#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bqh s VAL 2 N 0.00 3.82 0.55 3.15 1.01 -1.26 -0.90 120.40 126.77 2bqh s VAL 2 Ca 0.00 -1.36 -0.19 0.00 0.00 0.00 0.00 61.98 60.43 2bqh s VAL 2 Cb 0.00 -3.28 -0.06 0.00 0.00 0.00 0.00 36.38 33.04 2bqh s VAL 2 CO 0.00 -0.35 1.14 -0.36 0.00 0.00 0.00 175.10 175.52 2bqh s PHE 3 N 1.37 2.64 0.21 5.22 0.40 -0.31 -5.01 117.98 122.50 2bqh s PHE 3 Ca 0.01 1.54 -0.13 0.00 -0.60 0.00 0.00 56.93 57.75 2bqh s PHE 3 Cb -0.21 -3.31 -0.07 0.00 0.51 0.00 0.00 43.02 39.94 2bqh s PHE 3 CO 0.01 -1.63 0.59 -1.21 0.70 0.00 0.00 175.22 173.68 2bqh s GLU 4 N -3.30 3.95 0.07 0.44 2.02 -1.26 -4.89 118.70 115.74 2bqh s GLU 4 Ca 0.73 0.48 -0.14 0.00 0.02 0.00 0.00 54.97 56.06 2bqh s GLU 4 Cb -0.24 -2.76 -0.03 0.00 0.10 0.00 0.00 34.13 31.20 2bqh s GLU 4 CO 0.28 0.37 1.25 -0.09 0.02 0.00 0.00 175.26 177.08 2bqh h ARG 5 N 3.01 -0.01 -0.25 1.61 2.43 -1.96 -0.99 114.38 118.23 2bqh h ARG 5 Ca -0.48 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 58.62 2bqh h ARG 5 Cb 1.18 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.72 2bqh h ARG 5 CO 0.67 -0.00 -0.16 0.00 -1.51 0.00 0.00 179.97 178.97 2bqh h GLU 7 N 0.39 0.18 -0.57 0.00 4.81 -1.82 -1.27 114.58 116.30 2bqh h GLU 7 Ca 0.07 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.25 2bqh h GLU 7 Cb 0.51 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 2bqh h GLU 7 CO 0.03 0.12 0.20 1.25 -0.73 0.00 0.00 179.01 179.88 2bqh h LEU 8 N 0.18 0.80 -0.21 1.64 5.85 -0.73 -2.41 115.31 120.44 2bqh h LEU 8 Ca 0.11 -0.19 0.05 0.00 0.84 0.00 0.00 57.88 58.69 2bqh h LEU 8 Cb 0.08 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 40.85 2bqh h LEU 8 CO -0.12 0.78 -0.13 0.00 -0.34 0.00 0.00 178.44 178.63 2bqh h ALA 9 N 1.06 0.03 -0.85 1.25 0.00 -0.69 -0.34 119.26 119.72 2bqh h ALA 9 Ca 0.19 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 2bqh h ALA 9 Cb 0.24 0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 2bqh h ALA 9 CO -0.01 -0.55 0.44 0.00 0.00 0.00 0.00 179.25 179.12 2bqh h ARG 10 N -0.12 1.20 -0.50 0.00 3.08 -1.20 -1.84 114.38 115.01 2bqh h ARG 10 Ca 0.12 -0.16 -0.04 0.00 0.07 0.00 0.00 59.98 59.98 2bqh h ARG 10 Cb 0.30 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 30.10 2bqh h ARG 10 CO -0.28 0.90 0.17 1.15 -1.07 0.00 0.00 179.97 180.84 2bqh h THR 11 N 1.19 1.22 -0.64 2.04 2.02 -0.87 -1.27 112.91 116.59 2bqh h THR 11 Ca 0.30 -0.72 -0.07 0.00 0.77 0.00 0.00 66.41 66.68 2bqh h THR 11 Cb 0.07 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.22 2bqh h THR 11 CO -0.04 0.27 0.12 -0.07 0.37 0.00 0.00 175.52 176.17 2bqh h LEU 12 N 0.67 0.98 -0.36 2.58 3.38 -0.83 -1.81 115.31 119.92 2bqh h LEU 12 Ca 0.16 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 2bqh h LEU 12 Cb 0.24 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 2bqh h LEU 12 CO -0.01 0.97 0.16 0.50 0.09 0.00 0.00 178.44 180.15 2bqh h LYS 13 N 0.98 0.53 -0.05 1.13 3.64 -1.03 -2.00 116.57 119.78 2bqh h LYS 13 Ca 0.20 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 2bqh h LYS 13 Cb 0.39 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.12 2bqh h LYS 13 CO 0.01 0.49 -0.01 -0.09 -2.27 0.00 0.00 179.45 177.58 2bqh h ARG 14 N 0.44 0.06 -0.23 1.90 2.43 -0.98 -0.95 114.38 117.06 2bqh h ARG 14 Ca 0.12 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 2bqh h ARG 14 Cb 0.15 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 2bqh h ARG 14 CO -0.01 0.09 0.00 1.28 -1.51 0.00 0.00 179.97 179.81 2bqh n LEU 15 N -4.48 1.33 -0.88 3.80 4.77 -0.70 -4.93 117.00 115.91 2bqh n LEU 15 Ca -0.02 -0.64 -0.07 0.00 -0.03 0.00 0.00 56.01 55.24 2bqh n LEU 15 Cb 0.12 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 2bqh n LEU 15 CO 0.35 0.32 -0.07 0.61 -1.33 0.00 0.00 177.39 177.27 2bqh n GLY 16 N 0.93 0.13 0.13 -0.72 0.00 -0.36 -4.96 105.19 100.35 2bqh n GLY 16 Ca 0.10 -0.57 0.08 0.00 0.00 0.00 0.00 46.02 45.63 2bqh n GLY 16 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2bqh h MET 17 N -0.11 0.00 -6.19 1.61 2.86 -1.56 -3.41 114.93 108.13 2bqh h MET 17 Ca -0.17 0.00 -0.57 0.00 -2.06 0.00 0.00 59.70 56.90 2bqh h MET 17 Cb 1.12 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.76 2bqh h