#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s7z h TYR 7 N 0.00 1.03 -0.60 4.78 3.20 -1.81 -1.26 116.97 122.31 1s7z h TYR 7 Ca 0.00 -0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.81 1s7z h TYR 7 Cb 0.00 -0.32 -0.03 0.00 1.54 0.00 0.00 36.73 37.92 1s7z h TYR 7 CO 0.00 0.75 0.33 -0.91 -1.64 0.00 0.00 178.16 176.69 1s7z h ASN 8 N 1.00 0.73 -0.32 -2.11 2.35 -1.95 0.38 115.58 115.66 1s7z h ASN 8 Ca 0.25 -0.05 -0.10 0.00 -0.55 0.00 0.00 56.30 55.84 1s7z h ASN 8 Cb 0.11 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 1s7z h ASN 8 CO -0.03 0.59 -0.20 0.78 -1.65 0.00 0.00 177.43 176.91 1s7z h ASN 9 N 0.83 0.73 -0.63 5.81 -0.26 -1.83 -1.06 115.58 119.17 1s7z h ASN 9 Ca 0.21 -0.43 -0.04 0.00 -0.56 0.00 0.00 56.30 55.49 1s7z h ASN 9 Cb 0.02 -0.20 -0.03 0.00 -1.06 0.00 0.00 38.32 37.05 1s7z h ASN 9 CO -0.04 1.00 0.25 0.58 -1.06 0.00 0.00 177.43 178.16 1s7z h VAL 10 N 0.46 1.23 -0.66 2.81 2.07 -0.50 -2.46 116.25 119.21 1s7z h VAL 10 Ca 0.06 -0.74 -0.07 0.00 0.82 0.00 0.00 66.70 66.78 1s7z h VAL 10 Cb 0.75 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 1s7z h VAL 10 CO 0.06 0.29 0.14 0.15 0.02 0.00 0.00 177.57 178.23 1s7z h PHE 11 N 0.88 1.10 -0.87 1.57 3.57 -0.16 -1.72 116.94 121.31 1s7z h PHE 11 Ca 0.21 -0.13 -0.00 0.00 3.53 0.00 0.00 57.97 61.58 1s7z h PHE 11 Cb 0.21 -0.31 -0.04 0.00 2.79 0.00 0.00 35.95 38.60 1s7z h PHE 11 CO 0.01 0.91 0.53 -0.44 -2.23 0.00 0.00 178.31 177.09 1s7z h ASP 12 N 1.00 1.04 -0.40 0.41 3.32 -0.85 0.54 116.42 121.47 1s7z h ASP 12 Ca 0.21 -0.06 -0.10 0.00 0.02 0.00 0.00 57.03 57.10 1s7z h ASP 12 Cb 0.38 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 1s7z h ASP 12 CO 0.00 0.79 -0.13 0.45 -1.72 0.00 0.00 179.24 178.63 1s7z h HIS 13 N 1.20 0.91 -0.52 4.55 3.86 -1.06 -1.80 115.15 122.29 1s7z h HIS 13 Ca 0.31 -0.21 -0.06 0.00 -1.16 0.00 0.00 60.37 59.26 1s7z h HIS 13 Cb -0.06 -0.22 -0.02 0.00 1.06 0.00 0.00 27.41 28.17 1s7z h HIS 13 CO 0.00 0.94 0.10 0.00 0.86 0.00 0.00 177.93 179.83 1s7z h ALA 14 N 0.83 0.68 -0.79 2.45 0.00 -0.66 -2.89 119.26 118.88 1s7z h ALA 14 Ca 0.10 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 54.79 1s7z h ALA 14 Cb 0.67 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 1s7z h ALA 14 CO 0.05 0.41 0.51 -0.92 0.00 0.00 0.00 179.25 179.30 1s7z h TYR 15 N 0.73 0.97 0.00 0.00 5.03 -0.84 -1.87 116.97 121.00 1s7z h TYR 15 Ca 0.16 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.49 1s7z h TYR 15 Cb 0.38 -0.33 0.00 0.00 1.55 0.00 0.00 36.73 38.34 1s7z h TYR 15 CO 0.03 0.59 0.00 -1.91 -1.32 0.00 0.00 178.16 175.55 1s7z n GLU 16 N -4.56 0.39 0.00 1.82 4.07 -0.69 -1.57 120.64 120.10 1s7z n GLU 16 Ca 0.08 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.18 1s7z n GLU 16 Cb 0.04 -1.31 0.00 0.00 -0.06 0.00 0.00 31.44 30.11 1s7z n GLU 16 CO 0.00 0.00 0.00 -0.11 -0.06 0.00 0.00 177.13 176.96 1s7z n LEU 18 N 0.98 0.00 -0.10 4.31 7.94 -0.70 -1.83 117.00 127.60 1s7z n LEU 18 Ca 0.00 0.00 -0.06 0.00 -1.11 0.00 0.00 56.01 54.84 1s7z n LEU 18 Cb 0.19 0.00 0.01 0.00 0.53 0.00 0.00 43.42 44.15 1s7z n LEU 18 CO 0.00 0.00 0.91 0.11 -1.11 0.00 0.00 177.39 177.30 1s7z h LYS 19 N 0.00 0.19 -0.02 1.96 1.57 -1.55 0.47 116.57 119.18 1s7z h LYS 19 Ca 0.00 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1s7z h LYS 19 Cb 0.00 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.27 1s7z h LYS 19 CO 0.00 0.13 0.01 0.93 -0.57 0.00 0.00 179.45 179.95 1s7z h GLU 20 N 0.20 0.03 -0.75 3.15 