#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oqa n SER 2 N 0.00 0.00 -4.52 1.61 2.88 -1.26 -5.07 113.62 107.26 1oqa n SER 2 Ca 0.00 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.12 1oqa n SER 2 Cb 0.00 0.06 -0.03 0.00 -0.75 0.00 0.00 64.21 63.49 1oqa n SER 2 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 1oqa s GLN 3 N -1.26 3.31 0.00 -1.46 -0.21 -1.26 -4.27 119.66 114.52 1oqa s GLN 3 Ca 0.00 -0.77 0.00 0.00 0.02 0.00 0.00 55.36 54.61 1oqa s GLN 3 Cb 0.00 -4.56 0.00 0.00 1.00 0.00 0.00 33.01 29.45 1oqa s GLN 3 CO 0.00 -2.04 0.00 -0.25 -2.12 0.00 0.00 175.29 170.88 1oqa n ASP 4 N 8.52 0.00 -3.64 5.90 9.92 -1.26 -5.01 116.55 130.98 1oqa n ASP 4 Ca 0.11 0.00 -0.33 0.00 -0.53 0.00 0.00 54.79 54.03 1oqa n ASP 4 Cb 0.49 0.17 -0.04 0.00 -0.64 0.00 0.00 41.12 41.09 1oqa n ASP 4 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 1oqa n ARG 5 N -1.77 3.37 -1.96 -1.24 0.00 -1.26 -5.06 116.66 108.73 1oqa n ARG 5 Ca 0.00 -4.64 -0.29 0.00 -0.00 0.00 0.00 57.85 52.92 1oqa n ARG 5 Cb 0.00 -2.36 0.14 0.00 0.00 0.00 0.00 32.46 30.24 1oqa n ARG 5 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.63 176.04 1oqa s LYS 6 N -2.67 1.27 0.00 -0.14 -2.85 -1.26 -5.03 119.74 109.06 1oqa s LYS 6 Ca 0.37 -0.24 0.00 0.00 -1.00 0.00 0.00 55.97 55.10 1oqa s LYS 6 Cb 0.11 -1.92 0.00 0.00 -2.06 0.00 0.00 37.83 33.96 1oqa s LYS 6 CO 0.03 -2.00 0.00 0.44 0.10 0.00 0.00 175.35 173.92 1oqa n ILE 7 N -3.51 0.00 -0.07 3.79 -5.35 -0.10 -4.79 119.36 109.34 1oqa n ILE 7 Ca 0.12 -0.22 -0.22 0.00 -0.27 0.00 0.00 62.75 62.16 1oqa n ILE 7 Cb 0.60 0.73 -0.12 0.00 -1.74 0.00 0.00 39.64 39.10 1oqa n ILE 7 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1oqa n PHE 8 N -1.00 0.77 -3.24 4.28 3.72 0.73 -4.21 117.46 118.51 1oqa n PHE 8 Ca 0.00 0.22 -0.09 0.00 -0.05 0.00 0.00 57.45 57.53 1oqa n PHE 8 Cb 0.00 -1.09 0.01 0.00 -0.94 0.00 0.00 39.48 37.46 1oqa n PHE 8 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 1oqa n ARG 9 N -3.80 -0.80 -1.93 -1.08 0.63 -1.25 -4.30 116.66 104.13 1oqa n ARG 9 Ca -0.38 1.01 -0.01 0.00 -0.92 0.00 0.00 57.85 57.56 1oqa n ARG 9 Cb 0.92 -1.45 0.00 0.00 0.45 0.00 0.00 32.46 32.38 1oqa n ARG 9 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1oqa n GLY 10 N 0.90 -0.65 3.01 5.14 0.00 -1.25 -4.92 105.19 107.43 1oqa n GLY 10 Ca -0.02 0.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 1oqa n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1oqa s LEU 11 N -2.27 0.10 -0.23 0.99 0.20 -1.26 -1.96 118.68 114.24 1oqa s LEU 11 Ca 0.02 0.52 -0.08 0.00 0.69 0.00 0.00 54.13 55.28 1oqa s LEU 11 Cb -0.01 0.66 -0.04 0.00 -0.43 0.00 0.00 46.19 46.38 1oqa s LEU 11 CO 0.22 -0.20 0.09 -1.61 -0.29 0.00 0.00 176.35 174.55 1oqa s GLU 12 N 1.81 3.81 -0.09 1.98 2.02 0.14 0.15 118.70 128.52 1oqa s GLU 12 Ca -0.04 -0.41 0.00 0.00 0.02 0.00 0.00 54.97 54.55 1oqa s GLU 12 Cb -0.11 -3.34 0.02 0.00 0.10 0.00 0.00 34.13 30.80 1oqa s GLU 12 CO -0.08 -0.03 -0.08 0.42 0.02 0.00 0.00 175.26 175.50 1oqa s ILE 13 N 1.22 0.99 0.00 -1.63 1.01 -0.60 0.12 121.20 122.31 1oqa s ILE 13 Ca 0.05 -0.31 0.03 0.00 0.00 0.00 0.00 60.65 60.42 1oqa s ILE 13 Cb -0.14 -0.98 -0.03 0.00 0.01 0.00 0.00 42.46 41.31 1oqa s ILE 13 CO 0.04 0.35 -0.06 0.00 0.00 0.00 0.00 174.94 175.26 1oqa s TYR 16 N 1.52 3.18 0.00 0.00 6.14 -1.03 -4.92 117.35 122.24 1oqa s TYR 16 Ca 0.03 -0.41 0.00 0.00 0.64 0.00 0.00 57.07 57.33 1oqa s TYR 16 Cb -0.18 -2.85 0.00 0.00 0.42 0.00 0.00 41.96 39.35 1oqa s TYR 16 CO 0.04 -0.69 0.00 0.41 0.64 0.00 0.00 175.55 