#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nyx n GLU 11 N 0.00 1.78 -2.70 0.00 -0.00 -1.26 -4.57 120.64 113.89 2nyx n GLU 11 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 57.16 57.10 2nyx n GLU 11 Cb 0.00 -0.68 0.01 0.00 -0.00 0.00 0.00 31.44 30.77 2nyx n GLU 11 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 2nyx n GLU 12 N -0.98 -1.92 0.00 3.44 2.13 -1.26 -4.91 120.64 117.14 2nyx n GLU 12 Ca 0.00 1.82 0.00 0.00 0.66 0.00 0.00 57.16 59.64 2nyx n GLU 12 Cb 0.16 -5.15 0.00 0.00 0.27 0.00 0.00 31.44 26.72 2nyx n GLU 12 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2nyx n SER 13 N -0.55 0.00 0.12 4.31 2.88 -1.26 -4.47 113.62 114.65 2nyx n SER 13 Ca 0.09 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.62 2nyx n SER 13 Cb 0.42 0.00 0.26 0.00 -0.75 0.00 0.00 64.21 64.13 2nyx n SER 13 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 2nyx h VAL 14 N 0.00 1.30 -0.44 2.46 2.07 -1.98 -1.14 116.25 118.53 2nyx h VAL 14 Ca 0.00 -1.47 -0.01 0.00 0.82 0.00 0.00 66.70 66.04 2nyx h VAL 14 Cb 0.00 1.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.44 2nyx h VAL 14 CO 0.00 0.43 0.22 0.44 0.02 0.00 0.00 177.57 178.68 2nyx h ASP 15 N 0.15 0.57 -0.37 0.57 3.45 -1.99 -0.68 116.42 118.12 2nyx h ASP 15 Ca 0.01 -0.12 -0.03 0.00 0.43 0.00 0.00 57.03 57.32 2nyx h ASP 15 Cb 0.78 -0.15 -0.02 0.00 -0.56 0.00 0.00 39.33 39.39 2nyx h ASP 15 CO 0.06 0.53 0.10 0.58 -1.57 0.00 0.00 179.24 178.94 2nyx h VAL 16 N 0.57 1.22 -0.10 -1.35 2.07 -1.78 -1.26 116.25 115.62 2nyx h VAL 16 Ca 0.15 -0.74 -0.00 0.00 0.82 0.00 0.00 66.70 66.93 2nyx h VAL 16 Cb 0.11 1.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.88 2nyx h VAL 16 CO -0.02 0.25 0.05 0.40 0.02 0.00 0.00 177.57 178.27 2nyx h ILE 17 N 0.44 1.11 -0.56 4.57 1.08 -1.20 -2.54 117.51 120.41 2nyx h ILE 17 Ca 0.12 -0.32 0.05 0.00 -0.39 0.00 0.00 64.86 64.31 2nyx h ILE 17 Cb 0.29 1.15 -0.05 0.00 -3.07 0.00 0.00 36.82 35.14 2nyx h ILE 17 CO -0.00 0.10 0.29 0.74 -0.69 0.00 0.00 178.15 178.59 2nyx h THR 18 N 0.04 0.96 -0.47 -0.27 2.02 -1.00 -1.39 112.91 112.80 2nyx h THR 18 Ca 0.03 -0.19 0.06 0.00 0.77 0.00 0.00 66.41 67.09 2nyx h THR 18 Cb 0.11 0.35 -0.05 0.00 -1.74 0.00 0.00 68.15 66.82 2nyx h THR 18 CO -0.00 0.10 0.16 -0.78 0.37 0.00 0.00 175.52 175.37 2nyx h ASP 19 N 0.56 0.15 -0.57 4.18 3.58 -1.17 -2.20 116.42 120.96 2nyx h ASP 19 Ca 0.25 0.06 -0.02 0.00 0.42 0.00 0.00 57.03 57.74 2nyx h ASP 19 Cb 0.15 0.05 -0.03 0.00 1.72 0.00 0.00 39.33 41.21 2nyx h ASP 19 CO -0.16 0.12 0.29 0.00 -2.88 0.00 0.00 179.24 176.61 2nyx h ALA 20 N 1.32 1.39 -0.03 -0.78 0.00 -0.87 -2.96 119.26 117.33 2nyx