5.08 -1.63 -2.78 114.58 117.88 1s7z h GLU 20 Ca 0.16 -0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.60 1s7z h GLU 20 Cb 0.17 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.36 1s7z h GLU 20 CO -0.20 0.06 0.49 -0.91 -1.00 0.00 0.00 179.01 177.45 1s7z h ASN 21 N -0.01 0.64 -0.34 1.42 2.35 -1.69 0.39 115.58 118.33 1s7z h ASN 21 Ca 0.01 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 1s7z h ASN 21 Cb 0.04 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.27 1s7z h ASN 21 CO -0.00 0.40 0.15 0.40 -1.65 0.00 0.00 177.43 176.73 1s7z h ILE 22 N 0.72 1.17 -0.29 2.81 2.04 -0.77 -2.37 117.51 120.82 1s7z h ILE 22 Ca 0.34 -0.50 -0.05 0.00 1.00 0.00 0.00 64.86 65.64 1s7z h ILE 22 Cb 0.37 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 1s7z h ILE 22 CO -0.12 0.18 -0.03 -0.09 0.00 0.00 0.00 178.15 178.09 1s7z h ARG 23 N 0.41 0.53 -0.38 2.37 2.43 -0.99 -1.09 114.38 117.66 1s7z h ARG 23 Ca 0.12 -0.19 -0.02 0.00 -0.81 0.00 0.00 59.98 59.08 1s7z h ARG 23 Cb 0.14 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.63 1s7z h ARG 23 CO -0.01 0.71 0.15 1.88 -1.51 0.00 0.00 179.97 181.19 1s7z h TYR 24 N 0.31 0.53 -0.35 2.20 0.05 -0.89 -2.99 116.97 115.82 1s7z h TYR 24 Ca 0.08 -0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.84 1s7z h TYR 24 Cb 0.49 -0.17 0.00 0.00 1.01 0.00 0.00 36.73 38.06 1s7z h TYR 24 CO 0.04 0.42 0.00 -0.25 -1.05 0.00 0.00 178.16 177.32 1s7z n ASP 25 N -4.39 3.15 -3.88 3.88 8.00 -0.90 -5.01 116.55 117.40 1s7z n ASP 25 Ca 0.02 -2.17 -0.37 0.00 0.71 0.00 0.00 54.79 52.99 1s7z n ASP 25 Cb 0.14 -0.29 0.02 0.00 -0.02 0.00 0.00 41.12 40.97 1s7z n ASP 25 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1s7z n ASP 26 N 0.40 -4.18 -4.73 -2.24 2.03 -0.48 -4.90 116.55 102.45 1s7z n ASP 26 Ca 0.14 -1.13 -0.40 0.00 0.52 0.00 0.00 54.79 53.91 1s7z n ASP 26 Cb 0.51 -2.66 -0.04 0.00 -0.72 0.00 0.00 41.12 38.21 1s7z n ASP 26 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1s7z s ILE 27 N -3.57 4.85 0.00 5.18 1.01 -0.76 -4.92 121.20 122.98 1s7z s ILE 27 Ca 0.42 1.72 0.00 0.00 0.00 0.00 0.00 60.65 62.79 1s7z s ILE 27 Cb -0.19 -4.16 0.00 0.00 0.01 0.00 0.00 42.46 38.12 1s7z s ILE 27 CO 0.91 0.27 0.02 0.54 0.00 0.00 0.00 174.94 176.68 1s7z n ARG 28 N 3.40 5.08 -4.23 2.79 1.74 -1.26 -4.94 116.66 119.23 1s7z n ARG 28 Ca 0.01 -0.02 -0.17 0.00 -0.77 0.00 0.00 57.85 56.89 1s7z n ARG 28 Cb 0.51 -0.42 -0.15 0.00 -1.02 0.00 0.00 32.46 31.38 1s7z n ARG 28 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1s7z s ASP 29 N -0.73 0.78 0.64 0.55 2.15 -1.26 -5.01 116.67 113.79 1s7z s ASP 29 Ca 0.00 -0.12 0.39 0.00 0.43 0.00 0.00 52.55 53.25 1s7z s ASP 29 Cb 0.00 -0.10 2.21 0.00 -0.30 0.00 0.00 42.92 44.73 1s7z s ASP 29 CO 0.00 0.08 2.33 0.71 -0.17 0.00 0.00 175.17 178.12 1s7z h THR 30 N 5.04 0.20 0.00 1.71 1.35 -1.97 -1.78 112.91 117.45 1s7z h THR 30 Ca -0.29 -0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 1s7z h THR 30 Cb 1.19 1.