#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p7o h LEU 2 N 0.00 -1.43 -1.54 -4.53 5.85 -1.49 0.46 115.31 112.62 1p7o h LEU 2 Ca 0.00 0.25 -0.05 0.00 0.84 0.00 0.00 57.88 58.92 1p7o h LEU 2 Cb 0.00 0.68 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 1p7o h LEU 2 CO 0.00 -0.32 -0.24 -0.07 -0.34 0.00 0.00 178.44 177.48 1p7o h LEU 3 N -0.17 0.00 -0.20 2.25 3.38 -1.96 -2.27 115.31 116.35 1p7o h LEU 3 Ca 0.22 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.07 1p7o h LEU 3 Cb 0.56 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 1p7o h LEU 3 CO -0.74 0.24 -0.32 1.56 0.09 0.00 0.00 178.44 179.26 1p7o h GLN 4 N 0.00 0.57 -0.75 1.13 4.20 -1.39 -2.09 115.11 116.78 1p7o h GLN 4 Ca -0.00 -0.35 0.03 0.00 0.06 0.00 0.00 58.65 58.39 1p7o h GLN 4 Cb 0.43 0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.21 1p7o h GLN 4 CO 0.03 0.95 0.48 0.35 -0.67 0.00 0.00 178.83 179.97 1p7o h PHE 5 N 0.24 0.90 -0.71 2.96 3.57 -0.85 0.14 116.94 123.19 1p7o h PHE 5 Ca 0.02 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.57 1p7o h PHE 5 Cb 0.91 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 39.31 1p7o h PHE 5 CO 0.09 0.53 0.45 -0.09 -2.23 0.00 0.00 178.31 177.05 1p7o h ARG 6 N 0.95 0.85 -0.01 1.11 2.43 -1.32 -1.69 114.38 116.70 1p7o h ARG 6 Ca 0.30 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 59.29 1p7o h ARG 6 Cb -0.01 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.33 1p7o h ARG 6 CO -0.10 0.56 -0.58 -0.91 -1.51 0.00 0.00 179.97 177.43 1p7o h ASN 7 N 0.88 0.04 -0.40 -3.80 2.35 -0.56 -2.53 115.58 111.55 1p7o h ASN 7 Ca 0.28 -0.02 -0.05 0.00 -0.55 0.00 0.00 56.30 55.96 1p7o h ASN 7 Cb 0.01 -0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.35 1p7o h ASN 7 CO -0.11 0.61 0.10 0.24 -1.65 0.00 0.00 177.43 176.62 1p7o h MET 8 N 0.03 0.72 -0.39 0.81 2.86 -0.03 -0.66 114.93 118.27 1p7o h MET 8 Ca -0.01 -0.14 -0.11 0.00 -2.06 0.00 0.00 59.70 57.38 1p7o h MET 8 Cb 1.03 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.57 1p7o h MET 8 CO 0.08 0.67 -0.22 0.82 1.06 0.00 0.00 176.91 179.32 1p7o h ILE 9 N 0.70 1.27 0.00 -1.22 2.04 -1.03 -1.84 117.51 117.42 1p7o h ILE 9 Ca 0.15 -1.32 -0.07 0.00 1.00 0.00 0.00 64.86 64.62 1p7o h ILE 9 Cb 0.29 1.20 -0.01 0.00 -0.74 0.00 0.00 36.82 37.56 1p7o h ILE 9 CO 0.00 0.44 -0.34 0.11 0.00 0.00 0.00 178.15 178.36 1p7o h LYS 10 N 0.67 0.00 -0.16 2.37 1.57 -0.94 0.34 116.57 120.42 1p7o h LYS 10 Ca 0.09 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.81 1p7o h LYS 10 Cb 0.72 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.03 1p7o h LYS 10 CO 0.06 0.34 -0.15 0.00 -0.57 0.00 0.00 179.45 179.13 1p7o h THR 12 N 0.03 0.50 -2.51 0.00 1.35 -1.08 -3.41 112.91 107.79 1p7o h THR 12 Ca 0.03 -1.75 -0.60 0.00 -0.55 0.00 0.00 66.41 63.54 1p7o h THR 12 Cb 0.68 2.15 -0.40 0.00 -1.73 0.00 0.00 68.15 68.86 1p7o h THR 12 CO 0.04 0.28 -0.84 -0.38 -0.25 0.00 0.00 175.52 174.37 1p7o n ILE 13 N -3.08 0.04 -1.76 6.82 5.41 0.12 -4.82 119.36 122.08 1p7o n ILE 13 Ca 0.00 -4.10 -0.36 0.00 1.00 0.00 0.00 62.75 59.29 1p7o n ILE 13 Cb 0.68 -1.90 0.06 0.00 -0.71 0.00 0.00 39.64 37.78 1p7o n ILE 13 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 1p7o s PRO 14 N -0.81 2.59 0.00 0.38 0.02 -1.20 -3.67 135.00 132.31 1p7o s PRO 14 Ca 0.32 1.95 0.00 0.00 0.02 0.00 0.00 61.00 63.29 1p7o s PRO 14 Cb 0.05 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.70 1p7o s PRO 14 CO -0.16 -1.54 0.00 0.41 -0.33 0.00 0.00 177.00 175.38 1p7o n GLY 15 N 0.71 0.73 3.12 0.52 0.00 -1.26 -5.06 105.19 103.95 1p7o n GLY 15 Ca 0.15 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.03 1p7o n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1p7o s ARG 16 N -0.44 