h ALA 20 Ca 0.22 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.88 2nyx h ALA 20 Cb 0.24 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2nyx h ALA 20 CO -0.24 0.48 -0.62 -0.07 0.00 0.00 0.00 179.25 178.80 2nyx h LEU 21 N 0.84 0.14 -0.23 0.00 3.38 -0.78 -0.15 115.31 118.51 2nyx h LEU 21 Ca 0.21 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 58.10 2nyx h LEU 21 Cb 0.08 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2nyx h LEU 21 CO -0.03 0.73 0.13 -0.07 0.09 0.00 0.00 178.44 179.29 2nyx h LEU 22 N 0.09 0.22 0.03 1.67 3.38 -1.24 -0.37 115.31 119.10 2nyx h LEU 22 Ca -0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2nyx h LEU 22 Cb 1.12 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.82 2nyx h LEU 22 CO 0.09 0.16 -0.01 0.74 0.09 0.00 0.00 178.44 179.51 2nyx h THR 23 N 0.28 1.17 0.00 0.22 2.02 -1.56 -3.27 112.91 111.78 2nyx h THR 23 Ca 0.09 -0.61 -0.06 0.00 0.77 0.00 0.00 66.41 66.60 2nyx h THR 23 Cb -0.01 1.58 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 2nyx h THR 23 CO -0.04 0.16 -0.26 0.00 0.37 0.00 0.00 175.52 175.74 2nyx h ALA 24 N 0.66 1.29 -0.02 6.16 0.00 -0.87 -2.63 119.26 123.85 2nyx h ALA 24 Ca -0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2nyx h ALA 24 Cb 0.28 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2nyx h ALA 24 CO 0.01 0.33 -0.05 -1.13 0.00 0.00 0.00 179.25 178.41 2nyx n SER 25 N -3.83 1.71 -0.25 0.00 3.41 -0.16 -4.44 113.62 110.06 2nyx n SER 25 Ca -0.02 -1.51 0.00 0.00 -0.26 0.00 0.00 58.87 57.09 2nyx n SER 25 Cb 0.35 0.03 0.13 0.00 -0.26 0.00 0.00 64.21 64.46 2nyx n SER 25 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2nyx h ARG 26 N 2.61 0.64 -0.04 4.33 2.43 -1.51 -1.56 114.38 121.27 2nyx h ARG 26 Ca 0.00 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.13 2nyx h ARG 26 Cb 0.59 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 30.00 2nyx h ARG 26 CO 0.00 0.42 0.01 1.25 -1.51 0.00 0.00 179.97 180.14 2nyx h LEU 27 N 0.66 0.06 -0.96 3.80 5.85 -1.82 -1.54 115.31 121.37 2nyx h LEU 27 Ca 0.34 -0.23 0.03 0.00 0.84 0.00 0.00 57.88 58.85 2nyx h LEU 27 Cb 0.30 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.26 2nyx h LEU 27 CO -0.23 0.28 0.63 0.25 -0.34 0.00 0.00 178.44 179.03 2nyx h LEU 28 N -0.15 1.06 -0.79 2.25 5.85 -1.80 -0.46 115.31 121.28 2nyx h LEU 28 Ca 0.01 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 2nyx h LEU 28 Cb 0.24 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 2nyx h LEU 28 CO 0.00 0.74 0.40 0.58 -0.34 0.00 0.00 178.44 179.82 2nyx h VAL 29 N 1.24 1.24 -0.58 1.05 2.07 -1.19 -0.68 116.25 119.40 2nyx h VAL 29 Ca 0.37 -0.65 -0.10 0.00 0.82 0.00 0.00 66.70 67.15 2nyx h VAL 29 Cb -0.04 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 29.94 2nyx h VAL 29 CO -0.11 0.28 -0.02 0.00 0.02 0.00 0.00 177.57 177.74 2nyx h ALA 30 N 1.21 0.85 -0.27 1.67 0.00 -0.33 0.11 119.26 122.50 2nyx h ALA 30 Ca 0.27 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 2nyx h ALA 30 Cb 0.08 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2nyx h ALA 30 CO -0.04 0.66 -0.05 0.82 0.00 0.00 0.00 179.25 180.64 2nyx h ILE 31 N 0.94 1.28 -0.56 0.00 2.04 -0.97 -1.26 117.51 118.99 2nyx h ILE 31 Ca 0.16 -1.06 0.04 0.00 1.00 0.00 0.00 64.86 65.00 2nyx h ILE 31 Cb 0.58 1.41 -0.04 0.00 -0.74 0.00 0.00 36.82 38.03 2nyx h ILE 31 CO 0.03 0.33 0.32 0.28 0.00 0.00 0.00 178.15 179.11 2nyx h SER 32 N 0.28 0.49 -0.55 1.72 0.02 -0.98 -0.76 113.55 113.77 2nyx h SER 32 Ca 0.07 0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 60.95 2nyx h SER 32 Cb 0.52 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.95 2nyx h SER 32 CO 0.02 0.34 0.03 0.00 -1.14 0.00 0.00 176.83 176.08 2nyx h ALA 33 N 1.27 0.95 -0.35 3.77 0.00 -0.69 -2.91 119.26 121.30 2nyx h ALA 33 Ca 0.23 -0.29 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 2nyx h ALA 33 Cb 0.08 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2nyx h ALA 33 CO -0.13 0.64 -0.31 1.25 0.00 0.00 0.00 179.25 180.70 2nyx h HIS 34 N 0.91 0.88 -0.22 0.00 6.17 -0.96 -2.65 115.15 119.29 2nyx h HIS 34 Ca 0.17 -0.23 -0.05 0.00 0.71 0.00 0.00 60.37 60.97 2nyx h HIS 34 Cb 0.49 -0.20 -0.01 0.00 2.52 0.00 0.00 27.41 30.21 2nyx h HIS 34 CO 0.03 0.97 -0.08 0.66 0.71 0.00 0.00 177.93 180.22 2nyx h SER 35 N 0.64 0.31 0.15 3.26 4.64 -1.00 -1.77 113.55 119.78 2nyx h SER 35 Ca 0.07 -0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 61.32 2nyx h SER 35 Cb 0.84 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 2nyx h SER 35 CO 0.07 0.44 -0.07 0.40 -0.87 0.00 0.00 176.83 176.80 2nyx h ILE 36 N 0.32 0.97 0.00 0.95 2.04 -1.37 -3.30 117.51 117.12 2nyx h ILE 36 Ca 0.07 -1.06 -0.02 0.00 1.00 0.00 0.00 64.86 64.85 2nyx h ILE 36 Cb 0.35 1.57 -0.00 0.00 -0.74 0.00 0.00 36.82 37.99 2nyx h ILE 36 CO 0.02 0.23 -0.09 0.00 0.00 0.00 0.00 178.15 178.30 2nyx h ALA 37 N -0.08 1.64 0.00 1.87 0.00 -1.37 -2.21 119.26 119.10 2nyx h ALA 37 Ca -0.02 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2nyx h ALA 37 Cb 0.53 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2nyx h ALA 37 CO 0.03 0.12 0.00 0.00 0.00 0.00 0.00 179.25 179.40 2nyx n GLN 38 N -4.12 0.19 -0.13 0.00 10.64 -0.68 -2.66 117.38 120.62 2nyx n GLN 38 Ca -0.03 0.28 -0.23 0.00 -1.83 0.00 0.00 57.00 55.20 2nyx n GLN 