#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gxh n GLU 2 N 0.00 1.55 0.00 0.03 4.71 -1.26 -4.80 120.64 120.87 1gxh n GLU 2 Ca 0.00 -0.90 0.00 0.00 -0.01 0.00 0.00 57.16 56.25 1gxh n GLU 2 Cb 0.00 -2.02 0.00 0.00 -1.01 0.00 0.00 31.44 28.41 1gxh n GLU 2 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 1gxh n LEU 3 N 3.16 0.00 -4.69 -4.62 4.77 -1.26 -4.89 117.00 109.48 1gxh n LEU 3 Ca 0.33 0.00 -0.63 0.00 -0.03 0.00 0.00 56.01 55.68 1gxh n LEU 3 Cb 0.42 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.42 1gxh n LEU 3 CO 0.35 -0.56 1.07 0.29 -1.33 0.00 0.00 177.39 177.21 1gxh n LYS 4 N -0.49 0.37 0.09 3.23 4.76 -1.26 -4.78 118.16 120.08 1gxh n LYS 4 Ca 0.00 0.13 0.09 0.00 -2.87 0.00 0.00 58.31 55.67 1gxh n LYS 4 Cb 0.00 -1.69 0.42 0.00 -1.84 0.00 0.00 35.03 31.92 1gxh n LYS 4 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1gxh n ASN 5 N 3.79 0.43 -3.71 4.39 4.05 -1.26 -4.80 115.26 118.16 1gxh n ASN 5 Ca 0.27 0.63 -0.02 0.00 0.45 0.00 0.00 54.58 55.91 1gxh n ASN 5 Cb 0.03 -0.71 -0.01 0.00 1.23 0.00 0.00 39.78 40.31 1gxh n ASN 5 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 177.26 173.77 1gxh s SER 6 N -3.81 -0.16 0.51 1.20 0.01 -1.26 -4.90 113.70 105.30 1gxh s SER 6 Ca 0.03 -0.31 0.16 0.00 1.31 0.00 0.00 55.95 57.13 1gxh s SER 6 Cb 0.08 0.40 1.24 0.00 0.21 0.00 0.00 66.02 67.94 1gxh s SER 6 CO 0.29 -0.73 2.14 0.40 0.41 0.00 0.00 173.24 175.74 1gxh h ILE 7 N 2.00 1.00 0.00 1.44 1.08 -1.87 0.17 117.51 121.32 1gxh h ILE 7 Ca -0.25 -0.02 0.00 0.00 -0.39 0.00 0.00 64.86 64.20 1gxh h ILE 7 Cb 1.22 0.94 0.00 0.00 -3.07 0.00 0.00 36.82 35.91 1gxh h ILE 7 CO 0.26 0.01 0.00 -0.24 -0.69 0.00 0.00 178.15 177.49 1gxh n SER 8 N -4.53 0.00 -0.25 1.72 2.88 -1.26 -1.06 113.62 111.12 1gxh n SER 8 Ca -0.02 0.45 0.06 0.00 -1.33 0.00 0.00 58.87 58.04 1gxh n SER 8 Cb 0.11 -0.47 0.12 0.00 -0.75 0.00 0.00 64.21 63.21 1gxh n SER 8 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1gxh n ASP 9 N -1.47 2.55 -2.81 -3.46 2.03 0.04 -3.88 116.55 109.55 1gxh n ASP 9 Ca 0.03 -2.60 -0.31 0.00 0.52 0.00 0.00 54.79 52.43 1gxh n ASP 9 Cb 0.13 -0.29 -0.00 0.00 -0.72 0.00 0.00 41.12 40.24 1gxh n ASP 9 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1gxh n TYR 10 N -0.76 3.46 -0.47 -0.67 4.01 -0.22 -4.92 117.16 117.58 1gxh n TYR 10 Ca 0.11 -3.17 -0.16 0.00 -0.16 0.00 0.00 57.90 54.52 1gxh n TYR 10 Cb 0.53 -0.50 -0.01 0.00 -0.31 0.00 0.00 39.34 39.05 1gxh n TYR 10 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1gxh n THR 11 N -0.38 0.57 -0.34 -0.72 -2.24 -1.26 -3.65 114.28 106.26 1gxh n THR 11 Ca 0.40 -0.17 0.32 0.00 -2.27 0.00 0.00 64.05 62.33 1gxh n THR 11 Cb 0.47 0.00 0.67 0.00 -2.10 0.00 0.00 70.33 69.37 1gxh n THR 11 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1gxh h GLU 12 N 0.29 0.12 0.00 -0.78 4.81 -1.95 0.45 114.58 117.53 1gxh h GLU 12 Ca -0.10 -0.01 -0.27 0.00 -0.13 0.00 0.00 59.36 58.85 1gxh h GLU 12 Cb 0.49 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.80 1gxh h GLU 12 CO 0.19 0.08 -1.50 1.15 -0.73 0.00 0.00 179.01 178.19 1gxh h THR 13 N 0.13 1.10 -0.49 0.32 2.02 -1.98 -2.76 112.91 111.24 1gxh h THR 13 Ca 0.60 -2.91 -0.05 0.00 0.77 0.00 0.00 66.41 64.82 1gxh h THR 13 Cb 2.09 2.54 -0.02 0.00 -1.74 0.00 0.00 68.15 71.03 1gxh h THR 13 CO -0.12 0.63 0.13 -0.33 0.37 0.00 0.00 175.52 176.19 1gxh h GLU 14 N 0.00 0.79 -0.63 6.66 5.08 -0.42 0.11 114.58 126.17 1gxh h GLU 14 Ca -0.21 -0.19 -0.06 0.00 -1.00 0.00 0.00 59.36 57.90 1gxh h GLU 14 Cb 1.94 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 31.06 1gxh h GLU 14 CO 0.09 0.76 0.14 0.35 -1.00 0.00 0.00 179.01 179.36 1gxh h PHE 15 N 0.68 1.05 -0.29 4.33 3.57 -1.29 -1.98 116.94 123.00 1gxh h PHE 15 Ca 0.16 -0.12 0.07 0.00 3.53 0.00 0.00 57.97 61.61 1gxh h PHE 15 Cb 0.32 -0.30 -0.07 0.00 2.79 0.00 0.00 35.95 38.69 1gxh h PHE 15 CO 0.02 0.87 -0.21 -0.22 -2.23 0.00 0.00 178.31 176.54 1gxh h LYS 16 N 0.96 -0.18 -0.74 1.11 1.63 -1.19 -0.29 116.57 117.87 1gxh h LYS 16 Ca 0.20 0.01 0.16 0.00 -0.85 0.00 0.00 60.65 60.17 1gxh h LYS 16 Cb 0.36 0.04 -0.11 0.00 -0.60 0.00 0.00 32.23 31.92 1gxh h LYS 16 CO 0.00 -0.12 0.19 -0.22 -3.45 0.00 0.00 179.45 175.86 1gxh h LYS 17 N -0.18 0.27 -0.44 1.90 3.11 -0.21 0.51 116.57 121.54 1gxh h LYS 17 Ca 0.16 -0.02 -0.12 0.00 -2.81 0.00 0.00 60.65 57.86 1gxh h LYS 17 Cb 0.42 -0.06 -0.01 0.00 -1.00 0.00 0.00 32.23 31.57 1gxh h LYS 17 CO -0.40 0.18 -0.21 0.97 -2.81 0.00 0.00 179.45 177.18 1gxh h ILE 18 N 0.28 1.27 0.00 2.00 2.10 -1.09 0.47 117.51 122.54 1gxh h ILE 18 Ca 0.42 -1.35 -0.03 0.00 1.08 0.00 0.00 64.86 64.98 1gxh h ILE 18 Cb 0.72 1.16 -0.00 0.00 -1.09 0.00 0.00 36.82 37.61 1gxh h ILE 18 CO -0.51 0.46 -0.14 0.40 -1.08 0.00 0.00 178.15 177.29 1gxh h ILE 19 N 0.77 0.25 0.16 2.19 1.08 0.71 -2.71 117.51 119.95 1gxh h ILE 19 Ca 0.10 -1.27 -0.35 0.00 -0.39 0.00 0.00 64.86 62.95 1gxh h ILE 19 Cb 0.76 2.05 0.00 0.00 -3.07 0.00 0.00 36.82 36.56 1gxh h ILE 19 CO 0.06 0.13 -1.78 -0.08 -0.69 0.00 0.00 178.15 175.79 1gxh h GLU 20 N 0.00 0.34 -1.00 2.37 4.81 -0.01 -2.78 114.58 118.31 1gxh h GLU 20 Ca -0.00 -0.59 0.23 0.00 -0.13 0.00 0.00 59.36 58.87 1gxh h GLU 20 Cb 1.04 0.22 -0.10 0.00 0.63 0.00 0.00 28.75 30.54 1gxh h GLU 20 CO 0.02 1.26 0.62 0.22 -0.73 0.00 0.00 179.01 180.39 1gxh h ASP 21 N 0.09 0.63 0.00 1.04 1.82 -0.85 0.17 116.42 119.33 1gxh h ASP 21 Ca -0.35 0.10 0.00 0.00 -0.39 0.00 0.00 57.03 56.39 1gxh h ASP 21 Cb 2.08 -0.01 0.00 0.00 0.68 0.00 0.00 39.33 42.08 1gxh h ASP 21 CO 0.15 0.17 0.00 2.30 -1.61 0.00 0.00 179.24 180.25 1gxh n ILE 22 N -4.74 0.00 -0.12 2.25 -5.35 -1.03 -0.68 119.36 109.69 1gxh n ILE 22 Ca 0.24 0.42 -0.05 0.00 -0.27 0.00 0.00 62.75 63.09 1gxh n ILE 22 Cb 0.71 -0.92 0.03 0.00 -1.74 0.00 0.00 39.64 37.72 1gxh n ILE 22 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 1gxh h ILE 23 N 0.00 0.85 -0.00 7.28 1.08 -1.36 -0.67 117.51 124.69 1gxh h ILE 23 Ca 0.00 -0.09 0.00 0.00 -0.39 0.00 0.00 64.86 64.38 1gxh h ILE 23 Cb 0.00 0.57 0.00 0.00 -3.07 0.00 0.00 36.82 34.32 1gxh h ILE 23 CO 0.00 0.05 -0.03 -3.20 -0.69 0.00 0.00 178.15 174.28 1gxh n ASN 24 N -5.04 0.06 -1.69 1.72 5.15 0.58 -4.99 115.26 111.05 1gxh n ASN 24 Ca 0.02 -0.04 -0.01 0.00 -0.60 0.00 0.00 54.58 53.96 1gxh n ASN 24 Cb 0.16 -0.30 0.00 0.00 -0.53 0.00 0.00 39.78 39.11 1gxh n ASN 24 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1gxh n GLU 26 N -0.24 -0.06 -0.05 0.00 -0.58 0.14 -4.92 120.64 114.93 1gxh n GLU 26 Ca 0.01 0.06 0.01 0.00 -0.42 0.00 0.00 57.16 56.81 1gxh n GLU 26 Cb 0.04 -2.35 0.03 0.00 -0.57 0.00 0.00 31.44 28.59 1gxh n GLU 26 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1gxh n GLY 27 N 0.58 0.44 3.32 0.62 0.00 -1.26 -4.54 105.19 104.34 1gxh n GLY 27 Ca 0.12 -0.07 -0.10 0.00 0.00 0.00 0.00 46.02 45.98 1gxh n GLY 27 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1gxh s ASP 28 N -0.54 -0.53 0.17 1.61 -1.08 -1.26 -5.03 116.67 110.01 1gxh s ASP 28 Ca 0.04 0.99 -0.05 0.00 -0.52 0.00 0.00 52.55 53.01 1gxh s ASP 28 Cb 0.03 0.96 0.29 0.00 -1.46 0.00 0.00 42.92 42.74 1gxh s ASP 28 CO 0.02 -0.21 0.98 1.21 0.52 0.00 0.00 175.17 177.69 1gxh n GLU 29 N 4.48 -0.06 0.15 4.34 2.13 -1.26 -1.22 120.64 129.20 1gxh n GLU 29 Ca -0.20 0.98 0.02 0.00 0.66 0.00 0.00 57.16 58.62 1gxh n GLU 29 Cb 0.55 -1.46 0.38 0.00 0.27 0.00 0.00 31.44 31.18 1gxh n GLU 29 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1gxh h LYS 30 N 0.00 0.15 -0.54 5.31 1.79 -1.96 0.95 116.57 122.27 1gxh h LYS 30 Ca 0.30 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.72 1gxh h LYS 30 Cb 0.46 -0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 31.06 1gxh h LYS 30 CO -0.64 0.38 0.30 -0.22 -1.08 0.00 0.00 179.45 178.18 1gxh h LYS 31 N 0.14 0.74 -0.19 3.15 3.11 -1.54 1.00 116.57 122.98 1gxh h LYS 31 Ca 0.02 -0.08 -0.14 0.00 -2.81 0.00 0.00 60.65 57.64 1gxh h LYS 31 Cb 0.48 -0.15 -0.01 0.00 -1.00 0.00 0.00 32.23 31.55 1gxh h LYS 31 CO 0.03 0.57 -0.47 1.96 -2.81 0.00 0.00 179.45 178.73 1gxh h GLN 32 N 0.72 0.49 -0.77 1.90 4.20 -0.91 -1.99 115.11 118.75 1gxh h GLN 32 Ca 0.19 -0.28 -0.00 0.00 0.06 0.00 0.00 58.65 58.62 1gxh h GLN 32 Cb 0.03 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 27.79 1gxh h GLN 32 CO -0.03 0.86 0.48 0.22 -0.67 0.00 0.00 178.83 179.69 1gxh h ASP 33 N 0.40 0.91 -0.41 1.46 3.58 -0.73 -0.50 116.42 121.13 1gxh h ASP 33 Ca 0.02 -0.05 -0.00 0.00 0.42 0.00 0.00 57.03 57.42 1gxh h ASP 33 Cb 0.97 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 