#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nyx s ALA 8 N 0.00 3.86 -0.14 3.55 0.00 -1.26 -4.96 121.76 122.80 2nyx s ALA 8 Ca 0.00 -0.60 0.03 0.00 0.00 0.00 0.00 51.96 51.39 2nyx s ALA 8 Cb 0.00 -2.02 -0.11 0.00 0.00 0.00 0.00 23.12 20.99 2nyx s ALA 8 CO 0.00 0.59 -0.09 0.25 0.00 0.00 0.00 175.76 176.51 2nyx n THR 9 N 2.02 0.85 -3.19 0.00 -2.24 -1.26 -4.67 114.28 105.78 2nyx n THR 9 Ca -0.19 -0.37 -0.01 0.00 -2.27 0.00 0.00 64.05 61.21 2nyx n THR 9 Cb 0.55 -0.96 0.00 0.00 -2.10 0.00 0.00 70.33 67.82 2nyx n THR 9 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nyx n ALA 10 N -2.83 -0.18 -1.30 6.98 0.00 -1.26 -5.08 120.51 116.84 2nyx n ALA 10 Ca -0.25 -0.11 -0.31 0.00 0.00 0.00 0.00 53.44 52.77 2nyx n ALA 10 Cb 0.81 0.08 0.08 0.00 0.00 0.00 0.00 19.45 20.42 2nyx n ALA 10 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2nyx s GLU 11 N -2.01 2.34 0.05 0.00 2.02 -1.26 -4.97 118.70 114.88 2nyx s GLU 11 Ca 0.02 1.23 -0.20 0.00 0.02 0.00 0.00 54.97 56.04 2nyx s GLU 11 Cb -0.00 -1.90 -0.06 0.00 0.10 0.00 0.00 34.13 32.26 2nyx s GLU 11 CO 0.01 -1.58 0.57 -1.21 0.02 0.00 0.00 175.26 173.07 2nyx s GLU 12 N -4.71 4.23 0.82 1.61 2.02 -1.26 -5.07 118.70 116.34 2nyx s GLU 12 Ca 0.63 0.72 -0.11 0.00 0.02 0.00 0.00 54.97 56.23 2nyx s GLU 12 Cb -0.18 -3.27 0.09 0.00 0.10 0.00 0.00 34.13 30.86 2nyx s GLU 12 CO 0.53 0.56 1.09 -1.54 0.02 0.00 0.00 175.26 175.91 2nyx s SER 13 N -0.82 4.12 0.27 -0.19 1.04 -1.26 -4.89 113.70 111.98 2nyx s SER 13 Ca 0.29 1.61 -0.04 0.00 0.48 0.00 0.00 55.95 58.29 2nyx s SER 13 Cb -0.19 -2.32 0.34 0.00 0.10 0.00 0.00 66.02 63.96 2nyx s SER 13 CO 0.18 -2.24 1.94 0.58 0.98 0.00 0.00 173.24 174.68 2nyx h VAL 14 N -1.28 1.24 -0.16 5.02 2.07 -1.99 -2.44 116.25 118.71 2nyx h VAL 14 Ca -0.46 -0.45 -0.22 0.00 0.82 0.00 0.00 66.70 66.39 2nyx h VAL 14 Cb 1.26 -0.10 0.01 0.00 -1.52 0.00 0.00 31.29 30.93 2nyx h VAL 14 CO 0.54 0.23 -0.75 0.44 0.02 0.00 0.00 177.57 178.05 2nyx h ASP 15 N 1.25 0.94 -0.07 0.57 3.45 -1.98 -1.14 116.42 119.43 2nyx h ASP 15 Ca 0.33 -0.62 -0.16 0.00 0.43 0.00 0.00 57.03 57.01 2nyx h ASP 15 Cb -0.13 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 38.36 2nyx h ASP 15 CO -0.07 1.41 -0.49 1.62 -1.57 0.00 0.00 179.24 180.14 2nyx h VAL 16 N 0.53 1.30 -0.43 -1.35 3.04 -1.93 0.12 116.25 117.53 2nyx h VAL 16 Ca -0.05 -1.70 -0.15 0.00 -1.01 0.00 0.00 66.70 63.79 2nyx h VAL 16 Cb 1.39 1.65 -0.01 0.00 -2.01 0.00 0.00 31.29 32.31 2nyx h VAL 16 CO 0.16 0.54 -0.30 0.40 -1.01 0.00 0.00 177.57 177.36 2nyx h ILE 17 N 0.50 1.27 -0.11 3.17 2.04 -1.43 -2.83 117.51 120.12 2nyx h ILE 17 Ca 0.02 -1.47 -0.01 0.00 1.00 0.00 0.00 64.86 64.40 2nyx h ILE 17 Cb 1.04 1.25 -0.00 0.00 -0.74 0.00 0.00 36.82 38.37 2nyx h ILE 17 CO 0.10 0.50 0.03 0.74 0.00 0.00 0.00 178.15 179.51 2nyx h THR 18 N 0.81 1.20 -0.62 -0.27 2.02 -1.05 -1.74 112.91 113.26 2nyx h THR 18 Ca 0.09 -0.62 0.07 0.00 0.77 0.00 0.00 66.41 66.71 2nyx h THR 18 Cb 0.89 1.40 -0.06 0.00 -1.74 0.00 0.00 68.15 68.64 2nyx h THR 18 CO 0.08 0.18 0.31 0.44 0.37 0.00 0.00 175.52 176.90 2nyx h ASP 19 N -0.02 0.42 -0.67 4.18 3.45 -1.03 0.15 116.42 122.91 2nyx h ASP 19 Ca 0.04 0.04 -0.08 0.00 0.43 0.00 0.00 57.03 57.46 2nyx h ASP 19 Cb 0.26 -0.03 -0.03 0.00 -0.56 0.00 0.00 39.33 38.97 2nyx h ASP 19 CO 0.00 0.27 0.12 0.00 -1.57 0.00 0.00 179.24 178.06 2nyx h ALA 20 N 1.35 0.94 -0.34 3.45 0.00 -1.44 -2.58 119.26 120.64 2nyx h ALA 20 Ca 0.29 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2nyx h ALA 20 Cb 0.24 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2nyx h ALA 20 CO -0.21 0.66 -0.14 -0.07 0.00 0.00 0.00 179.25 179.49 2nyx h LEU 21 N 1.03 0.60 0.09 0.00 3.38 -0.69 -1.91 115.31 117.82 2nyx h LEU 21 Ca 0.21 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 2nyx h LEU 21 Cb 0.42 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.01 2nyx h LEU 21 CO 0.01 0.76 -0.04 0.25 0.09 0.00 0.00 178.44 179.51 2nyx h LEU 22 N 0.56 -0.11 -0.78 1.67 6.46 -0.46 0.48 115.31 123.13 2nyx h LEU 22 Ca 0.10 -0.01 -0.02 0.00 -0.12 0.00 0.00 57.88 57.83 2nyx h LEU 22 Cb 0.56 0.03 -0.04 0.00 -0.73 0.00 0.00 40.66 40.48 2nyx h LEU 22 CO 0.04 -0.06 0.42 0.74 -0.62 0.00 0.00 178.44 178.95 2nyx h THR 23 N -0.14 1.24 -0.75 1.05 2.02 -1.44 -2.35 112.91 112.53 2nyx h THR 23 Ca -0.01 -0.60 -0.00 0.00 0.77 0.00 0.00 66.41 66.57 2nyx h THR 23 Cb 0.11 0.21 -0.04 0.00 -1.74 0.00 0.00 68.15 66.69 2nyx h THR 23 CO 0.02 0.26 0.46 0.00 0.37 0.00 0.00 175.52 176.63 2nyx h ALA 24 N 1.22 1.40 -0.39 6.16 0.00 -1.12 -2.19 119.26 124.34 2nyx h ALA 24 Ca 0.27 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 2nyx h ALA 24 Cb 0.04 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2nyx h ALA 24 CO -0.04 0.53 -0.07 0.66 0.00 0.00 0.00 179.25 180.32 2nyx h SER 25 N 1.03 0.64 -0.57 0.00 4.64 -0.45 -1.13 113.55 117.70 2nyx h SER 25 Ca 0.27 -0.16 -0.08 0.00 -0.47 0.00 0.00 61.79 61.35 2nyx h SER 25 Cb -0.05 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 