MET 17 CO 0.19 0.13 1.33 0.34 1.06 0.00 0.00 176.91 179.97 2bqh s ASP 18 N -5.75 5.76 0.00 1.22 2.15 -1.26 -1.76 116.67 117.03 2bqh s ASP 18 Ca 0.01 1.39 0.00 0.00 0.43 0.00 0.00 52.55 54.37 2bqh s ASP 18 Cb 0.08 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.18 2bqh s ASP 18 CO 0.77 -1.80 0.00 0.61 -0.17 0.00 0.00 175.17 174.58 2bqh n GLY 19 N 5.51 0.54 3.66 2.66 0.00 0.56 -4.92 105.19 113.20 2bqh n GLY 19 Ca 0.24 -0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 2bqh n GLY 19 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2bqh s TYR 20 N -2.00 1.74 -1.46 1.61 5.04 -0.72 -1.82 117.35 119.75 2bqh s TYR 20 Ca 0.00 -0.03 -0.10 0.00 -2.44 0.00 0.00 57.07 54.50 2bqh s TYR 20 Cb 0.00 -4.03 0.06 0.00 0.35 0.00 0.00 41.96 38.35 2bqh s TYR 20 CO 0.00 -4.44 0.76 0.54 -1.34 0.00 0.00 175.55 171.07 2bqh n ARG 21 N 7.27 -4.81 -1.00 4.97 5.12 -1.26 -1.30 116.66 125.65 2bqh n ARG 21 Ca 0.18 0.63 0.00 0.00 -1.93 0.00 0.00 57.85 56.73 2bqh n ARG 21 Cb 0.42 -5.47 0.00 0.00 -1.16 0.00 0.00 32.46 26.26 2bqh n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2bqh n GLY 22 N -1.50 0.57 3.57 -0.13 0.00 -0.75 -5.00 105.19 101.94 2bqh n GLY 22 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 2bqh n GLY 22 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bqh s ILE 23 N -2.32 5.29 0.73 -0.61 1.01 -0.42 -4.91 121.20 119.96 2bqh s ILE 23 Ca 0.00 0.07 -0.12 0.00 0.00 0.00 0.00 60.65 60.60 2bqh s ILE 23 Cb 0.00 -3.61 0.03 0.00 0.01 0.00 0.00 42.46 38.89 2bqh s ILE 23 CO 0.00 0.15 1.10 -0.94 0.00 0.00 0.00 174.94 175.25 2bqh s SER 24 N 1.74 4.75 0.29 3.58 1.04 -1.26 -0.32 113.70 123.51 2bqh s SER 24 Ca 0.07 1.88 -0.02 0.00 0.48 0.00 0.00 55.95 58.37 2bqh s SER 24 Cb -0.16 -2.53 0.41 0.00 0.10 0.00 0.00 66.02 63.83 2bqh s SER 24 CO 0.11 -1.87 1.90 0.25 0.98 0.00 0.00 173.24 174.61 2bqh h LEU 25 N -0.69 0.90 -1.40 2.42 5.85 -1.91 -1.60 115.31 118.87 2bqh h LEU 25 Ca -0.45 -0.08 0.08 0.00 0.84 0.00 0.00 57.88 58.28 2bqh h LEU 25 Cb 1.24 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.99 2bqh h LEU 25 CO 0.52 0.74 0.48 0.00 -0.34 0.00 0.00 178.44 179.85 2bqh h ALA 26 N 1.41 1.78 -0.16 1.25 0.00 -1.92 0.28 119.26 121.89 2bqh h ALA 26 Ca 0.25 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.93 2bqh h ALA 26 Cb 0.05 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.69 2bqh h ALA 26 CO -0.04 0.08 -0.74 -0.91 0.00 0.00 0.00 179.25 177.64 2bqh h ASN 27 N 0.69 0.90 -0.21 0.00 2.35 -1.63 -1.41 115.58 116.27 2bqh h ASN 27 Ca 0.33 -0.58 -0.07 0.00 -0.55 0.00 0.00 56.30 55.44 2bqh h ASN 27 Cb 0.39 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.48 2bqh h ASN 27 CO -0.12 1.37 -0.08 -0.50 -1.65 0.00 0.00 177.43 176.45 2bqh h TRP 28 N 0.53 0.60 -0.41 1.19 4.06 -0.92 -1.52 115.95 119.47 2bqh h TRP 28 Ca -0.04 -0.08 -0.13 0.00 2.06 0.00 0.00 58.89 60.69 2bqh h TRP 28 Cb 1.36 -0.16 -0.01 0.00 -1.00 0.00 0.00 29.16 29.35 2bqh h TRP 28 CO 0.08 0.63 -0.26 0.52 -3.56 0.00 0.00 178.44 175.85 2bqh h MET 29 N 0.52 0.90 -0.59 0.49 2.86 -0.85 -1.66 114.93 116.60 2bqh h MET 29 Ca 0.10 -0.42 -0.05 0.00 -2.06 0.00 0.00 59.70 57.27 2bqh h MET 29 Cb 0.46 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.08 2bqh h MET 29 CO 0.02 1.07 0.16 0.00 1.06 0.00 0.00 176.91 179.23 2bqh h LEU 31 N 0.85 -0.31 -1.07 0.00 5.85 -1.14 -2.41 115.31 117.08 2bqh h LEU 31 Ca 0.19 -0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.92 2bqh h LEU 31 Cb 0.32 0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.37 2bqh h LEU 31 CO -0.00 -0.16 0.63 0.00 -0.34 0.00 0.00 178.44 178.56 2bqh h ALA 32 N 0.29 1.41 -0.17 1.25 0.00 -1.22 0.93 119.26 121.75 2bqh h ALA 32 Ca -0.04 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2bqh h ALA 32 Cb 0.33 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2bqh h ALA 32 CO 0.06 0.47 0.10 -0.22 0.00 0.00 0.00 179.25 179.66 2bqh h LYS 33 N 1.16 0.23 0.00 0.00 1.63 -1.18 -1.47 116.57 116.93 2bqh h LYS 33 Ca 0.39 -0.02 -0.19 0.00 -0.85 0.00 0.00 60.65 59.98 2bqh h LYS 33 Cb 0.08 -0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 31.64 2bqh h LYS 33 CO -0.14 0.21 -0.92 -1.49 -3.45 0.00 0.00 179.45 173.66 2bqh h TRP 34 N 0.18 0.00 -0.04 1.91 