175.95 1oqa n GLY 17 N 5.12 -2.82 0.59 8.97 0.00 -1.26 -4.74 105.19 111.05 1oqa n GLY 17 Ca -0.08 -1.28 -0.04 0.00 0.00 0.00 0.00 46.02 44.62 1oqa n GLY 17 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1oqa n PRO 18 N -1.42 -1.48 0.00 1.61 -0.02 -1.26 -4.80 135.00 127.62 1oqa n PRO 18 Ca 0.00 -0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.27 1oqa n PRO 18 Cb 0.00 -0.32 0.00 0.00 -0.02 0.00 0.00 33.50 33.16 1oqa n PRO 18 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1oqa n PHE 19 N -3.23 0.00 0.00 6.00 3.01 -1.26 -4.42 117.46 117.56 1oqa n PHE 19 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.48 1oqa n PHE 19 Cb 0.09 0.03 0.00 0.00 -0.01 0.00 0.00 39.48 39.59 1oqa n PHE 19 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1oqa n THR 20 N -1.29 0.00 0.00 4.37 -2.24 -1.26 -0.08 114.28 113.78 1oqa n THR 20 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1oqa n THR 20 Cb 0.00 -0.79 0.00 0.00 -2.10 0.00 0.00 70.33 67.44 1oqa n THR 20 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1oqa n ASN 21 N -2.61 0.00 -2.69 3.42 3.02 -1.26 -4.73 115.26 110.41 1oqa n ASN 21 Ca 0.00 0.00 -0.06 0.00 -0.03 0.00 0.00 54.58 54.49 1oqa n ASN 21 Cb 0.46 0.00 0.08 0.00 -0.61 0.00 0.00 39.78 39.71 1oqa n ASN 21 CO 0.00 0.00 0.00 0.80 -2.62 0.00 0.00 177.26 175.44 1oqa n MET 22 N -1.70 0.69 -0.39 3.52 1.56 -1.26 -5.00 117.12 114.54 1oqa n MET 22 Ca 0.00 -1.34 0.03 0.00 -0.27 0.00 0.00 57.70 56.11 1oqa n MET 22 Cb 0.00 -0.30 0.17 0.00 2.15 0.00 0.00 33.22 35.24 1oqa n MET 22 CO 0.00 0.00 0.00 -0.35 -0.73 0.00 0.00 175.97 174.89 1oqa n PRO 23 N -0.11 2.64 -0.31 2.12 -0.04 -1.26 -4.38 135.00 133.66 1oqa n PRO 23 Ca -0.07 -1.34 0.01 0.00 -0.04 0.00 0.00 63.50 62.06 1oqa n PRO 23 Cb 0.74 -1.82 0.15 0.00 -0.04 0.00 0.00 33.50 32.53 1oqa n PRO 23 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1oqa h THR 24 N 1.67 1.02 0.00 0.52 2.02 -1.94 0.96 112.91 117.15 1oqa h THR 24 Ca 0.01 -0.33 -0.13 0.00 0.77 0.00 0.00 66.41 66.73 1oqa h THR 24 Cb 1.15 -0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 67.52 1oqa h THR 24 CO 0.22 0.17 -0.98 -0.78 0.37 0.00 0.00 175.52 174.52 1oqa h ASP 25 N 0.95 0.00 0.72 4.18 1.82 -2.00 -3.13 116.42 118.97 1oqa h ASP 25 Ca 0.39 0.00 -0.17 0.00 -0.39 0.00 0.00 57.03 56.86 1oqa h ASP 25 Cb 0.21 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.20 1oqa h ASP 25 CO -0.19 0.53 -0.78 -0.61 -1.61 0.00 0.00 179.24 176.58 1oqa h GLN 26 N 0.00 0.04 0.03 0.28 4.15 -1.58 -2.28 115.11 115.76 1oqa h GLN 26 Ca -0.08 -0.04 -0.00 0.00 0.77 0.00 0.00 58.65 59.29 1oqa h GLN 26 Cb 1.48 0.01 0.00 0.00 0.21 0.00 0.00 27.48 29.18 1oqa h GLN 26 CO 0.05 0.80 -0.02 -0.07 -1.93 0.00 0.00 178.83 177.67 1oqa h LEU 27 N 0.02 -0.04 -1.92 -2.39 -0.00 0.86 -2.13 115.31 109.72 1oqa h LEU 27 Ca -0.01 -0.58 -0.02 0.00 -0.00 0.00 0.00 57.88 57.27 1oqa h LEU 27 Cb 1.37 0.01 -0.00 0.00 -0.00 0.00 0.00 40.66 42.04 1oqa h LEU 27 CO 0.11 0.58 -0.10 1.05 -0.00 0.00 0.00 178.44 180.07 1oqa h GLU 28 N -0.67 0.00 0.09 1.13 4.11 -1.61 -1.85 114.58 115.79 1oqa h GLU 28 Ca -0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.42 1oqa h GLU 28 Cb 0.61 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.86 1oqa h GLU 28 CO 0.01 0.10 -0.04 2.35 0.07 0.00 0.00 179.01 181.50 1oqa h TRP 29 N 0.00 -0.12 -0.37 2.06 7.01 -1.37 -0.29 115.95 122.88 1oqa h TRP 29 Ca -0.00 -0.00 0.07 0.00 2.11 0.00 0.00 58.89 61.07 1oqa h TRP 29 Cb 0.21 0.04 -0.07 0.00 -2.10 0.00 0.00 29.16 27.24 1oqa h TRP 29 CO 0.00 0.29 -0.06 0.52 -2.79 0.00 0.00 178.44 176.40 1oqa h MET 30 N -0.56 0.03 -0.42 2.65 2.86 -0.89 0.40 114.93 119.00 1oqa h MET 30 Ca -0.01 -0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 1oqa h MET 30 Cb 0.46 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.09 1oqa h MET 30 CO 0.02 0.02 0.22 -0.39 1.06 0.00 0.00 176.91 177.84 1oqa h VAL 31 N 0.04 1.17 -0.69 -2.22 -1.51 -1.37 -1.79 116.25 109.88 1oqa h VAL 31 Ca 0.18 -0.45 0.07 0.00 -1.23 0.00 0.00 66.70 65.27 1oqa h VAL 31 Cb 0.27 0.70 -0.04 0.00 -2.13 0.00 0.00 31.29 30.08 1oqa h VAL 31 CO -0.35 0.18 0.45 1.56 -1.23 0.00 0.00 177.57 178.18 1oqa h GLN 32 N 0.54 0.63 0.00 5.19 4.20 0.01 0.28 115.11 125.96 1oqa h GLN 32 Ca 0.15 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.80 1oqa h GLN 32 Cb 0.09 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 27.72 1oqa h GLN 32 CO -0.02 0.42 -0.07 1.25 -0.67 0.00 0.00 178.83 179.74 1oqa h LEU 33 N 0.65 0.00 -0.87 1.46 5.85 0.59 -2.38 115.31 120.60 1oqa h LEU 33 Ca 0.30 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.02 1oqa h LEU 33 Cb 0.34 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.37 1oqa h LEU 33 CO -0.10 0.07 -0.22 0.00 -0.34 0.00 0.00 178.44 177.85 1oqa n GLY 35 N 1.32 2.35 3.67 0.00 0.00 -0.89 -0.19 105.19 111.45 1oqa n GLY 35 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 1oqa n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oqa s ALA 36 N -2.33 0.99 0.09 4.61 0.00 -0.62 -3.81 121.76 120.70 1oqa s ALA 36 Ca 0.00 -1.03 0.06 0.00 0.00 0.00 0.00 51.96 50.99 1oqa s ALA 36 Cb 0.00 -2.85 -0.03 0.00 0.00 0.00 0.00 23.12 20.24 1oqa s ALA 36 CO 0.00 -3.33 -0.16 0.45 0.00 0.00 0.00 175.76 172.71 1oqa s SER 37 N -4.15 2.04 -0.23 0.00 0.15 0.40 -3.89 113.70 108.01 1oqa s SER 37 Ca 0.72 -0.68 -0.23 0.00 0.70 0.00 0.00 55.95 56.46 1oqa s SER 37 Cb -0.08 -0.08 -0.01 0.00 -1.71 0.00 0.00 66.02 64.13 1oqa s SER 37 CO 0.55 -0.04 0.76 0.54 1.20 0.00 0.00 173.24 176.25 1oqa s VAL 38 N -1.40 4.90 -0.16 4.45 0.11 -1.26 -1.55 120.40 125.48 1oqa s VAL 38 Ca 0.03 1.43 -0.16 0.00 -2.93 0.00 0.00 61.98 60.34 1oqa s VAL 38 Cb -0.09 -4.06 -0.04 0.00 -1.53 0.00 0.00 36.38 30.66 1oqa s VAL 38 CO 0.03 -0.02 0.40 -0.69 -3.33 0.00 0.00 175.10 171.49 1oqa s VAL 39 N 2.60 5.23 0.12 2.04 1.01 -1.18 -4.96 120.40 125.27 1oqa s VAL 39 Ca 0.32 0.76 -0.20 0.00 0.00 0.00 0.00 61.98 62.87 1oqa s VAL 39 Cb -0.15 -3.74 -0.06 0.00 0.00 0.00 0.00 36.38 32.43 1oqa s VAL 39 CO 0.08 0.32 1.76 0.11 0.00 0.00 0.00 175.10 177.37 1oqa h LYS 40 N 6.92 0.20 -4.47 2.72 6.56 -1.93 -3.42 116.57 123.15 1oqa h LYS 40 Ca -0.39 -0.01 -0.38 0.00 -1.06 0.00 0.00 60.65 58.80 1oqa h LYS 40 Cb 1.17 -0.05 -0.10 0.00 -0.57 0.00 0.00 32.23 32.69 1oqa h LYS 40 CO 0.75 0.13 -0.30 -1.21 -2.06 0.00 0.00 179.45 176.76 1oqa s GLU 41 N -6.18 1.91 0.14 3.15 2.02 -1.26 -4.96 118.70 113.52 1oqa s GLU 41 Ca -0.13 -1.92 -0.13 0.00 0.02 0.00 0.00 54.97 52.81 1oqa s GLU 41 Cb 0.09 0.40 -0.00 0.00 0.10 0.00 0.00 34.13 34.72 1oqa s GLU 41 CO 0.69 -0.77 1.59 -0.07 0.02 0.00 0.00 175.26 176.72 1oqa h LEU 42 N 2.08 0.77 -1.46 1.80 3.38 -1.98 -2.66 115.31 117.23 1oqa h LEU 42 Ca -0.26 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.39 1oqa h LEU 42 Cb 1.23 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.78 1oqa h LEU 42 CO 0.37 0.89 -0.04 -1.28 0.09 0.00 0.00 178.44 178.47 1oqa h SER 43 N 0.63 0.00 0.52 -0.43 0.87 -1.97 -2.69 113.55 110.48 1oqa h SER 43 Ca 0.13 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 1oqa h SER 43 Cb 0.49 