41.78 1gxh h ASP 33 CO 0.09 0.69 0.25 -0.78 -2.88 0.00 0.00 179.24 176.61 1gxh h ASP 34 N 1.05 0.48 -0.14 2.28 3.58 -0.58 -0.53 116.42 122.56 1gxh h ASP 34 Ca 0.28 -0.04 0.04 0.00 0.42 0.00 0.00 57.03 57.73 1gxh h ASP 34 Cb -0.07 -0.12 -0.04 0.00 1.72 0.00 0.00 39.33 40.82 1gxh h ASP 34 CO -0.06 0.38 -0.10 -1.13 -2.88 0.00 0.00 179.24 175.46 1gxh h ASN 35 N 0.54 -0.32 -0.26 2.28 -1.24 -1.16 -2.61 115.58 112.81 1gxh h ASN 35 Ca 0.15 0.07 0.04 0.00 0.71 0.00 0.00 56.30 57.26 1gxh h ASN 35 Cb -0.02 0.17 -0.04 0.00 0.73 0.00 0.00 38.32 39.16 1gxh h ASN 35 CO -0.03 -0.13 0.05 -0.07 -1.29 0.00 0.00 177.43 175.96 1gxh h LEU 36 N -0.10 0.00 -0.37 0.34 3.38 0.51 0.54 115.31 119.61 1gxh h LEU 36 Ca 0.09 0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.16 1gxh h LEU 36 Cb 0.23 0.06 -0.06 0.00 0.09 0.00 0.00 40.66 40.99 1gxh h LEU 36 CO -0.21 0.04 0.04 -0.08 0.09 0.00 0.00 178.44 178.31 1gxh h GLU 37 N 0.15 0.14 -0.68 1.13 4.22 -1.48 -2.62 114.58 115.44 1gxh h GLU 37 Ca 0.12 -0.01 -0.06 0.00 0.08 0.00 0.00 59.36 59.49 1gxh h GLU 37 Cb 0.13 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 1gxh h GLU 37 CO -0.17 0.10 0.19 1.25 -2.18 0.00 0.00 179.01 178.20 1gxh h HIS 38 N 0.15 1.12 -0.01 0.92 2.76 -0.30 -0.12 115.15 119.67 1gxh h HIS 38 Ca 0.18 -0.12 0.00 0.00 -2.20 0.00 0.00 60.37 58.23 1gxh h HIS 38 Cb 0.23 -0.32 -0.00 0.00 1.55 0.00 0.00 27.41 28.87 1gxh h HIS 38 CO -0.22 0.91 0.05 0.35 -1.30 0.00 0.00 177.93 177.72 1gxh h PHE 39 N 1.01 0.00 0.15 5.26 3.57 0.05 0.24 116.94 127.22 1gxh h PHE 39 Ca 0.22 0.00 -0.32 0.00 3.53 0.00 0.00 57.97 61.40 1gxh h PHE 39 Cb 0.33 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.07 1gxh h PHE 39 CO 0.03 0.00 -1.55 0.82 -2.23 0.00 0.00 178.31 175.37 1gxh h ILE 40 N 0.00 1.14 0.00 1.41 5.03 -0.81 -3.38 117.51 120.90 1gxh h ILE 40 Ca 0.01 -2.74 0.00 0.00 -0.12 0.00 0.00 64.86 62.00 1gxh h ILE 40 Cb 0.11 2.80 0.00 0.00 -3.03 0.00 0.00 36.82 36.71 1gxh h ILE 40 CO -0.00 0.83 0.00 0.28 -0.68 0.00 0.00 178.15 178.58 1gxh h SER 41 N 0.09 0.00 0.00 1.72 0.02 0.12 -3.36 113.55 112.14 1gxh h SER 41 Ca -0.26 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.62 1gxh h SER 41 Cb 2.05 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.58 1gxh h SER 41 CO 0.18 0.00 -1.23 0.55 -1.14 0.00 0.00 176.83 175.19 1gxh n VAL 42 N -2.56 0.23 -2.46 2.27 3.14 -0.82 -4.93 118.33 113.20 1gxh n VAL 42 Ca 0.04 -0.06 -0.34 0.00 -2.96 0.00 0.00 64.34 61.02 1gxh n VAL 42 Cb 0.42 -1.36 -0.03 0.00 -1.06 0.00 0.00 33.84 31.82 1gxh n VAL 42 CO 0.00 0.00 0.00 0.42 -6.46 0.00 0.00 176.83 170.79 1gxh s THR 43 N -2.08 3.71 -2.59 1.55 -4.23 -1.26 -3.84 115.64 106.91 1gxh s THR 43 Ca -0.06 1.04 0.25 0.00 -1.18 0.00 0.00 61.69 61.74 1gxh s THR 43 Cb 0.02 -3.42 0.43 0.00 1.34 0.00 0.00 72.50 70.86 1gxh s THR 43 