61.84 2nyx h SER 25 CO -0.05 0.75 0.05 0.03 -0.87 0.00 0.00 176.83 176.74 2nyx h ARG 26 N 0.61 1.00 -0.45 4.77 3.08 -1.04 -0.08 114.38 122.27 2nyx h ARG 26 Ca 0.12 -0.28 -0.13 0.00 0.07 0.00 0.00 59.98 59.75 2nyx h ARG 26 Cb 0.48 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 2nyx h ARG 26 CO 0.03 0.95 -0.25 1.25 -1.07 0.00 0.00 179.97 180.88 2nyx h LEU 27 N 0.93 0.98 -0.81 3.04 5.85 -1.04 -0.04 115.31 124.21 2nyx h LEU 27 Ca 0.18 -0.38 -0.03 0.00 0.84 0.00 0.00 57.88 58.49 2nyx h LEU 27 Cb 0.47 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 2nyx h LEU 27 CO 0.02 1.17 0.40 -0.07 -0.34 0.00 0.00 178.44 179.61 2nyx h LEU 28 N 0.81 1.06 -0.56 2.25 4.07 -1.06 0.21 115.31 122.10 2nyx h LEU 28 Ca 0.10 -0.13 -0.10 0.00 0.08 0.00 0.00 57.88 57.82 2nyx h LEU 28 Cb 0.82 -0.27 -0.02 0.00 1.08 0.00 0.00 40.66 42.27 2nyx h LEU 28 CO 0.07 0.89 -0.06 0.58 -1.08 0.00 0.00 178.44 178.85 2nyx h VAL 29 N 1.15 1.27 -0.49 1.22 2.07 -0.84 -0.79 116.25 119.84 2nyx h VAL 29 Ca 0.28 -1.20 0.09 0.00 0.82 0.00 0.00 66.70 66.69 2nyx h VAL 29 Cb 0.11 0.91 -0.08 0.00 -1.52 0.00 0.00 31.29 30.71 2nyx h VAL 29 CO -0.04 0.43 0.02 0.00 0.02 0.00 0.00 177.57 178.01 2nyx h ALA 30 N 0.95 0.49 -0.29 1.67 0.00 -0.58 0.23 119.26 121.71 2nyx h ALA 30 Ca 0.15 0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.21 2nyx h ALA 30 Cb 0.62 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 2nyx h ALA 30 CO 0.04 -0.37 0.18 0.82 0.00 0.00 0.00 179.25 179.92 2nyx h ILE 31 N 0.14 1.05 -0.48 0.00 2.04 -0.56 -2.10 117.51 117.59 2nyx h ILE 31 Ca 0.25 -0.12 -0.11 0.00 1.00 0.00 0.00 64.86 65.88 2nyx h ILE 31 Cb 0.37 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 37.08 2nyx h ILE 31 CO -0.39 0.07 -0.13 0.28 0.00 0.00 0.00 178.15 177.98 2nyx h SER 32 N 0.36 0.91 -0.27 1.72 0.02 -0.74 -2.16 113.55 113.39 2nyx h SER 32 Ca 0.11 -0.30 -0.01 0.00 -0.84 0.00 0.00 61.79 60.76 2nyx h SER 32 Cb -0.02 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.26 2nyx h SER 32 CO -0.04 1.04 0.13 0.00 -1.14 0.00 0.00 176.83 176.82 2nyx h ALA 33 N 1.04 0.35 -0.27 3.77 0.00 -0.33 0.30 119.26 124.11 2nyx h ALA 33 Ca 0.13 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 54.98 2nyx h ALA 33 Cb 0.66 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 2nyx h ALA 33 CO 0.05 -0.09 0.05 1.25 0.00 0.00 0.00 179.25 180.50 2nyx h HIS 34 N 0.30 0.08 0.25 0.00 6.17 -1.35 -1.35 115.15 119.25 2nyx h HIS 34 Ca 0.09 0.02 -0.01 0.00 0.71 0.00 0.00 60.37 61.18 2nyx h HIS 34 Cb 0.12 0.01 0.00 0.00 2.52 0.00 0.00 27.41 30.06 2nyx h HIS 34 CO -0.02 0.01 -0.12 0.77 0.71 0.00 0.00 177.93 179.28 2nyx h SER 35 N 0.14 -0.28 -0.21 3.26 0.02 -1.04 -2.97 113.55 112.46 2nyx h SER 35 Ca 0.12 -0.22 0.04 0.00 -0.84 0.00 0.00 61.79 60.89 2nyx h SER 35 Cb 0.13 0.07 -0.04 0.00 0.14 0.00 0.00 62.40 62.70 2nyx h SER 35 CO -0.17 0.11 -0.06 0.40 -1.14 0.00 0.00 176.83 175.97 2nyx h ILE 36 N -0.73 0.77 -0.06 3.27 2.04 -0.46 -3.05 117.51 119.28 2nyx h ILE 36 Ca -0.03 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.79 2nyx h ILE 36 Cb 0.49 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 2nyx h ILE 36 CO 0.06 0.00 -0.11 0.00 0.00 0.00 0.00 178.15 178.10 2nyx h ALA 37 N 1.20 1.71 0.00 1.87 0.00 -1.32 -0.48 119.26 122.24 2nyx h ALA 37 Ca 0.10 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 2nyx h ALA 37 Cb 0.17 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2nyx h ALA 37 CO -0.23 0.22 -0.23 1.96 0.00 0.00 0.00 179.25 180.97 2nyx h GLN 38 N 0.09 0.00 0.00 0.00 1.08 -1.41 -3.35 115.11 111.52 2nyx h GLN 38 Ca 0.02 0.00 -0.30 0.00 -1.45 0.00 0.00 58.65 56.92 2nyx h GLN 38 Cb 0.25 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 27.64 2nyx h GLN 38 CO 0.02 0.23 -1.83 0.28 -0.95 0.00 0.00 178.83 176.57 2nyx n VAL 39 N -4.13 1.52 -3.48 -0.54 0.31 -0.74 -4.95 118.33 106.31 2nyx n VAL 39 Ca -0.02 -0.17 -0.18 0.00 -0.01 0.00 0.00 64.34 63.96 2nyx n VAL 39 Cb 0.29 -2.03 -0.13 0.00 -0.91 0.00 0.00 33.84 31.06 2nyx n VAL 39 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2nyx s ASP 40 N -6.96 1.43 0.06 4.52 -1.08 -0.26 -5.04 116.67 109.33 2nyx s ASP 40 Ca -0.33 -0.28 0.26 0.00 -0.52 0.00 0.00 52.55 51.67 2nyx s ASP 40 Cb 0.10 0.39 1.03 0.00 -1.46 0.00 0.00 42.92 42.98 2nyx s ASP 40 CO 0.49 -0.33 1.81 -1.84 0.52 0.00 0.00 175.17 175.81 2nyx n GLU 41 N 5.32 0.06 -0.01 4.34 0.28 -1.26 -3.45 120.64 125.93 2nyx n GLU 41 Ca -0.05 0.11 0.07 0.00 -0.16 0.00 0.00 57.16 57.13 2nyx n GLU 41 Cb 0.49 -1.58 -0.12 0.00 1.43 0.00 0.00 31.44 31.66 2nyx n GLU 41 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2nyx n ASN 42 N -1.69 1.48 -4.69 -1.84 3.02 -1.26 -5.00 115.26 105.28 2nyx n ASN 42 Ca 0.06 0.00 -0.44 0.00 -0.03 0.00 0.00 54.58 54.17 2nyx n ASN 42 Cb 0.32 1.67 -0.03 0.00 -0.61 0.00 0.00 39.78 41.13 2nyx n ASN 42 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2nyx n ILE 43 N -2.06 0.19 -2.00 2.41 3.06 -1.22 -4.98 