38 Cb 0.18 -1.78 -0.11 0.00 -0.86 0.00 0.00 30.24 27.67 2nyx n GLN 38 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.06 175.51 2nyx n VAL 39 N -2.12 1.51 -3.54 -0.39 0.31 -0.87 -4.90 118.33 108.34 2nyx n VAL 39 Ca 0.04 -0.49 -0.19 0.00 -0.01 0.00 0.00 64.34 63.69 2nyx n VAL 39 Cb 0.32 -1.62 -0.14 0.00 -0.91 0.00 0.00 33.84 31.49 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 -6.94 1.40 0.20 4.52 2.15 -1.01 -5.02 116.67 111.97 2nyx s ASP 40 Ca -0.36 -0.17 0.17 0.00 0.43 0.00 0.00 52.55 52.61 2nyx s ASP 40 Cb 0.11 0.28 0.81 0.00 -0.30 0.00 0.00 42.92 43.83 2nyx s ASP 40 CO 0.56 -0.32 1.51 -1.84 -0.17 0.00 0.00 175.17 174.92 2nyx n GLU 41 N 5.31 0.11 0.00 4.34 0.00 -1.09 -2.46 120.64 126.87 2nyx n GLU 41 Ca -0.06 0.50 0.11 0.00 0.00 0.00 0.00 57.16 57.72 2nyx n GLU 41 Cb 0.49 -1.78 0.04 0.00 0.00 0.00 0.00 31.44 30.20 2nyx n GLU 41 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2nyx n ASN 42 N -2.00 0.72 -4.65 -1.84 5.03 -1.26 -4.88 115.26 106.38 2nyx n ASN 42 Ca 0.00 -0.56 -0.40 0.00 0.87 0.00 0.00 54.58 54.49 2nyx n ASN 42 Cb 0.10 0.70 -0.06 0.00 -1.02 0.00 0.00 39.78 39.50 2nyx n ASN 42 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.26 174.92 2nyx s ILE 43 N -3.04 5.01 0.84 2.41 1.10 -1.03 -5.06 121.20 121.43 2nyx s ILE 43 Ca 0.08 1.19 -0.12 0.00 -0.51 0.00 0.00 60.65 61.28 2nyx s ILE 43 Cb 0.16 -3.95 0.10 0.00 0.15 0.00 0.00 42.46 38.92 2nyx s ILE 43 CO 0.79 0.09 1.18 0.42 -2.11 0.00 0.00 174.94 175.32 2nyx s THR 44 N 2.05 2.00 0.07 4.00 -4.23 -1.26 -4.78 115.64 113.49 2nyx s THR 44 Ca 0.28 0.00 -0.19 0.00 -1.18 0.00 0.00 61.69 60.60 2nyx s THR 44 Cb -0.16 -2.96 -0.10 0.00 1.34 0.00 0.00 72.50 70.63 2nyx s THR 44 CO 0.10 0.00 1.49 0.40 -0.54 0.00 0.00 174.62 176.07 2nyx h ILE 45 N -1.18 1.27 -0.61 2.99 2.04 -1.98 0.75 117.51 120.78 2nyx h ILE 45 Ca -0.47 -0.94 0.03 0.00 1.00 0.00 0.00 64.86 64.48 2nyx h ILE 45 Cb 1.32 1.46 -0.04 0.00 -0.74 0.00 0.00 36.82 38.82 2nyx h ILE 45 CO 0.63 0.29 0.37 -0.65 0.00 0.00 0.00 178.15 178.79 2nyx h PRO 46 N 0.14 0.71 0.02 2.37 0.11 -1.99 0.88 132.00 134.25 2nyx h PRO 46 Ca 0.06 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 66.15 2nyx h PRO 46 Cb 0.44 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 31.35 2nyx h PRO 46 CO 0.01 0.47 -0.19 1.96 -0.21 0.00 0.00 178.00 180.04 2nyx h GLN 47 N 0.74 -0.32 -0.55 1.05 4.20 -1.92 -1.26 115.11 117.05 2nyx h GLN 47 Ca 0.25 0.02 0.06 0.00 0.06 0.00 0.00 58.65 59.04 2nyx h GLN 47 Cb 0.02 0.07 -0.05 0.00 0.30 0.00 0.00 27.48 27.82 2nyx h GLN 47 CO -0.10 -0.21 0.25 0.35 -0.67 0.00 0.00 178.83 178.45 2nyx h PHE 48 N -0.33 0.45 -0.93 