#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xn7 s ALA 2 N 0.00 -2.00 -0.13 3.04 0.00 -1.26 -4.62 121.76 116.79 1xn7 s ALA 2 Ca 0.00 1.78 -0.34 0.00 0.00 0.00 0.00 51.96 53.40 1xn7 s ALA 2 Cb 0.00 -1.31 0.15 0.00 0.00 0.00 0.00 23.12 21.96 1xn7 s ALA 2 CO 0.00 -0.24 1.44 -1.54 0.00 0.00 0.00 175.76 175.42 1xn7 s SER 3 N -0.16 -0.00 0.30 0.00 1.04 -1.26 -4.96 113.70 108.65 1xn7 s SER 3 Ca 0.03 -0.00 -0.00 0.00 0.48 0.00 0.00 55.95 56.45 1xn7 s SER 3 Cb -0.04 0.01 0.45 0.00 0.10 0.00 0.00 66.02 66.54 1xn7 s SER 3 CO -0.06 -0.01 1.86 -0.07 0.98 0.00 0.00 173.24 175.95 1xn7 h LEU 4 N 2.00 0.75 -1.14 2.42 3.38 -2.01 -1.32 115.31 119.39 1xn7 h LEU 4 Ca -0.28 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.51 1xn7 h LEU 4 Cb 1.18 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.72 1xn7 h LEU 4 CO 0.28 0.70 -0.13 0.40 0.09 0.00 0.00 178.44 179.79 1xn7 h ILE 5 N 0.79 1.22 0.34 1.22 1.08 -1.97 0.18 117.51 120.38 1xn7 h ILE 5 Ca 0.18 -0.99 -0.02 0.00 -0.39 0.00 0.00 64.86 63.65 1xn7 h ILE 5 Cb 0.22 1.16 0.00 0.00 -3.07 0.00 0.00 36.82 35.13 1xn7 h ILE 5 CO -0.01 0.32 -0.16 1.56 -0.69 0.00 0.00 178.15 179.17 1xn7 h GLN 6 N 0.42 -0.44 -0.52 2.37 4.20 -1.63 1.47 115.11 120.98 1xn7 h GLN 6 Ca 0.08 0.03 -0.07 0.00 0.06 0.00 0.00 58.65 58.75 1xn7 h GLN 6 Cb 0.48 0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.33 1xn7 h GLN 6 CO 0.03 -0.23 0.04 -0.24 -0.67 0.00 0.00 178.83 177.76 1xn7 h VAL 7 N -0.57 1.24 0.19 -0.54 3.04 -1.26 0.91 116.25 119.26 1xn7 h VAL 7 Ca -0.05 -0.96 -0.01 0.00 -1.01 0.00 0.00 66.70 64.67 1xn7 h VAL 7 Cb 0.42 0.80 0.00 0.00 -2.01 0.00 0.00 31.29 30.50 1xn7 h VAL 7 CO 0.08 0.35 -0.09 0.03 -1.01 0.00 0.00 177.57 176.92 1xn7 h ARG 8 N 0.79 -0.25 -0.27 4.17 3.08 -0.40 0.45 114.38 121.95 1xn7 h ARG 8 Ca 0.16 0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.27 1xn7 h ARG 8 Cb 0.41 0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.48 1xn7 h ARG 8 CO 0.01 0.09 0.00 0.22 -1.07 0.00 0.00 179.97 179.22 1xn7 h ASP 9 N -0.62 -0.10 -0.18 7.04 -0.00 0.22 0.99 116.42 123.77 1xn7 h ASP 9 Ca -0.03 0.06 -0.00 0.00 -0.00 0.00 0.00 57.03 57.06 1xn7 h ASP 9 Cb 0.45 0.10 -0.01 0.00 -0.00 0.00 0.00 39.33 39.88 1xn7 h ASP 9 CO 0.04 -0.02 0.11 -0.07 -0.00 0.00 0.00 179.24 179.30 1xn7 h LEU 10 N 0.08 0.22 -2.01 2.28 -0.00 -0.80 1.59 115.31 116.68 1xn7 h LEU 10 Ca 0.13 -0.05 0.16 0.00 -0.00 0.00 0.00 57.88 58.12 1xn7 h LEU 10 Cb 0.16 -0.06 -0.02 0.00 -0.00 0.00 0.00 40.66 40.75 1xn7 h LEU 10 CO -0.21 0.21 0.41 -0.07 -0.00 0.00 0.00 178.44 178.77 1xn7 h LEU 11 N 0.22 0.00 0.00 1.67 3.38 0.63 1.56 115.31 122.77 1xn7 h LEU 11 Ca 0.07 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.97 1xn7 h LEU 11 Cb 0.