CO 0.08 -0.26 1.55 -0.62 -0.54 0.00 0.00 174.62 174.83 1gxh n GLU 44 N -1.11 1.93 -2.07 3.99 1.02 -1.26 -4.82 120.64 118.31 1gxh n GLU 44 Ca 0.09 -1.37 -0.41 0.00 -0.02 0.00 0.00 57.16 55.45 1gxh n GLU 44 Cb 0.52 -1.46 -0.03 0.00 -0.02 0.00 0.00 31.44 30.45 1gxh n GLU 44 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1gxh s HIS 45 N -1.91 1.84 0.36 -0.32 2.46 -1.26 -4.89 115.29 111.57 1gxh s HIS 45 Ca 0.34 0.69 0.06 0.00 0.47 0.00 0.00 55.06 56.62 1gxh s HIS 45 Cb 0.20 -4.14 0.70 0.00 -0.13 0.00 0.00 32.58 29.21 1gxh s HIS 45 CO 0.31 -2.53 1.93 -1.00 -2.47 0.00 0.00 174.74 170.98 1gxh h PRO 46 N 13.38 0.49 0.00 2.88 0.13 -1.99 -1.27 132.00 145.62 1gxh h PRO 46 Ca -0.30 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 1gxh h PRO 46 Cb 1.16 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1gxh h PRO 46 CO 1.12 0.47 0.00 0.77 -0.23 0.00 0.00 178.00 180.13 1gxh h SER 47 N 0.48 0.00 0.00 1.44 0.02 -2.01 -3.48 113.55 110.01 1gxh h SER 47 Ca 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1gxh h SER 47 Cb 0.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.76 1gxh h SER 47 CO -0.00 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.30 1gxh n GLY 48 N -0.15 2.66 0.05 -3.77 0.00 -0.48 -1.68 105.19 101.82 1gxh n GLY 48 Ca 0.01 0.18 0.02 0.00 0.00 0.00 0.00 46.02 46.23 1gxh n GLY 48 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1gxh n SER 49 N 2.90 0.11 -0.31 1.61 3.41 -1.26 -2.41 113.62 117.67 1gxh n SER 49 Ca 0.00 0.42 0.08 0.00 -0.26 0.00 0.00 58.87 59.11 1gxh n SER 49 Cb 0.00 -0.41 0.29 0.00 -0.26 0.00 0.00 64.21 63.82 1gxh n SER 49 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1gxh h ASP 50 N 0.00 0.83 0.72 4.04 3.32 -1.66 -1.25 116.42 122.42 1gxh h ASP 50 Ca 0.00 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1gxh h ASP 50 Cb 0.36 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.77 1gxh h ASP 50 CO 0.00 0.47 0.00 -0.07 -1.72 0.00 0.00 179.24 177.92 1gxh h LEU 51 N 0.91 0.00 0.03 1.55 4.07 -1.71 0.31 115.31 120.46 1gxh h LEU 51 Ca 0.44 0.00 -0.31 0.00 0.08 0.00 0.00 57.88 58.09 1gxh h LEU 51 Cb 0.46 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.16 1gxh h LEU 51 CO -0.21 0.00 -1.79 -0.38 -1.08 0.00 0.00 178.44 174.98 1gxh n ILE 52 N -2.57 1.64 0.00 1.22 5.41 -0.51 -4.63 119.36 119.91 1gxh n ILE 52 Ca 0.01 -0.77 0.00 0.00 1.00 0.00 0.00 62.75 62.99 1gxh n ILE 52 Cb 0.23 -1.17 0.00 0.00 -0.71 0.00 0.00 39.64 37.99 1gxh n ILE 52 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 1gxh n TYR 53 N -3.13 0.00 -3.17 1.39 4.01 -0.88 -4.87 117.16 110.50 1gxh n TYR 53 Ca -0.21 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.31 1gxh n TYR 53 Cb 1.05 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 40.03 1gxh n TYR 53 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1gxh