4.06 -1.15 -1.62 115.95 119.29 2bqh h TRP 34 Ca 0.06 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 60.94 2bqh h TRP 34 Cb 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.21 2bqh h TRP 34 CO -0.05 0.92 -0.25 0.93 -3.56 0.00 0.00 178.44 176.43 2bqh h GLU 35 N 0.00 0.24 0.00 0.49 4.39 -0.79 -3.42 114.58 115.50 2bqh h GLU 35 Ca -0.01 -0.21 0.00 0.00 0.34 0.00 0.00 59.36 59.48 2bqh h GLU 35 Cb 1.71 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 30.40 2bqh h GLU 35 CO 0.12 0.87 0.00 -1.13 -1.16 0.00 0.00 179.01 177.71 2bqh n SER 36 N -4.50 0.09 -1.12 1.42 3.41 -0.60 -4.86 113.62 107.46 2bqh n SER 36 Ca -0.09 -0.45 -0.08 0.00 -0.26 0.00 0.00 58.87 57.99 2bqh n SER 36 Cb 0.47 0.16 0.00 0.00 -0.26 0.00 0.00 64.21 64.59 2bqh n SER 36 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bqh n GLY 37 N 0.16 0.12 2.42 5.00 0.00 -0.61 -3.07 105.19 109.20 2bqh n GLY 37 Ca 0.00 -0.49 -0.18 0.00 0.00 0.00 0.00 46.02 45.35 2bqh n GLY 37 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2bqh n TYR 38 N -3.88 -0.98 -3.74 1.61 4.01 -1.14 -4.80 117.16 108.24 2bqh n TYR 38 Ca -0.07 0.07 -0.37 0.00 -0.16 0.00 0.00 57.90 57.36 2bqh n TYR 38 Cb 0.56 -3.65 -0.12 0.00 -0.31 0.00 0.00 39.34 35.82 2bqh n TYR 38 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 2bqh s ASN 39 N -2.26 5.20 0.50 7.72 2.47 -1.18 -1.16 114.94 126.24 2bqh s ASN 39 Ca 0.04 -0.42 0.29 0.00 0.42 0.00 0.00 52.86 53.19 2bqh s ASN 39 Cb -0.02 -1.93 1.20 0.00 -1.45 0.00 0.00 41.25 39.06 2bqh s ASN 39 CO 0.05 -0.11 1.93 0.71 -3.72 0.00 0.00 177.10 175.96 2bqh h THR 40 N 5.66 0.32 -0.70 -5.21 1.35 -1.35 -3.08 112.91 109.91 2bqh h THR 40 Ca -0.35 -0.78 0.00 0.00 -0.55 0.00 0.00 66.41 64.73 2bqh h THR 40 Cb 1.15 1.59 0.00 0.00 -1.73 0.00 0.00 68.15 69.17 2bqh h THR 40 CO 0.59 0.12 0.00 -2.11 -0.25 0.00 0.00 175.52 173.87 2bqh n ARG 41 N -3.30 3.10 -1.96 4.72 1.85 -1.26 -3.99 116.66 115.82 2bqh n ARG 41 Ca -0.00 -2.75 -0.42 0.00 -1.00 0.00 0.00 57.85 53.68 2bqh n ARG 41 Cb 0.35 -1.68 -0.03 0.00 -1.05 0.00 0.00 32.46 30.04 2bqh n ARG 41 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2bqh s ALA 42 N -1.30 3.75 0.04 2.89 0.00 -1.17 -4.80 121.76 121.17 2bqh s ALA 42 Ca 0.50 1.34 0.03 0.00 0.00 0.00 0.00 51.96 53.83 2bqh s ALA 42 Cb 0.28 -3.61 -0.02 0.00 0.00 0.00 0.00 23.12 19.77 2bqh s ALA 42 CO 0.30 -0.76 -0.10 0.95 0.00 0.00 0.00 175.76 176.15 2bqh s THR 43 N 1.09 0.74 -0.17 0.00 -4.23 -1.26 -0.51 115.64 111.30 2bqh s THR 43 Ca 0.69 -1.01 -0.04 0.00 -1.18 0.00 0.00 61.69 60.15 2bqh s THR 43 Cb -0.43 -0.74 0.08 0.00 1.34 0.00 0.00 72.50 72.76 2bqh s THR 43 CO 0.32 -0.23 0.26 0.21 -0.54 0.00 0.00 174.62 174.64 2bqh s ASN 44 N -1.37 0.76 0.02 3.99 2.47 -0.56 -4.96 114.94 115.29 2bqh s ASN 44 Ca -0.05 0.21 -0.26 0.00 0.42 0.00 0.00 52.86 53.18 2bqh s ASN 44 Cb -0.09 0.62 -0.05 0.00 -1.45 0.00 0.00 41.25 40.28 2bqh s ASN 44 CO 0.01 -0.28 0.81 -0.47 -3.72 0.00 0.00 177.10 173.45 2bqh s TYR 45 N 2.40 3.69 -0.58 0.43 5.04 -1.26 -0.37 117.35 126.70 2bqh s TYR 45 Ca 0.05 1.50 -0.11 0.00 -2.44 0.00 0.00 57.07 56.07 2bqh s TYR 45 Cb -0.14 -2.90 0.15 0.00 0.35 0.00 0.00 41.96 39.42 2bqh s TYR 45 CO -0.11 0.17 0.48 -0.80 -1.34 0.00 0.00 175.55 173.95 2bqh s ASN 46 N 0.35 6.00 0.54 4.32 0.01 0.77 -4.92 114.94 122.02 2bqh s ASN 46 Ca 0.42 -2.13 0.22 0.00 -0.71 0.00 0.00 52.86 50.66 2bqh s ASN 46 Cb -0.20 -2.09 1.43 0.00 0.41 0.00 0.00 41.25 40.80 2bqh s ASN 46 CO 0.24 -0.69 2.13 0.00 -1.51 0.00 0.00 177.10 177.27 2bqh h ALA 47 N 8.30 2.00 -0.55 0.60 0.00 -1.96 0.86 119.26 128.52 2bqh h ALA 47 Ca -0.15 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2bqh h ALA 47 Cb 1.06 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 2bqh h ALA 47 CO 0.88 -0.17 0.27 0.78 0.00 0.00 0.00 179.25 181.00 2bqh h GLY 48 N 0.00 0.84 0.00 0.00 0.00 -1.95 -3.30 103.07 98.66 2bqh h GLY 48 Ca 0.06 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.98 2bqh h GLY 48 CO -0.00 0.40 0.00 2.09 0.00 0.00 0.00 176.54 179.02 2bqh n ASP 49 N -4.57 1.61 -1.52 0.19 5.75 -1.14 -5.02 116.55 111.85 2bqh n ASP 49 Ca 0.03 -1.67 -0.14 0.00 -0.01 0.00 0.00 54.79 53.01 2bqh n ASP 49 Cb 0.12 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.20 