0.70 -0.56 1.61 0.52 -1.24 -5.10 118.95 114.44 1p7o s ARG 16 Ca 0.00 -1.00 -0.12 0.00 -0.52 0.00 0.00 55.73 54.10 1p7o s ARG 16 Cb 0.00 -0.39 0.14 0.00 0.52 0.00 0.00 34.95 35.22 1p7o s ARG 16 CO 0.00 0.06 0.47 -2.00 0.02 0.00 0.00 175.30 173.85 1p7o s GLU 17 N -2.36 2.83 0.36 3.54 2.56 -1.26 -4.85 118.70 119.53 1p7o s GLU 17 Ca -0.01 -1.91 0.19 0.00 0.00 0.00 0.00 54.97 53.24 1p7o s GLU 17 Cb -0.05 -4.12 1.28 0.00 2.00 0.00 0.00 34.13 33.24 1p7o s GLU 17 CO -0.01 -1.26 1.59 -1.35 -0.56 0.00 0.00 175.26 173.67 1p7o h PRO 18 N 8.40 0.03 0.00 4.30 0.11 -1.95 1.18 132.00 144.06 1p7o h PRO 18 Ca -0.18 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.93 1p7o h PRO 18 Cb 1.07 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1p7o h PRO 18 CO 0.90 0.02 0.00 -0.07 -0.21 0.00 0.00 178.00 178.63 1p7o h LEU 19 N 0.03 0.00 -0.01 2.35 3.38 -1.93 0.44 115.31 119.55 1p7o h LEU 19 Ca 0.82 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.79 1p7o h LEU 19 Cb 2.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.87 1p7o h LEU 19 CO -0.77 0.00 -0.66 -0.11 0.09 0.00 0.00 178.44 176.99 1p7o n LEU 20 N -2.62 0.69 0.00 1.67 7.94 0.40 -3.93 117.00 121.15 1p7o n LEU 20 Ca 0.03 -0.18 0.00 0.00 -1.11 0.00 0.00 56.01 54.75 1p7o n LEU 20 Cb 0.33 -0.16 0.00 0.00 0.53 0.00 0.00 43.42 44.12 1p7o n LEU 20 CO 0.26 0.17 -0.38 0.00 -1.11 0.00 0.00 177.39 176.33 1p7o n ALA 21 N -1.48 1.80 0.41 1.96 0.00 -0.99 -4.81 120.51 117.41 1p7o n ALA 21 Ca 0.05 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.57 1p7o n ALA 21 Cb 0.33 0.22 0.10 0.00 0.00 0.00 0.00 19.45 20.11 1p7o n ALA 21 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1p7o n PHE 22 N -1.75 0.17 0.28 0.00 3.72 0.12 -4.62 117.46 115.38 1p7o n PHE 22 Ca 0.00 -0.13 -0.16 0.00 -0.05 0.00 0.00 57.45 57.11 1p7o n PHE 22 Cb 0.38 -0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 38.83 1p7o n PHE 22 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 1p7o h SER 23 N 3.00 -0.80 -2.34 4.37 0.02 -1.68 -3.29 113.55 112.84 1p7o h SER 23 Ca 0.00 0.05 -0.59 0.00 -0.84 0.00 0.00 61.79 60.41 1p7o h SER 23 Cb 0.70 0.24 -0.40 0.00 0.14 0.00 0.00 62.40 63.08 1p7o h SER 23 CO 0.00 -0.49 -0.86 -3.20 -1.14 0.00 0.00 176.83 171.14 1p7o n ASN 24 N -5.45 1.31 -4.41 3.07 4.05 -1.24 -3.60 115.26 108.99 1p7o n ASN 24 Ca -0.11 -2.87 -0.32 0.00 0.45 0.00 0.00 54.58 51.73 1p7o n ASN 24 Cb 0.34 -0.64 -0.14 0.00 1.23 0.00 0.00 39.78 40.57 1p7o n ASN 24 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 177.26 173.74 1p7o s TYR 25 N -1.18 2.61 0.00 1.20 6.14 -0.91 0.19 117.35 125.40 1p7o s TYR 25 Ca 0.34 -0.34 0.00 0.00 0.64 0.00 0.00 57.07 57.71 1p7o s TYR 25 Cb 0.09 -1.62 0.00 0.00 0.42 0.00 0.00 41.96 40.85 1p7o s TYR 25 CO -0.12 0.05 0.00 0.41 0.64 0.00 0.00 175.55 176.53 1p7o n GLY 26 N 2.54 3.23 0.00 8.97 0.00 -0.80 -2.24 105.19 116.89 1p7o n GLY 26 Ca -0.17 -0.11 0.02 0.00 0.00 0.00 0.00 46.02 45.76 1p7o n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p7o n TYR 28 N -1.28 0.00 -2.48 0.00 4.02 -1.25 -3.08 117.16 113.09 1p7o n TYR 28 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.46 1p7o n TYR 28 Cb 0.07 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.37 1p7o n TYR 28 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1p7o n GLY 30 N 5.00 0.23 2.90 0.00 0.00 -1.24 -2.14 105.19 109.95 1p7o n GLY 30 Ca 0.14 -1.17 -0.29 0.00 0.00 0.00 0.00 46.02 44.70 1p7o n GLY 30 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1p7o s LYS 31 N 0.00 1.48 0.00 1.61 1.02 -1.26 -4.89 119.74 117.70 1p7o s LYS 31 Ca 0.00 -0.58 0.00 0.00 0.02 0.00 0.00 55.97 55.41 1p7o s LYS 31 Cb 0.00 -2.10 0.00 0.00 -0.52 0.00 0.00 37.83 35.21 1p7o s LYS 31 CO 0.00 -0.45 0.00 0.41 -0.92 0.00 0.00 175.35 174.39 1p7o n GLY 32 N 4.85 1.85 1.01 -3.33 0.00 -1.26 -5.10 105.19 103.21 1p7o n GLY 32 Ca -0.12 -0.24 0.14 0.00 0.00 0.00 0.00 46.02 45.79 1p7o n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p7o n GLY 33 N 0.00 -1.89 0.00 -0.02 0.00 -1.18 -5.05 105.19 97.05 1p7o n GLY 33 Ca 0.00 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.76 1p7o n GLY 33 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1p7o n SER 34 N -3.40 0.00 0.00 1.61 2.88 -1.23 -4.86 113.62 108.63 1p7o n SER 34 Ca -0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1p7o n SER 34 Cb 0.46 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.92 1p7o n SER 34 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1p7o n GLY 35 N 0.23 -0.06 3.50 0.46 0.00 -1.20 -4.77 105.19 103.36 1p7o n GLY 35 Ca 0.00 -1.47 -0.33 0.00 0.00 0.00 0.00 46.02 44.22 1p7o n GLY 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1p7o s THR 36 N 0.00 3.32 0.53 2.61 2.01 -1.26 -5.01 115.64 117.84 1p7o s THR 36 Ca 0.00 -0.62 -0.22 0.00 0.31 0.00 0.00 61.69 61.16 1p7o s THR 36 Cb 0.00 -2.34 -0.05 0.00 0.01 0.00 0.00 72.50 70.12 1p7o s THR 36 CO 0.00 0.58 1.33 -2.84 -0.69 0.00 0.00 174.62 173.00 1p7o s PRO 37 N -0.59 3.24 0.14 4.92 0.02 -1.26 -4.78 135.00 136.68 1p7o s PRO 37 Ca 0.09 2.17 0.26 0.00 0.02 0.00 0.00 61.00 63.54 1p7o s PRO 37 Cb -0.11 -2.28 0.81 0.00 0.02 0.00 0.00 34.50 32.94 1p7o s PRO 37 CO 0.01 -1.09 1.72 1.33 -0.33 0.00 0.00 177.00 178.65 1p7o n VAL 38 N -0.94 0.40 -3.43 3.83 0.24 -1.26 -4.93 118.33 112.24 1p7o n VAL 38 Ca 0.10 -0.21 0.00 0.00 -2.04 0.00 0.00 64.34 62.19 1p7o n VAL 38 Cb 0.45 -0.45 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1p7o n VAL 38 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1p7o n ASP 39 N -2.04 0.00 0.01 -1.34 5.68 -1.26 -5.03 116.55 112.58 1p7o n ASP 39 Ca 0.06 -0.83 -0.13 0.00 -0.50 0.00 0.00 54.79 53.39 1p7o n ASP 39 Cb 0.41 0.00 -0.09 0.00 -1.14 0.00 0.00 41.12 40.30 1p7o n ASP 39 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1p7o h GLU 40 N 0.00 -0.01 -0.33 0.11 4.39 -1.93 -2.07 114.58 114.73 1p7o h GLU 40 Ca 0.00 0.00 0.07 0.00 0.34 0.00 0.00 59.36 59.77 1p7o h GLU 40 Cb 0.00 0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 28.57 1p7o h GLU 40 CO 0.00 0.27 -0.26 1.25 -1.16 0.00 0.00 179.01 179.11 1p7o h LEU 41 N -0.30 -0.86 -0.94 1.33 5.85 -1.89 0.16 115.31 118.66 1p7o h LEU 41 Ca -0.00 0.16 0.13 0.00 0.84 0.00 0.00 57.88 59.01 1p7o h LEU 41 Cb 0.29 0.41 -0.09 0.00 0.37 0.00 0.00 40.66 41.65 1p7o h LEU 41 CO 0.00 -0.29 0.57 -0.78 -0.34 0.00 0.00 178.44 177.60 1p7o h ASP 42 N -0.23 0.80 -0.21 1.25 -0.00 -1.92 0.75 116.42 116.86 1p7o h ASP 42 Ca 0.16 0.06 -0.07 0.00 -0.00 0.00 0.00 57.03 57.19 1p7o h ASP 42 Cb 0.48 -0.09 -0.02 0.00 -0.00 0.00 0.00 39.33 39.71 1p7o h ASP 42 CO -0.46 0.40 -0.07 -0.09 -0.00 0.00 0.00 179.24 179.02 1p7o h ARG 43 N 0.87 0.56 -0.73 0.28 2.43 -0.09 -0.94 114.38 116.75 1p7o h ARG 43 Ca 0.48 -0.15 0.01 0.00 -0.81 0.00 0.00 59.98 59.52 1p7o h ARG 43 Cb 0.54 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.99 1p7o h ARG 43 CO -0.29 0.64 0.47 0.00 -1.51 0.00 0.00 179.97 179.28 1p7o h GLN 46 N 0.57 0.55 -0.68 0.00 4.15 -0.43 -0.25 115.11 119.02 1p7o h GLN 46 Ca 0.08 -0.05 -0.08 0.00 0.77 0.00 0.00 58.65 59.37 1p7o h GLN 46 Cb 0.71 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 28.26 1p7o h GLN 46 CO 0.05 0.41 0.12 1.15 -1.93 0.00 0.00 178.83 178.64 1p7o h THR 47 N 0.53 1.26 0.17 2.39 2.02 -0.83 -2.59 112.91 115.86 1p7o h THR 47 Ca 0.14 -1.02 0.01 0.00 0.77 0.00 0.00 66.41 66.31 1p7o h THR 47 Cb 0.00 0.61 -0.03 0.00 -1.74 0.00 0.00 68.15 67.00 1p7o h THR 47 CO -0.03 0.39 -0.25 -0.74 