119.36 114.77 2nyx n ILE 43 Ca -0.04 -0.03 -0.29 0.00 -2.50 0.00 0.00 62.75 59.89 2nyx n ILE 43 Cb 0.42 -1.93 0.19 0.00 0.54 0.00 0.00 39.64 38.86 2nyx n ILE 43 CO 0.00 0.00 0.00 0.42 -2.50 0.00 0.00 176.55 174.47 2nyx s THR 44 N 1.95 2.01 0.01 9.51 -4.23 -1.26 -4.86 115.64 118.76 2nyx s THR 44 Ca 0.80 -0.06 -0.25 0.00 -1.18 0.00 0.00 61.69 61.00 2nyx s THR 44 Cb -0.55 -2.95 -0.17 0.00 1.34 0.00 0.00 72.50 70.17 2nyx s THR 44 CO 0.37 0.00 1.25 0.40 -0.54 0.00 0.00 174.62 176.10 2nyx h ILE 45 N -1.58 0.80 0.00 2.99 2.04 -1.99 -2.08 117.51 117.68 2nyx h ILE 45 Ca -0.43 -0.65 -0.04 0.00 1.00 0.00 0.00 64.86 64.73 2nyx h ILE 45 Cb 1.23 1.15 -0.01 0.00 -0.74 0.00 0.00 36.82 38.45 2nyx h ILE 45 CO 0.36 0.13 -0.21 -0.65 0.00 0.00 0.00 178.15 177.79 2nyx h PRO 46 N -0.69 0.00 0.01 2.37 0.11 -1.99 -1.50 132.00 130.32 2nyx h PRO 46 Ca -0.03 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.07 2nyx h PRO 46 Cb 0.48 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.59 2nyx h PRO 46 CO 0.06 0.21 -0.01 1.96 -0.21 0.00 0.00 178.00 180.01 2nyx h GLN 47 N 0.00 -0.02 -0.15 1.05 4.20 -1.93 -1.80 115.11 116.46 2nyx h GLN 47 Ca -0.00 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.63 2nyx h GLN 47 Cb 0.38 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 2nyx h GLN 47 CO 0.03 0.25 -0.26 0.35 -0.67 0.00 0.00 178.83 178.53 2nyx h PHE 48 N -0.29 0.31 -0.45 2.96 3.57 -1.08 -2.21 116.94 119.75 2nyx h PHE 48 Ca -0.00 -0.06 -0.11 0.00 3.53 0.00 0.00 57.97 61.33 2nyx h PHE 48 Cb 0.28 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 2nyx h PHE 48 CO 0.02 0.52 -0.15 0.00 -2.23 0.00 0.00 178.31 176.47 2nyx h ARG 49 N 0.25 0.90 -0.35 1.11 3.08 -1.25 -1.77 114.38 116.35 2nyx h ARG 49 Ca 0.04 -0.36 0.07 0.00 0.07 0.00 0.00 59.98 59.80 2nyx h ARG 49 Cb 0.59 -0.04 -0.06 0.00 0.08 0.00 0.00 29.97 30.54 2nyx h ARG 49 CO 0.04 1.01 -0.04 1.15 -1.07 0.00 0.00 179.97 181.06 2nyx h THR 50 N 0.73 0.69 -0.77 2.04 2.02 -0.92 -0.12 112.91 116.59 2nyx h THR 50 Ca 0.11 -0.02 0.06 0.00 0.77 0.00 0.00 66.41 67.33 2nyx h THR 50 Cb 0.70 0.64 -0.06 0.00 -1.74 0.00 0.00 68.15 67.69 2nyx h THR 50 CO 0.05 0.01 0.46 -0.07 0.37 0.00 0.00 175.52 176.34 2nyx h LEU 51 N 0.05 0.70 -0.36 2.58 4.07 -1.09 -1.58 115.31 119.68 2nyx h LEU 51 Ca 0.17 0.02 -0.13 0.00 0.08 0.00 0.00 57.88 58.03 2nyx h LEU 51 Cb 0.25 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 41.87 2nyx h LEU 51 CO -0.32 0.44 -0.27 0.58 -1.08 0.00 0.00 178.44 177.79 2nyx h VAL 52 N 0.83 1.29 -0.21 1.22 2.07 -1.00 -1.75 116.25 118.70 2nyx h VAL 52 Ca 0.34 -1.43 0.01 0.00 0.82 0.00 0.00 66.70 66.45 2nyx h VAL 52 Cb 0.19 1.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 2nyx h VAL 52 CO -0.18 0.47 0.11 0.40 0.02 0.00 0.00 177.57 178.39 2nyx h ILE 53 N 0.60 1.00 -0.53 4.57 2.04 -0.56 -0.30 117.51 124.33 2nyx h ILE 53 Ca 0.07 -0.08 0.02 0.00 1.00 0.00 0.00 64.86 65.87 2nyx h ILE 53 Cb 0.84 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.64 2nyx h ILE 53 CO 0.07 0.04 0.33 -0.07 0.00 0.00 0.00 178.15 178.52 2nyx h LEU 54 N 0.23 0.54 -1.00 1.44 3.38 -1.25 -0.04 115.31 118.61 2nyx h LEU 54 Ca 0.09 -0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.14 2nyx h LEU 54 Cb 0.02 -0.12 -0.08 0.00 0.09 0.00 0.00 40.66 40.57 2nyx h LEU 54 CO -0.06 0.39 0.63 -1.28 0.09 0.00 0.00 178.44 178.21 2nyx h SER 55 N 0.66 0.98 1.77 -0.43 0.87 -0.83 0.35 113.55 116.91 2nyx h SER 55 Ca 0.21 0.03 -0.05 0.00 -1.23 0.00 0.00 61.79 60.75 2nyx h SER 55 Cb -0.01 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.77 2nyx h SER 55 CO -0.08 0.58 -0.23 0.78 -0.53 0.00 0.00 176.83 177.35 2nyx h ASN 56 N 1.08 0.00 0.00 6.23 2.35 -0.27 -3.38 115.58 121.60 2nyx h ASN 56 Ca 0.46 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.21 2nyx h ASN 56 Cb 0.31 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.68 2nyx h ASN 56 CO -0.22 0.22 -0.80 1.41 -1.65 0.00 0.00 177.43 176.39 2nyx n HIS 57 N -3.15 0.00 -4.10 1.19 8.25 -0.10 -5.09 115.22 112.22 2nyx n HIS 57 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 2nyx n HIS 57 Cb 0.62 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.70 2nyx n HIS 57 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2nyx n GLY 58 N 1.99 -1.94 3.69 -1.41 0.00 0.12 -4.81 105.19 102.82 2nyx n GLY 58 Ca -0.00 -1.38 -0.44 0.00 0.00 0.00 0.00 46.02 44.20 2nyx n GLY 58 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2nyx n PRO 59 N -0.19 2.57 -3.94 1.61 -0.02 -1.26 -4.78 135.00 128.99 2nyx n PRO 59 Ca 0.00 0.93 -0.10 0.00 -2.02 0.00 0.00 63.50 62.32 2nyx n PRO 59 Cb 0.00 -2.78 -0.10 0.00 -0.02 0.00 0.00 33.50 30.59 2nyx n PRO 59 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 2nyx s ILE 60 N 2.16 0.11 0.74 4.25 -4.36 -1.06 -4.91 121.20 118.12 2nyx s ILE 60 Ca 0.81 -0.88 -0.11 0.00 -0.26 0.00 0.00 60.65 60.20 2nyx s ILE 60 Cb -0.56 -0.42 0.03 0.00 1.25 0.00 0.00 42.46 42.77 2nyx s ILE 60 CO 0.38 -0.49 1.09 0.54 0.24 0.00 0.00 174.94 