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.45 1oqa h SER 43 CO 0.02 0.04 0.00 0.28 -0.53 0.00 0.00 176.83 176.64 1oqa h SER 44 N 0.00 0.00 -1.06 6.23 0.02 -1.87 -3.43 113.55 113.44 1oqa h SER 44 Ca -0.00 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.39 1oqa h SER 44 Cb 0.53 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.05 1oqa h SER 44 CO 0.01 0.00 1.57 0.49 -1.14 0.00 0.00 176.83 177.76 1oqa n PHE 45 N -2.34 1.33 -4.09 3.45 3.72 -1.02 -4.90 117.46 113.61 1oqa n PHE 45 Ca 0.01 0.23 -0.10 0.00 -0.05 0.00 0.00 57.45 57.53 1oqa n PHE 45 Cb 0.17 -2.54 -0.11 0.00 -0.94 0.00 0.00 39.48 36.07 1oqa n PHE 45 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1oqa s THR 46 N 9.38 0.46 -0.19 4.37 -4.23 -1.26 -5.12 115.64 119.04 1oqa s THR 46 Ca 1.11 -1.52 -0.15 0.00 -1.18 0.00 0.00 61.69 59.95 1oqa s THR 46 Cb -0.69 -1.14 0.05 0.00 1.34 0.00 0.00 72.50 72.05 1oqa s THR 46 CO 0.41 -0.71 0.48 -1.48 -0.54 0.00 0.00 174.62 172.78 1oqa s LEU 47 N -2.39 0.01 -0.06 4.79 2.34 -1.26 -4.88 118.68 117.23 1oqa s LEU 47 Ca 0.01 1.00 0.06 0.00 0.06 0.00 0.00 54.13 55.26 1oqa s LEU 47 Cb -0.00 1.64 -0.09 0.00 -0.56 0.00 0.00 46.19 47.18 1oqa s LEU 47 CO -0.04 -0.18 0.04 0.61 -1.06 0.00 0.00 176.35 175.72 1oqa n GLY 48 N 3.27 -0.35 0.80 -3.48 0.00 -1.26 -4.89 105.19 99.28 1oqa n GLY 48 Ca -0.16 -0.13 -0.02 0.00 0.00 0.00 0.00 46.02 45.71 1oqa n GLY 48 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1oqa n THR 49 N -2.19 1.27 -2.72 2.61 -1.04 -1.26 -5.06 114.28 105.89 1oqa n THR 49 Ca -0.10 0.33 0.00 0.00 -2.04 0.00 0.00 64.05 62.25 1oqa n THR 49 Cb 0.65 -1.77 0.02 0.00 -1.82 0.00 0.00 70.33 67.41 1oqa n THR 49 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1oqa s GLY 50 N -4.20 -1.69 -0.07 3.41 0.00 -1.26 -5.16 107.32 98.35 1oqa s GLY 50 Ca -0.07 1.09 0.04 0.00 0.00 0.00 0.00 44.72 45.77 1oqa s GLY 50 CO 0.11 4.34 -0.18 0.14 0.00 0.00 0.00 173.10 177.51 1oqa s VAL 51 N 1.63 1.55 -0.17 1.40 1.01 -1.26 -4.46 120.40 120.10 1oqa s VAL 51 Ca 0.17 -0.74 -0.16 0.00 0.00 0.00 0.00 61.98 61.25 1oqa s VAL 51 Cb 0.07 -1.35 -0.04 0.00 0.00 0.00 0.00 36.38 35.05 1oqa s VAL 51 CO -0.14 0.44 0.40 -1.00 0.00 0.00 0.00 175.10 174.80 1oqa s HIS 52 N 0.36 3.43 0.03 5.22 0.09 -0.83 -4.81 115.29 118.77 1oqa s HIS 52 Ca -0.13 0.68 -0.30 0.00 -0.00 0.00 0.00 55.06 55.32 1oqa s HIS 52 Cb -0.15 -2.49 -0.04 0.00 -0.00 0.00 0.00 32.58 29.90 1oqa s HIS 52 CO 0.05 0.09 0.96 -1.25 -0.00 0.00 0.00 174.74 174.59 1oqa s PRO 53 N 0.94 4.59 0.10 8.40 0.04 -1.26 0.25 135.00 148.07 1oqa s PRO 53 Ca 0.20 1.41 -0.05 0.00 0.04 0.00 0.00 61.00 62.60 1oqa s PRO 53 Cb -0.14 -3.43 -0.02 0.00 0.04 0.00 0.00 34.50 30.94 1oqa s PRO 53 CO 0.08 0.03 0.11 0.42 0.04 0.00 0.00 177.00 177.68 1oqa s ILE 54 N 0.70 0.15 0.04 0.56 -1.09 0.32 -4.24 121.20 117.63 1oqa s ILE 54 Ca 0.50 -1.56 0.01 0.00 -2.23 0.00 0.00 60.65 57.37 1oqa s ILE 54 Cb -0.22 -1.62 -0.02 0.00 -1.58 0.00 0.00 42.46 39.02 1oqa s ILE 54 CO 0.28 -0.67 -0.05 -0.69 -1.23 0.00 0.00 174.94 172.58 1oqa s VAL 55 N -3.93 0.33 0.09 2.92 1.01 0.25 -1.55 120.40 119.52 1oqa s VAL 55 Ca 0.11 -1.10 0.08 0.00 0.00 0.00 0.00 61.98 61.07 1oqa s VAL 55 Cb 0.06 -0.56 -0.03 0.00 0.00 0.00 0.00 36.38 35.84 1oqa s VAL 55 CO -0.06 -0.50 -0.19 -0.69 0.00 0.00 0.00 175.10 173.65 1oqa s VAL 56 N -1.70 1.58 0.27 2.92 1.01 0.54 0.40 120.40 125.41 1oqa s VAL 56 Ca -0.10 -1.49 0.02 0.00 0.00 0.00 0.00 61.98 60.41 1oqa s VAL 56 Cb -0.08 -1.45 -0.01 0.00 0.00 0.00 0.00 36.38 34.84 1oqa s VAL 56 CO -0.01 -0.09 0.31 1.33 0.00 0.00 0.00 175.10 176.63 1oqa n VAL 57 N 1.13 0.00 0.00 2.92 0.24 -0.95 -2.45 118.33 119.22 1oqa n VAL 57 Ca -0.20 -1.66 0.00 0.00 -2.04 0.00 0.00 64.34 60.44 1oqa n VAL 57 Cb 0.54 0.91 0.00 0.00 -1.47 0.00 0.00 33.84 33.82 1oqa n VAL 57 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 1oqa n GLN 58 N -0.48 0.00 -1.54 7.34 -0.06 -1.26 -2.43 117.38 118.95 1oqa n GLN 58 Ca 0.03 0.00 -0.20 0.00 -2.00 0.00 0.00 57.00 54.83 1oqa n GLN 58 Cb 0.47 0.00 -0.11 0.00 -4.06 0.00 0.00 30.24 26.54 1oqa n GLN 58 CO 0.00 0.00 0.00 -2.30 -0.20 0.00 0.00 177.06 174.56 1oqa n PRO 59 N 0.00 0.43 0.00 3.69 -0.02 -1.26 -3.83 135.00 134.01 1oqa n PRO 59 Ca 0.00 -0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.03 1oqa n PRO 59 Cb 0.00 -2.77 0.00 0.00 -0.02 0.00 0.00 33.50 30.71 1oqa n PRO 59 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1oqa n ASP 60 N 14.18 0.00 -2.17 2.55 8.00 -1.25 -4.96 116.55 132.90 1oqa n ASP 60 Ca 0.53 0.00 -0.24 0.00 0.71 0.00 0.00 54.79 55.79 1oqa n ASP 60 Cb 0.34 0.20 0.02 0.00 -0.02 0.00 0.00 41.12 41.65 1oqa n ASP 60 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1oqa n ALA 61 N -1.86 4.95 1.18 2.24 0.00 0.88 -4.75 120.51 123.15 1oqa n ALA 61 Ca 0.00 -3.89 0.13 0.00 0.00 0.00 0.00 53.44 49.67 1oqa n ALA 61 Cb 0.00 -0.40 0.64 0.00 0.00 0.00 0.00 19.45 19.69 1oqa n ALA 61 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1oqa n TRP 62 N -0.64 0.00 0.00 0.00 -0.00 -1.26 -4.31 117.44 111.23 1oqa n TRP 62 Ca 0.41 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.91 1oqa n TRP 62 Cb 0.88 -0.30 0.00 0.00 -0.00 0.00 0.00 31.31 31.89 1oqa n TRP 62 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 177.69 180.10 1oqa n THR 63 N -1.30 0.00 -3.28 5.87 -1.04 -1.26 -4.70 114.28 108.57 1oqa n THR 63 Ca 0.12 0.00 -0.38 0.00 -2.04 0.00 0.00 64.05 61.74 1oqa n THR 63 Cb 0.21 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.66 1oqa n THR 63 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1oqa s GLU 64 N 0.00 4.32 -1.02 -2.82 2.02 -1.26 -5.02 118.70 114.92 1oqa s GLU 64 Ca 0.00 0.54 -0.05 0.00 0.02 0.00 0.00 54.97 55.47 1oqa s GLU 64 Cb 0.00 -3.41 0.26 0.00 0.10 0.00 0.00 34.13 31.08 1oqa s GLU 64 CO 0.00 0.22 1.00 -0.25 0.02 0.00 0.00 175.26 176.24 1oqa n ASP 65 N 3.41 5.00 -0.07 -0.19 9.92 -1.26 -4.83 116.55 128.53 1oqa n ASP 65 Ca -0.07 -3.11 -0.05 0.00 -0.53 0.00 0.00 54.79 51.03 1oqa n ASP 65 Cb 0.52 -1.22 -0.02 0.00 -0.64 0.00 0.00 41.12 39.75 1oqa n ASP 65 CO 0.00 0.00 0.00 0.78 0.13 0.00 0.00 177.20 178.11 1oqa h ASN 66 N 6.24 0.00 -0.08 -2.24 2.35 -1.96 -3.49 115.58 116.40 1oqa h ASN 66 Ca 0.17 -0.03 0.27 0.00 -0.55 0.00 0.00 56.30 56.16 1oqa h ASN 66 Cb 0.82 0.00 -0.19 0.00 0.05 0.00 0.00 38.32 39.00 1oqa h ASN 66 CO 0.97 0.77 0.16 -0.83 -1.65 0.00 0.00 177.43 176.85 1oqa s GLY 67 N -4.21 -0.55 0.00 2.83 0.00 -1.26 -5.02 107.32 99.12 1oqa s GLY 67 Ca -0.14 2.66 0.21 0.00 0.00 0.00 0.00 44.72 47.45 1oqa s GLY 67 CO 0.22 4.11 1.45 0.33 0.00 0.00 0.00 173.10 179.21 1oqa n PHE 68 N 5.22 0.59 -1.48 1.90 7.35 -1.26 -4.51 117.46 125.28 1oqa n PHE 68 Ca 0.02 -0.30 -0.26 0.00 -0.76 0.00 0.00 57.45 56.15 1oqa n PHE 68 Cb 0.57 0.00 -0.06 0.00 0.35 0.00 0.00 39.48 40.34 1oqa n PHE 68 CO 0.00 0.00 0.00 1.58 -0.76 0.00 0.00 176.76 177.58 1oqa n HIS 69 N 1.19 1.51 -2.10 -5.13 -0.00 -1.26 -3.86 115.22 105.57 1oqa n HIS 69 Ca 0.19 -1.96 -0.02 0.00 0.46 0.00 0.00 57.72 56.39 1oqa n HIS 69 Cb 0.51 -1.43 0.01 0.00 -0.12 0.00 0.00 29.99 28.96 1oqa n HIS 69 