0.37 0.00 0.00 175.52 175.26 1p7o h HIS 48 N 1.04 -0.66 -0.76 3.16 -0.00 -0.37 -0.95 115.15 116.60 1p7o h HIS 48 Ca 0.21 0.01 0.17 0.00 -0.00 0.00 0.00 60.37 60.76 1p7o h HIS 48 Cb 0.42 0.27 -0.11 0.00 -0.00 0.00 0.00 27.41 27.99 1p7o h HIS 48 CO 0.03 -0.36 0.18 -0.44 -0.00 0.00 0.00 177.93 177.35 1p7o h ASP 49 N -0.49 0.01 -0.49 3.26 5.19 -0.85 0.14 116.42 123.18 1p7o h ASP 49 Ca 0.01 0.15 -0.05 0.00 -0.62 0.00 0.00 57.03 56.53 1p7o h ASP 49 Cb 0.48 0.21 -0.03 0.00 0.18 0.00 0.00 39.33 40.18 1p7o h ASP 49 CO -0.11 -0.05 0.13 -1.13 -3.12 0.00 0.00 179.24 174.96 1p7o h ASN 50 N 0.26 0.79 -0.73 6.45 -0.00 -1.01 -0.37 115.58 120.97 1p7o h ASN 50 Ca 0.43 -0.14 -0.07 0.00 -0.00 0.00 0.00 56.30 56.52 1p7o h ASN 50 Cb 0.76 -0.21 -0.03 0.00 -0.00 0.00 0.00 38.32 38.85 1p7o h ASN 50 CO -0.53 0.78 0.19 0.00 -0.00 0.00 0.00 177.43 177.87 1p7o h TYR 52 N 1.09 0.53 -0.23 0.00 -1.99 -0.65 -1.48 116.97 114.25 1p7o h TYR 52 Ca 0.23 -0.08 -0.07 0.00 2.00 0.00 0.00 58.73 60.81 1p7o h TYR 52 Cb 0.36 -0.14 -0.01 0.00 2.00 0.00 0.00 36.73 38.93 1p7o h TYR 52 CO 0.03 0.60 -0.16 -0.44 -0.00 0.00 0.00 178.16 178.19 1p7o h ASP 53 N 0.46 0.38 0.56 3.88 3.45 -0.20 -2.72 116.42 122.23 1p7o h ASP 53 Ca 0.09 -0.10 -0.17 0.00 0.43 0.00 0.00 57.03 57.28 1p7o h ASP 53 Cb 0.48 -0.10 -0.01 0.00 -0.56 0.00 0.00 39.33 39.13 1p7o h ASP 53 CO 0.03 0.56 -0.75 0.11 -1.57 0.00 0.00 179.24 177.62 1p7o h LYS 54 N 0.36 0.15 -0.26 3.56 1.57 -0.47 -3.21 116.57 118.27 1p7o h LYS 54 Ca 0.07 -0.14 -0.10 0.00 -1.87 0.00 0.00 60.65 58.60 1p7o h LYS 54 Cb 0.50 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 1p7o h LYS 54 CO 0.03 0.83 -0.28 0.00 -0.57 0.00 0.00 179.45 179.46 1p7o h ALA 55 N 1.13 1.04 0.00 3.86 0.00 -1.00 -1.54 119.26 122.74 1p7o h ALA 55 Ca -0.02 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 1p7o h ALA 55 Cb 1.32 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 1p7o h ALA 55 CO 0.11 0.58 -0.03 0.93 0.00 0.00 0.00 179.25 180.85 1p7o h GLU 56 N 0.45 0.00 0.00 0.00 5.08 -1.50 -2.22 114.58 116.39 1p7o h GLU 56 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1p7o h GLU 56 Cb 0.72 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.97 1p7o h GLU 56 CO 0.06 0.03 -1.24 1.63 -1.00 0.00 0.00 179.01 178.48 1p7o n LYS 57 N -3.17 0.20 -1.71 2.33 5.02 -0.96 -4.96 118.16 114.91 1p7o n LYS 57 Ca -0.01 -0.05 -0.43 0.00 -2.02 0.00 0.00 58.31 55.80 1p7o n LYS 57 Cb 0.24 -1.51 -0.03 0.00 -0.02 0.00 0.00 35.03 33.70 1p7o n LYS 57 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1p7o n LEU 58 N -1.74 3.88 -0.30 -0.35 7.94 -0.62 -4.89 117.00 120.92 1p7o n LEU 58 Ca 0.02 1.06 0.05 0.00 -1.11 0.00 0.00 56.01 56.03 1p7o n LEU 58 Cb 0.40 -1.55 0.20 0.00 0.53 0.00 0.00 43.42 43.00 1p7o n LEU 58 CO 0.43 0.12 1.13 -0.65 -1.11 0.00 0.00 177.39 177.31 1p7o h PRO 59 N 6.71 0.70 0.00 1.96 0.11 -1.91 -0.40 132.00 139.17 1p7o h PRO 59 Ca -0.43 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 1p7o h PRO 59 Cb 1.21 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 1p7o h PRO 59 CO 0.95 0.47 -0.05 0.93 -0.21 0.00 0.00 178.00 180.09 1p7o h GLU 60 N 0.72 0.00 -5.51 1.05 3.07 -1.94 -3.40 114.58 108.58 1p7o h GLU 60 Ca 0.44 0.00 -0.63 0.00 -0.50 0.00 0.00 59.36 58.66 1p7o h GLU 60 Cb 0.52 0.00 -0.14 0.00 -0.84 0.00 0.00 28.75 28.29 1p7o h GLU 60 CO -0.31 0.05 0.44 0.00 -1.40 0.00 0.00 179.01 177.79 1p7o s LYS 62 N 3.67 0.13 0.00 0.00 -2.85 -1.26 -4.75 119.74 114.67 1p7o s LYS 62 Ca 0.24 0.27 0.00 0.00 -1.00 0.00 0.00 55.97 55.48 1p7o s LYS 62 Cb -0.16 0.09 0.00 0.00 -2.06 0.00 0.00 37.83 35.70 1p7o s LYS 62 CO 0.15 -0.03 0.00 0.41 0.10 0.00 0.00 175.35 175.97 1p7o n GLY 63 N 3.84 3.34 3.71 0.59 0.00 -1.26 -4.98 105.19 