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1xn7 h LEU 11 CO -0.01 0.00 -0.56 0.00 0.09 0.00 0.00 178.44 177.96 1xn7 h ALA 12 N 1.70 0.08 0.54 1.53 0.00 0.60 -0.68 119.26 123.03 1xn7 h ALA 12 Ca 0.26 -0.61 -0.02 0.00 0.00 0.00 0.00 54.91 54.54 1xn7 h ALA 12 Cb 1.07 0.41 -0.02 0.00 0.00 0.00 0.00 17.79 19.26 1xn7 h ALA 12 CO -0.00 0.40 -0.48 -0.07 0.00 0.00 0.00 179.25 179.10 1xn7 h LEU 13 N -1.00 -1.30 0.00 0.00 3.38 0.28 -1.54 115.31 115.13 1xn7 h LEU 13 Ca -0.10 0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xn7 h LEU 13 Cb 0.70 0.42 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1xn7 h LEU 13 CO -0.06 -0.66 0.00 0.54 0.09 0.00 0.00 178.44 178.35 1xn7 n ARG 14 N -5.39 0.23 0.00 1.13 3.00 0.53 -5.00 116.66 111.16 1xn7 n ARG 14 Ca -0.12 0.04 0.00 0.00 -0.01 0.00 0.00 57.85 57.76 1xn7 n ARG 14 Cb 0.45 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.41 1xn7 n ARG 14 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1xn7 n GLY 15 N 1.10 -0.02 3.76 -0.13 0.00 -0.27 -4.77 105.19 104.87 1xn7 n GLY 15 Ca 0.10 -0.97 -0.41 0.00 0.00 0.00 0.00 46.02 44.73 1xn7 n GLY 15 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1xn7 n ARG 16 N 0.00 2.65 -3.62 1.61 0.00 -1.20 -4.28 116.66 111.82 1xn7 n ARG 16 Ca 0.00 0.93 -0.03 0.00 -0.00 0.00 0.00 57.85 58.75 1xn7 n ARG 16 Cb 0.00 -2.67 -0.02 0.00 -0.00 0.00 0.00 32.46 29.77 1xn7 n ARG 16 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.63 179.04 1xn7 s MET 17 N -1.62 0.18 0.63 2.89 1.75 -0.19 -4.98 119.30 117.96 1xn7 s MET 17 Ca 0.56 -0.05 -0.16 0.00 -1.25 0.00 0.00 55.69 54.79 1xn7 s MET 17 Cb -0.49 0.08 -0.02 0.00 2.84 0.00 0.00 34.83 37.25 1xn7 s MET 17 CO 0.59 -0.07 1.12 -1.83 -0.65 0.00 0.00 175.02 174.18 1xn7 s GLU 18 N -2.05 2.93 0.21 4.11 1.03 -1.26 -2.50 118.70 121.17 1xn7 s GLU 18 Ca 0.10 1.47 -0.06 0.00 0.03 0.00 0.00 54.97 56.50 1xn7 s GLU 18 Cb -0.01 -1.96 0.18 0.00 -0.80 0.00 0.00 34.13 31.54 1xn7 s GLU 18 CO -0.04 -1.16 1.70 0.00 -1.33 0.00 0.00 175.26 174.43 1xn7 h ALA 19 N 0.34 0.95 -1.10 -0.84 0.00 -1.92 -2.32 119.26 114.37 1xn7 h ALA 19 Ca -0.48 -0.29 0.33 0.00 0.00 0.00 0.00 54.91 54.47 1xn7 h ALA 19 Cb 1.25 -0.22 -0.12 0.00 0.00 0.00 