2bqh n ASP 49 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2bqh n ARG 50 N -0.33 -1.07 -3.94 0.11 1.74 0.28 -4.79 116.66 108.65 2bqh n ARG 50 Ca 0.00 0.67 -0.23 0.00 -0.77 0.00 0.00 57.85 57.52 2bqh n ARG 50 Cb 0.19 -4.92 -0.06 0.00 -1.02 0.00 0.00 32.46 26.66 2bqh n ARG 50 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2bqh s SER 51 N -2.41 4.74 0.00 0.55 1.04 -1.16 -4.49 113.70 111.98 2bqh s SER 51 Ca 0.00 -0.84 0.03 0.00 0.48 0.00 0.00 55.95 55.62 2bqh s SER 51 Cb 0.00 -0.63 -0.01 0.00 0.10 0.00 0.00 66.02 65.48 2bqh s SER 51 CO 0.00 -0.47 -0.09 -0.89 0.98 0.00 0.00 173.24 172.76 2bqh s THR 52 N -2.48 0.74 -0.17 2.02 2.01 -1.26 -0.16 115.64 116.33 2bqh s THR 52 Ca 0.42 -0.52 -0.11 0.00 0.31 0.00 0.00 61.69 61.78 2bqh s THR 52 Cb -0.01 -0.65 -0.05 0.00 0.01 0.00 0.00 72.50 71.81 2bqh s THR 52 CO 0.24 0.12 0.19 -1.81 -0.69 0.00 0.00 174.62 172.68 2bqh s ASP 53 N -0.46 6.32 -0.06 3.53 1.01 0.50 -1.44 116.67 126.07 2bqh s ASP 53 Ca 0.02 0.37 0.06 0.00 0.71 0.00 0.00 52.55 53.71 2bqh s ASP 53 Cb -0.05 -2.12 -0.01 0.00 1.01 0.00 0.00 42.92 41.75 2bqh s ASP 53 CO -0.00 0.18 -0.24 -0.31 0.21 0.00 0.00 175.17 175.01 2bqh s TYR 54 N 0.20 2.41 0.00 4.23 1.51 0.13 -1.49 117.35 124.34 2bqh s TYR 54 Ca 0.12 -0.76 0.00 0.00 -1.01 0.00 0.00 57.07 55.43 2bqh s TYR 54 Cb -0.12 -1.59 0.00 0.00 -0.11 0.00 0.00 41.96 40.14 2bqh s TYR 54 CO 0.01 -0.24 0.00 0.41 -1.11 0.00 0.00 175.55 174.62 2bqh n GLY 55 N 3.04 -2.21 0.34 0.71 0.00 0.33 -1.56 105.19 105.84 2bqh n GLY 55 Ca -0.18 -1.57 0.11 0.00 0.00 0.00 0.00 46.02 44.38 2bqh n GLY 55 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2bqh h ILE 56 N 0.00 0.93 -0.23 -0.61 2.10 -1.67 -1.49 117.51 116.54 2bqh h ILE 56 Ca 0.00 -0.13 0.00 0.00 1.08 0.00 0.00 64.86 65.81 2bqh h ILE 56 Cb 0.00 0.50 0.00 0.00 -1.09 0.00 0.00 36.82 36.23 2bqh h ILE 56 CO 0.00 0.07 0.00 0.49 -1.08 0.00 0.00 178.15 177.63 2bqh n PHE 57 N -4.47 0.29 -3.52 2.19 3.72 -1.26 -3.93 117.46 110.48 2bqh n PHE 57 Ca 0.08 -0.17 -0.19 0.00 -0.05 0.00 0.00 57.45 57.12 2bqh n PHE 57 Cb 0.32 -0.00 0.02 0.00 -0.94 0.00 0.00 39.48 38.87 2bqh n PHE 57 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 2bqh n GLN 58 N 1.24 -1.36 -3.04 -1.08 1.13 -0.56 -4.92 117.38 108.78 2bqh n GLN 58 Ca 0.15 0.88 -0.40 0.00 -1.94 0.00 0.00 57.00 55.69 2bqh n GLN 58 Cb 0.54 -4.11 -0.05 0.00 0.11 0.00 0.00 30.24 26.73 2bqh n GLN 58 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2bqh s ILE 59 N -3.18 5.04 0.10 5.09 1.01 -0.60 -4.54 121.20 124.12 2bqh s ILE 59 Ca 0.19 1.44 -0.30 0.00 0.00 0.00 0.00 60.65 61.97 2bqh s ILE 59 Cb -0.06 -4.04 -0.06 0.00 0.01 0.00 0.00 42.46 38.31 2bqh s ILE 59 CO 0.84 0.24 1.02 0.21 0.00 0.00 0.00 174.94 177.24 2bqh s ASN 60 N 0.83 7.38 0.36 3.58 3.84 -1.26 -0.69 114.94 128.97 2bqh s ASN 60 Ca 0.37 1.86 0.27 0.00 0.21 0.00 0.00 52.86 55.57 2bqh s ASN 60 Cb -0.18 -2.59 1.14 0.00 -0.55 0.00 0.00 41.25 39.07 2bqh s ASN 60 CO 0.17 -0.18 1.81 0.77 -2.79 0.00 0.00 177.10 176.88 2bqh h SER 61 N 5.82 0.00 0.52 -4.21 4.64 -1.45 -1.97 113.55 116.90 2bqh h SER 61 Ca -0.43 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.74 2bqh h SER 61 Cb 1.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 2bqh h SER 61 CO 0.74 0.00 -0.68 -0.09 -0.87 0.00 0.00 176.83 175.93 2bqh h ARG 62 N 0.00 0.14 0.00 4.77 2.43 -1.84 -3.40 114.38 116.47 2bqh h ARG 62 Ca 0.00 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.06 2bqh h ARG 62 Cb 0.39 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 2bqh h ARG 62 CO 0.00 0.76 -0.77 0.66 -1.51 0.00 0.00 179.97 179.11 2bqh n TYR 63 N -3.78 0.00 -0.05 2.20 4.02 -1.18 0.13 117.16 118.50 2bqh n TYR 63 Ca -0.02 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.86 2bqh n TYR 63 Cb 0.67 0.00 -0.13 0.00 -0.02 0.00 0.00 39.34 39.86 2bqh n TYR 63 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 176.86 176.76 2bqh n TRP 64 N -1.61 0.00 -3.97 -0.72 7.02 -0.75 0.18 117.44 117.59 2bqh n TRP 64 Ca 0.00 0.00 -0.08 0.00 -1.02 0.00 0.00 57.50 56.40 2bqh n TRP 64 Cb 0.35 -0.60 -0.09 0.00 -2.42 0.00 0.00 31.31 28.55 2bqh n TRP 64 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2bqh s ASN 66 N -2.83 5.19 0.00 0.00 2.47 -0.24 -4.41 114.94 115.12 2bqh s ASN 66 Ca 0.05 -0.07 0.00 0.00 0.42 0.00 0.00 52.86 53.26 2bqh s ASN 66 Cb 0.06 -1.89 0.00 0.00 -1.45 0.00 0.00 41.25 37.97 2bqh s ASN 66 CO -0.10 0.12 0.73 -0.90 -3.72 0.00 0.00 177.10 173.23 2bqh n ASP 67 N 3.89 1.33 0.00 -4.21 5.75 -1.26 -1.55 116.55 120.50 2bqh n ASP 67 Ca -0.17 -1.53 0.00 0.00 -0.01 0.00 0.00 54.79 53.09 2bqh n ASP 67 Cb 0.52 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.61 2bqh n ASP 67 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2bqh n GLY 68 N -0.26 1.27 0.88 6.12 0.00 -1.26 -4.65 105.19 107.28 2bqh n GLY 68 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 2bqh n GLY 68 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2bqh n LYS 69 N -0.00 2.18 -3.22 1.61 2.85 -1.26 -4.88 118.16 115.43 2bqh n LYS 69 Ca 0.00 -1.75 -0.41 0.00 -1.05 0.00 0.00 58.31 55.11 2bqh n LYS 69 Cb 0.00 -1.47 -0.08 0.00 -0.65 0.00 0.00 35.03 32.84 2bqh n LYS 69 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 2bqh s THR 70 N -1.77 5.03 0.19 0.58 2.01 -1.26 -4.98 115.64 115.43 2bqh s THR 70 Ca 0.34 0.64 -0.33 0.00 0.31 0.00 0.00 61.69 62.65 2bqh s THR 70 Cb 0.21 -3.91 -0.14 0.00 0.01 0.00 0.00 72.50 68.67 2bqh s THR 70 CO 0.30 -0.08 1.55 -2.65 -0.69 0.00 0.00 174.62 173.05 2bqh n PRO 71 N 5.68 2.19 -3.94 4.92 -0.02 -1.26 -2.98 135.00 139.58 2bqh n PRO 71 Ca -0.04 0.79 -0.27 0.00 -2.02 0.00 0.00 63.50 61.95 2bqh n PRO 71 Cb 0.49 -2.53 -0.00 0.00 -0.02 0.00 0.00 33.50 31.44 2bqh n PRO 71 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bqh n GLY 72 N 3.07 -0.32 3.90 -1.23 0.00 -1.26 -4.96 105.19 104.39 2bqh n GLY 72 Ca 0.15 0.15 -0.29 0.00 0.00 0.00 0.00 46.02 46.03 2bqh n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bqh s ALA 73 N -3.69 3.59 0.29 4.61 0.00 -1.16 -4.98 121.76 120.43 2bqh s ALA 73 Ca 0.23 -0.50 0.06 0.00 0.00 0.00 0.00 51.96 51.75 2bqh s ALA 73 Cb -0.12 -2.35 -0.06 0.00 0.00 0.00 0.00 23.12 20.59 2bqh s ALA 73 CO 0.87 0.25 -0.04 0.14 0.00 0.00 0.00 175.76 176.98 2bqh s VAL 74 N -2.08 1.60 -0.48 0.00 -7.23 0.12 -5.01 120.40 107.31 2bqh s VAL 74 Ca 0.45 -2.10 0.03 0.00 -1.81 0.00 0.00 61.98 58.55 2bqh s VAL 74 Cb -0.11 -2.54 0.14 0.00 0.56 0.00 0.00 36.38 34.44 2bqh s VAL 74 CO 0.29 -0.23 0.28 0.21 -0.31 0.00 0.00 175.10 175.34 2bqh s ASN 75 N -3.47 3.70 -0.02 4.85 3.84 -1.25 -3.75 114.94 118.85 2bqh s ASN 75 Ca 0.31 -2.87 -0.25 0.00 0.21 0.00 0.00 52.86 50.26 2bqh s ASN 75 Cb 0.05 -1.14 -0.19 0.00 -0.55 0.00 0.00 41.25 39.42 2bqh s ASN 75 CO 0.13 -0.23 1.23 0.00 -2.79 0.00 0.00 177.10 175.44 2bqh h ALA 76 N 6.44 -0.10 -0.25 1.71 0.00 -0.45 -3.16 119.26 123.44 2bqh h ALA 76 Ca 0.02 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.62 2bqh h ALA 76 Cb 0.90 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 2bqh h ALA 76 CO 0.53 -0.33 -0.24 0.00 0.00 0.00 0.00 179.25 179.21 2bqh h ALA 77 N 0.29 1.12 0.00 0.00 0.00 -1.71 -3.47 119.26 115.48 2bqh h ALA 77 Ca -0.01 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2bqh h ALA 77 Cb 0.48 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2bqh h ALA 77 CO 0.02 0.55 0.00 0.72 0.00 0.00 0.00 179.25 180.54 2bqh n HIS 78 N -4.13 0.00 -4.05 0.00 -0.00 -1.20 -5.04 115.22 100.81 2bqh n HIS 78 Ca -0.00 0.00 -0.22 0.00 -0.00 0.00 0.00 57.72 57.50 2bqh n HIS 78 Cb 0.40 -0.71 -0.04 0.00 -0.00 0.00 0.00 29.99 29.63 2bqh n HIS 78 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 2bqh s LEU 79 N 0.00 3.69 0.15 2.41 1.43 -1.26 -4.99 118.68 120.10 2bqh s LEU 79 Ca 0.00 -0.37 -0.25 0.00 -1.03 0.00 0.00 54.13 52.49 2bqh s LEU 79 Cb 0.00 -2.24 -0.08 0.00 0.03 0.00 0.00 46.19 43.90 2bqh s LEU 79 CO 0.00 -0.13 0.75 -0.55 0.23 0.00 0.00 176.35 176.65 2bqh s SER 80 N -3.87 7.35 0.66 2.29 0.15 -1.26 -1.08 113.70 117.93 2bqh s SER 80 Ca 0.35 1.59 0.44 0.00 0.70 0.00 0.00 55.95 59.04 2bqh s SER 80 Cb -0.07 -2.48 2.39 0.00 -1.71 0.00 0.00 66.02 64.15 2bqh s SER 80 CO 0.25 0.21 2.36 0.00 1.20 0.00 0.00 173.24 177.26 2bqh h SER 82 N 0.00 0.99 -0.00 0.00 0.87 -1.91 -1.83 113.55 111.66 2bqh h SER 82 Ca -0.00 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.54 2bqh h SER 82 Cb 0.03 -0.25 -0.00 0.00 -0.44 0.00 0.00 