110.43 1p7o n GLY 63 Ca -0.13 -1.23 -0.42 0.00 0.00 0.00 0.00 46.02 44.24 1p7o n GLY 63 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1p7o s ILE 64 N -2.00 3.08 -1.45 -0.61 2.07 -1.26 -2.62 121.20 118.42 1p7o s ILE 64 Ca 0.00 0.74 0.00 0.00 -1.41 0.00 0.00 60.65 59.98 1p7o s ILE 64 Cb 0.00 -3.47 0.00 0.00 0.13 0.00 0.00 42.46 39.12 1p7o s ILE 64 CO 0.00 0.05 0.00 0.18 -1.91 0.00 0.00 174.94 173.26 1p7o n LEU 65 N 4.24 -1.62 -1.19 8.50 4.77 -1.26 -4.89 117.00 125.56 1p7o n LEU 65 Ca 0.13 0.07 0.07 0.00 -0.03 0.00 0.00 56.01 56.25 1p7o n LEU 65 Cb 0.41 -2.37 0.25 0.00 -2.33 0.00 0.00 43.42 39.38 1p7o n LEU 65 CO 0.60 -0.31 0.69 -1.54 -1.33 0.00 0.00 177.39 175.51 1p7o n SER 66 N -0.99 3.45 -4.86 -1.43 3.41 -1.08 -3.26 113.62 108.88 1p7o n SER 66 Ca -0.19 -2.28 -0.31 0.00 -0.26 0.00 0.00 58.87 55.83 1p7o n SER 66 Cb 0.62 -0.47 -0.04 0.00 -0.26 0.00 0.00 64.21 64.06 1p7o n SER 66 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1p7o s GLY 67 N -0.81 2.06 0.36 5.00 0.00 -1.26 -4.70 107.32 107.97 1p7o s GLY 67 Ca 0.36 0.00 0.19 0.00 0.00 0.00 0.00 44.72 45.27 1p7o s GLY 67 CO 0.18 0.23 1.63 -2.55 0.00 0.00 0.00 173.10 172.60 1p7o h PRO 68 N 1.28 0.18 -0.65 2.90 0.11 -1.91 0.31 132.00 134.23 1p7o h PRO 68 Ca -0.47 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.59 1p7o h PRO 68 Cb 1.18 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 1p7o h PRO 68 CO 0.63 0.12 0.25 -0.92 -0.21 0.00 0.00 178.00 177.87 1p7o h TYR 69 N 0.18 0.99 0.00 0.65 3.20 -1.94 -3.32 116.97 116.73 1p7o h TYR 69 Ca 0.78 -0.08 -0.01 0.00 3.14 0.00 0.00 58.73 62.56 1p7o h TYR 69 Cb 1.98 -0.30 -0.00 0.00 1.54 0.00 0.00 36.73 39.95 1p7o h TYR 69 CO -0.01 0.79 -1.51 1.19 -1.64 0.00 0.00 178.16 176.98 1p7o n PHE 70 N -4.41 0.00 -1.89 -3.82 3.72 -0.56 -1.95 117.46 108.55 1p7o n PHE 70 Ca 0.04 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.01 1p7o n PHE 70 Cb 0.18 -0.26 -0.03 0.00 -0.94 0.00 0.00 39.48 38.43 1p7o n PHE 70 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1p7o s ASN 71 N -3.32 5.89 -0.30 4.37 3.04 1.00 -4.70 114.94 120.92 1p7o s ASN 71 Ca -0.04 1.61 -0.26 0.00 0.04 0.00 0.00 52.86 54.21 1p7o s ASN 71 Cb 0.07 -2.52 0.01 0.00 -1.54 0.00 0.00 41.25 37.26 1p7o s ASN 71 CO 0.45 -1.66 0.94 -0.89 -3.04 0.00 0.00 177.10 172.89 1p7o s THR 72 N 6.84 4.67 0.53 -5.21 2.01 -1.26 0.24 115.64 123.46 1p7o s THR 72 Ca 0.85 1.53 0.07 0.00 0.31 0.00 0.00 61.69 64.44 1p7o s THR 72 Cb -0.27 -4.27 0.07 0.00 0.01 0.00 0.00 72.50 68.03 1p7o s THR 72 CO 0.34 -0.33 0.55 0.00 -0.69 0.00 0.00 174.62 174.50 1p7o n TYR 73 N 6.48 -1.38 -3.89 4.92 0.18 -1.26 -4.88 117.16 117.33 1p7o n TYR 73 Ca 0.08 -2.12 -0.35 0.00 1.88 0.00 0.00 57.90 57.39 1p7o n TYR 73 Cb 0.47 -0.47 -0.14 0.00 -0.38 0.00 0.00 39.34 38.83 1p7o n TYR 73 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 1p7o s SER 74 N -4.22 4.42 0.22 9.48 0.15 -1.26 -4.92 113.70 117.56 1p7o s SER 74 Ca 0.42 -0.39 -0.09 0.00 0.70 0.00 0.00 55.95 56.59 1p7o s SER 74 Cb -0.03 -1.76 -0.01 0.00 -1.71 0.00 0.00 66.02 62.50 1p7o s SER 74 CO 0.27 -0.03 0.36 -0.72 1.20 0.00 0.00 173.24 174.32 1p7o s TYR 75 N 1.49 0.58 -0.00 3.44 -0.85 -1.26 -0.50 117.35 120.24 1p7o s TYR 75 Ca 0.06 -0.90 0.01 0.00 -0.52 0.00 0.00 57.07 55.72 1p7o s TYR 75 Cb -0.14 -0.04 -0.00 0.00 0.38 0.00 0.00 41.96 42.16 1p7o s TYR 75 CO -0.02 -0.87 -0.04 0.34 -1.52 0.00 0.00 175.55 173.44 1p7o s ASP 76 N -3.05 0.51 -0.30 -0.18 2.15 0.81 -4.91 116.67 111.70 1p7o s ASP 76 Ca 0.26 -0.08 0.02 0.00 0.43 0.00 0.00 52.55 53.19 1p7o s ASP 76 Cb 0.02 -0.07 0.08 0.00 -0.30 0.00 0.00 42.92 42.65 1p7o s ASP 76 CO 0.09 0.05 -0.02 0.00 -0.17 0.00 0.00 175.17 175.11 1p7o s THR 78 N 1.05 1.12 -1.26 0.00 2.01 