n TYR 54 N -1.98 1.23 -1.36 -0.72 4.01 0.10 -5.07 117.16 113.38 1gxh n TYR 54 Ca 0.00 -3.83 -0.29 0.00 -0.16 0.00 0.00 57.90 53.63 1gxh n TYR 54 Cb 0.43 -0.43 0.15 0.00 -0.31 0.00 0.00 39.34 39.18 1gxh n TYR 54 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1gxh s PRO 55 N -2.28 0.89 0.00 -0.72 0.04 -1.18 -4.55 135.00 127.20 1gxh s PRO 55 Ca 0.40 0.43 0.00 0.00 0.04 0.00 0.00 61.00 61.87 1gxh s PRO 55 Cb 0.26 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 33.00 1gxh s PRO 55 CO -0.09 -2.40 0.00 0.39 0.04 0.00 0.00 177.00 174.94 1gxh n GLU 56 N -3.93 -0.66 -0.00 4.56 -0.58 -1.26 -5.02 120.64 113.74 1gxh n GLU 56 Ca 0.06 0.00 0.02 0.00 -0.42 0.00 0.00 57.16 56.82 1gxh n GLU 56 Cb 0.58 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 31.42 1gxh n GLU 56 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1gxh n GLY 57 N 2.09 -0.04 0.29 0.62 0.00 -1.26 -4.14 105.19 102.76 1gxh n GLY 57 Ca 0.00 -0.10 0.18 0.00 0.00 0.00 0.00 46.02 46.10 1gxh n GLY 57 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1gxh h ASN 58 N 0.00 0.00 -2.73 1.61 -1.24 -2.01 -3.44 115.58 107.77 1gxh h ASN 58 Ca 0.00 0.00 -0.55 0.00 0.71 0.00 0.00 56.30 56.46 1gxh h ASN 58 Cb 0.17 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 39.17 1gxh h ASN 58 CO 0.00 0.03 1.19 0.21 -1.29 0.00 0.00 177.43 177.57 1gxh s ASN 59 N -5.66 5.95 -0.05 1.15 3.84 -1.26 -4.87 114.94 114.03 1gxh s ASN 59 Ca -0.00 0.70 0.01 0.00 0.21 0.00 0.00 52.86 53.78 1gxh s ASN 59 Cb 0.10 -2.54 0.11 0.00 -0.55 0.00 0.00 41.25 38.37 1gxh s ASN 59 CO 0.53 -1.77 0.96 -0.90 -2.79 0.00 0.00 177.10 173.13 1gxh n ASP 60 N 10.21 2.58 0.00 -4.21 5.75 -1.26 -4.84 116.55 124.78 1gxh n ASP 60 Ca 0.18 -2.20 0.00 0.00 -0.01 0.00 0.00 54.79 52.76 1gxh n ASP 60 Cb 0.49 -0.54 0.00 0.00 -1.03 0.00 0.00 41.12 40.04 1gxh n ASP 60 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1gxh n GLY 61 N 0.20 0.27 3.74 6.12 0.00 -1.26 -4.83 105.19 109.42 1gxh n GLY 61 Ca 0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 1gxh n GLY 61 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1gxh s SER 62 N -2.09 4.63 0.52 1.61 0.01 -1.26 -4.97 113.70 112.15 1gxh s SER 62 Ca 0.00 -0.83 0.19 0.00 1.31 0.00 0.00 55.95 56.62 1gxh s SER 62 Cb 0.00 -0.67 1.33 0.00 0.21 0.00 0.00 66.02 66.89 1gxh s SER 62 CO 0.00 -0.35 2.13 1.55 0.41 0.00 0.00 173.24 176.98 1gxh h PRO 63 N 1.52 0.00 0.03 12.44 0.13 -1.92 -0.43 132.00 143.76 1gxh h PRO 63 Ca -0.43 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.73 1gxh h PRO 63 Cb 1.25 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.33 1gxh h PRO 63 CO 0.64 0.05 -0.36 0.93 -0.23 0.00 0.00 178.00 179.03 1gxh h GLU 64 N 0.00 -0.52 -1.00 0.86 4.39 -1.95 -2.56 114.58 113.81 1gxh h GLU 64 Ca -0.00 0.04 0.19 0.00 0.34 0.00 0.00 59.36 59.93 