 115.64 114.52 1ojr s THR 266 Ca 0.11 -0.75 -0.26 0.00 -1.18 0.00 0.00 61.69 59.61 1ojr s THR 266 Cb -0.10 -3.19 -0.09 0.00 1.34 0.00 0.00 72.50 70.46 1ojr s THR 266 CO 0.05 -0.02 1.27 -2.84 -0.54 0.00 0.00 174.62 172.54 1ojr s PRO 267 N 1.51 4.04 -0.31 3.99 0.02 -1.26 -4.63 135.00 138.36 1ojr s PRO 267 Ca 0.02 2.08 -0.41 0.00 0.02 0.00 0.00 61.00 62.71 1ojr s PRO 267 Cb -0.18 -2.78 -0.16 0.00 0.02 0.00 0.00 34.50 31.40 1ojr s PRO 267 CO 0.04 -0.41 1.72 -0.11 -0.33 0.00 0.00 177.00 177.91 1ojr n LEU 268 N 0.21 2.20 -0.27 -5.54 7.94 0.17 -4.83 117.00 116.88 1ojr n LEU 268 Ca 0.03 1.09 -0.05 0.00 -1.11 0.00 0.00 56.01 55.98 1ojr n LEU 268 Cb 0.44 -1.10 0.06 0.00 0.53 0.00 0.00 43.42 43.35 1ojr n LEU 268 CO 0.55 -0.50 1.16 0.00 -1.11 0.00 0.00 177.39 177.49 1ojr h ALA 269 N 6.87 0.93 -0.80 1.96 0.00 -1.91 -2.13 119.26 124.19 1ojr h ALA 269 Ca -0.46 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.34 1ojr h ALA 269 Cb 1.33 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.78 1ojr h ALA 269 CO 0.96 0.39 0.37 0.66 0.00 0.00 0.00 179.25 181.63 1ojr h SER 270 N 1.00 1.05 0.14 0.00 4.64 -1.98 -0.61 113.55 117.80 1ojr h SER 270 Ca 0.27 -0.13 -0.16 0.00 -0.47 0.00 0.00 61.79 61.29 1ojr h SER 270 Cb -0.06 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 61.75 1ojr h SER 270 CO -0.05 0.90 -0.59 0.00 -0.87 0.00 0.00 176.83 176.22 1ojr h ALA 271 N 1.26 0.73 -0.11 5.18 0.00 -1.69 -3.05 119.26 121.57 1ojr h ALA 271 Ca 0.27 -0.53 -0.12 0.00 0.00 0.00 0.00 54.91 54.53 1ojr h ALA 271 Cb 0.14 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1ojr h ALA 271 CO -0.03 0.70 -0.47 1.25 0.00 0.00 0.00 179.25 180.71 1ojr h LEU 272 N 0.34 0.29 -1.00 0.00 5.85 -0.89 -3.17 115.31 116.73 1ojr h LEU 272 Ca -0.00 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.58 1ojr h LEU 272 Cb 1.12 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.07 1ojr h LEU 272 CO 0.10 0.72 0.00 0.00 -0.34 0.00 0.00 178.44 178.92 1ojr h ALA 273 N 1.29 1.00 0.00 1.25 0.00 -1.01 -3.48 119.26 118.32 1ojr h ALA 273 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1ojr h ALA 273 Cb 0.91 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1ojr h ALA 273 CO 0.07 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.60