0.27 -4.82 115.64 114.01 1p7o s THR 78 Ca -0.00 -0.70 -0.00 0.00 0.31 0.00 0.00 61.69 61.29 1p7o s THR 78 Cb -0.20 -1.33 -0.00 0.00 0.01 0.00 0.00 72.50 70.98 1p7o s THR 78 CO -0.06 0.08 0.81 0.47 -0.69 0.00 0.00 174.62 175.23 1p7o n ASP 79 N 4.86 -1.63 0.00 3.53 8.00 -1.26 -2.05 116.55 128.01 1p7o n ASP 79 Ca -0.12 -0.75 0.00 0.00 0.71 0.00 0.00 54.79 54.63 1p7o n ASP 79 Cb 0.47 -4.46 0.00 0.00 -0.02 0.00 0.00 41.12 37.11 1p7o n ASP 79 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1p7o n GLY 80 N -1.41 0.36 3.45 0.44 0.00 -1.26 -4.99 105.19 101.79 1p7o n GLY 80 Ca -0.29 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.40 1p7o n GLY 80 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1p7o s LYS 81 N -0.76 2.78 -0.13 1.61 2.20 -0.87 -4.68 119.74 119.89 1p7o s LYS 81 Ca 0.00 -0.68 -0.03 0.00 -0.36 0.00 0.00 55.97 54.90 1p7o s LYS 81 Cb 0.00 -2.47 -0.03 0.00 -1.51 0.00 0.00 37.83 33.82 1p7o s LYS 81 CO 0.00 0.51 -0.03 -0.51 -0.36 0.00 0.00 175.35 174.95 1p7o s LEU 82 N -0.42 3.31 -0.05 5.43 1.43 -1.26 -0.57 118.68 126.55 1p7o s LEU 82 Ca 0.05 -0.07 0.03 0.00 -1.03 0.00 0.00 54.13 53.11 1p7o s LEU 82 Cb -0.12 -1.78 0.01 0.00 0.03 0.00 0.00 46.19 44.33 1p7o s LEU 82 CO 0.02 0.23 -0.12 -0.89 0.23 0.00 0.00 176.35 175.82 1p7o s THR 83 N 0.02 1.10 -0.22 5.49 2.01 0.06 -4.95 115.64 119.15 1p7o s THR 83 Ca 0.01 -0.48 -0.19 0.00 0.31 0.00 0.00 61.69 61.34 1p7o s THR 83 Cb -0.13 -0.99 -0.03 0.00 0.01 0.00 0.00 72.50 71.36 1p7o s THR 83 CO 0.03 0.34 0.53 0.00 -0.69 0.00 0.00 174.62 174.83 1p7o n ASN 85 N 5.02 1.09 -4.77 0.00 3.02 0.35 -4.98 115.26 114.99 1p7o n ASN 85 Ca -0.04 -1.04 -0.41 0.00 -0.03 0.00 0.00 54.58 53.06 1p7o n ASN 85 Cb 0.50 0.94 -0.01 0.00 -0.61 0.00 0.00 39.78 40.60 1p7o n ASN 85 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1p7o s ASP 86 N -2.95 6.39 0.00 6.41 1.01 -1.24 -4.88 116.67 121.41 1p7o s ASP 86 Ca 0.09 2.98 0.00 0.00 0.71 0.00 0.00 52.55 56.33 1p7o s ASP 86 Cb 0.16 -2.65 0.00 0.00 1.01 0.00 0.00 42.92 41.44 1p7o s ASP 86 CO 0.84 -0.86 0.00 0.00 0.21 0.00 0.00 175.17 175.36 1p7o n GLN 87 N 1.11 0.29 0.01 8.23 6.02 -1.26 -4.84 117.38 126.94 1p7o n GLN 87 Ca 0.03 0.00 -0.18 0.00 -0.01 0.00 0.00 57.00 56.84 1p7o n GLN 87 Cb 0.39 -0.80 -0.11 0.00 1.02 0.00 0.00 30.24 30.74 1p7o n GLN 87 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.06 175.14 1p7o h ASN 88 N 0.00 0.58 -3.27 1.08 2.35 -2.05 -3.41 115.58 110.85 1p7o h ASN 88 Ca 0.00 -0.77 -0.73 0.00 -0.55 0.00 0.00 56.30 54.25 1p7o h ASN 88 Cb 0.59 -0.18 -0.28 0.00 0.05 0.00 0.00 38.32 38.50 1p7o h ASN 88 CO 0.00 1.28 -0.36 -0.62 -1.65 0.00 0.00 177.43 176.08 1p7o s ASP 89 N -6.84 5.81 0.42 5.81 3.68 -1.26 -4.93 116.67 119.36 1p7o s ASP 89 Ca -0.13 -1.83 0.30 0.00 2.13 0.00 0.00 52.55 53.02 1p7o s ASP 89 Cb 0.04 -2.06 1.36 0.00 -1.45 0.00 0.00 42.92 40.81 1p7o s ASP 89 CO 0.84 -0.71 1.89 0.11 0.13 0.00 0.00 175.17 177.42 1p7o h LYS 90 N 8.55 0.00 0.09 4.34 1.57 -1.92 -2.07 116.57 127.12 1p7o h LYS 90 Ca -0.23 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.33 1p7o h LYS 90 Cb 1.08 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.41 1p7o h LYS 90 CO 0.89 0.00 -0.90 0.00 -0.57 0.00 0.00 179.45 178.87 1p7o h LYS 92 N -0.05 0.55 -0.40 0.00 1.57 -1.87 -1.37 116.57 115.01 1p7o h LYS 92 Ca -0.14 -0.15 -0.12 0.00 -1.87 0.00 0.00 60.65 58.36 1p7o h LYS 92 Cb 1.63 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.87 1p7o h LYS 92 CO 0.17 0.65 -0.25 1.25 -0.57 0.00 0.00 179.45 180.70 1p7o h LEU 93 N 0.52 0.84 -0.18 2.94 5.85 -1.35 -0.30 115.31 123.62 1p7o h LEU 93 Ca 0.10 -0.32 -0.05 0.00 0.84 0.00 0.00 57.88 58.45 1p7o h LEU 93 Cb 0.47 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.26 