1gxh h GLU 64 Cb 0.09 0.12 -0.10 0.00 -0.10 0.00 0.00 28.75 28.75 1gxh h GLU 64 CO 0.01 -0.34 0.61 0.00 -1.16 0.00 0.00 179.01 178.13 1gxh h ALA 65 N 0.10 1.72 -0.26 3.43 0.00 -1.40 0.13 119.26 122.99 1gxh h ALA 65 Ca 0.05 0.07 -0.14 0.00 0.00 0.00 0.00 54.91 54.89 1gxh h ALA 65 Cb 0.61 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1gxh h ALA 65 CO -0.27 -0.09 -0.39 0.28 0.00 0.00 0.00 179.25 178.78 1gxh h VAL 66 N 0.74 1.31 -0.52 0.00 2.07 -1.27 0.38 116.25 118.95 1gxh h VAL 66 Ca 0.57 -1.59 -0.01 0.00 0.82 0.00 0.00 66.70 66.50 1gxh h VAL 66 Cb 0.93 1.70 -0.02 0.00 -1.52 0.00 0.00 31.29 32.37 1gxh h VAL 66 CO -0.36 0.50 0.30 0.40 0.02 0.00 0.00 177.57 178.43 1gxh h ILE 67 N 0.44 1.17 -0.30 4.57 5.03 -0.63 -0.13 117.51 127.66 1gxh h ILE 67 Ca 0.02 -0.40 0.07 0.00 -0.12 0.00 0.00 64.86 64.43 1gxh h ILE 67 Cb 0.98 0.49 -0.07 0.00 -3.03 0.00 0.00 36.82 35.19 1gxh h ILE 67 CO 0.09 0.17 -0.21 0.11 -0.68 0.00 0.00 178.15 177.64 1gxh h LYS 68 N 0.69 -0.17 0.00 2.37 1.57 -0.68 0.15 116.57 120.49 1gxh h LYS 68 Ca 0.18 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.95 1gxh h LYS 68 Cb 0.02 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.36 1gxh h LYS 68 CO -0.03 -0.12 -0.13 0.93 -0.57 0.00 0.00 179.45 179.53 1gxh h GLU 69 N -0.18 0.00 0.14 3.15 3.07 -0.20 0.24 114.58 120.80 1gxh h GLU 69 Ca 0.16 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.01 1gxh h GLU 69 Cb 0.42 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.33 1gxh h GLU 69 CO -0.40 0.13 -0.07 0.82 -1.40 0.00 0.00 179.01 178.09 1gxh h ILE 70 N 0.00 0.24 -0.73 3.13 1.08 0.07 0.38 117.51 121.68 1gxh h ILE 70 Ca -0.00 -1.00 0.07 0.00 -0.39 0.00 0.00 64.86 63.53 1gxh h ILE 70 Cb 0.26 0.43 -0.10 0.00 -3.07 0.00 0.00 36.82 34.34 1gxh h ILE 70 CO 0.02 0.07 -0.56 0.11 -0.69 0.00 0.00 178.15 177.10 1gxh h LYS 71 N -1.03 -0.15 0.00 2.37 1.57 -0.67 -0.56 116.57 118.10 1gxh h LYS 71 Ca -0.02 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1gxh h LYS 71 Cb 0.26 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1gxh h LYS 71 CO 0.03 -0.10 -0.48 -1.91 -0.57 0.00 0.00 179.45 176.42 1gxh n GLU 72 N -5.22 0.27 0.04 3.15 4.07 0.85 0.16 120.64 123.96 1gxh n GLU 72 Ca -0.00 0.11 -0.13 0.00 -0.06 0.00 0.00 57.16 57.08 1gxh n GLU 72 Cb 0.28 -1.70 -0.09 0.00 -0.06 0.00 0.00 31.44 29.88 1gxh n GLU 72 CO 0.00 0.00 0.00 2.35 -0.06 0.00 0.00 177.13 179.42 1gxh h TRP 73 N 0.00 -0.11 -0.44 4.31 7.01 -0.81 0.41 115.95 126.33 1gxh h TRP 73 Ca 0.00 -0.00 0.07 0.00 2.11 0.00 0.00 58.89 61.06 1gxh h TRP 73 Cb 0.73 0.03 -0.02 0.00 -2.10 0.00 0.00 29.16 27.80 1gxh h TRP 73 CO 0.00 0.28 0.29 0.00 -2.79 0.00 0.00 178.44 176.22 1gxh h ARG 74 N -0.51 0.30 0.00 2.65 2.47 -0.46 0.31 114.38 119.14 1gxh h ARG 74 Ca -0.01 -0.02 -0.03 0.00 -1.26 0.00 0.00 59.98 58.66 1gxh h