176.71 2nyx s ASN 61 N -1.55 5.07 0.22 4.36 2.20 -1.26 -0.45 114.94 123.53 2nyx s ASN 61 Ca -0.14 1.25 -0.08 0.00 -0.94 0.00 0.00 52.86 52.95 2nyx s ASN 61 Cb -0.08 -2.04 0.29 0.00 -2.00 0.00 0.00 41.25 37.42 2nyx s ASN 61 CO -0.01 -1.59 1.77 -0.07 -2.94 0.00 0.00 177.10 174.26 2nyx h LEU 62 N -0.83 0.40 -0.45 3.54 3.38 -1.97 -0.54 115.31 118.85 2nyx h LEU 62 Ca -0.46 0.06 0.08 0.00 0.09 0.00 0.00 57.88 57.65 2nyx h LEU 62 Cb 1.25 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.93 2nyx h LEU 62 CO 0.61 0.24 0.03 0.00 0.09 0.00 0.00 178.44 179.42 2nyx h ALA 63 N 1.40 0.45 0.09 1.53 0.00 -1.94 0.29 119.26 121.09 2nyx h ALA 63 Ca 0.32 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.35 2nyx h ALA 63 Cb 0.33 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2nyx h ALA 63 CO -0.26 -0.36 -0.04 1.15 0.00 0.00 0.00 179.25 179.74 2nyx h THR 64 N 0.15 1.01 -0.22 0.00 2.02 -1.79 -2.55 112.91 111.53 2nyx h THR 64 Ca 0.23 -0.36 0.05 0.00 0.77 0.00 0.00 66.41 67.10 2nyx h THR 64 Cb 0.32 1.24 -0.04 0.00 -1.74 0.00 0.00 68.15 67.93 2nyx h THR 64 CO -0.35 0.09 -0.07 0.25 0.37 0.00 0.00 175.52 175.81 2nyx h LEU 65 N -0.28 -0.25 -0.49 2.58 5.85 -0.75 -1.82 115.31 120.15 2nyx h LEU 65 Ca -0.01 0.07 0.10 0.00 0.84 0.00 0.00 57.88 58.88 2nyx h LEU 65 Cb 0.24 0.16 -0.10 0.00 0.37 0.00 0.00 40.66 41.32 2nyx h LEU 65 CO 0.02 -0.09 -0.22 0.00 -0.34 0.00 0.00 178.44 177.80 2nyx h ALA 66 N 1.19 0.13 -0.03 1.25 0.00 -0.41 -1.41 119.26 119.98 2nyx h ALA 66 Ca 0.11 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2nyx h ALA 66 Cb 0.19 0.55 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 2nyx h ALA 66 CO -0.24 -0.56 0.00 1.15 0.00 0.00 0.00 179.25 179.60 2nyx h THR 67 N -0.11 0.98 0.00 0.00 2.02 -0.96 1.24 112.91 116.08 2nyx h THR 67 Ca 0.23 -0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.40 2nyx h THR 67 Cb 0.47 0.97 0.00 0.00 -1.74 0.00 0.00 68.15 67.85 2nyx h THR 67 CO -0.56 0.00 0.00 -0.07 0.37 0.00 0.00 175.52 175.26 2nyx h LEU 68 N 0.01 0.00 0.00 2.58 4.07 -0.86 -2.74 115.31 118.37 2nyx h LEU 68 Ca 0.01 0.00 -0.29 0.00 0.08 0.00 0.00 57.88 57.69 2nyx h LEU 68 Cb 0.01 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 41.70 2nyx h LEU 68 CO -0.02 0.00 -2.08 -0.11 -1.08 0.00 0.00 178.44 175.15 2nyx n LEU 69 N -2.84 1.01 -1.74 1.67 7.94 -0.58 -5.04 117.00 117.43 2nyx n LEU 69 Ca -0.02 -0.04 -0.06 0.00 -1.11 0.00 0.00 56.01 54.78 2nyx n LEU 69 Cb 0.09 0.02 0.03 0.00 0.53 0.00 0.00 43.42 44.08 2nyx n LEU 69 CO 0.18 0.53 0.05 0.61 -1.11 0.00 0.00 177.39 177.65 2nyx n GLY 70 N 2.22 0.25 0.05 -3.96 0.00 0.42 -5.06 105.19 99.11 2nyx n GLY 70 Ca -0.28 -0.31 -0.04 0.00 0.00 0.00 0.00 46.02 45.39 2nyx n GLY 70 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2nyx n VAL 71 N -2.36 0.82 0.00 1.61 3.14 -1.19 -5.06 118.33 115.29 2nyx n VAL 71 Ca -0.07 0.31 0.00 0.00 -2.96 0.00 0.00 64.34 61.62 2nyx n VAL 71 Cb 0.55 -1.98 0.00 0.00 -1.06 0.00 0.00 33.84 31.35 2nyx n VAL 71 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2nyx n GLN 72 N -3.58 0.00 0.00 1.45 0.00 -1.26 -4.94 117.38 109.04 2nyx n GLN 72 Ca -0.07 0.00 0.11 0.00 0.00 0.00 0.00 57.00 57.04 2nyx n GLN 72 Cb 0.25 0.00 0.08 0.00 0.00 0.00 0.00 30.24 30.57 2nyx n GLN 72 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.06 176.71 2nyx n PRO 73 N -0.34 1.94 0.19 2.61 -0.04 -1.26 -4.72 135.00 133.38 2nyx n PRO 73 Ca 0.00 -1.69 -0.14 0.00 -0.04 0.00 0.00 63.50 61.63 2nyx n PRO 73 Cb 0.00 -1.42 -0.08 0.00 -0.04 0.00 0.00 33.50 31.97 2nyx n PRO 73 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2nyx h SER 74 N 4.02 -0.42 0.45 3.54 0.02 -1.98 -3.08 113.55 116.10 2nyx h SER 74 Ca 0.00 -0.12 -0.04 0.00 -0.84 0.00 0.00 61.79 60.79 2nyx h SER 74 Cb 0.88 0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.52 2nyx h SER 74 CO 0.00 -0.09 -0.17 0.00 -1.14 0.00 0.00 176.83 175.43 2nyx h ALA 75 N -0.26 1.27 -0.55 3.77 0.00 -1.92 -2.39 119.26 119.18 2nyx h ALA 75 Ca -0.05 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.60 2nyx h ALA 75 Cb 0.52 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2nyx h ALA 75 CO 0.08 0.21 -0.08 1.15 0.00 0.00 0.00 179.25 180.61 2nyx h THR 76 N 0.00 1.27 -0.54 0.00 2.02 -1.92 -3.22 112.91 110.51 2nyx h THR 76 Ca -0.00 -1.23 -0.00 0.00 0.77 0.00 0.00 66.41 65.94 2nyx h THR 76 Cb 0.44 0.93 -0.03 0.00 -1.74 0.00 0.00 68.15 67.75 2nyx h THR 76 CO 0.02 0.44 0.33 1.23 0.37 0.00 0.00 175.52 177.90 2nyx h GLY 77 N 0.96 0.79 -0.80 2.16 0.00 -1.33 0.32 103.07 105.17 2nyx h GLY 77 Ca 0.15 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.15 2nyx h GLY 77 CO 0.04 0.32 0.00 -2.13 0.00 0.00 0.00 176.54 174.77 2nyx n ARG 78 N -4.66 0.00 0.00 4.80 3.00 -1.22 -1.73 116.66 116.85 2nyx n ARG 78 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.88 2nyx n ARG 78 Cb 0.06 -1.00 0.00 0.00 0.00 0.00 0.00 32.46 31.52 2nyx n ARG 78 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 2nyx n VAL 80 