1p7o h LEU 93 CO 0.03 1.05 -0.08 0.15 -0.34 0.00 0.00 178.44 179.25 1p7o h PHE 94 N 0.70 0.42 -0.64 1.25 3.57 -0.91 -2.14 116.94 119.20 1p7o h PHE 94 Ca 0.09 -0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.49 1p7o h PHE 94 Cb 0.78 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.39 1p7o h PHE 94 CO 0.04 0.66 0.41 0.82 -2.23 0.00 0.00 178.31 178.02 1p7o h ILE 95 N 0.06 1.17 -0.79 1.41 1.08 -1.17 -1.12 117.51 118.16 1p7o h ILE 95 Ca 0.04 -0.33 0.02 0.00 -0.39 0.00 0.00 64.86 64.19 1p7o h ILE 95 Cb 0.55 0.25 -0.04 0.00 -3.07 0.00 0.00 36.82 34.50 1p7o h ILE 95 CO 0.02 0.17 0.52 0.00 -0.69 0.00 0.00 178.15 178.17 1p7o h ASN 97 N 1.04 0.26 -0.27 0.00 2.35 -0.76 0.15 115.58 118.35 1p7o h ASN 97 Ca 0.30 -0.09 -0.03 0.00 -0.55 0.00 0.00 56.30 55.93 1p7o h ASN 97 Cb -0.08 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.21 1p7o h ASN 97 CO -0.08 0.57 0.05 0.00 -1.65 0.00 0.00 177.43 176.32 1p7o h ASP 99 N 0.25 0.66 0.39 0.00 5.19 -1.07 -2.55 116.42 119.31 1p7o h ASP 99 Ca 0.08 -0.30 -0.01 0.00 -0.62 0.00 0.00 57.03 56.18 1p7o h ASP 99 Cb 0.31 -0.18 -0.00 0.00 0.18 0.00 0.00 39.33 39.63 1p7o h ASP 99 CO 0.00 0.80 -0.24 -0.09 -3.12 0.00 0.00 179.24 176.60 1p7o h ARG 100 N 0.51 -0.58 -0.01 3.56 2.43 -0.62 0.35 114.38 120.01 1p7o h ARG 100 Ca 0.11 0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.27 1p7o h ARG 100 Cb 0.45 0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.13 1p7o h ARG 100 CO 0.02 -0.39 -0.22 1.79 -1.51 0.00 0.00 179.97 179.66 1p7o h THR 101 N -0.60 1.16 -0.17 0.20 1.35 -1.40 -1.31 112.91 112.15 1p7o h THR 101 Ca -0.04 -0.77 -0.04 0.00 -0.55 0.00 0.00 66.41 65.00 1p7o h THR 101 Cb 0.49 1.40 -0.00 0.00 -1.73 0.00 0.00 68.15 68.31 1p7o h THR 101 CO 0.05 0.22 -0.05 0.00 -0.25 0.00 0.00 175.52 175.49 1p7o h ALA 102 N 1.77 0.24 -0.94 6.62 0.00 -1.14 -0.27 119.26 125.54 1p7o h ALA 102 Ca 0.00 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1p7o h ALA 102 Cb 0.40 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 1p7o h ALA 102 CO 0.03 0.02 0.58 0.00 0.00 0.00 0.00 179.25 179.87 1p7o h ALA 103 N 0.71 1.25 -0.08 0.00 0.00 -0.49 0.63 119.26 121.28 1p7o h ALA 103 Ca 0.04 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 1p7o h ALA 103 Cb 0.50 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1p7o h ALA 103 CO 0.02 0.65 -0.55 0.52 0.00 0.00 0.00 179.25 179.89 1p7o h MET 104 N 1.29 0.24 -0.36 0.00 2.07 -1.18 -2.80 114.93 114.19 1p7o h MET 104 Ca 0.34 -0.15 -0.13 0.00 -2.07 0.00 0.00 59.70 57.69 1p7o h MET 104 Cb -0.08 0.02 -0.01 0.00 -1.87 0.00 0.00 31.60 29.66 1p7o h MET 104 CO -0.07 0.73 -0.28 0.00 1.07 0.00 0.00 176.91 178.36 1p7o h PHE 106 N 0.62 1.12 0.00 0.00 -1.00 -0.80 -2.48 116.94 114.39 1p7o h PHE 106 Ca 0.07 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.88 1p7o h PHE 106 Cb 0.86 -0.37 0.00 0.00 3.61 0.00 0.00 35.95 40.05 1p7o h PHE 106 CO 0.06 0.62 0.00 0.00 -1.61 0.00 0.00 178.31 177.39 1p7o h ALA 107 N 1.39 1.00 -0.01 2.45 0.00 -1.30 -2.39 119.26 120.40 1p7o h ALA 107 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1p7o h ALA 107 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1p7o h ALA 107 CO -0.14 0.00 -0.49 1.63 0.00 0.00 0.00 179.25 180.26 1p7o n LYS 108 N -3.09 0.86 -4.21 0.00 5.02 -0.95 -4.93 118.16 110.85 1p7o n LYS 108 Ca -0.00 -0.65 -0.35 0.00 -2.02 0.00 0.00 58.31 55.28 1p7o n LYS 108 Cb 0.23 -1.49 -0.09 0.00 -0.02 0.00 0.00 35.03 33.67 1p7o n LYS 108 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1p7o s ALA 109 N -2.59 3.41 0.28 7.82 0.00 -0.90 -5.05 121.76 124.73 1p7o s ALA 109 Ca 0.18 -0.76 -0.29 0.00 0.00 0.00 0.00 51.96 51.09 1p7o s ALA 109 Cb 0.18 -1.66 -0.10 0.00 0.00 0.00 0.00 