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.61 1s7z h THR 30 CO 0.50 0.00 0.00 -0.67 -0.25 0.00 0.00 175.52 175.10 1s7z n ASP 31 N -3.38 0.00 -0.08 5.36 2.03 -1.26 -2.21 116.55 117.02 1s7z n ASP 31 Ca -0.03 -0.95 0.05 0.00 0.52 0.00 0.00 54.79 54.39 1s7z n ASP 31 Cb 0.07 0.00 0.08 0.00 -0.72 0.00 0.00 41.12 40.55 1s7z n ASP 31 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1s7z n ASP 32 N -1.00 1.95 -0.00 1.67 8.00 -0.67 -4.74 116.55 121.75 1s7z n ASP 32 Ca 0.23 -2.55 0.11 0.00 0.71 0.00 0.00 54.79 53.29 1s7z n ASP 32 Cb 0.10 -0.25 -0.15 0.00 -0.02 0.00 0.00 41.12 40.81 1s7z n ASP 32 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1s7z n LEU 33 N -0.95 0.40 -0.16 0.64 4.77 -0.94 -4.67 117.00 116.10 1s7z n LEU 33 Ca 0.09 -0.19 -0.08 0.00 -0.03 0.00 0.00 56.01 55.79 1s7z n LEU 33 Cb 0.51 -0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.57 1s7z n LEU 33 CO 0.01 0.10 0.60 -0.74 -1.33 0.00 0.00 177.39 176.02 1s7z h HIS 34 N 0.00 -1.12 -0.30 -1.77 2.76 -1.85 -1.60 115.15 111.26 1s7z h HIS 34 Ca 0.00 0.07 -0.11 0.00 -2.20 0.00 0.00 60.37 58.13 1s7z h HIS 34 Cb 0.80 0.56 -0.01 0.00 1.55 0.00 0.00 27.41 30.31 1s7z h HIS 34 CO 0.00 -0.41 -0.25 -0.44 -1.30 0.00 0.00 177.93 175.52 1s7z h ASP 35 N -0.26 0.61 -0.72 3.26 3.32 -1.98 -2.27 116.42 118.38 1s7z h ASP 35 Ca 0.17 -0.22 -0.05 0.00 0.02 0.00 0.00 57.03 56.95 1s7z h ASP 35 Cb 0.56 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.92 1s7z h ASP 35 CO -0.61 0.85 0.25 0.00 -1.72 0.00 0.00 179.24 178.01 1s7z h ALA 36 N 1.20 1.07 -0.17 3.45 0.00 -1.61 -3.12 119.26 120.08 1s7z h ALA 36 Ca 0.07 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1s7z h ALA 36 Cb 0.72 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1s7z h ALA 36 CO 0.05 0.64 0.04 0.82 0.00 0.00 0.00 179.25 180.80 1s7z h ILE 37 N 1.08 1.21 0.00 0.00 2.04 -1.18 -2.49 117.51 118.17 1s7z h ILE 37 Ca 0.24 -0.67 0.00 0.00 1.00 0.00 0.00 64.86 65.43 1s7z h ILE 37 Cb 0.26 1.33 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 1s7z h ILE 37 CO -0.01 0.20 0.00 1.41 0.00 0.00 0.00 178.15 179.75 1s7z n HIS 38 N -4.79 0.00 0.00 1.37 8.25 -0.87 -1.06 115.22 118.12 1s7z n HIS 38 Ca -0.05 -0.17 0.00 0.00 -0.26 0.00 0.00 57.72 57.24 1s7z n HIS 38 Cb 0.17 -0.15 0.00 0.00 1.12 0.00 0.00 29.99 31.13 1s7z n HIS 38 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1s7z n ALA 40 N 0.80 0.00 -0.19 -1.41 0.00 -0.94 -1.49 120.51 117.28 1s7z n ALA 40 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1s7z n ALA 40 Cb 0.18 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.71 1s7z n ALA 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1s7z h ALA 41 N 0.00 0.75 -0.57 0.00 0.00 -1.37 -1.89 119.26 116.17 1s7z h ALA 41 Ca 0.00 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1s7z h ALA 41 Cb 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1s7z h ALA 41 CO 0.00 -0.12 0.17 0.22 0.00 0.00 0.00 179.25 179.52 1s7z h ASP 42 N 0.49 0.85 1.02 0.00 3.58 -1.53 -1.76 116.42 119.07 1s7z h ASP 42 Ca 0.27 -0.22 0.00 0.00 0.42 0.00 0.00 57.03 57.51 1s7z h ASP 42 Cb 0.25 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 41.08 1s7z h ASP 42 CO -0.23 0.84 0.00 0.78 -2.88 0.00 0.00 179.24 177.75 1s7z h ASN 43 N 0.81 0.00 0.18 2.28 2.35 -1.78 -3.29 115.58 116.14 1s7z h ASN 43 Ca 0.18 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.93 1s7z h ASN 43 Cb 0.31 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.68 1s7z h ASN 43 CO -0.00 0.00 -1.81 0.00 -1.65 0.00 0.00 177.43 173.96 1s7z n ALA 44 N -1.99 2.77 -1.78 -0.83 0.00 -0.73 -4.95 120.51 113.00 1s7z n ALA 44 Ca 0.01 -0.47 -0.41 0.00 0.00 0.00 0.00 53.44 52.57 1s7z n ALA 44 Cb 0.30 -0.81 -0.01 0.00 0.00 0.00 0.00 19.45 18.93 1s7z n ALA 44 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1s7z s VAL 45 N -3.49 2.19 0.67 0.00 -7.23 -0.73 -4.93 120.40 106.88 1s7z s VAL 45 Ca -0.07 0.18 -0.14 0.00 -1.81 0.00 0.00 61.98 60.14 1s7z s VAL 45 Cb 0.13 -3.12 0.00 0.00 0.56 0.00 