2.96 3.57 -0.19 -2.12 116.94 120.35 2nyx h PHE 48 Ca 0.05 0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.65 2nyx h PHE 48 Cb 0.39 -0.12 -0.07 0.00 2.79 0.00 0.00 35.95 38.94 2nyx h PHE 48 CO -0.23 0.19 0.58 -0.09 -2.23 0.00 0.00 178.31 176.53 2nyx h ARG 49 N 0.48 1.00 -0.56 1.11 9.65 -0.57 -1.71 114.38 123.77 2nyx h ARG 49 Ca 0.25 -0.06 0.11 0.00 -1.10 0.00 0.00 59.98 59.19 2nyx h ARG 49 Cb 0.22 -0.23 -0.09 0.00 -1.39 0.00 0.00 29.97 28.48 2nyx h ARG 49 CO -0.21 0.66 0.03 1.15 2.80 0.00 0.00 179.97 184.40 2nyx h THR 50 N 1.03 0.57 -0.07 0.20 2.02 -0.56 0.18 112.91 116.28 2nyx h THR 50 Ca 0.42 -0.05 0.03 0.00 0.77 0.00 0.00 66.41 67.57 2nyx h THR 50 Cb 0.23 0.42 -0.03 0.00 -1.74 0.00 0.00 68.15 67.03 2nyx h THR 50 CO -0.19 0.03 -0.10 -0.07 0.37 0.00 0.00 175.52 175.55 2nyx h LEU 51 N 0.14 -0.32 -0.48 2.58 4.07 -1.01 -0.56 115.31 119.73 2nyx h LEU 51 Ca 0.29 0.06 0.00 0.00 0.08 0.00 0.00 57.88 58.31 2nyx h LEU 51 Cb 0.45 0.15 -0.02 0.00 1.08 0.00 0.00 40.66 42.32 2nyx h LEU 51 CO -0.45 -0.14 0.32 0.58 -1.08 0.00 0.00 178.44 177.66 2nyx h VAL 52 N -0.14 1.13 -0.39 1.22 2.07 -1.02 0.16 116.25 119.28 2nyx h VAL 52 Ca 0.06 -0.25 0.07 0.00 0.82 0.00 0.00 66.70 67.40 2nyx h VAL 52 Cb 0.23 0.43 -0.06 0.00 -1.52 0.00 0.00 31.29 30.38 2nyx h VAL 52 CO -0.16 0.13 0.05 0.40 0.02 0.00 0.00 177.57 178.00 2nyx h ILE 53 N 0.65 0.76 -0.04 4.57 2.04 -0.39 -1.25 117.51 123.86 2nyx h ILE 53 Ca 0.18 -0.06 -0.05 0.00 1.00 0.00 0.00 64.86 65.93 2nyx h ILE 53 Cb -0.06 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 2nyx h ILE 53 CO -0.04 0.03 -0.22 -0.07 0.00 0.00 0.00 178.15 177.85 2nyx h LEU 54 N 0.16 0.06 -0.09 1.44 3.38 -0.46 0.17 115.31 119.96 2nyx h LEU 54 Ca 0.19 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.14 2nyx h LEU 54 Cb 0.25 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 2nyx h LEU 54 CO -0.28 0.28 0.04 -1.28 0.09 0.00 0.00 178.44 177.30 2nyx h SER 55 N 0.06 0.12 0.62 -0.43 0.87 -0.30 -1.55 113.55 112.93 2nyx h SER 55 Ca 0.01 -0.13 -0.21 0.00 -1.23 0.00 0.00 61.79 60.23 2nyx h SER 55 Cb 0.43 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.34 2nyx h SER 55 CO 0.03 0.22 -0.92 0.78 -0.53 0.00 0.00 176.83 176.40 2nyx h ASN 56 N 0.02 0.26 0.00 6.23 2.35 -0.76 -3.37 115.58 120.30 2nyx h ASN 56 Ca 0.03 -0.22 0.00 0.00 -0.55 0.00 0.00 56.30 55.56 2nyx h ASN 56 Cb 0.13 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.42 2nyx h ASN 56 CO -0.00 1.05 -1.22 1.41 -1.65 0.00 0.00 177.43 177.01 2nyx n HIS 57 N -3.62 0.00 -3.63 1.19 8.25 0.54 -5.10 115.22 112.84 2nyx n HIS 57 Ca -0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 