0.00 17.79 18.70 1xn7 h ALA 19 CO 0.55 0.64 0.68 0.00 0.00 0.00 0.00 179.25 181.12 1xn7 h ALA 20 N 1.11 2.25 0.01 0.00 0.00 -1.92 1.61 119.26 122.32 1xn7 h ALA 20 Ca 0.17 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 1xn7 h ALA 20 Cb 0.50 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1xn7 h ALA 20 CO 0.02 -0.79 -0.01 1.96 0.00 0.00 0.00 179.25 180.44 1xn7 h GLN 21 N 0.30 -0.02 -0.89 0.00 1.08 -1.81 -2.71 115.11 111.06 1xn7 h GLN 21 Ca 0.71 0.00 0.10 0.00 -1.45 0.00 0.00 58.65 58.01 1xn7 h GLN 21 Cb 1.83 0.00 -0.07 0.00 -0.05 0.00 0.00 27.48 29.20 1xn7 h GLN 21 CO -0.44 0.78 0.58 0.82 -0.95 0.00 0.00 178.83 179.61 1xn7 h ILE 22 N -0.88 0.95 -0.03 2.54 2.04 -0.34 -0.28 117.51 121.51 1xn7 h ILE 22 Ca -0.00 -0.30 -0.00 0.00 1.00 0.00 0.00 64.86 65.56 1xn7 h ILE 22 Cb 0.80 0.01 -0.00 0.00 -0.74 0.00 0.00 36.82 36.89 1xn7 h ILE 22 CO 0.00 0.16 0.02 0.77 0.00 0.00 0.00 178.15 179.10 1xn7 h SER 23 N 0.86 0.04 -0.63 1.72 4.64 0.21 -2.78 113.55 117.61 1xn7 h SER 23 Ca 0.42 -0.11 0.06 0.00 -0.47 0.00 0.00 61.79 61.69 1xn7 h SER 23 Cb 0.45 -0.01 -0.06 0.00 -0.31 0.00 0.00 62.40 62.47 1xn7 h SER 23 CO -0.18 0.14 0.33 1.56 -0.87 0.00 0.00 176.83 177.81 1xn7 h GLN 24 N -0.06 0.59 -0.86 4.77 1.08 -0.90 1.72 115.11 121.46 1xn7 h GLN 24 Ca 0.01 -0.04 0.22 0.00 -1.45 0.00 0.00 58.65 57.40 1xn7 h GLN 24 Cb 0.11 -0.13 -0.15 0.00 -0.05 0.00 0.00 27.48 27.26 1xn7 h GLN 24 CO -0.00 0.39 0.13 1.15 -0.95 0.00 0.00 178.83 179.55 1xn7 h THR 25 N 0.61 0.27 -0.80 -0.54 2.02 -0.82 1.15 112.91 114.80 1xn7 h THR 25 Ca 0.29 -0.05 -0.43 0.00 0.77 0.00 0.00 66.41 66.99 1xn7 h THR 25 Cb 0.21 0.12 -0.25 0.00 -1.74 0.00 0.00 68.15 66.49 1xn7 h THR 25 CO -0.20 0.03 0.42 0.00 0.37 0.00 0.00 175.52 176.13 1xn7 n LEU 26 N -5.31 5.99 -2.51 2.58 -0.00 -0.64 -4.88 117.00 112.22 1xn7 n LEU 26 Ca 0.19 -3.75 -0.02 0.00 -0.00 0.00 0.00 56.01 52.44 1xn7 n LEU 26 Cb 0.63 -0.78 -0.00 0.00 -0.00 0.00 0.00 43.42 43.27 1xn7 n LEU 26 CO 0.03 1.18 -0.01 -3.20 -0.00 0.00 0.00 177.39 175.39 1xn7 n ASN 27 N -1.12 -0.99 -4.86 1.45 5.15 0.40 -4.74 115.26 110.55 1xn7 n ASN 27 Ca 0.52 0.40 -0.32 0.00 -0.60 0.00 0.00 54.58 54.58 1xn7 n ASN 27 Cb 1.39 -0.98 -0.05 0.00 -0.53 0.00 0.00 39.78 39.60 1xn7 n ASN 27 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1xn7 s THR 28 N -1.97 4.75 0.12 -0.44 2.01 0.58 -4.92 115.64 115.77 1xn7 s THR 28 Ca 0.04 0.78 -0.30 0.00 0.31 0.00 0.00 61.69 62.52 1xn7 s THR 28 Cb -0.02 -3.64 -0.07 0.00 0.01 0.00 0.00 72.50 68.78 1xn7 s THR 28 CO 0.05 -0.25 1.14 -2.16 -0.69 0.00 0.00 174.62 172.70 1xn7 s PRO 29 N -3.19 4.52 0.23 4.92 0.04 -1.26 -3.93 135.00 136.33 1xn7 s PRO 29 Ca 0.52 1.74 -0.13 0.00 0.04 0.00 0.00 61.00 63.17 1xn7 s PRO 29 Cb -0.10 -3.31 0.30 0.00 0.04 0.00 0.00 34.50 31.42 1xn7 s PRO 29 CO 0.22 -0.08 1.43 0.94 0.04 0.00 0.00 177.00 179.55 1xn7 n GLN 30 N 3.07 -0.17 -0.85 4.56 0.00 -1.26 -0.45 117.38 122.29 1xn7 n GLN 30 Ca 0.05 1.43 -0.17 0.00 -0.00 0.00 0.00 57.00 58.31 1xn7 n GLN 30 Cb 0.46 -2.12 -0.08 0.00 0.00 0.00 0.00 30.24 28.50 1xn7 n GLN 30 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.06 176.71 1xn7 n PRO 31 N -5.41 2.03 0.00 3.69 -0.04 -1.26 -3.07 135.00 130.94 1xn7 n PRO 31 Ca 0.11 -1.17 0.00 0.00 -0.04 0.00 0.00 63.50 62.40 1xn7 n PRO 31 Cb 0.40 -2.18 0.00 0.00 -0.04 0.00 0.00 33.50 31.69 1xn7 n PRO 31 CO 0.00 0.00 0.00 -0.12 -0.04 0.00 0.00 175.50 175.34 1xn7 n MET 32 N 3.17 0.00 0.06 0.54 1.56 0.40 -4.87 117.12 117.98 1xn7 n MET 32 Ca 0.43 0.00 -0.18 0.00 -0.27 0.00 0.00 57.70 57.68 1xn7 n MET 32 Cb 0.48 -0.14 -0.09 0.00 2.15 0.00 0.00 33.22 35.62 1xn7 n MET 32 CO 0.00 0.00 0.00 0.82 -0.73 0.00 0.00 175.97 176.06 1xn7 h ILE 33 N 0.00 1.32 -0.96 1.12 1.08 -1.63 -3.16 117.51 115.28 1xn7 h ILE 33 Ca 0.00 -2.39 0.18 0.00 -0.39 0.00 0.00 64.86 62.26 1xn7 h ILE 33 Cb 0.00 2.48 -0.09 0.00 -3.07 0.00 0.00 36.82 36.15 1xn7 h ILE 33 CO 0.00 0.73 0.61 0.78 -0.69 0.00 0.00 178.15 179.57 1xn7 h ASN 34 N 0.31 0.67 -0.42 1.72 2.35 -1.89 0.34 115.58 118.66 1xn7 h ASN 34 Ca -0.13 0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 1xn7 h ASN 34 Cb 1.72 -0.06 -0.02 0.00 0.05 0.00 0.00 38.32 40.01 1xn7 h ASN 34 CO 0.20 0.27 0.28 0.00 -1.65 0.00 0.00 177.43 176.53 1xn7 h ALA 35 N 1.61 0.54 -0.06 -0.83 0.00 -1.86 0.19 119.26 118.85 1xn7 h ALA 35 Ca 0.52 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.39 1xn7 h ALA 35 Cb 0.92 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1xn7 h ALA 35 CO -0.28 -0.01 -0.00 0.52 0.00 0.00 0.00 179.25 179.48 1xn7 h MET 36 N 0.57 0.11 -0.78 0.00 2.86 -0.63 -2.55 114.93 114.52 1xn7 h MET 36 Ca 0.15 -0.04 0.10 0.00 -2.06 0.00 0.00 59.70 57.85 1xn7 h MET 36 Cb -0.06 -0.01 -0.05 0.00 0.06 0.00 0.00 31.60 31.54 1xn7 h MET 36 CO -0.03 0.39 0.51 -0.07 1.06 0.00 0.00 176.91 178.77 1xn7 h LEU 37 N -0.18 0.64 -1.12 1.22 3.38 -0.28 0.14 115.31 119.11 1xn7 h LEU 37 Ca 0.02 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 