0.00 36.38 33.96 1s7z s VAL 45 CO 0.89 0.04 1.10 -2.16 -0.31 0.00 0.00 175.10 174.66 1s7z s PRO 46 N -1.72 2.79 -0.25 4.82 0.04 -1.26 -4.99 135.00 134.43 1s7z s PRO 46 Ca 0.54 1.31 0.05 0.00 0.04 0.00 0.00 61.00 62.95 1s7z s PRO 46 Cb -0.45 -1.95 -0.19 0.00 0.04 0.00 0.00 34.50 31.94 1s7z s PRO 46 CO 0.58 -1.25 -0.17 0.72 0.04 0.00 0.00 177.00 176.93 1s7z n HIS 47 N -2.57 0.00 -2.49 0.56 8.25 -1.26 -4.84 115.22 112.87 1s7z n HIS 47 Ca 0.10 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.16 1s7z n HIS 47 Cb 0.52 -1.00 -0.04 0.00 1.12 0.00 0.00 29.99 30.59 1s7z n HIS 47 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 1s7z s TYR 48 N -2.51 3.61 0.27 4.41 2.02 -1.26 -4.91 117.35 118.97 1s7z s TYR 48 Ca -0.30 1.71 0.00 0.00 -0.37 0.00 0.00 57.07 58.12 1s7z s TYR 48 Cb 0.08 -3.26 0.59 0.00 -0.40 0.00 0.00 41.96 38.96 1s7z s TYR 48 CO 0.65 -0.49 1.75 1.88 -1.57 0.00 0.00 175.55 177.77 1s7z h TYR 49 N 3.88 0.76 -0.47 2.71 -1.99 -2.00 -1.54 116.97 118.32 1s7z h TYR 49 Ca -0.47 0.04 -0.04 0.00 2.00 0.00 0.00 58.73 60.27 1s7z h TYR 49 Cb 1.21 -0.20 -0.02 0.00 2.00 0.00 0.00 36.73 39.71 1s7z h TYR 49 CO 0.59 0.14 0.15 0.00 -0.00 0.00 0.00 178.16 179.03 1s7z h ALA 50 N 1.59 1.37 -0.05 3.88 0.00 -1.99 -0.04 119.26 124.03 1s7z h ALA 50 Ca 0.49 -0.16 -0.20 0.00 0.00 0.00 0.00 54.91 55.04 1s7z h ALA 50 Cb 0.75 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1s7z h ALA 50 CO -0.40 0.46 -0.82 -0.44 0.00 0.00 0.00 179.25 178.05 1s7z h ASP 51 N 0.68 0.50 -0.25 0.00 3.32 -1.69 -1.19 116.42 117.79 1s7z h ASP 51 Ca 0.16 -0.36 -0.01 0.00 0.02 0.00 0.00 57.03 56.84 1s7z h ASP 51 Cb 0.20 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 1s7z h ASP 51 CO -0.01 1.13 0.11 0.40 -1.72 0.00 0.00 179.24 179.15 1s7z h ILE 52 N 0.25 1.16 -0.78 0.35 2.04 -0.54 -1.34 117.51 118.65 1s7z h ILE 52 Ca -0.05 -0.46 -0.03 0.00 1.00 0.00 0.00 64.86 65.32 1s7z h ILE 52 Cb 1.42 1.00 -0.04 0.00 -0.74 0.00 0.00 36.82 38.46 1s7z h ILE 52 CO 0.14 0.16 0.37 -0.26 0.00 0.00 0.00 178.15 178.56 1s7z h PHE 53 N 0.26 1.11 -0.34 1.37 0.04 -1.01 -2.93 116.94 115.46 1s7z h PHE 53 Ca 0.09 -0.05 -0.09 0.00 2.80 0.00 0.00 57.97 60.71 1s7z h PHE 53 Cb 0.14 -0.35 -0.02 0.00 2.20 0.00 0.00 35.95 37.93 1s7z h PHE 53 CO -0.02 0.81 -0.18 1.03 -0.60 0.00 0.00 178.31 179.36 1s7z h SER 54 N 1.11 0.62 0.00 2.17 0.87 -0.97 -1.89 113.55 115.46 1s7z h SER 54 Ca 0.27 -0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 1s7z h SER 54 Cb 0.12 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 61.91 1s7z h SER 54 CO -0.03 0.80 0.00 0.52 -0.53 0.00 0.00 176.83 177.59 1s7z n VAL 55 N -4.15 0.31 0.00 2.23 0.31 -0.53 -2.71 118.33 113.79 1s7z n VAL 55 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1s7z n VAL 55 Cb 0.38 -0.63 0.00 0.00 -0.91 0.00 0.00 33.84 32.68 1s7z n VAL 55 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1s7z n ALA 57 N 0.79 0.00 -2.03 3.52 0.00 -0.71 -4.27 120.51 117.82 1s7z n ALA 57 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 1s7z n ALA 57 Cb 0.16 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.66 1s7z n ALA 57 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1s7z s SER 58 N 0.00 5.19 0.21 0.00 1.04 -1.10 -5.06 113.70 113.97 1s7z s SER 58 Ca 0.00 -0.73 -0.31 0.00 0.48 0.00 0.00 55.95 55.40 1s7z s SER 58 Cb 0.00 0.07 -0.10 0.00 0.10 0.00 0.00 66.02 66.09 1s7z s SER 58 CO 0.00 -1.24 1.46 -1.83 0.98 0.00 0.00 173.24 172.61 1s7z s GLU 59 N -4.62 4.27 0.00 4.02 