2nyx n HIS 57 Cb 0.84 -0.16 0.00 0.00 1.12 0.00 0.00 29.99 31.79 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 1.43 -1.93 3.70 -1.41 0.00 -0.58 -4.77 105.19 101.63 2nyx n GLY 58 Ca 0.01 -1.46 -0.42 0.00 0.00 0.00 0.00 46.02 44.15 2nyx n GLY 58 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2nyx s PRO 59 N 0.00 4.29 0.10 1.61 0.02 -1.26 -4.74 135.00 135.03 2nyx s PRO 59 Ca 0.00 2.07 0.02 0.00 0.02 0.00 0.00 61.00 63.11 2nyx s PRO 59 Cb 0.00 -3.41 -0.04 0.00 0.02 0.00 0.00 34.50 31.07 2nyx s PRO 59 CO 0.00 -0.53 -0.06 0.96 -0.33 0.00 0.00 177.00 177.04 2nyx s ILE 60 N 1.78 0.71 0.83 2.83 -4.36 -0.97 -4.92 121.20 117.10 2nyx s ILE 60 Ca 0.65 -1.94 -0.12 0.00 -0.26 0.00 0.00 60.65 58.98 2nyx s ILE 60 Cb -0.35 -1.71 0.09 0.00 1.25 0.00 0.00 42.46 41.74 2nyx s ILE 60 CO 0.29 -0.85 1.18 0.54 0.24 0.00 0.00 174.94 176.35 2nyx s ASN 61 N -3.06 4.30 0.21 4.36 2.20 -1.26 -0.43 114.94 121.26 2nyx s ASN 61 Ca 0.13 0.78 -0.10 0.00 -0.94 0.00 0.00 52.86 52.73 2nyx s ASN 61 Cb 0.05 -1.25 0.16 0.00 -2.00 0.00 0.00 41.25 38.21 2nyx s ASN 61 CO -0.04 -2.04 1.86 0.25 -2.94 0.00 0.00 177.10 174.19 2nyx h LEU 62 N -1.15 0.93 -0.42 3.54 7.12 -1.98 -1.49 115.31 121.86 2nyx h LEU 62 Ca -0.46 -0.06 0.04 0.00 0.13 0.00 0.00 57.88 57.53 2nyx h LEU 62 Cb 1.33 -0.23 -0.04 0.00 -0.53 0.00 0.00 40.66 41.18 2nyx h LEU 62 CO 0.64 0.72 0.18 0.00 -0.13 0.00 0.00 178.44 179.84 2nyx h ALA 63 N 1.25 0.52 -0.28 1.25 0.00 -1.96 0.49 119.26 120.53 2nyx h ALA 63 Ca 0.28 0.04 -0.15 0.00 0.00 0.00 0.00 54.91 55.07 2nyx h ALA 63 Cb -0.04 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2nyx h ALA 63 CO -0.05 -0.20 -0.42 1.15 0.00 0.00 0.00 179.25 179.73 2nyx h THR 64 N 0.36 1.29 -0.11 0.00 2.02 -1.91 -2.36 112.91 112.20 2nyx h THR 64 Ca 0.19 -1.61 0.03 0.00 0.77 0.00 0.00 66.41 65.79 2nyx h THR 64 Cb 0.15 1.64 -0.03 0.00 -1.74 0.00 0.00 68.15 68.17 2nyx h THR 64 CO -0.17 0.52 -0.05 0.25 0.37 0.00 0.00 175.52 176.44 2nyx h LEU 65 N 0.54 -0.16 -0.90 2.58 5.85 -1.02 -0.91 115.31 121.29 2nyx h LEU 65 Ca 0.03 0.04 0.09 0.00 0.84 0.00 0.00 57.88 58.87 2nyx h LEU 65 Cb 1.02 0.09 -0.07 0.00 0.37 0.00 0.00 40.66 42.07 2nyx h LEU 65 CO 0.10 -0.06 0.55 0.00 -0.34 0.00 0.00 178.44 178.69 2nyx h ALA 66 N 1.08 1.29 0.06 1.25 0.00 -0.80 0.31 119.26 122.45 2nyx h ALA 66 Ca 0.06 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2nyx h ALA 66 Cb 0.12 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2nyx h ALA 66 CO -0.14 0.24 -0.03 1.15 0.00 0.00 0.00 179.25 180.47 2nyx h THR 67 N 0.95 1.19 -0.67 0.00 2.02 -1.09 0.48 112.91 115.80 2nyx h THR 67 Ca 0.42 -0.89 0.05 0.00 0.77 0.00 