N 0.30 0.00 -0.33 5.15 0.31 0.10 -2.46 118.33 121.39 2nyx n VAL 80 Ca 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.30 2nyx n VAL 80 Cb 0.00 0.00 0.11 0.00 -0.91 0.00 0.00 33.84 33.04 2nyx n VAL 80 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 2nyx h ASP 81 N 0.00 1.11 -0.30 4.52 3.58 -1.58 0.22 116.42 123.96 2nyx h ASP 81 Ca 0.00 -0.08 0.01 0.00 0.42 0.00 0.00 57.03 57.38 2nyx h ASP 81 Cb 0.00 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 40.75 2nyx h ASP 81 CO 0.00 0.87 0.17 0.03 -2.88 0.00 0.00 179.24 177.43 2nyx h ARG 82 N 1.26 0.34 0.00 0.28 3.08 -1.77 -1.49 114.38 116.07 2nyx h ARG 82 Ca 0.32 -0.02 -0.10 0.00 0.07 0.00 0.00 59.98 60.25 2nyx h ARG 82 Cb -0.01 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 2nyx h ARG 82 CO -0.06 0.23 -0.49 -0.07 -1.07 0.00 0.00 179.97 178.51 2nyx h LEU 83 N 0.35 0.00 -0.15 3.04 3.38 -1.76 0.10 115.31 120.27 2nyx h LEU 83 Ca 0.12 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 2nyx h LEU 83 Cb 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2nyx h LEU 83 CO -0.06 0.49 0.08 0.58 0.09 0.00 0.00 178.44 179.61 2nyx h VAL 84 N 0.00 1.11 -0.96 1.22 2.07 -0.80 0.16 116.25 119.05 2nyx h VAL 84 Ca -0.00 -0.33 0.03 0.00 0.82 0.00 0.00 66.70 67.22 2nyx h VAL 84 Cb 0.88 1.06 -0.05 0.00 -1.52 0.00 0.00 31.29 31.65 2nyx h VAL 84 CO 0.06 0.11 0.63 1.23 0.02 0.00 0.00 177.57 179.62 2nyx h GLY 85 N 0.13 1.37 1.88 2.17 0.00 -0.50 0.10 103.07 108.22 2nyx h GLY 85 Ca 0.05 -0.48 0.00 0.00 0.00 0.00 0.00 47.33 46.90 2nyx h GLY 85 CO -0.01 0.44 0.00 0.00 0.00 0.00 0.00 176.54 176.97 2nyx n ALA 86 N -2.39 1.62 -2.72 3.60 0.00 0.28 -4.90 120.51 116.01 2nyx n ALA 86 Ca 0.12 -0.05 -0.14 0.00 0.00 0.00 0.00 53.44 53.37 2nyx n ALA 86 Cb 0.07 -1.20 0.02 0.00 0.00 0.00 0.00 19.45 18.34 2nyx n ALA 86 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2nyx n GLU 87 N -1.44 -3.05 -0.05 0.00 1.02 0.36 -4.93 120.64 112.55 2nyx n GLU 87 Ca 0.04 0.58 -0.02 0.00 -0.02 0.00 0.00 57.16 57.74 2nyx n GLU 87 Cb 0.13 -4.74 -0.12 0.00 -0.02 0.00 0.00 31.44 26.69 2nyx n GLU 87 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2nyx n LEU 88 N -2.61 0.00 -4.18 -4.62 4.77 0.50 -4.40 117.00 106.47 2nyx n LEU 88 Ca -0.07 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.65 2nyx n LEU 88 Cb 0.58 0.24 -0.15 0.00 -2.33 0.00 0.00 43.42 41.75 2nyx n LEU 88 CO 0.29 0.24 -0.51 -0.63 -1.33 0.00 0.00 177.39 175.46 2nyx s ILE 89 N -2.65 1.44 0.07 -0.08 1.01 -1.05 -1.47 121.20 118.47 2nyx s ILE 89 Ca -0.07 -0.80 0.06 0.00 0.00 0.00 0.00 60.65 59.84 2nyx s ILE 89 Cb 0.07 -1.20 -0.04 0.00 0.01 0.00 0.00 42.46 41.30 2nyx s ILE 89 CO 0.65 0.39 -0.08 -1.81 0.00 0.00 0.00 174.94 174.09 2nyx s ASP 90 N -0.48 4.55 -0.17 3.58 -0.00 0.92 -4.10 116.67 120.97 2nyx s ASP 90 Ca 0.07 -0.29 -0.09 0.00 -0.00 0.00 0.00 52.55 52.24 2nyx s ASP 90 Cb -0.07 -0.96 -0.05 0.00 -0.00 0.00 0.00 42.92 41.84 2nyx s ASP 90 CO -0.01 0.21 0.13 -0.13 -0.00 0.00 0.00 175.17 175.37 2nyx s ARG 91 N -2.00 3.95 0.06 8.23 0.52 -1.26 -0.85 118.95 127.59 2nyx s ARG 91 Ca 0.21 -0.21 0.08 0.00 -0.52 0.00 0.00 55.73 55.30 2nyx s ARG 91 Cb -0.11 -3.33 -0.03 0.00 0.52 0.00 0.00 34.95 32.00 2nyx s ARG 91 CO 0.13 0.44 -0.23 -0.51 0.02 0.00 0.00 175.30 175.15 2nyx s LEU 92 N -0.05 2.20 0.62 2.53 1.43 0.15 -4.93 118.68 120.62 2nyx s LEU 92 Ca 0.10 -0.59 -0.18 0.00 -1.03 0.00 0.00 54.13 52.43 2nyx s LEU 92 Cb -0.11 -1.05 -0.02 0.00 0.03 0.00 0.00 46.19 45.03 2nyx s LEU 92 CO -0.00 0.17 1.19 -2.16 0.23 0.00 0.00 176.35 175.78 2nyx s PRO 93 N -1.39 2.85 0.27 1.29 0.04 -1.26 -0.09 135.00 136.70 2nyx s PRO 93 Ca 0.09 1.76 -0.29 0.00 0.04 0.00 0.00 61.00 62.59 2nyx s PRO 93 Cb -0.09 -1.92 -0.09 0.00 0.04 0.00 0.00 34.50 32.43 2nyx s PRO 93 CO 0.03 -1.29 1.13 -1.58 0.04 0.00 0.00 177.00 175.33 2nyx s HIS 94 N -1.74 3.52 0.00 0.56 2.46 -1.18 -4.70 115.29 114.20 2nyx s HIS 94 Ca 0.76 1.64 0.00 0.00 0.47 0.00 0.00 55.06 57.92 2nyx s HIS 94 Cb -0.29 -3.33 0.00 0.00 -0.13 0.00 0.00 32.58 28.83 2nyx s HIS 94 CO 0.35 -0.74 0.00 -2.30 -2.47 0.00 0.00 174.74 169.59 2nyx n PRO 95 N 1.38 0.00 0.00 2.88 -0.02 -1.26 -3.71 135.00 134.27 2nyx n PRO 95 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2nyx n PRO 95 Cb 0.45 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.93 2nyx n PRO 95 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 2nyx n THR 96 N -0.81 0.00 -2.33 3.45 -1.04 -1.26 -5.07 114.28 107.23 2nyx n THR 96 Ca 0.00 0.00 -0.39 0.00 -2.04 0.00 0.00 64.05 61.62 2nyx n THR 96 Cb 0.00 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.48 2nyx n THR 96 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 2nyx s SER 97 N -4.00 6.75 0.00 8.00 0.15 -1.24 -4.95 113.70 118.41 2nyx s SER 97 Ca 0.00 2.36 0.23 0.00 0.70 0.00 0.00 55.95 59.24 2nyx s SER 97 Cb 0.00 -2.62 0.10 0.00 -1.71 0.00 0.00 66.02 61.79 2nyx s SER 97 CO 0.00 -0.52 1.12 -2.11 1.20 0.00 0.00 173.24 172.93 2nyx n ARG 98 N 0.43 0.03 -2.63 