ARG 74 Cb 0.43 -0.07 -0.00 0.00 -1.65 0.00 0.00 29.97 28.68 1gxh h ARG 74 CO 0.02 0.20 -0.24 0.00 0.56 0.00 0.00 179.97 180.51 1gxh h ALA 75 N 1.77 0.87 0.06 0.04 0.00 -0.07 0.10 119.26 122.03 1gxh h ALA 75 Ca 0.19 -0.15 -0.24 0.00 0.00 0.00 0.00 54.91 54.72 1gxh h ALA 75 Cb 0.37 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1gxh h ALA 75 CO -0.04 0.20 -1.09 0.00 0.00 0.00 0.00 179.25 178.32 1gxh h ALA 76 N 1.85 0.27 0.00 0.00 0.00 0.28 -3.33 119.26 118.32 1gxh h ALA 76 Ca -0.01 -0.84 -0.11 0.00 0.00 0.00 0.00 54.91 53.95 1gxh h ALA 76 Cb 1.12 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 1gxh h ALA 76 CO 0.02 1.01 -0.54 -0.91 0.00 0.00 0.00 179.25 178.83 1gxh h ASN 77 N 0.08 0.00 0.00 0.00 2.35 -0.60 -3.46 115.58 113.95 1gxh h ASN 77 Ca -0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 1gxh h ASN 77 Cb 1.79 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.16 1gxh h ASN 77 CO 0.17 0.54 0.00 0.61 -1.65 0.00 0.00 177.43 177.10 1gxh n GLY 78 N 0.49 0.01 0.05 2.83 0.00 0.20 -5.07 105.19 103.70 1gxh n GLY 78 Ca -0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 46.02 45.75 1gxh n GLY 78 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1gxh n LYS 79 N 0.00 0.00 -3.09 1.61 5.02 -0.24 -4.77 118.16 116.70 1gxh n LYS 79 Ca 0.00 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.13 1gxh n LYS 79 Cb 0.00 -0.02 -0.05 0.00 -0.02 0.00 0.00 35.03 34.94 1gxh n LYS 79 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1gxh s SER 80 N 0.11 0.02 0.00 4.39 0.01 -1.25 -4.92 113.70 112.06 1gxh s SER 80 Ca 0.02 -2.42 0.00 0.00 1.31 0.00 0.00 55.95 54.86 1gxh s SER 80 Cb -0.02 0.70 0.00 0.00 0.21 0.00 0.00 66.02 66.90 1gxh s SER 80 CO 0.01 -0.11 0.00 0.61 0.41 0.00 0.00 173.24 174.16 1gxh n GLY 81 N 2.90 0.28 0.00 3.44 0.00 -1.26 -4.86 105.19 105.69 1gxh n GLY 81 Ca 0.24 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.48 1gxh n GLY 81 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1gxh n PHE 82 N 0.00 -1.56 -1.46 1.61 3.72 -1.26 -4.61 117.46 113.90 1gxh n PHE 82 Ca 0.00 0.00 -0.50 0.00 -0.05 0.00 0.00 57.45 56.90 1gxh n PHE 82 Cb 0.00 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.50 1gxh n PHE 82 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1gxh n LYS 83 N -0.86 0.31 -2.67 -1.08 3.00 -1.25 -4.87 118.16 110.74 1gxh n LYS 83 Ca 0.00 0.11 -0.09 0.00 -0.00 0.00 0.00 58.31 58.33 1gxh n LYS 83 Cb 0.00 -1.30 0.03 0.00 0.00 0.00 0.00 35.03 33.76 1gxh n LYS 83 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.40 178.34 1gxh n GLN 84 N 1.13 1.39 0.00 1.64 7.27 -1.26 -4.44 117.38 123.12 1gxh n GLN 84 Ca 0.17 -3.37 0.00 0.00 0.07 0.00 0.00 57.00 53.87 1gxh n GLN 84 Cb 0.23 -1.36 0.00 0.00 2.41 0.00 0.00 30.24 31.51 1gxh n GLN 84 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54