62.40 61.74 2bqh h SER 82 CO 0.00 0.71 0.01 0.00 -0.53 0.00 0.00 176.83 177.02 2bqh h ALA 83 N 1.46 1.31 -0.37 6.23 0.00 -1.71 -2.11 119.26 124.06 2bqh h ALA 83 Ca 0.31 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.22 2bqh h ALA 83 Cb -0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2bqh h ALA 83 CO -0.07 -0.01 0.00 1.28 0.00 0.00 0.00 179.25 180.45 2bqh n LEU 84 N -3.51 2.02 -0.13 0.00 4.77 -0.69 -3.60 117.00 115.87 2bqh n LEU 84 Ca -0.03 -1.01 0.02 0.00 -0.03 0.00 0.00 56.01 54.96 2bqh n LEU 84 Cb 0.08 -0.25 0.04 0.00 -2.33 0.00 0.00 43.42 40.96 2bqh n LEU 84 CO 0.24 0.50 0.53 0.18 -1.33 0.00 0.00 177.39 177.51 2bqh n LEU 85 N 0.59 2.20 -4.84 2.23 4.77 -0.79 -3.35 117.00 117.81 2bqh n LEU 85 Ca 0.13 -2.06 -0.31 0.00 -0.03 0.00 0.00 56.01 53.74 2bqh n LEU 85 Cb 0.32 -0.07 0.03 0.00 -2.33 0.00 0.00 43.42 41.37 2bqh n LEU 85 CO 0.09 0.55 0.71 -1.10 -1.33 0.00 0.00 177.39 176.31 2bqh s GLN 86 N -1.10 3.31 0.20 3.23 -0.21 -1.24 -4.59 119.66 119.27 2bqh s GLN 86 Ca 0.06 0.87 0.05 0.00 0.02 0.00 0.00 55.36 56.36 2bqh s GLN 86 Cb 0.04 -2.04 0.13 0.00 1.00 0.00 0.00 33.01 32.13 2bqh s GLN 86 CO 0.03 -0.80 1.47 -0.44 -2.12 0.00 0.00 175.29 173.43 2bqh h ASP 87 N -0.40 0.18 -3.20 5.90 3.32 -1.93 -3.42 116.42 116.87 2bqh h ASP 87 Ca -0.44 -0.13 -0.59 0.00 0.02 0.00 0.00 57.03 55.89 2bqh h ASP 87 Cb 1.20 -0.05 -0.08 0.00 0.22 0.00 0.00 39.33 40.62 2bqh h ASP 87 CO 0.59 0.87 0.60 0.21 -1.72 0.00 0.00 179.24 179.79 2bqh s ASN 88 N -6.88 6.94 -0.05 6.45 3.84 -1.26 -4.90 114.94 119.07 2bqh s ASN 88 Ca -0.02 1.17 0.09 0.00 0.21 0.00 0.00 52.86 54.30 2bqh s ASN 88 Cb 0.11 -2.48 0.34 0.00 -0.55 0.00 0.00 41.25 38.67 2bqh s ASN 88 CO 0.80 -0.58 1.17 2.30 -2.79 0.00 0.00 177.10 178.01 2bqh n ILE 89 N 5.28 0.82 -0.13 -5.21 -5.35 -1.26 -4.44 119.36 109.08 2bqh n ILE 89 Ca 0.08 -0.54 -0.05 0.00 -0.27 0.00 0.00 62.75 61.98 2bqh n ILE 89 Cb 0.47 -0.05 0.04 0.00 -1.74 0.00 0.00 39.64 38.35 2bqh n ILE 89 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2bqh h ALA 90 N 3.31 0.50 -0.27 -1.28 0.00 -1.95 -0.02 119.26 119.55 2bqh h ALA 90 Ca 0.00 0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 2bqh h ALA 90 Cb 0.78 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 2bqh h ALA 90 CO 0.10 -0.25 -0.36 -0.44 0.00 0.00 0.00 179.25 178.30 2bqh h ASP 91 N 0.30 0.63 -0.47 0.00 3.32 -1.87 -1.21 116.42 117.12 2bqh h ASP 91 Ca 0.20 -0.26 -0.08 0.00 0.02 0.00 0.00 57.03 56.91 2bqh h ASP 91 Cb 0.21 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 2bqh h ASP 91 CO -0.22 0.93 0.02 0.00 -1.72 0.00 0.00 179.24 178.26 2bqh h ALA 92 N 1.10 1.04 -0.25 3.45 0.00 -1.70 -0.66 119.26 122.24 2bqh h ALA 92 Ca 0.05 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.60 2bqh h ALA 92 Cb 0.85 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 2bqh h ALA 92 CO 0.07 0.60 -0.21 0.28 0.00 0.00 0.00 179.25 180.00 2bqh h VAL 93 N 0.82 1.31 -0.51 0.00 2.07 -0.79 -0.07 116.25 119.08 2bqh h VAL 93 Ca 0.16 -1.35 -0.04 0.00 0.82 0.00 0.00 66.70 66.29 2bqh h VAL 93 Cb 0.46 1.63 -0.02 0.00 -1.52 0.00 0.00 31.29 31.83 2bqh h VAL 93 CO 0.02 0.42 0.15 0.00 0.02 0.00 0.00 177.57 178.18 2bqh h ALA 94 N 0.69 1.30 -0.26 1.67 0.00 -0.98 -1.28 119.26 120.41 2bqh h ALA 94 Ca 0.05 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 2bqh h ALA 94 Cb 0.75 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2bqh h ALA 94 CO 0.05 0.50 -0.02 0.00 0.00 0.00 0.00 179.25 179.78 2bqh h ALA 95 N 1.42 0.35 -0.63 0.00 0.00 -0.96 -2.42 119.26 117.02 2bqh h ALA 95 Ca 0.17 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2bqh h ALA 95 Cb 0.24 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2bqh h ALA 95 CO -0.01 0.11 0.40 0.00 0.00 0.00 0.00 179.25 179.75 2bqh h ALA 96 N 0.80 1.53 -0.64 0.00 0.00 -0.61 -1.53 119.26 118.82 2bqh h ALA 96 Ca 0.07 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 2bqh h ALA 96 Cb 0.45 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 2bqh h ALA 96 CO 0.02 0.43 0.11 0.87 0.00 0.00 0.00 179.25 180.67 2bqh h LYS 97 N 0.85 1.05 -0.50 0.00 1.57 -1.08 -2.73 116.57 115.74 2bqh h LYS 97 Ca 0.23 -0.28 -0.03 0.00 -1.87 0.00 0.00 60.65 58.70 2bqh h LYS 97 Cb -0.08 