5.44 1.85 -1.26 -3.99 116.66 116.53 2nyx n ARG 98 Ca 0.02 -0.00 -0.08 0.00 -1.00 0.00 0.00 57.85 56.79 2nyx n ARG 98 Cb 0.46 -1.51 0.04 0.00 -1.05 0.00 0.00 32.46 30.39 2nyx n ARG 98 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 177.63 180.51 2nyx n ARG 99 N -1.55 2.07 -3.77 2.89 1.85 -1.26 -5.02 116.66 111.87 2nyx n ARG 99 Ca 0.04 -3.65 -0.12 0.00 -1.00 0.00 0.00 57.85 53.13 2nyx n ARG 99 Cb 0.34 -1.70 -0.08 0.00 -1.05 0.00 0.00 32.46 29.97 2nyx n ARG 99 CO 0.00 0.00 0.00 -2.00 -0.01 0.00 0.00 177.63 175.62 2nyx s GLU 100 N -3.62 0.75 0.06 2.89 2.12 -1.26 -5.13 118.70 114.51 2nyx s GLU 100 Ca 0.33 -0.45 0.05 0.00 0.36 0.00 0.00 54.97 55.26 2nyx s GLU 100 Cb 0.37 0.32 -0.03 0.00 0.26 0.00 0.00 34.13 35.06 2nyx s GLU 100 CO -0.02 -0.23 -0.13 -0.51 -0.54 0.00 0.00 175.26 173.83 2nyx s LEU 101 N -1.88 2.23 -0.02 2.70 1.02 -1.26 -3.13 118.68 118.34 2nyx s LEU 101 Ca -0.07 -0.55 0.04 0.00 0.02 0.00 0.00 54.13 53.57 2nyx s LEU 101 Cb -0.02 -0.50 -0.03 0.00 0.02 0.00 0.00 46.19 45.66 2nyx s LEU 101 CO -0.01 -0.05 -0.12 -0.76 0.02 0.00 0.00 176.35 175.43 2nyx s LEU 102 N -1.49 2.89 -0.01 1.79 1.43 0.87 -4.17 118.68 119.99 2nyx s LEU 102 Ca -0.02 -0.20 -0.11 0.00 -1.03 0.00 0.00 54.13 52.77 2nyx s LEU 102 Cb -0.09 -1.64 -0.05 0.00 0.03 0.00 0.00 46.19 44.44 2nyx s LEU 102 CO 0.02 0.31 0.33 0.00 0.23 0.00 0.00 176.35 177.24 2nyx s ALA 103 N -0.86 3.76 -0.08 4.21 0.00 0.40 0.31 121.76 129.50 2nyx s ALA 103 Ca 0.14 -0.38 -0.11 0.00 0.00 0.00 0.00 51.96 51.61 2nyx s ALA 103 Cb -0.11 -2.24 0.03 0.00 0.00 0.00 0.00 23.12 20.80 2nyx s ALA 103 CO 0.04 0.55 0.29 0.00 0.00 0.00 0.00 175.76 176.63 2nyx s ALA 104 N -1.15 -0.73 0.32 0.00 0.00 -0.03 -2.57 121.76 117.60 2nyx s ALA 104 Ca 0.24 0.68 -0.29 0.00 0.00 0.00 0.00 51.96 52.59 2nyx s ALA 104 Cb -0.15 -0.34 -0.11 0.00 0.00 0.00 0.00 23.12 22.53 2nyx s ALA 104 CO 0.12 -0.17 1.44 -0.51 0.00 0.00 0.00 175.76 176.64 2nyx s LEU 105 N -0.25 4.37 0.00 0.00 1.43 -1.26 -0.05 118.68 122.91 2nyx s LEU 105 Ca -0.04 2.84 -0.15 0.00 -1.03 0.00 0.00 54.13 55.76 2nyx s LEU 105 Cb -0.03 -3.65 0.20 0.00 0.03 0.00 0.00 46.19 42.74 2nyx s LEU 105 CO 0.01 -0.74 1.15 0.35 0.23 0.00 0.00 176.35 177.35 2nyx n THR 106 N 1.23 0.00 -0.24 5.49 -2.24 -0.54 -4.74 114.28 113.24 2nyx n THR 106 Ca 0.03 -0.83 0.05 0.00 -2.27 0.00 0.00 64.05 61.04 2nyx n THR 106 Cb 0.40 -1.55 0.30 0.00 -2.10 0.00 0.00 70.33 67.38 2nyx n THR 106 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2nyx h LYS 107 N 0.00 0.87 -0.10 -0.78 3.64 -1.89 -0.93 116.57 117.38 2nyx h LYS 107 Ca -0.37 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 58.93 2nyx h LYS 107 Cb 1.04 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 32.66 2nyx h LYS 107 CO 0.26 0.57 -0.04 0.00 -2.27 0.00 0.00 179.45 177.98 2nyx h ARG 108 N 0.89 0.20 -0.50 1.90 2.47 -1.88 -0.63 114.38 116.82 2nyx h ARG 108 Ca 0.35 -0.08 0.07 0.00 -1.26 0.00 0.00 59.98 59.06 2nyx h ARG 108 Cb 0.22 -0.01 -0.06 0.00 -1.65 0.00 0.00 29.97 28.48 2nyx h ARG 108 CO -0.12 0.54 0.17 0.78 0.56 0.00 0.00 179.97 181.90 2nyx h GLY 109 N -0.15 0.66 0.98 0.04 0.00 -1.58 0.12 103.07 103.14 2nyx h GLY 109 Ca 0.02 -0.09 -0.00 0.00 0.00 0.00 0.00 47.33 47.26 2nyx h GLY 109 CO 0.01 -0.00 0.14 3.21 0.00 0.00 0.00 176.54 179.90 2nyx h ARG 110 N 0.34 0.29 -0.60 4.80 3.08 -1.09 -2.36 114.38 118.84 2nyx h ARG 110 Ca 0.24 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.28 2nyx h ARG 110 Cb 0.27 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.22 2nyx h ARG 110 CO -0.25 0.22 0.40 -0.44 -1.07 0.00 0.00 179.97 178.82 2nyx h ASP 111 N 0.28 0.68 -0.19 7.04 3.45 -0.64 -1.61 116.42 125.43 2nyx h ASP 111 Ca 0.08 -0.02 0.04 0.00 0.43 0.00 0.00 57.03 57.57 2nyx h ASP 111 Cb 0.00 -0.17 -0.07 0.00 -0.56 0.00 0.00 39.33 38.53 2nyx h ASP 111 CO -0.02 0.49 -0.46 0.58 -1.57 0.00 0.00 179.24 178.27 2nyx h VAL 112 N 0.81 0.10 -0.02 -1.35 2.07 -0.84 0.14 116.25 117.15 2nyx h VAL 112 Ca 0.22 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.75 2nyx h VAL 112 Cb -0.08 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 29.78 2nyx h VAL 112 CO -0.05 0.00 -0.02 0.58 0.02 0.00 0.00 177.57 178.09 2nyx h VAL 113 N -0.48 0.93 -0.93 2.57 2.07 -1.04 -1.91 116.25 117.46 2nyx h VAL 113 Ca 0.08 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.64 2nyx h VAL 113 Cb 0.63 0.93 -0.05 0.00 -1.52 0.00 0.00 31.29 31.28 2nyx h VAL 113 CO -0.45 0.00 0.61 -0.09 0.02 0.00 0.00 177.57 177.66 2nyx h ARG 114 N -0.03 1.12 -0.15 1.57 1.12 -1.18 -2.29 114.38 114.53 2nyx h ARG 114 Ca 0.02 -0.07 -0.15 0.00 -1.11 0.00 0.00 59.98 58.67 2nyx h ARG 114 Cb 0.06 -0.25 -0.01 0.00 -0.01 0.00 0.00 29.97 29.76 2nyx h ARG 114 CO -0.04 0.74 -0.53 1.96 -3.11 0.00 0.00 179.97 178.99 2nyx h GLN 115 N 1.16 0.43 -0.38 0.20 4.20 -0.27 -1.52 115.11 118.92 2nyx h GLN 115 Ca 0.37 -0.26 -0.12 0.00 0.06 0.00 0.00 58.65 58.70 2nyx h GLN 115 Cb 0.03 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 2nyx