1.03 -1.26 -4.08 118.70 118.05 1s7z s GLU 59 Ca 0.61 2.28 0.00 0.00 0.03 0.00 0.00 54.97 57.88 1s7z s GLU 59 Cb -0.07 -3.14 0.00 0.00 -0.80 0.00 0.00 34.13 30.12 1s7z s GLU 59 CO 0.38 -0.47 0.00 0.41 -1.33 0.00 0.00 175.26 174.25 1s7z n GLY 60 N 2.82 0.80 3.08 -3.83 0.00 -1.26 -4.43 105.19 102.37 1s7z n GLY 60 Ca 0.09 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.99 1s7z n GLY 60 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1s7z s ILE 61 N -2.00 -0.04 0.45 -0.61 2.07 -1.26 -5.09 121.20 114.72 1s7z s ILE 61 Ca 0.00 0.13 0.08 0.00 -1.41 0.00 0.00 60.65 59.45 1s7z s ILE 61 Cb 0.00 -0.40 0.02 0.00 0.13 0.00 0.00 42.46 42.20 1s7z s ILE 61 CO 0.00 0.05 0.55 -1.81 -1.91 0.00 0.00 174.94 171.83 1s7z s ASP 62 N 1.21 5.40 0.41 4.50 1.01 -1.26 -4.89 116.67 123.05 1s7z s ASP 62 Ca -0.09 -0.59 0.22 0.00 0.71 0.00 0.00 52.55 52.81 1s7z s ASP 62 Cb -0.10 -0.46 0.51 0.00 1.01 0.00 0.00 42.92 43.89 1s7z s ASP 62 CO -0.08 -0.84 1.65 0.25 0.21 0.00 0.00 175.17 176.36 1s7z h LEU 63 N 0.66 0.00 -9.81 1.23 5.85 -2.01 -3.46 115.31 107.77 1s7z h LEU 63 Ca -0.39 0.00 -0.49 0.00 0.84 0.00 0.00 57.88 57.85 1s7z h LEU 63 Cb 1.28 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.30 1s7z h LEU 63 CO 0.48 0.18 0.38 -1.61 -0.34 0.00 0.00 178.44 177.53 1s7z s GLU 64 N -3.28 4.71 0.29 1.25 8.01 -1.26 -5.04 118.70 123.38 1s7z s GLU 64 Ca 0.04 1.52 -0.23 0.00 0.01 0.00 0.00 54.97 56.30 1s7z s GLU 64 Cb 0.07 -3.10 -0.09 0.00 -4.31 0.00 0.00 34.13 26.69 1s7z s GLU 64 CO 0.67 0.36 0.86 -0.06 0.01 0.00 0.00 175.26 177.10 1s7z s PHE 65 N -1.31 3.65 -0.05 1.61 0.40 -1.26 -5.01 117.98 116.02 1s7z s PHE 65 Ca 0.45 1.63 -0.23 0.00 -0.60 0.00 0.00 56.93 58.18 1s7z s PHE 65 Cb -0.25 -2.81 -0.27 0.00 0.51 0.00 0.00 43.02 40.20 1s7z s PHE 65 CO 0.32 0.24 0.95 1.49 0.70 0.00 0.00 175.22 178.91 1s7z h GLU 66 N 3.17 0.27 -4.88 0.44 4.57 -1.99 -3.43 114.58 112.74 1s7z h GLU 66 Ca -0.47 -0.38 -0.66 0.00 -1.18 0.00 0.00 59.36 56.67 1s7z h GLU 66 Cb 1.19 0.13 -0.36 0.00 -0.16 0.00 0.00 28.75 29.55 1s7z h GLU 66 CO 0.65 1.12 -0.82 0.34 -1.18 0.00 0.00 179.01 179.12 1s7z s ASP 67 N -6.71 3.79 0.40 1.04 -1.08 -1.26 -5.01 116.67 107.85 1s7z s ASP 67 Ca -0.15 -1.04 0.29 0.00 -0.52 0.00 0.00 52.55 51.13 1s7z s ASP 67 Cb 0.01 -1.46 1.25 0.00 -1.46 0.00 0.00 42.92 41.25 1s7z s ASP 67 CO 0.80 -0.12 1.85 0.28 0.52 0.00 0.00 175.17 178.50 1s7z h SER 68 N 7.87 0.00 0.38 -0.34 0.02 -2.03 -1.42 113.55 118.03 1s7z h SER 68 Ca -0.30 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 1s7z h SER 68 Cb 1.09 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.63 1s7z h SER 68 CO 0.52 0.00 0.00 1.23 -1.14 0.00 0.00 176.83 177.44 1s7z h GLY 69 N 1.82 0.00 -6.94 -3.77 0.00 -1.99 -3.44 103.07 88.75 1s7z h GLY 69 Ca 0.00 0.00 -0.78 0.00 0.00 0.00 0.00 47.33 46.55 1s7z h GLY 69 CO 0.00 0.00 1.19 1.04 0.00 0.00 0.00 176.54 178.77 1s7z n LEU 70 N -2.84 6.25 -3.94 3.11 4.32 -0.54 -5.10 117.00 118.26 1s7z n LEU 70 Ca -0.01 -4.94 -0.16 0.00 -0.02 0.00 0.00 56.01 50.88 1s7z n LEU 70 Cb 0.15 -1.40 -0.15 0.00 -1.62 0.00 0.00 43.42 40.40 1s7z n LEU 70 CO 0.20 1.45 -0.40 -2.16 -1.22 0.00 0.00 177.39 175.26 1s7z s PRO 72 N -1.15 0.46 -0.87 3.23 0.04 -1.26 -4.87 135.00 130.58 1s7z s PRO 72 Ca 0.35 -0.16 -0.24 0.00 0.04 0.00 0.00 61.00 60.98 1s7z s PRO 72 Cb 0.03 -0.46 0.05 0.00 0.04 0.00 0.00 34.50 34.16 1s7z s PRO 72 CO 0.04 0.08 1.32 0.34 0.04 0.00 0.00 177.00 178.82 1s7z s ASP 73 N 0.06 6.34 0.05 6.66 -1.08 -1.26 -4.92 116.67 122.52 1s7z s ASP 73 Ca -0.00 -1.02 -0.20 0.00 -0.52 0.00 0.00 52.55 50.81 1s7z s ASP 73 Cb -0.04 -2.54 0.04 0.00 -1.46 0.00 0.00 42.92 38.92 1s7z s ASP 73 CO -0.00 -1.62 0.46 0.28 0.52 0.00 0.00 175.17 174.80 1s7z s THR 74 N 5.11 0.05 -0.69 1.71 -1.32 -1.26 -5.03 115.64 114.21 1s7z s THR 74 Ca 0.39 -0.37 0.25 0.00 -1.21 0.00 0.00 61.69 60.74 1s7z s THR 74 Cb -0.05 -0.97 0.15 0.00 -1.51 0.00 0.00 72.50 70.11 1s7z s THR 74 CO 0.02 -0.21 1.51 0.29 -2.21 0.00 0.00 174.62 174.03 1s7z n LYS 75 N 0.41 0.27 -2.28 7.08 5.02 -1.26 -4.77 118.16 122.62 1s7z n LYS 75 Ca -0.18 0.13 -0.38 0.00 -2.02 0.00 0.00 58.31 55.86 1s7z n LYS 75 Cb 0.60 -1.73 -0.03 0.00 -0.02 0.00 0.00 35.03 33.85 1s7z n LYS 75 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1s7z s ASP 76 N -4.30 5.72 0.26 4.39 1.11 -1.26 -4.89 116.67 117.69 1s7z s ASP 76 Ca 0.08 -0.31 -0.02 0.00 0.18 0.00 0.00 52.55 52.49 1s7z s ASP 76 Cb 0.13 -2.55 0.51 0.00 1.07 0.00 0.00 42.92 42.08 1s7z s ASP 76 CO 0.67 -2.13 1.76 0.58 1.18 0.00 0.00 175.17 177.22 1s7z h VAL 77 N 6.63 0.73 -0.09 -1.27 2.07 -2.01 -2.20 116.25 120.10 1s7z h VAL 77 Ca -0.16 -0.20 -0.04 0.00 0.82 0.00 0.00 66.70 67.11 1s7z h VAL 77 Cb 1.08 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 1s7z h VAL 77 CO 1.27 0.11 -0.15 -0.29 0.02 0.00 0.00 177.57 178.53 1s7z h ILE 78 N 0.60 1.16 -0.08 4.57 6.09 -2.00 -2.02 117.51 125.82 1s7z h ILE 78 Ca 0.45 -0.70 -0.18 0.00 -1.37 0.00 0.00 64.86 63.06 1s7z h ILE 78 Cb 0.63 1.25 -0.01 0.00 0.47 0.00 0.00 36.82 39.17 1s7z h ILE 78 CO -0.36 0.21 -0.71 0.03 -3.07 0.00 0.00 178.15 174.26 1s7z h ARG 79 N 0.13 0.40 -0.24 2.19 2.47 -1.81 -1.45 114.38 116.07 1s7z h ARG 79 Ca 0.03 -0.32 -0.01 0.00 -1.26 0.00 0.00 59.98 58.42 1s7z h ARG 79 Cb 0.34 0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 28.72 1s7z h ARG 79 CO 0.02 0.95 0.11 0.82 0.56 0.00 0.00 179.97 182.44 1s7z h ILE 80 N 0.28 1.14 -0.68 2.04 2.04 -1.30 -0.92 117.51 120.12 1s7z h ILE 80 Ca -0.03 -0.41 -0.02 0.00 1.00 0.00 0.00 64.86 65.40 1s7z h ILE 80 Cb 1.27 0.98 -0.03 0.00 -0.74 0.00 0.00 36.82 38.30 1s7z h ILE 80 CO 0.12 0.14 0.36 -0.07 0.00 0.00 0.00 178.15 178.70 1s7z h LEU 81 N 0.25 0.85 -0.69 1.44 3.38 -1.29 -1.47 115.31 117.79 1s7z h LEU 81 Ca 0.08 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 1s7z h LEU 81 Cb 0.12 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 1s7z h LEU 81 CO -0.01 0.72 0.28 -0.61 0.09 0.00 0.00 178.44 178.90 1s7z h GLN 82 N 0.93 1.04 -0.09 1.13 4.15 -1.16 -2.24 115.11 118.87 1s7z h GLN 82 Ca 0.24 -0.19 -0.05 0.00 0.77 0.00 0.00 58.65 59.42 1s7z h GLN 82 Cb 0.06 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 27.57 1s7z h GLN 82 CO -0.04 0.86 -0.16 0.00 -1.93 0.00 0.00 178.83 177.57 1s7z h ALA 83 N 1.13 1.58 -0.16 3.38 0.00 -0.86 -0.97 119.26 123.36 1s7z h ALA 83 Ca 0.23 -0.19 -0.19 0.00 0.00 0.00 0.00 54.91 54.76 1s7z h ALA 83 Cb 0.21 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1s7z h ALA 83 CO -0.02 0.31 -0.67 -0.09 0.00 0.00 0.00 179.25 178.78 1s7z h ARG 84 N 0.13 0.62 -0.11 0.00 9.65 -0.85 -0.71 114.38 123.11 1s7z h ARG 84 Ca 0.03 -0.46 -0.01 0.00 -1.10 0.00 0.00 59.98 58.44 1s7z h ARG 84 Cb 0.36 0.08 -0.00 0.00 -1.39 0.00 0.00 29.97 29.02 1s7z h ARG 84 CO 0.02 1.08 0.04 0.82 2.80 0.00 0.00 179.97 184.73 1s7z h ILE 85 N 0.44 1.17 -0.48 1.20 2.04 -0.98 -0.59 117.51 120.31 1s7z h ILE 85 Ca -0.02 -0.52 0.06 0.00 1.00 0.00 0.00 64.86 65.37 1s7z h ILE 85 Cb 1.26 