1xn7 h LEU 37 Cb 0.34 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1xn7 h LEU 37 CO 0.00 0.38 0.26 -0.61 0.09 0.00 0.00 178.44 178.57 1xn7 h GLN 38 N 0.71 0.88 -0.13 1.13 -0.00 -0.36 0.17 115.11 117.52 1xn7 h GLN 38 Ca 0.36 -0.13 -0.08 0.00 -0.00 0.00 0.00 58.65 58.80 1xn7 h GLN 38 Cb 0.45 -0.16 0.00 0.00 0.00 0.00 0.00 27.48 27.77 1xn7 h GLN 38 CO -0.14 0.71 -0.24 0.37 0.00 0.00 0.00 178.83 179.54 1xn7 h GLN 39 N 0.87 0.39 -0.80 1.69 -0.00 -0.40 -2.49 115.11 114.36 1xn7 h GLN 39 Ca 0.21 -0.24 -0.00 0.00 -0.00 0.00 0.00 58.65 58.62 1xn7 h GLN 39 Cb 0.14 0.03 -0.04 0.00 0.00 0.00 0.00 27.48 27.61 1xn7 h GLN 39 CO -0.02 0.84 0.50 -0.07 0.00 0.00 0.00 178.83 180.08 1xn7 h LEU 40 N -0.02 0.95 -0.11 -2.39 3.38 -0.75 -1.78 115.31 114.59 1xn7 h LEU 40 Ca 0.01 -0.05 0.03 0.00 0.09 0.00 0.00 57.88 57.95 1xn7 h LEU 40 Cb 0.82 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 1xn7 h LEU 40 CO 0.05 0.72 -0.08 -0.08 0.09 0.00 0.00 178.44 179.15 1xn7 h GLU 41 N 1.10 -0.08 -0.12 1.13 4.81 -0.63 0.61 114.58 121.39 1xn7 h GLU 41 Ca 0.29 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.57 1xn7 h GLU 41 Cb -0.07 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.28 1xn7 h GLU 41 CO -0.06 -0.05 -0.19 1.03 -0.73 0.00 0.00 179.01 179.01 1xn7 h SER 42 N -0.09 -0.57 -0.42 1.04 0.87 -1.02 -2.21 113.55 111.15 1xn7 h SER 42 Ca 0.07 0.10 0.01 0.00 -1.23 0.00 0.00 61.79 60.73 1xn7 h SER 42 Cb 0.19 0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 62.39 1xn7 h SER 42 CO -0.16 -0.24 0.27 0.24 -0.53 0.00 0.00 176.83 176.42 1xn7 h MET 43 N -0.24 0.54 -0.04 2.24 2.86 -0.92 -3.47 114.93 115.90 1xn7 h MET 43 Ca 0.09 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 1xn7 h MET 43 Cb 0.38 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.92 1xn7 h MET 43 CO -0.26 0.36 0.00 0.41 1.06 0.00 0.00 176.91 178.48 1xn7 n GLY 44 N -1.21 0.72 0.14 8.32 0.00 0.21 -5.05 105.19 108.32 1xn7 n GLY 44 Ca 0.01 -0.02 -0.28 0.00 0.00 0.00 0.00 46.02 45.73 1xn7 n GLY 44 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xn7 n LYS 45 N -0.02 0.59 -2.58 1.61 4.76 -0.90 -5.00 118.16 116.62 1xn7 n LYS 45 Ca 0.00 0.29 -0.23 0.00 -2.87 0.00 0.00 58.31 55.50 1xn7 n LYS 45 Cb 0.01 -1.52 0.09 0.00 -1.84 0.00 0.00 35.03 31.77 1xn7 n LYS 45 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1xn7 s ALA 46 N -2.49 3.71 0.09 7.82 0.00 -1.26 -2.78 121.76 126.85 1xn7 s ALA 46 Ca -0.37 -1.62 