h GLN 115 CO -0.12 0.85 -0.25 0.28 -0.67 0.00 0.00 178.83 178.93 2nyx h VAL 116 N 0.33 1.27 0.34 -0.54 2.07 -1.15 -3.25 116.25 115.32 2nyx h VAL 116 Ca 0.01 -1.38 -0.02 0.00 0.82 0.00 0.00 66.70 66.14 2nyx h VAL 116 Cb 1.04 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 32.06 2nyx h VAL 116 CO 0.09 0.46 -0.16 0.74 0.02 0.00 0.00 177.57 178.72 2nyx h THR 117 N 0.67 0.68 -4.08 2.57 2.02 -1.17 -2.55 112.91 111.05 2nyx h THR 117 Ca 0.09 -0.35 -0.56 0.00 0.77 0.00 0.00 66.41 66.36 2nyx h THR 117 Cb 0.77 0.86 0.15 0.00 -1.74 0.00 0.00 68.15 68.19 2nyx h THR 117 CO 0.06 0.07 0.57 -1.61 0.37 0.00 0.00 175.52 174.98 2nyx s GLU 118 N -5.29 2.82 0.00 6.66 0.41 -0.59 -0.19 118.70 122.52 2nyx s GLU 118 Ca -0.15 2.17 0.00 0.00 -0.41 0.00 0.00 54.97 56.58 2nyx s GLU 118 Cb 0.03 -2.04 0.00 0.00 -1.78 0.00 0.00 34.13 30.34 2nyx s GLU 118 CO 0.59 -1.42 0.00 0.72 -0.49 0.00 0.00 175.26 174.66 2nyx n HIS 119 N -1.50 0.00 0.18 1.61 8.25 -1.26 -4.60 115.22 117.91 2nyx n HIS 119 Ca 0.13 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.45 2nyx n HIS 119 Cb 0.46 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.51 2nyx n HIS 119 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2nyx h ARG 120 N 0.00 -0.49 -0.42 -0.41 3.08 -1.18 0.32 114.38 115.28 2nyx h ARG 120 Ca 0.00 0.03 0.09 0.00 0.07 0.00 0.00 59.98 60.17 2nyx h ARG 120 Cb 0.00 0.11 -0.08 0.00 0.08 0.00 0.00 29.97 30.08 2nyx h ARG 120 CO 0.00 -0.33 -0.14 -0.09 -1.07 0.00 0.00 179.97 178.34 2nyx h ARG 121 N -0.51 -0.04 -0.45 0.04 2.43 -0.82 0.72 114.38 115.74 2nyx h ARG 121 Ca -0.01 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 2nyx h ARG 121 Cb 0.45 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.99 2nyx h ARG 121 CO -0.02 -0.03 0.21 1.15 -1.51 0.00 0.00 179.97 179.77 2nyx h THR 122 N -0.05 1.19 -0.50 0.20 2.02 -1.73 -1.21 112.91 112.84 2nyx h THR 122 Ca 0.21 -0.55 -0.07 0.00 0.77 0.00 0.00 66.41 66.76 2nyx h THR 122 Cb 0.36 0.71 -0.02 0.00 -1.74 0.00 0.00 68.15 67.47 2nyx h THR 122 CO -0.46 0.21 0.03 -0.08 0.37 0.00 0.00 175.52 175.59 2nyx h GLU 123 N 0.59 0.85 -0.20 6.66 4.57 -0.01 -0.80 114.58 126.24 2nyx h GLU 123 Ca 0.15 -0.25 -0.01 0.00 -1.18 0.00 0.00 59.36 58.07 2nyx h GLU 123 Cb 0.14 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.63 2nyx h GLU 123 CO -0.02 0.87 0.11 0.82 -1.18 0.00 0.00 179.01 179.61 2nyx h ILE 124 N 0.72 1.12 -0.94 2.32 2.04 -0.70 -1.96 117.51 120.12 2nyx h ILE 124 Ca 0.14 -0.32 0.03 0.00 1.00 0.00 0.00 64.86 65.72 2nyx h ILE 124 Cb 0.47 0.97 -0.05 0.00 -0.74 0.00 0.00 36.82 37.46 2nyx h ILE 124 CO 0.02 0.11 0.61 0.00 0.00 0.00 0.00 178.15 178.89 2nyx h ALA 125 N 0.99 1.24 0.18 1.87 0.00 -1.08 0.34 119.26 122.79 2nyx h ALA 125 Ca 0.07 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.94 2nyx h ALA 125 Cb 0.09 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 2nyx h ALA 125 CO -0.01 0.48 -0.20 -0.09 0.00 0.00 0.00 179.25 179.43 2nyx h ARG 126 N 1.18 -0.40 -0.79 0.00 2.43 -0.81 -0.76 114.38 115.23 2nyx h ARG 126 Ca 0.37 0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.59 2nyx h ARG 126 Cb 0.00 0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.60 2nyx h ARG 126 CO -0.12 -0.27 0.52 0.82 -1.51 0.00 0.00 179.97 179.41 2nyx h ILE 127 N -0.41 1.17 -0.30 1.20 2.04 -0.96 -3.19 117.51 117.05 2nyx h ILE 127 Ca 0.01 -0.36 -0.11 0.00 1.00 0.00 0.00 64.86 65.40 2nyx h ILE 127 Cb 0.40 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.51 2nyx h ILE 127 CO -0.06 0.19 -0.26 0.58 0.00 0.00 0.00 178.15 178.60 2nyx h VAL 128 N 1.03 1.27 -0.20 1.67 2.07 0.06 -2.42 116.25 119.73 2nyx h VAL 128 Ca 0.30 -1.33 0.06 0.00 0.82 0.00 0.00 66.70 66.55 2nyx h VAL 128 Cb -0.07 1.32 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 2nyx h VAL 128 CO -0.08 0.43 0.19 -0.33 0.02 0.00 0.00 177.57 177.80 2nyx h GLU 129 N 0.52 0.00 -2.40 1.57 5.08 -1.13 -3.44 114.58 114.78 2nyx h GLU 129 Ca 0.07 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.84 2nyx h GLU 129 Cb 0.72 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.86 2nyx h GLU 129 CO 0.06 0.00 1.63 1.04 -1.00 0.00 0.00 179.01 180.74 2nyx n GLN 130 N -3.96 3.46 -4.29 2.33 6.02 -0.92 -5.06 117.38 114.96 2nyx n GLN 130 Ca 0.02 -2.63 -0.34 0.00 -0.01 0.00 0.00 57.00 54.04 2nyx n GLN 130 Cb 0.32 -2.42 -0.09 0.00 1.02 0.00 0.00 30.24 29.07 2nyx n GLN 130 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2nyx s ALA 132 N -0.61 3.35 0.28 -1.58 0.00 -1.26 -5.15 121.76 116.79 2nyx s ALA 132 Ca 0.59 -0.84 0.00 0.00 0.00 0.00 0.00 51.96 51.72 2nyx s ALA 132 Cb 0.26 -1.48 0.64 0.00 0.00 0.00 0.00 23.12 22.54 2nyx s ALA 132 CO -0.12 0.62 1.68 -1.35 0.00 0.00 0.00 175.76 176.59 2nyx h PRO 133 N 4.81 0.30 -0.59 0.00 0.11 -1.97 -0.72 132.00 133.95 2nyx h PRO 133 Ca -0.50 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.54 2nyx h PRO 133 Cb 1.19 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.20 2nyx h PRO 133 CO 0.56 0.20 0.19 