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1oqa n ALA 70 N 1.09 0.44 0.07 1.57 0.00 -1.26 -5.00 120.51 117.42 1oqa n ALA 70 Ca 0.49 -0.35 -0.05 0.00 0.00 0.00 0.00 53.44 53.53 1oqa n ALA 70 Cb 0.56 -0.44 -0.03 0.00 0.00 0.00 0.00 19.45 19.55 1oqa n ALA 70 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1oqa h ILE 71 N 1.93 0.09 0.00 0.00 1.08 -1.91 -2.15 117.51 116.55 1oqa h ILE 71 Ca -0.22 -0.84 -0.01 0.00 -0.39 0.00 0.00 64.86 63.40 1oqa h ILE 71 Cb 0.99 0.16 -0.00 0.00 -3.07 0.00 0.00 36.82 34.90 1oqa h ILE 71 CO -0.10 0.03 -0.06 1.23 -0.69 0.00 0.00 178.15 178.56 1oqa h GLY 72 N -1.06 0.00 1.40 5.37 0.00 -1.88 -0.60 103.07 106.30 1oqa h GLY 72 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.30 1oqa h GLY 72 CO 0.05 0.00 -0.59 -1.61 0.00 0.00 0.00 176.54 174.39 1oqa h GLN 73 N 0.00 0.00 0.00 4.80 5.75 -1.95 -3.33 115.11 120.38 1oqa h GLN 73 Ca -0.00 0.00 -0.29 0.00 -0.15 0.00 0.00 58.65 58.21 1oqa h GLN 73 Cb 0.35 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 28.84 1oqa h GLN 73 CO 0.01 0.00 -1.91 -0.12 -2.65 0.00 0.00 178.83 174.15 1oqa n MET 74 N -2.82 0.65 -4.10 1.69 1.56 -0.77 -4.93 117.12 108.39 1oqa n MET 74 Ca 0.02 0.16 -0.29 0.00 -0.27 0.00 0.00 57.70 57.32 1oqa n MET 74 Cb 0.54 -1.69 -0.07 0.00 2.15 0.00 0.00 33.22 34.15 1oqa n MET 74 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1oqa n GLU 76 N 0.30 2.09 -4.09 0.00 2.13 -1.26 -4.73 120.64 115.08 1oqa n GLU 76 Ca -0.10 -2.60 -0.07 0.00 0.66 0.00 0.00 57.16 55.05 1oqa n GLU 76 Cb 0.53 -2.02 -0.10 0.00 0.27 0.00 0.00 31.44 30.12 1oqa n GLU 76 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1oqa s ALA 77 N -2.86 0.50 -0.09 4.31 0.00 -1.26 -5.01 121.76 117.35 1oqa s ALA 77 Ca 0.49 -1.17 -0.30 0.00 0.00 0.00 0.00 51.96 50.99 1oqa s ALA 77 Cb 0.41 0.26 -0.03 0.00 0.00 0.00 0.00 23.12 23.76 1oqa s ALA 77 CO 0.09 -0.35 1.24 -1.25 0.00 0.00 0.00 175.76 175.50 1oqa s PRO 78 N -3.73 4.30 0.04 0.00 0.04 -1.26 -4.70 135.00 129.69 1oqa s PRO 78 Ca 0.05 1.69 -0.16 0.00 0.04 0.00 0.00 61.00 62.62 1oqa s PRO 78 Cb 0.06 -3.64 -0.06 0.00 0.04 0.00 0.00 34.50 30.90 1oqa s PRO 78 CO -0.09 -0.56 0.48 0.08 0.04 0.00 0.00 177.00 176.95 1oqa s VAL 79 N 2.74 4.91 -0.17 -0.36 1.01 -1.25 0.86 120.40 128.14 1oqa s VAL 79 Ca 0.56 0.97 -0.12 0.00 0.00 0.00 0.00 61.98 63.40 1oqa s VAL 79 Cb -0.24 -3.78 0.05 0.00 0.00 0.00 0.00 36.38 32.41 1oqa s VAL 79 CO 0.19 0.54 0.43 0.68 0.00 0.00 0.00 175.10 176.95 1oqa s VAL 80 N -1.12 -0.02 0.94 2.92 -7.23 0.16 -3.31 120.40 112.75 1oqa s VAL 80 Ca 0.27 0.06 -0.15 0.00 -1.81 0.00 0.00 61.98 60.35 1oqa s VAL 80 Cb -0.18 -0.63 -0.04 0.00 0.56 0.00 0.00 36.38 36.10 1oqa s VAL 80 CO 0.16 0.02 -0.02 0.35 -0.31 0.00 0.00 175.10 175.30 1oqa n THR 81 N 3.79 0.15 0.31 5.32 -2.24 0.92 -2.24 114.28 120.28 1oqa n THR 81 Ca -0.20 -0.32 0.18 0.00 -2.27 0.00 0.00 64.05 61.43 1oqa n THR 81 Cb 0.56 -0.40 0.91 0.00 -2.10 0.00 0.00 70.33 69.30 1oqa n THR 81 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 1oqa h ARG 82 N -1.23 0.00 -0.96 -0.78 0.11 -1.83 -2.00 114.38 107.70 1oqa h ARG 82 Ca -0.44 0.00 0.25 0.00 0.10 0.00 0.00 59.98 59.89 1oqa h ARG 82 Cb 1.30 0.00 -0.13 0.00 1.11 0.00 0.00 29.97 32.25 1oqa h ARG 82 CO 0.31 0.00 0.50 1.49 0.10 0.00 0.00 179.97 182.37 1oqa h GLU 83 N 0.00 0.43 0.53 0.08 4.81 -1.89 0.86 114.58 119.40 1oqa h GLU 83 Ca 0.02 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1oqa h GLU 83 Cb 0.53 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 1oqa h GLU 83 CO -0.00 0.28 -0.38 2.35 -0.73 0.00 0.00 179.01 180.53 1oqa h TRP 84 N 0.44 -1.01 -0.73 0.92 7.01 -1.66 0.82 115.95 121.74 1oqa h TRP 84 Ca 0.63 -0.00 0.11 0.00 2.11 0.00 0.00 58.89 61.73 1oqa h TRP 84 Cb 1.25 0.37 -0.08 0.00 -2.10 0.00 0.00 29.16 28.61 1oqa h TRP 84 CO -0.07 -0.56 0.34 0.28 -2.79 0.00 0.00 178.44 175.65 1oqa h VAL 85 N -0.88 0.79 0.17 2.65 2.07 -1.19 0.32 116.25 120.18 1oqa h VAL 85 Ca -0.06 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.26 1oqa h VAL 85 Cb 0.74 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 1oqa h VAL 85 CO 0.02 0.10 -0.08 0.25 0.02 0.00 0.00 177.57 177.88 1oqa h LEU 86 N 0.56 -0.19 -2.00 2.57 5.85 -0.61 -1.00 115.31 120.48 1oqa h LEU 86 Ca 0.37 -0.31 0.06 0.00 0.84 0.00 0.00 57.88 58.84 1oqa h LEU 86 Cb 0.45 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.53 1oqa h LEU 86 CO -0.31 0.25 0.15 -0.78 -0.34 0.00 0.00 178.44 177.42 1oqa h ASP 87 N -0.69 0.00 0.01 1.25 3.58 0.98 0.54 116.42 122.08 1oqa h ASP 87 Ca -0.02 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.40 1oqa h ASP 87 Cb 0.49 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.55 1oqa h ASP 87 CO 0.04 0.00 -0.10 0.28 -2.88 0.00 0.00 179.24 176.58 1oqa h SER 88 N 0.00 0.08 0.65 2.28 0.02 -0.30 -2.83 113.55 113.44 1oqa h SER 88 Ca 0.10 -0.84 -0.10 0.00 -0.84 0.00 0.00 61.79 60.11 1oqa h SER 88 Cb 0.41 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 1oqa h SER 88 CO -0.00 0.91 -0.47 0.58 -1.14 0.00 0.00 176.83 176.71 1oqa h VAL 89 N -0.75 1.17 0.40 2.27 2.07 -0.73 1.11 116.25 121.80 1oqa h VAL 89 Ca -0.01 -1.69 -0.02 0.00 0.82 0.00 0.00 66.70 65.80 1oqa h VAL 89 Cb 0.93 1.95 0.00 0.00 -1.52 0.00 0.00 31.29 32.66 1oqa h VAL 89 CO 0.02 0.46 -0.19 0.00 0.02 0.00 0.00 177.57 177.87 1oqa h ALA 90 N 1.53 -0.54 0.00 1.67 0.00 -0.02 -3.31 119.26 118.60 1oqa h ALA 90 Ca -0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1oqa h ALA 90 Cb 0.92 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1oqa h ALA 90 CO 0.06 -0.57 -0.59 -0.11 0.00 0.00 0.00 179.25 178.04 1oqa n LEU 91 N -5.16 0.56 -2.73 0.00 7.94 -1.07 -5.01 117.00 111.53 1oqa n LEU 91 Ca -0.09 0.04 -0.05 0.00 -1.11 0.00 0.00 56.01 54.80 1oqa n LEU 91 Cb 0.28 -0.22 0.01 0.00 0.53 0.00 0.00 43.42 44.02 1oqa n LEU 91 CO 0.25 0.08 0.12 -1.22 -1.11 0.00 0.00 177.39 175.52 1oqa n TYR 92 N -1.67 -2.92 -3.65 1.96 4.01 0.38 -5.06 117.16 110.21 1oqa n TYR 92 Ca 0.05 1.16 0.01 0.00 -0.16 0.00 0.00 57.90 58.96 1oqa n TYR 92 Cb 0.37 -3.78 -0.06 0.00 -0.31 0.00 0.00 39.34 35.56 1oqa n TYR 92 CO 0.00 0.00 0.00 -1.14 -0.46 0.00 0.00 176.86 175.26 1oqa s GLN 93 N -2.59 0.05 -0.91 -0.72 2.00 -0.79 -4.93 119.66 111.76 1oqa s GLN 93 Ca 0.15 0.08 -0.26 0.00 -2.00 0.00 0.00 55.36 53.33 1oqa s GLN 93 Cb -0.04 0.01 -0.17 0.00 0.80 0.00 0.00 33.01 33.61 1oqa s GLN 93 CO 0.67 -0.01 2.28 0.00 -0.50 0.00 0.00 175.29 177.72 1oqa s GLN 95 N 8.64 0.85 0.73 0.00 -1.52 -1.26 -5.00 119.66 122.10 1oqa s GLN 95 Ca 0.87 0.74 -0.13 0.00 -1.95 0.00 0.00 55.36 54.89 1oqa s GLN 95 Cb -0.09 -1.77 0.04 0.00 -0.22 0.00 0.00 33.01 30.97 1oqa s GLN 95 CO 0.12 -2.50 1.13 -1.21 -0.25 0.00 0.00 175.29 172.57 1oqa s GLU 96 N -4.91 2.33 -0.04 2.91 2.02 -1.26 -4.97 118.70 114.77 1oqa s GLU 96 Ca 0.64 1.41 0.20 0.00 0.02 0.00 0.00 54.97 57.24 1oqa s GLU 96 Cb -0.19 -1.89 -0.30 0.00 0.10 0.00 0.00 34.13 31.85 1oqa s GLU 96 CO 0.58 -1.62 0.40 1.28 0.02 0.00 0.00 175.26 175.91 1oqa n LEU 97 N -2.99 0.00 0.23 1.80 4.32 -1.26 -4.31 117.00 114.79 1oqa n LEU 97 Ca 0.11 0.00 0.09 0.00 -0.02 0.00 