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.09 2bqh h LYS 97 CO -0.05 0.98 0.20 -0.09 -0.57 0.00 0.00 179.45 179.92 2bqh h ARG 98 N 0.97 0.74 -0.34 3.15 9.65 -0.90 -2.73 114.38 124.92 2bqh h ARG 98 Ca 0.19 -0.13 0.05 0.00 -1.10 0.00 0.00 59.98 59.00 2bqh h ARG 98 Cb 0.43 -0.12 -0.05 0.00 -1.39 0.00 0.00 29.97 28.84 2bqh h ARG 98 CO 0.01 0.66 0.05 0.28 2.80 0.00 0.00 179.97 183.77 2bqh h VAL 99 N 0.66 0.81 0.00 0.20 2.07 -1.09 -2.20 116.25 116.71 2bqh h VAL 99 Ca 0.17 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.63 2bqh h VAL 99 Cb 0.19 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 2bqh h VAL 99 CO -0.01 0.03 0.00 1.33 0.02 0.00 0.00 177.57 178.93 2bqh n VAL 100 N -5.12 0.07 1.39 2.57 0.24 -1.05 -2.58 118.33 113.86 2bqh n VAL 100 Ca 0.01 0.02 0.15 0.00 -2.04 0.00 0.00 64.34 62.48 2bqh n VAL 100 Cb 0.16 -0.61 0.74 0.00 -1.47 0.00 0.00 33.84 32.66 2bqh n VAL 100 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2bqh n ARG 101 N -1.09 0.40 -3.06 7.34 1.74 -0.83 -4.28 116.66 116.89 2bqh n ARG 101 Ca 0.17 -0.01 -0.31 0.00 -0.77 0.00 0.00 57.85 56.93 2bqh n ARG 101 Cb 0.12 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.02 2bqh n ARG 101 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2bqh s ASP 102 N -2.60 6.61 0.48 0.55 1.11 -1.07 -4.99 116.67 116.75 2bqh s ASP 102 Ca 0.27 1.11 0.27 0.00 0.18 0.00 0.00 52.55 54.39 2bqh s ASP 102 Cb 0.20 -2.31 1.33 0.00 1.07 0.00 0.00 42.92 43.21 2bqh s ASP 102 CO 0.47 -0.28 1.81 1.55 1.18 0.00 0.00 175.17 179.90 2bqh h PRO 103 N 1.76 0.18 -0.14 8.23 0.13 -1.89 -0.85 132.00 139.42 2bqh h PRO 103 Ca -0.47 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 64.61 2bqh h PRO 103 Cb 1.18 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 2bqh h PRO 103 CO 0.65 0.12 -0.07 1.96 -0.23 0.00 0.00 178.00 180.43 2bqh h GLN 104 N 0.19 0.21 0.00 0.86 4.20 -1.91 -3.48 115.11 115.18 2bqh h GLN 104 Ca 0.54 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 59.22 2bqh h GLN 104 Cb 1.78 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 29.52 2bqh h GLN 104 CO -0.13 0.29 0.00 0.41 -0.67 0.00 0.00 178.83 178.73 2bqh n GLY 105 N -1.07 2.06 0.29 3.46 0.00 -0.33 -2.32 105.19 107.28 2bqh n GLY 105 Ca -0.01 -0.56 0.19 0.00 0.00 0.00 0.00 46.02 45.65 2bqh n GLY 105 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2bqh h ILE 106 N 0.00 0.00 0.00 -0.61 6.09 -1.90 -2.61 117.51 118.47 2bqh h ILE 106 Ca 0.00 -0.23 0.00 0.00 -1.37 0.00 0.00 64.86 63.26 2bqh h ILE 106 Cb 0.00 1.18 0.00 0.00 0.47 0.00 0.00 36.82 38.47 2bqh h ILE 106 CO 0.00 0.00 0.00 0.54 -3.07 0.00 0.00 178.15 175.62 2bqh n ARG 107 N -2.99 0.10 0.27 2.19 1.74 -0.98 -2.81 116.66 114.19 2bqh n ARG 107 Ca -0.01 0.22 0.11 0.00 -0.77 0.00 0.00 57.85 57.40 2bqh n ARG 107 Cb 0.17 -1.50 0.75 0.00 -1.02 0.00 0.00 32.46 30.86 2bqh n ARG 107 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2bqh h ALA 108 N 2.52 1.60 -2.67 7.54 0.00 -1.63 -3.39 119.26 123.23 2bqh h ALA 108 Ca 0.00 -0.05 -0.64 0.00 0.00 0.00 0.00 54.91 54.22 2bqh h ALA 108 Cb 0.16 -0.01 -0.15 0.00 0.00 0.00 0.00 17.79 17.79 2bqh h ALA 108 CO 0.00 0.07 -0.23 -1.58 0.00 0.00 0.00 179.25 177.52 2bqh s TRP 109 N -4.63 3.23 0.22 0.00 0.51 -1.12 -4.96 118.94 112.19 2bqh s TRP 109 Ca -0.04 0.31 -0.08 0.00 -2.12 0.00 0.00 56.10 54.16 2bqh s TRP 109 Cb 0.15 -2.62 0.25 0.00 -0.81 0.00 0.00 33.47 30.44 2bqh s TRP 109 CO 0.61 -0.30 1.84 0.00 -0.51 0.00 0.00 176.95 178.59 2bqh h ALA 110 N 8.25 1.00 -0.87 0.98 0.00 -1.89 -2.19 119.26 124.54 2bqh h ALA 110 Ca -0.31 -0.01 0.12 0.00 0.00 0.00 0.00 54.91 54.71 2bqh h ALA 110 Cb 1.16 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.68 2bqh h ALA 110 CO 0.66 0.20 0.56 0.00 0.00 0.00 0.00 179.25 180.67 2bqh h ALA 111 N 1.35 1.77 -0.45 0.00 0.00 -1.95 -1.95 119.26 118.04 2bqh h ALA 111 Ca 0.32 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 2bqh h ALA 111 Cb 0.11 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2bqh h ALA 111 CO -0.15 0.02 0.25 2.35 0.00 0.00 0.00 179.25 181.72 2bqh h TRP 112 N 0.74 0.61 -0.78 0.00 7.01 -1.71 -0.82 115.95 120.99 2bqh h TRP 112 Ca 0.42 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.40 2bqh h TRP 112 Cb 