0.04 0.00 0.00 0.00 0.00 51.96 50.01 1xn7 s ALA 46 Cb 0.14 -2.05 -0.03 0.00 0.00 0.00 0.00 23.12 21.17 1xn7 s ALA 46 CO 0.51 -1.32 -0.12 0.14 0.00 0.00 0.00 175.76 174.97 1xn7 s VAL 47 N -3.08 1.05 0.11 0.00 -7.23 0.05 -4.70 120.40 106.60 1xn7 s VAL 47 Ca 0.64 -1.55 -0.23 0.00 -1.81 0.00 0.00 61.98 59.03 1xn7 s VAL 47 Cb -0.06 -1.29 -0.07 0.00 0.56 0.00 0.00 36.38 35.51 1xn7 s VAL 47 CO 0.43 -0.44 0.69 -0.13 -0.31 0.00 0.00 175.10 175.34 1xn7 s ARG 48 N -2.46 4.41 0.15 4.82 1.81 -1.26 -1.50 118.95 124.92 1xn7 s ARG 48 Ca 0.04 0.97 0.10 0.00 -1.72 0.00 0.00 55.73 55.12 1xn7 s ARG 48 Cb -0.05 -3.27 -0.04 0.00 -0.45 0.00 0.00 34.95 31.14 1xn7 s ARG 48 CO 0.01 0.56 -0.20 0.42 -0.68 0.00 0.00 175.30 175.41 1xn7 s ILE 49 N -0.97 2.66 0.13 1.52 -1.09 0.21 -4.92 121.20 118.76 1xn7 s ILE 49 Ca 0.33 -1.72 0.06 0.00 -2.23 0.00 0.00 60.65 57.09 1xn7 s ILE 49 Cb -0.21 -2.25 -0.04 0.00 -1.58 0.00 0.00 42.46 38.38 1xn7 s ILE 49 CO 0.23 0.00 -0.02 -1.58 -1.23 0.00 0.00 174.94 172.34 1xn7 s GLN 50 N -2.39 2.39 0.53 2.79 0.74 -1.26 0.18 119.66 122.64 1xn7 s GLN 50 Ca 0.19 -1.01 0.02 0.00 0.05 0.00 0.00 55.36 54.62 1xn7 s GLN 50 Cb -0.09 -2.40 0.03 0.00 1.10 0.00 0.00 33.01 31.64 1xn7 s GLN 50 CO 0.10 0.49 0.75 -2.00 -0.55 0.00 0.00 175.29 174.08 1xn7 s GLU 51 N -2.58 2.59 0.02 1.67 2.12 -1.26 -4.77 118.70 116.48 1xn7 s GLU 51 Ca 0.26 -0.82 -0.39 0.00 0.36 0.00 0.00 54.97 54.38 1xn7 s GLU 51 Cb -0.10 -2.52 -0.18 0.00 0.26 0.00 0.00 34.13 31.59 1xn7 s GLU 51 CO 0.17 -0.65 1.25 0.39 -0.54 0.00 0.00 175.26 175.89 1xn7 n GLU 52 N -2.28 0.63 0.00 4.30 1.02 -1.26 -4.95 120.64 118.10 1xn7 n GLU 52 Ca 0.08 0.23 0.00 0.00 -0.02 0.00 0.00 57.16 57.44 1xn7 n GLU 52 Cb 0.60 -1.81 0.00 0.00 -0.02 0.00 0.00 31.44 30.21 1xn7 n GLU 52 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1xn7 n PRO 53 N 2.27 0.63 -4.51 3.49 -0.04 -1.26 -5.06 135.00 130.52 1xn7 n PRO 53 Ca 0.20 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.41 1xn7 n PRO 53 Cb 0.13 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.49 1xn7 n PRO 53 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 1xn7 s ASP 54 N -1.25 3.46 0.00 3.54 1.47 -1.26 -5.11 116.67 117.52 1xn7 s ASP 54 Ca 0.00 -1.20 0.00 0.00 1.18 0.00 0.00 52.55 52.53 1xn7 s ASP 54 Cb 0.00 -0.30 0.00 0.00 -0.34 0.00 0.00 42.92 42.28 1xn7 s ASP 54 CO 0.00 -0.24 0.00 0.61 0.68 0.00 0.00 175.17 176.22 1xn7 n GLY 55 N -0.73 0.36 1.76 2.12 0.00 -1.26 -5.10 105.19 102.34 