1.31 -0.05 0.00 -0.74 0.00 0.00 36.82 38.60 1s7z h ILE 85 CO 0.13 0.15 0.19 0.22 0.00 0.00 0.00 178.15 178.85 1s7z h TYR 86 N 0.00 0.34 -0.24 1.37 5.03 -1.15 -0.17 116.97 122.16 1s7z h TYR 86 Ca 0.04 0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.36 1s7z h TYR 86 Cb 0.21 -0.08 -0.01 0.00 1.55 0.00 0.00 36.73 38.40 1s7z h TYR 86 CO -0.00 0.13 0.10 1.49 -1.32 0.00 0.00 178.16 178.56 1s7z h GLU 87 N 0.38 0.36 -0.68 1.82 4.81 -0.83 -2.01 114.58 118.43 1s7z h GLU 87 Ca 0.22 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.37 1s7z h GLU 87 Cb 0.21 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 1s7z h GLU 87 CO -0.21 0.39 0.34 0.37 -0.73 0.00 0.00 179.01 179.17 1s7z h GLN 88 N 0.24 0.95 -0.31 1.92 5.75 -0.64 -0.71 115.11 122.32 1s7z h GLN 88 Ca 0.08 -0.12 0.01 0.00 -0.15 0.00 0.00 58.65 58.47 1s7z h GLN 88 Cb 0.16 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.51 1s7z h GLN 88 CO -0.01 0.73 0.19 -0.07 -2.65 0.00 0.00 178.83 177.02 1s7z h LEU 89 N 0.95 0.31 -0.63 -2.39 3.38 -0.84 0.20 115.31 116.29 1s7z h LEU 89 Ca 0.24 -0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.10 1s7z h LEU 89 Cb 0.08 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1s7z h LEU 89 CO -0.03 0.23 -0.05 0.71 0.09 0.00 0.00 178.44 179.38 1s7z h THR 90 N 0.38 1.26 -0.07 0.22 1.35 -0.60 -0.58 112.91 114.87 1s7z h THR 90 Ca 0.12 -1.20 -0.00 0.00 -0.55 0.00 0.00 66.41 64.78 1s7z h THR 90 Cb -0.01 0.89 -0.00 0.00 -1.73 0.00 0.00 68.15 67.29 1s7z h THR 90 CO -0.05 0.43 0.04 0.40 -0.25 0.00 0.00 175.52 176.09 1s7z h ILE 91 N 0.92 1.10 -0.26 6.82 2.04 -0.78 -1.37 117.51 125.98 1s7z h ILE 91 Ca 0.15 -0.27 -0.10 0.00 1.00 0.00 0.00 64.86 65.64 1s7z h ILE 91 Cb 0.61 1.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 1s7z h ILE 91 CO 0.04 0.08 -0.25 0.44 0.00 0.00 0.00 178.15 178.46 1s7z h ASP 92 N 0.01 0.50 -0.46 1.72 3.32 -0.76 -2.40 116.42 118.35 1s7z h ASP 92 Ca 0.03 -0.17 -0.11 0.00 0.02 0.00 0.00 57.03 56.79 1s7z h ASP 92 Cb 0.10 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 1s7z h ASP 92 CO -0.00 0.75 -0.14 -0.07 -1.72 0.00 0.00 179.24 178.05 1s7z h LEU 93 N 0.44 0.92 -1.52 1.55 3.38 -1.05 -2.70 115.31 116.33 1s7z h LEU 93 Ca 0.06 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.66 1s7z h LEU 93 Cb 0.68 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 1s7z h LEU 93 CO 0.05 1.08 0.30 -0.50 0.09 0.00 0.00 178.44 179.47 1s7z h TRP 94 N 0.74 0.60 0.00 1.13 4.06 -0.96 -0.99 115.95 120.53 1s7z h TRP 94 Ca 0.11 0.01 -0.03 0.00 2.06 0.00 0.00 58.89 61.05 1s7z h TRP 94 Cb 0.70 -0.20 -0.00 0.00 -1.00 0.00 0.00 29.16 28.65 1s7z h TRP 94 CO 0.05 0.38 -0.13 0.93 -3.56 0.00 0.00 178.44 176.12 1s7z h GLU 95 N 0.64 0.00 -0.24 0.49 5.08 -1.12 -2.50 114.58 116.93 1s7z h GLU 95 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1s7z h GLU 95 Cb -0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.19 1s7z h GLU 95 CO -0.04 0.13 0.00 -0.25 -1.00 0.00 0.00 179.01 177.85 1s7z n ASP 96 N -3.47 2.92 0.15 1.42 8.00 -0.42 -4.70 116.55 120.45 1s7z n ASP 96 Ca -0.01 -1.92 -0.13 0.00 0.71 0.00 0.00 54.79 53.44 1s7z n ASP 96 Cb 0.29 -0.15 -0.07 0.00 -0.02 0.00 0.00 41.12 41.17 1s7z n ASP 96 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1s7z h ALA 97 N 4.48 -0.39 -0.62 2.24 0.00 -0.96 -0.52 119.26 123.48 1s7z h ALA 97 Ca 0.00 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1s7z h ALA 97 Cb 0.87 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.89 