0.58 -0.20 -0.04 0.00 -2.10 0.00 0.00 29.16 27.41 2bqh h TRP 112 CO -0.00 0.45 0.45 0.00 -2.79 0.00 0.00 178.44 176.55 2bqh h ARG 113 N 0.59 1.07 -0.22 2.65 -0.00 -1.41 0.18 114.38 117.24 2bqh h ARG 113 Ca 0.16 -0.11 -0.13 0.00 -0.50 0.00 0.00 59.98 59.40 2bqh h ARG 113 Cb 0.03 -0.22 -0.00 0.00 0.00 0.00 0.00 29.97 29.79 2bqh h ARG 113 CO -0.03 0.77 -0.37 -0.91 0.00 0.00 0.00 179.97 179.44 2bqh h ASN 114 N 1.07 0.70 -0.00 7.04 2.35 -1.26 -3.36 115.58 122.11 2bqh h ASN 114 Ca 0.28 -0.53 0.00 0.00 -0.55 0.00 0.00 56.30 55.50 2bqh h ASN 114 Cb -0.01 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.16 2bqh h ASN 114 CO -0.05 1.10 -0.10 -2.11 -1.65 0.00 0.00 177.43 174.62 2bqh n ARG 115 N -4.26 2.43 0.00 0.81 0.00 -0.33 -4.87 116.66 110.44 2bqh n ARG 115 Ca -0.05 -0.42 0.00 0.00 -0.00 0.00 0.00 57.85 57.37 2bqh n ARG 115 Cb 0.52 -0.91 0.00 0.00 -0.00 0.00 0.00 32.46 32.06 2bqh n ARG 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2bqh n GLN 117 N -2.78 2.05 -2.15 0.00 7.27 -0.24 -2.12 117.38 119.40 2bqh n GLN 117 Ca 0.00 0.73 -0.21 0.00 0.07 0.00 0.00 57.00 57.59 2bqh n GLN 117 Cb 0.50 -2.41 -0.03 0.00 2.41 0.00 0.00 30.24 30.71 2bqh n GLN 117 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 2bqh n ASN 118 N 2.35 -5.80 -4.55 1.69 5.03 -1.26 -4.95 115.26 107.77 2bqh n ASN 118 Ca 0.12 0.15 -0.26 0.00 0.87 0.00 0.00 54.58 55.47 2bqh n ASN 118 Cb 0.31 -4.92 -0.11 0.00 -1.02 0.00 0.00 39.78 34.05 2bqh n ASN 118 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 2bqh s ARG 119 N -4.65 1.81 -0.62 3.52 0.52 -0.90 -5.08 118.95 113.55 2bqh s ARG 119 Ca 0.00 -1.96 -0.26 0.00 -0.52 0.00 0.00 55.73 52.99 2bqh s ARG 119 Cb 0.00 -1.59 0.04 0.00 0.52 0.00 0.00 34.95 33.92 2bqh s ARG 119 CO 0.00 0.07 1.10 0.34 0.02 0.00 0.00 175.30 176.83 2bqh s ASP 120 N -3.61 6.30 0.00 0.23 2.15 -1.26 -4.87 116.67 115.61 2bqh s ASP 120 Ca 0.33 -0.35 0.21 0.00 0.43 0.00 0.00 52.55 53.17 2bqh s ASP 120 Cb 0.05 -2.50 0.54 0.00 -0.30 0.00 0.00 42.92 40.71 2bqh s ASP 120 CO 0.16 -1.49 1.46 1.33 -0.17 0.00 0.00 175.17 176.46 2bqh n VAL 121 N 6.33 0.84 -0.16 1.11 0.24 -1.26 -4.53 118.33 120.90 2bqh n VAL 121 Ca 0.03 -0.92 0.09 0.00 -2.04 0.00 0.00 64.34 61.50 2bqh n VAL 121 Cb 0.48 0.65 0.41 0.00 -1.47 0.00 0.00 33.84 33.91 2bqh n VAL 121 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 2bqh h ARG 122 N 4.05 0.59 -0.89 7.34 3.08 -1.92 -2.02 114.38 124.61 2bqh h ARG 122 Ca 0.00 -0.04 0.26 0.00 0.07 0.00 0.00 59.98 60.27 2bqh h ARG 122 Cb 0.95 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.83 2bqh h ARG 122 CO 0.00 0.39 0.65 -0.56 -1.07 0.00 0.00 179.97 179.39 2bqh h GLN 123 N 0.61 0.00 0.00 0.04 3.07 -1.97 -1.24 115.11 115.63 2bqh h GLN 123 Ca 0.32 0.00 -0.08 0.00 0.09 0.00 0.00 58.65 58.98 2bqh h GLN 123 Cb 0.43 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.98 2bqh h GLN 123 CO -0.11 0.00 -0.37 1.88 0.09 0.00 0.00 178.83 180.32 2bqh h TYR 124 N 0.00 0.00 -0.02 0.06 0.05 -1.70 -3.27 116.97 112.09 2bqh h TYR 124 Ca 0.42 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.20 2bqh h TYR 124 Cb 1.73 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.47 2bqh h TYR 124 CO 0.00 0.37 0.00 1.33 -1.05 0.00 0.00 178.16 178.81 2bqh n VAL 125 N -3.81 0.10 -1.94 -2.88 0.24 -0.58 -4.84 118.33 104.62 2bqh n VAL 125 Ca -0.01 -0.55 -0.42 0.00 -2.04 0.00 0.00 64.34 61.32 2bqh n VAL 125 Cb 0.44 1.02 -0.03 0.00 -1.47 0.00 0.00 33.84 33.80 2bqh n VAL 125 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 2bqh s GLN 126 N -0.38 4.22 0.00 7.34 2.00 -0.57 -2.65 119.66 129.62 2bqh s GLN 126 Ca 0.05 2.36 0.00 0.00 -2.00 0.00 0.00 55.36 55.77 2bqh s GLN 126 Cb 0.03 -3.15 0.00 0.00 0.80 0.00 0.00 33.01 30.70 2bqh s GLN 126 CO 0.05 -0.59 0.00 0.41 -0.50 0.00 0.00 175.29 174.66 2bqh n GLY 127 N 3.56 0.82 0.02 2.59 0.00 -1.26 -4.91 105.19 106.00 2bqh n GLY 127 Ca 0.13 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.27 2bqh n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bqh n GLY 129 N 1.44 0.37 0.59 0.00 0.00 -1.26 -4.85 105.19 101.49 2bqh n GLY 129 Ca 0.05 -0.89 0.07 0.00 0.00 0.00 0.00 46.02 45.25 2bqh n GLY 129 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65