0.00 56.01 56.19 1oqa n LEU 97 Cb 0.52 0.04 0.55 0.00 -1.62 0.00 0.00 43.42 42.91 1oqa n LEU 97 CO 0.49 0.04 0.85 0.44 -1.22 0.00 0.00 177.39 178.00 1oqa h ASP 98 N 0.00 0.00 1.09 -1.43 5.19 -1.94 0.67 116.42 120.00 1oqa h ASP 98 Ca -0.05 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.36 1oqa h ASP 98 Cb 1.02 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.53 1oqa h ASP 98 CO 0.00 0.22 0.00 0.41 -3.12 0.00 0.00 179.24 176.75 1oqa n THR 99 N -3.64 0.72 -1.62 0.35 -1.04 -1.26 -3.55 114.28 104.24 1oqa n THR 99 Ca -0.01 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 61.98 1oqa n THR 99 Cb 0.35 -0.89 0.00 0.00 -1.82 0.00 0.00 70.33 67.97 1oqa n THR 99 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1oqa n TYR 100 N -2.28 0.00 -2.38 -1.42 4.01 -0.88 -5.04 117.16 109.18 1oqa n TYR 100 Ca 0.04 -0.03 -0.40 0.00 -0.16 0.00 0.00 57.90 57.35 1oqa n TYR 100 Cb 0.33 -0.04 -0.03 0.00 -0.31 0.00 0.00 39.34 39.29 1oqa n TYR 100 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1oqa s LEU 101 N -0.09 3.23 0.30 7.72 0.20 0.23 -0.06 118.68 130.22 1oqa s LEU 101 Ca 0.01 -0.33 0.00 0.00 0.69 0.00 0.00 54.13 54.50 1oqa s LEU 101 Cb 0.01 -2.55 0.00 0.00 -0.43 0.00 0.00 46.19 43.22 1oqa s LEU 101 CO 0.00 -2.01 0.00 -0.38 -0.29 0.00 0.00 176.35 173.67 1oqa n ILE 102 N 6.75 -6.21 -1.28 6.68 5.41 -1.21 -4.96 119.36 124.54 1oqa n ILE 102 Ca 0.13 2.38 -0.26 0.00 1.00 0.00 0.00 62.75 66.01 1oqa n ILE 102 Cb 0.50 -3.43 0.20 0.00 -0.71 0.00 0.00 39.64 36.20 1oqa n ILE 102 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 1oqa n PRO 103 N 0.58 -2.20 -3.63 0.38 -0.04 -1.26 -4.98 135.00 123.85 1oqa n PRO 103 Ca 0.00 -1.61 -0.03 0.00 -0.04 0.00 0.00 63.50 61.82 1oqa n PRO 103 Cb 0.00 -1.32 -0.03 0.00 -0.04 0.00 0.00 33.50 32.10 1oqa n PRO 103 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 1oqa s GLN 104 N -5.28 0.15 0.27 0.54 -2.07 -1.26 -5.15 119.66 106.87 1oqa s GLN 104 Ca 0.63 -0.00 -0.30 0.00 -1.82 0.00 0.00 55.36 53.87 1oqa s GLN 104 Cb -0.04 0.07 -0.10 0.00 -1.09 0.00 0.00 33.01 31.84 1oqa s GLN 104 CO 0.46 -0.05 1.41 0.96 -1.32 0.00 0.00 175.29 176.75 1oqa s ILE 105 N -1.48 2.66 0.83 3.63 -5.25 -1.26 -5.00 121.20 115.32 1oqa s ILE 105 Ca 0.09 0.58 -0.11 0.00 -0.99 0.00 0.00 60.65 60.21 1oqa s ILE 105 Cb -0.01 -3.37 0.09 0.00 2.95 0.00 0.00 42.46 42.12 1oqa s ILE 105 CO -0.05 0.11 1.10 -2.16 -1.79 0.00 0.00 174.94 172.14 1oqa s PRO 106 N -0.80 1.81 -0.36 0.37 0.04 -1.26 -4.90 135.00 129.90 1oqa s PRO 106 Ca 0.56 0.70 -0.27 0.00 0.04 0.00 0.00 61.00 62.03 1oqa s PRO 106 Cb -0.41 -1.88 -0.06 0.00 0.04 0.00 0.00 34.50 32.19 1oqa s PRO 106 CO 0.46 -1.83 2.29 -1.01 0.04 0.00 0.00 177.00 176.96 1oqa s HIS 107 N -3.08 1.14 -0.17 0.56 3.76 -1.26 -4.91 115.29 111.33 1oqa s HIS 107 Ca 0.62 1.03 -0.07 0.00 -0.15 0.00 0.00 55.06 56.49 1oqa s HIS 107 Cb -0.16 -3.77 0.07 0.00 1.11 0.00 0.00 32.58 29.84 1oqa s HIS 107 CO 0.55 -3.30 0.37 0.45 -0.85 0.00 0.00 174.74 171.96 1oqa s SER 108 N 10.10 -0.20 -1.25 1.40 0.15 -1.26 -4.91 113.70 117.72 1oqa s SER 108 Ca 0.98 0.83 -0.05 0.00 0.70 0.00 0.00 55.95 58.42 1oqa s SER 108 Cb -0.25 0.95 0.01 0.00 -1.71 0.00 0.00 66.02 65.01 1oqa s SER 108 CO 0.31 -0.22 1.07 1.41 1.20 0.00 0.00 173.24 177.01 1oqa n HIS 109 N 4.94 -2.50 -1.01 3.44 8.25 -1.26 -5.22 115.22 121.85 1oqa n HIS 109 Ca -0.14 0.96 0.00 0.00 -0.26 0.00 0.00 57.72 58.28 1oqa n HIS 109 Cb 0.51 -4.97 0.00 0.00 1.12 0.00 0.00 29.99 26.66 1oqa n HIS 109 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64