1s7z h ALA 97 CO 0.00 -0.74 0.38 0.93 0.00 0.00 0.00 179.25 179.82 1s7z h GLU 98 N -0.41 0.84 -0.52 0.00 4.39 -1.84 -1.36 114.58 115.68 1s7z h GLU 98 Ca -0.00 -0.07 0.01 0.00 0.34 0.00 0.00 59.36 59.64 1s7z h GLU 98 Cb 0.38 -0.18 -0.03 0.00 -0.10 0.00 0.00 28.75 28.82 1s7z h GLU 98 CO -0.03 0.60 0.33 -0.44 -1.16 0.00 0.00 179.01 178.30 1s7z h ASP 99 N 0.84 0.56 -0.50 1.42 3.32 -1.80 -0.86 116.42 119.40 1s7z h ASP 99 Ca 0.22 -0.01 -0.09 0.00 0.02 0.00 0.00 57.03 57.17 1s7z h ASP 99 Cb -0.03 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 1s7z h ASP 99 CO -0.04 0.40 -0.04 -0.07 -1.72 0.00 0.00 179.24 177.76 1s7z h LEU 100 N 0.67 0.91 -0.89 1.55 3.38 -0.90 -1.41 115.31 118.62 1s7z h LEU 100 Ca 0.20 -0.33 -0.08 0.00 0.09 0.00 0.00 57.88 57.76 1s7z h LEU 100 Cb -0.04 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 1s7z h LEU 100 CO -0.06 1.02 -0.01 -0.07 0.09 0.00 0.00 178.44 179.41 1s7z h LEU 101 N 0.78 0.79 -0.31 1.67 3.38 -1.07 -2.01 115.31 118.54 1s7z h LEU 101 Ca 0.14 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1s7z h LEU 101 Cb 0.58 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1s7z h LEU 101 CO 0.03 0.86 0.07 0.78 0.09 0.00 0.00 178.44 180.27 1s7z h ASN 102 N 0.76 0.48 -0.95 -0.43 2.35 -1.08 -2.21 115.58 114.50 1s7z h ASN 102 Ca 0.15 -0.24 0.03 0.00 -0.55 0.00 0.00 56.30 55.69 1s7z h ASN 102 Cb 0.47 -0.13 -0.05 0.00 0.05 0.00 0.00 38.32 38.66 1s7z h ASN 102 CO 0.02 0.60 0.62 -0.08 -1.65 0.00 0.00 177.43 176.94 1s7z h GLU 103 N 0.34 1.18 0.08 0.81 4.81 -1.06 -0.01 114.58 120.74 1s7z h GLU 103 Ca 0.10 -0.07 -0.00 0.00 -0.13 0.00 0.00 59.36 59.25 1s7z h GLU 103 Cb 0.31 -0.27 0.00 0.00 0.63 0.00 0.00 28.75 29.42 1s7z h GLU 103 CO 0.00 0.78 -0.04 -0.92 -0.73 0.00 0.00 179.01 178.10 1s7z h TYR 104 N 1.22 -0.10 -0.76 0.92 3.20 -1.20 -2.88 116.97 117.37 1s7z h TYR 104 Ca 0.37 -0.00 0.05 0.00 3.14 0.00 0.00 58.73 62.28 1s7z h TYR 104 Cb -0.03 0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.22 1s7z h TYR 104 CO -0.00 0.15 0.46 -0.07 -1.64 0.00 0.00 178.16 177.06 1s7z h LEU 105 N -0.35 0.74 0.00 2.82 3.38 -1.17 -2.74 115.31 117.98 1s7z h LEU 105 Ca -0.01 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1s7z h LEU 105 Cb 0.30 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1s7z h LEU 105 CO 0.02 0.49 0.00 -0.62 0.09 0.00 0.00 178.44 178.42 1s7z n GLU 106 N -4.66 0.94 -0.05 1.13 1.02 -0.04 -4.22 120.64 114.75 1s7z n GLU 106 Ca 0.09 0.00 0.04 0.00 -0.02 0.00 0.00 57.16 57.28 1s7z n GLU 106 Cb 0.13 -1.44 0.19 0.00 -0.02 0.00 0.00 31.44 30.30 1s7z n GLU 106 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1s7z n GLU 107 N -0.94 1.29 -3.99 3.49 2.13 -1.04 -4.80 120.64 116.78 1s7z n GLU 107 Ca 0.20 -0.44 -0.09 0.00 0.66 0.00 0.00 57.16 57.49 1s7z n GLU 107 Cb 0.09 -1.17 -0.10 0.00 0.27 0.00 0.00 31.44 30.53 1s7z n GLU 107 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 1s7z s VAL 108 N -1.86 0.15 -0.23 6.31 -7.23 -1.26 -5.14 120.40 111.14 1s7z s VAL 108 Ca 0.15 -1.20 -0.20 0.00 -1.81 0.00 0.00 61.98 58.91 1s7z s VAL 108 Cb 0.07 -0.79 0.06 0.00 0.56 0.00 0.00 36.38 36.28 1s7z s VAL 108 CO 0.11 -0.66 0.61 -0.70 -0.31 0.00 0.00 175.10 174.14 1s7z s GLU 109 N -2.46 0.70 0.00 4.82 2.12 -1.26 -5.10 118.70 117.51 1s7z s GLU 109 Ca -0.06 0.87 0.28 0.00 0.36 0.00 0.00 54.97 56.42 1s7z s GLU 109 Cb -0.02 0.32 1.11 0.00 0.26 0.00 0.00 34.13 35.80 1s7z s GLU 109 CO -0.04 -0.09 1.78 -1.91 -0.54 0.00 0.00 175.26 174.46