1xn7 n GLY 55 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1xn7 n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xn7 s LEU 57 N -1.11 2.68 -0.17 0.00 2.01 -1.26 -5.10 118.68 115.73 1xn7 s LEU 57 Ca 0.00 0.47 -0.35 0.00 0.01 0.00 0.00 54.13 54.26 1xn7 s LEU 57 Cb 0.00 -2.88 0.14 0.00 0.01 0.00 0.00 46.19 43.46 1xn7 s LEU 57 CO 0.00 -2.04 1.33 -0.55 1.01 0.00 0.00 176.35 176.10 1xn7 s SER 58 N -4.66 -0.05 -0.37 2.29 0.15 -1.26 -5.13 113.70 104.67 1xn7 s SER 58 Ca 0.65 -0.03 0.03 0.00 0.70 0.00 0.00 55.95 57.31 1xn7 s SER 58 Cb -0.09 0.08 0.16 0.00 -1.71 0.00 0.00 66.02 64.46 1xn7 s SER 58 CO 0.48 -0.13 0.39 -0.83 1.20 0.00 0.00 173.24 174.36 1xn7 s GLY 59 N -2.43 -0.10 -0.40 9.45 0.00 -1.26 -5.00 107.32 107.59 1xn7 s GLY 59 Ca 0.12 -0.91 -0.20 0.00 0.00 0.00 0.00 44.72 43.73 1xn7 s GLY 59 CO -0.04 2.79 0.52 1.44 0.00 0.00 0.00 173.10 177.81 1xn7 n SER 60 N 4.26 -7.20 -3.57 1.64 7.64 -1.26 -5.04 113.62 110.09 1xn7 n SER 60 Ca 0.11 0.43 -0.08 0.00 1.01 0.00 0.00 58.87 60.34 1xn7 n SER 60 Cb 0.46 -4.14 -0.04 0.00 -1.01 0.00 0.00 64.21 59.48 1xn7 n SER 60 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xn7 s LYS 62 N -1.69 0.75 -0.16 0.00 2.36 -1.26 -5.11 119.74 114.64 1xn7 s LYS 62 Ca 0.02 -0.62 -0.27 0.00 -2.55 0.00 0.00 55.97 52.56 1xn7 s LYS 62 Cb -0.01 -2.11 0.07 0.00 -1.05 0.00 0.00 37.83 34.73 1xn7 s LYS 62 CO -0.02 -0.72 0.68 0.45 1.55 0.00 0.00 175.35 177.29 1xn7 s SER 63 N 1.77 -0.68 -0.43 1.43 0.15 -1.26 -5.09 113.70 109.59 1xn7 s SER 63 Ca 0.01 1.07 0.08 0.00 0.70 0.00 0.00 55.95 57.81 1xn7 s SER 63 Cb -0.17 1.01 0.26 0.00 -1.71 0.00 0.00 66.02 65.41 1xn7 s SER 63 CO -0.12 -0.40 0.59 0.00 1.20 0.00 0.00 173.24 174.50 1xn7 n PRO 65 N 1.16 0.67 -3.09 0.00 -0.04 -1.26 -4.78 135.00 127.66 1xn7 n PRO 65 Ca 0.23 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.69 1xn7 n PRO 65 Cb 0.52 0.00 -0.00 0.00 -0.04 0.00 0.00 33.50 33.98 1xn7 n PRO 65 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1xn7 n GLU 66 N -0.27 -1.02 -3.39 0.54 0.00 -1.26 -4.86 120.64 110.37 1xn7 n GLU 66 Ca 0.00 1.20 -0.42 0.00 0.00 0.00 0.00 57.16 57.94 1xn7 n GLU 66 Cb 0.00 -1.54 -0.02 0.00 0.00 0.00 0.00 31.44 29.89 1xn7 n GLU 66 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1xn7 n GLY 67 N 1.57 4.29 3.97 8.31 0.00 -1.26 -5.02 105.19 117.05 1xn7 n GLY 67 Ca -0.02 -2.60 -0.22 0.00 0.00 0.00 0.00 46.02 43.18 1xn7 n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xn7 