0.00 -0.21 0.00 0.00 178.00 178.74 2nyx h ALA 134 N 1.70 1.23 -0.46 -0.75 0.00 -2.02 -2.90 119.26 116.05 2nyx h ALA 134 Ca 0.51 -0.19 -0.14 0.00 0.00 0.00 0.00 54.91 55.10 2nyx h ALA 134 Cb 0.96 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2nyx h ALA 134 CO -0.56 0.55 -0.25 0.93 0.00 0.00 0.00 179.25 179.92 2nyx h GLU 135 N 0.86 0.99 -0.94 0.00 5.08 -1.58 -1.39 114.58 117.60 2nyx h GLU 135 Ca 0.20 -0.44 0.08 0.00 -1.00 0.00 0.00 59.36 58.20 2nyx h GLU 135 Cb 0.24 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.40 2nyx h GLU 135 CO -0.01 1.11 0.61 0.00 -1.00 0.00 0.00 179.01 179.72 2nyx h ARG 136 N 0.84 0.99 -0.10 2.33 3.08 -1.25 -0.20 114.38 120.07 2nyx h ARG 136 Ca 0.10 -0.06 -0.16 0.00 0.07 0.00 0.00 59.98 59.93 2nyx h ARG 136 Cb 0.83 -0.22 0.01 0.00 0.08 0.00 0.00 29.97 30.67 2nyx h ARG 136 CO 0.07 0.65 -0.56 1.25 -1.07 0.00 0.00 179.97 180.32 2nyx h HIS 137 N 1.02 0.76 -0.88 3.04 2.76 -1.31 -2.68 115.15 117.86 2nyx h HIS 137 Ca 0.42 -0.34 0.07 0.00 -2.20 0.00 0.00 60.37 58.32 2nyx h HIS 137 Cb 0.30 -0.12 -0.06 0.00 1.55 0.00 0.00 27.41 29.08 2nyx h HIS 137 CO -0.00 1.13 0.57 0.78 -1.30 0.00 0.00 177.93 179.11 2nyx h GLY 138 N 0.17 1.27 0.74 5.26 0.00 -0.80 -1.28 103.07 108.43 2nyx h GLY 138 Ca -0.04 -0.40 -0.01 0.00 0.00 0.00 0.00 47.33 46.89 2nyx h GLY 138 CO 0.12 0.28 -0.07 -2.00 0.00 0.00 0.00 176.54 174.87 2nyx h LEU 139 N 0.98 -0.16 -0.69 3.11 5.85 -0.92 0.98 115.31 124.47 2nyx h LEU 139 Ca 0.38 -0.21 0.13 0.00 0.84 0.00 0.00 57.88 59.03 2nyx h LEU 139 Cb 0.22 0.04 -0.09 0.00 0.37 0.00 0.00 40.66 41.20 2nyx h LEU 139 CO -0.14 0.12 0.22 0.58 -0.34 0.00 0.00 178.44 178.88 2nyx h VAL 140 N -0.45 0.63 -0.04 1.05 2.07 -1.32 -1.15 116.25 117.04 2nyx h VAL 140 Ca -0.02 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.38 2nyx h VAL 140 Cb 0.36 0.25 -0.00 0.00 -1.52 0.00 0.00 31.29 30.38 2nyx h VAL 140 CO 0.03 0.06 0.02 -0.09 0.02 0.00 0.00 177.57 177.62 2nyx h ARG 141 N 0.35 0.05 -0.88 1.57 2.43 -0.87 -1.98 114.38 115.05 2nyx h ARG 141 Ca 0.38 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.54 2nyx h ARG 141 Cb 0.58 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.08 2nyx h ARG 141 CO -0.42 0.03 0.52 0.00 -1.51 0.00 0.00 179.97 178.59 2nyx h ALA 142 N 1.01 1.12 0.04 2.80 0.00 -0.05 -1.03 119.26 123.15 2nyx h ALA 142 Ca 0.01 -0.11 -0.22 0.00 0.00 0.00 0.00 54.91 54.59 2nyx h ALA 142 Cb -0.01 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 2nyx h ALA 142 CO -0.00 0.59 -1.00 -0.07 0.00 0.00 0.00 179.25 178.77 2nyx h LEU 143 N 1.21 0.29 -0.28 0.00 3.38 -1.14 -2.08 115.31 116.69 2nyx h LEU 143 Ca 0.31 -0.26 -0.18 0.00 0.09 0.00 0.00 57.88 57.84 2nyx h LEU 143 Cb -0.03 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.63 2nyx h LEU 143 CO -0.06 1.12 -0.51 0.71 0.09 0.00 0.00 178.44 179.79 2nyx h THR 144 N 0.09 1.28 -0.93 0.22 1.35 -1.28 -1.86 112.91 111.78 2nyx h THR 144 Ca -0.07 -1.70 0.03 0.00 -0.55 0.00 0.00 66.41 64.13 2nyx h THR 144 Cb 1.68 1.64 -0.05 0.00 -1.73 0.00 0.00 68.15 69.69 2nyx h THR 144 CO 0.15 0.55 0.61 0.00 -0.25 0.00 0.00 175.52 176.59 2nyx h ALA 145 N 0.67 1.39 -0.26 6.62 0.00 -1.14 -0.64 119.26 125.91 2nyx h ALA 145 Ca 0.02 -0.05 -0.18 0.00 0.00 0.00 0.00 54.91 54.70 2nyx h ALA 145 Cb 1.12 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.57 2nyx h ALA 145 CO 0.12 0.52 -0.53 0.35 0.00 0.00 0.00 179.25 179.71 2nyx h PHE 146 N 1.18 1.02 -0.74 0.00 3.57 -1.36 -2.79 116.94 117.82 2nyx h PHE 146 Ca 0.36 -0.37 0.04 0.00 3.53 0.00 0.00 57.97 61.53 2nyx h PHE 146 Cb -0.01 -0.19 -0.05 0.00 2.79 0.00 0.00 35.95 38.49 2nyx h PHE 146 CO -0.00 1.19 0.46 1.15 -2.23 0.00 0.00 178.31 178.88 2nyx h THR 147 N 0.57 1.09 -0.59 4.41 2.02 -0.87 -2.26 112.91 117.28 2nyx h THR 147 Ca 0.01 -0.31 -0.02 0.00 0.77 0.00 0.00 66.41 66.86 2nyx h THR 147 Cb 1.14 0.11 -0.03 0.00 -1.74 0.00 0.00 68.15 67.63 2nyx h THR 147 CO 0.12 0.16 0.31 -0.33 0.37 0.00 0.00 175.52 176.15 2nyx h GLU 148 N 0.90 0.84 0.00 6.66 4.39 -1.11 -2.79 114.58 123.47 2nyx h GLU 148 Ca 0.30 -0.11 -0.03 0.00 0.34 0.00 0.00 59.36 59.86 2nyx h GLU 148 Cb 0.04 -0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 28.53 2nyx h GLU 148 CO -0.12 0.66 -0.17 0.00 -1.16 0.00 0.00 179.01 178.22 2nyx h ALA 149 N 1.14 1.66 -0.25 3.43 0.00 -1.19 -2.97 119.26 121.08 2nyx h ALA 149 Ca 0.21 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 2nyx h ALA 149 Cb 0.07 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.77 2nyx h ALA 149 CO -0.03 0.21 0.14 0.41 0.00 0.00 0.00 179.25 179.98 2nyx n GLY 150 N -1.00 2.50 3.70 0.00 0.00 -0.88 -4.96 105.19 104.55 2nyx n GLY 150 Ca -0.02 -0.29 -0.43 0.00 0.00 0.00 0.00 46.02 45.28 2nyx n GLY 150 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nyx n GLY 151 N 0.08 1.59 3.37 -0.02 0.00 -1.12 -5.06 105.19 104.02 2nyx n GLY 151 Ca 0.14 0.69 0.00 0.00 0.00 0.00 0.00 46.02 46.85 2nyx n GLY 151 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11