23.12 21.54 1p7o s ALA 109 CO 0.61 0.49 1.40 -2.14 0.00 0.00 0.00 175.76 176.12 1p7o s PRO 110 N -0.59 4.29 -0.32 0.00 0.02 -1.26 -4.87 135.00 132.26 1p7o s PRO 110 Ca 0.10 2.29 -0.11 0.00 0.02 0.00 0.00 61.00 63.30 1p7o s PRO 110 Cb -0.12 -3.09 -0.01 0.00 0.02 0.00 0.00 34.50 31.30 1p7o s PRO 110 CO 0.02 -0.35 0.19 -0.47 -0.33 0.00 0.00 177.00 176.06 1p7o s TYR 111 N -0.44 3.20 -0.32 6.54 5.04 -1.26 -4.56 117.35 125.55 1p7o s TYR 111 Ca 0.55 -0.42 -0.11 0.00 -2.44 0.00 0.00 57.07 54.66 1p7o s TYR 111 Cb -0.41 -2.40 -0.01 0.00 0.35 0.00 0.00 41.96 39.48 1p7o s TYR 111 CO 0.48 -0.41 0.18 1.21 -1.34 0.00 0.00 175.55 175.66 1p7o s ASN 112 N 1.66 5.73 0.50 4.32 3.04 -1.26 -4.96 114.94 123.97 1p7o s ASN 112 Ca 0.05 -0.44 0.24 0.00 0.04 0.00 0.00 52.86 52.75 1p7o s ASN 112 Cb -0.17 -2.05 1.31 0.00 -1.54 0.00 0.00 41.25 38.79 1p7o s ASN 112 CO 0.08 -0.19 2.04 -0.08 -3.04 0.00 0.00 177.10 175.91 1p7o h GLU 113 N 8.39 0.00 0.00 0.43 4.81 -1.99 -2.36 114.58 123.86 1p7o h GLU 113 Ca -0.32 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.91 1p7o h GLU 113 Cb 1.15 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.53 1p7o h GLU 113 CO 0.61 0.15 0.00 0.00 -0.73 0.00 0.00 179.01 179.04 1p7o h ALA 114 N 1.85 1.00 -0.01 2.92 0.00 -2.04 -2.30 119.26 120.69 1p7o h ALA 114 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1p7o h ALA 114 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1p7o h ALA 114 CO 0.02 0.00 -0.10 0.66 0.00 0.00 0.00 179.25 179.83 1p7o n TYR 115 N -2.93 0.00 -1.98 0.00 0.53 -0.89 -4.85 117.16 107.05 1p7o n TYR 115 Ca -0.00 0.00 -0.40 0.00 -1.02 0.00 0.00 57.90 56.48 1p7o n TYR 115 Cb 0.21 -0.11 -0.00 0.00 -1.03 0.00 0.00 39.34 38.41 1p7o n TYR 115 CO 0.00 0.00 0.00 -0.80 -1.02 0.00 0.00 176.86 175.04 1p7o s ASN 116 N -2.33 6.30 -1.46 7.72 0.01 -0.87 -1.91 114.94 122.40 1p7o s ASN 116 Ca 0.32 2.77 -0.02 0.00 -0.71 0.00 0.00 52.86 55.22 1p7o s ASN 116 Cb 0.20 -2.65 0.02 0.00 0.41 0.00 0.00 41.25 39.23 1p7o s ASN 116 CO 0.44 -0.87 0.39 1.57 -1.51 0.00 0.00 177.10 177.12 1p7o n HIS 117 N 0.21 -1.59 -2.14 2.20 -0.00 0.52 -4.89 115.22 109.53 1p7o n HIS 117 Ca 0.03 0.73 -0.39 0.00 0.46 0.00 0.00 57.72 58.55 1p7o n HIS 117 Cb 0.42 -3.51 -0.01 0.00 -0.12 0.00 0.00 29.99 26.78 1p7o n HIS 117 CO 0.00 0.00 0.00 0.12 0.46 0.00 0.00 176.34 176.92 1p7o s PHE 118 N -3.96 2.87 -0.86 1.57 5.36 -1.15 -4.91 117.98 116.91 1p7o s PHE 118 Ca 0.08 1.47 -0.25 0.00 -0.96 0.00 0.00 56.93 57.27 1p7o s PHE 118 Cb -0.04 -3.56 -0.01 0.00 -0.34 0.00 0.00 43.02 39.07 1p7o s PHE 118 CO 0.91 -1.82 1.77 1.21 -1.46 0.00 0.00 175.22 175.83 1p7o s ASN 119 N -0.94 5.54 0.00 6.13 2.47 -1.26 -4.85 114.94 122.03 1p7o s ASN 119 Ca 0.58 -0.62 0.00 0.00 0.42 0.00 0.00 52.86 53.24 1p7o s ASN 119 Cb -0.35 -2.56 0.00 0.00 -1.45 0.00 0.00 41.25 36.90 1p7o s ASN 119 CO 0.44 -2.33 0.87 0.54 -3.72 0.00 0.00 177.10 172.90 1p7o n ARG 120 N 8.97 0.00 0.10 0.43 1.74 -1.26 -1.20 116.66 125.44 1p7o n ARG 120 Ca 0.32 0.38 0.12 0.00 -0.77 0.00 0.00 57.85 57.90 1p7o n ARG 120 Cb 0.49 -1.58 0.45 0.00 -1.02 0.00 0.00 32.46 30.80 1p7o n ARG 120 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1p7o n GLN 121 N -1.37 0.20 0.00 5.56 6.02 -1.26 -1.85 117.38 124.68 1p7o n GLN 121 Ca 0.00 0.26 0.14 0.00 -0.01 0.00 0.00 57.00 57.40 1p7o n GLN 121 Cb 0.08 -1.78 0.65 0.00 1.02 0.00 0.00 30.24 30.21 1p7o n GLN 121 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1p7o n LEU 122 N -2.15 0.58 -3.22 1.08 4.77 -0.34 -4.32 117.00 113.40 1p7o n LEU 122 Ca 0.04 -0.09 -0.37 0.00 -0.03 0.00 0.00 56.01 55.56 1p7o n LEU 122 Cb 0.34 -0.11 -0.01 0.00 -2.33 0.00 0.00 43.42 41.31 1p7o n LEU 122 CO 0.26 0.10 2.05 0.00 -1.33 0.00 0.00 177.39 178.47