s LYS 68 N -1.48 2.33 1.03 1.61 -0.14 -1.26 -5.08 119.74 116.74 1xn7 s LYS 68 Ca 0.30 -1.76 -0.19 0.00 -1.36 0.00 0.00 55.97 52.96 1xn7 s LYS 68 Cb -0.07 -2.43 -0.04 0.00 -1.68 0.00 0.00 37.83 33.61 1xn7 s LYS 68 CO -0.08 -0.70 -0.47 0.00 -0.76 0.00 0.00 175.35 173.35 1xn7 n ALA 69 N -2.00 -4.51 -2.30 5.17 0.00 -1.26 -4.94 120.51 110.68 1xn7 n ALA 69 Ca 0.08 -1.06 -0.31 0.00 0.00 0.00 0.00 53.44 52.16 1xn7 n ALA 69 Cb 0.62 -1.32 -0.04 0.00 0.00 0.00 0.00 19.45 18.71 1xn7 n ALA 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xn7 n LEU 71 N -0.74 -0.81 -4.56 0.00 7.99 -1.26 -4.68 117.00 112.95 1xn7 n LEU 71 Ca 0.01 0.23 -0.16 0.00 -0.01 0.00 0.00 56.01 56.09 1xn7 n LEU 71 Cb 0.53 -1.14 -0.07 0.00 -0.11 0.00 0.00 43.42 42.63 1xn7 n LEU 71 CO 0.46 -3.59 1.23 -0.13 -1.51 0.00 0.00 177.39 173.85 1xn7 s ARG 72 N -3.55 1.74 0.42 3.23 0.52 -1.26 -4.90 118.95 115.16 1xn7 s ARG 72 Ca 0.56 0.31 -0.26 0.00 -0.52 0.00 0.00 55.73 55.83 1xn7 s ARG 72 Cb -0.19 -4.84 -0.09 0.00 0.52 0.00 0.00 34.95 30.35 1xn7 s ARG 72 CO 0.68 -4.32 1.40 -1.21 0.02 0.00 0.00 175.30 171.87 1xn7 s GLU 73 N 8.56 3.85 0.44 3.54 0.41 -1.26 -4.12 118.70 130.11 1xn7 s GLU 73 Ca 0.88 2.37 0.08 0.00 -0.41 0.00 0.00 54.97 57.89 1xn7 s GLU 73 Cb -0.12 -2.75 0.01 0.00 -1.78 0.00 0.00 34.13 29.49 1xn7 s GLU 73 CO 0.07 -0.67 0.51 -1.58 -0.49 0.00 0.00 175.26 173.10 1xn7 s TRP 74 N -1.20 2.62 0.09 1.61 0.51 0.49 -4.87 118.94 118.18 1xn7 s TRP 74 Ca 0.58 -0.48 0.08 0.00 -2.12 0.00 0.00 56.10 54.17 1xn7 s TRP 74 Cb -0.43 -2.27 -0.03 0.00 -0.81 0.00 0.00 33.47 29.93 1xn7 s TRP 74 CO 0.55 -0.37 -0.21 -1.58 -0.51 0.00 0.00 176.95 174.83 1xn7 s TRP 75 N -2.44 1.83 0.37 -1.98 0.52 -1.04 0.68 118.94 116.88 1xn7 s TRP 75 Ca 0.52 -0.40 -0.12 0.00 0.02 0.00 0.00 56.10 56.12 1xn7 s TRP 75 Cb -0.07 -1.02 0.04 0.00 -1.15 0.00 0.00 33.47 31.27 1xn7 s TRP 75 CO 0.31 0.18 0.69 0.00 0.02 0.00 0.00 176.95 178.15 1xn7 s ALA 76 N -1.06 -0.26 0.20 0.98 0.00 -0.56 -1.02 121.76 120.03 1xn7 s ALA 76 Ca 0.07 -0.99 0.01 0.00 0.00 0.00 0.00 51.96 51.05 1xn7 s ALA 76 Cb -0.10 0.83 -0.04 0.00 0.00 0.00 0.00 23.12 23.82 1xn7 s ALA 76 CO 0.04 -0.93 0.36 -0.51 0.00 0.00 0.00 175.76 174.72 1xn7 s LEU 77 N -3.12 4.26 0.00 0.00 1.43 -1.26 -0.77 118.68 119.22 1xn7 s LEU 77 Ca 0.20 0.29 0.16 0.00 -1.03 0.00 0.00 54.13 53.75 1xn7 s LEU 77 Cb -0.04 -3.06 0.94 0.00 0.03 0.00 0.00 46.19 44.06 1xn7 s LEU 77 CO 0.14 -0.03 1.35 -1.14 0.23 0.00 0.00 176.35 176.90