0.00 66.41 66.75 2nyx h THR 67 Cb 0.30 1.77 -0.04 0.00 -1.74 0.00 0.00 68.15 68.44 2nyx h THR 67 CO -0.22 0.22 0.44 -0.07 0.37 0.00 0.00 175.52 176.26 2nyx h LEU 68 N -0.49 0.63 -0.36 2.58 3.38 -0.91 -2.21 115.31 117.93 2nyx h LEU 68 Ca -0.01 -0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.77 2nyx h LEU 68 Cb 0.43 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 2nyx h LEU 68 CO 0.01 0.42 -0.72 0.25 0.09 0.00 0.00 178.44 178.49 2nyx h LEU 69 N 0.73 0.59 0.00 1.67 5.85 -0.79 -3.48 115.31 119.88 2nyx h LEU 69 Ca 0.28 -0.38 0.00 0.00 0.84 0.00 0.00 57.88 58.62 2nyx h LEU 69 Cb 0.18 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.04 2nyx h LEU 69 CO -0.08 1.13 0.00 0.61 -0.34 0.00 0.00 178.44 179.75 2nyx n GLY 70 N 0.56 0.68 3.34 3.75 0.00 0.12 -5.07 105.19 108.56 2nyx n GLY 70 Ca -0.05 -0.73 -0.25 0.00 0.00 0.00 0.00 46.02 44.99 2nyx n GLY 70 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2nyx s VAL 71 N -2.00 1.96 0.39 1.61 1.01 -0.93 -5.06 120.40 117.38 2nyx s VAL 71 Ca 0.00 -1.72 -0.26 0.00 0.00 0.00 0.00 61.98 59.99 2nyx s VAL 71 Cb 0.00 -1.80 -0.11 0.00 0.00 0.00 0.00 36.38 34.47 2nyx s VAL 71 CO 0.00 -0.07 1.20 0.00 0.00 0.00 0.00 175.10 176.23 2nyx n GLN 72 N 0.80 1.82 -0.37 2.72 6.02 -1.26 -4.54 117.38 122.57 2nyx n GLN 72 Ca -0.17 0.64 0.01 0.00 -0.01 0.00 0.00 57.00 57.47 2nyx n GLN 72 Cb 0.54 -2.25 0.15 0.00 1.02 0.00 0.00 30.24 29.70 2nyx n GLN 72 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.06 174.70 2nyx h PRO 73 N 2.10 1.21 -0.32 -1.09 0.11 -1.93 -2.03 132.00 130.04 2nyx h PRO 73 Ca -0.46 -0.07 0.06 0.00 0.11 0.00 0.00 66.00 65.64 2nyx h PRO 73 Cb 1.30 -0.27 -0.06 0.00 0.11 0.00 0.00 31.00 32.08 2nyx h PRO 73 CO 0.60 0.80 -0.05 0.77 -0.21 0.00 0.00 178.00 179.91 2nyx h SER 74 N 1.24 -0.23 0.34 -2.05 0.02 -1.99 0.18 113.55 111.06 2nyx h SER 74 Ca 0.41 0.09 -0.14 0.00 -0.84 0.00 0.00 61.79 61.30 2nyx h SER 74 Cb 0.04 0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.74 2nyx h SER 74 CO -0.14 -0.08 -0.59 0.00 -1.14 0.00 0.00 176.83 174.88 2nyx h ALA 75 N 1.30 0.86 -0.36 3.77 0.00 -1.90 -2.42 119.26 120.51 2nyx h ALA 75 Ca 0.16 -0.53 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 2nyx h ALA 75 Cb 0.23 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2nyx h ALA 75 CO -0.30 0.72 0.21 1.15 0.00 0.00 0.00 179.25 181.02 2nyx h THR 76 N 0.19 1.14 -0.67 0.00 2.02 -0.90 -2.96 112.91 111.73 2nyx h THR 76 Ca -0.00 -0.34 0.10 0.00 0.77 0.00 0.00 66.41 66.94 2nyx h THR 76 Cb 1.09 0.70 -0.08 0.00 -1.74 0.00 0.00 68.15 68.13 2nyx h THR 76 CO 0.09 0.14 0.28 1.23 0.37 0.00 0.00 175.52 177.63 2nyx h GLY 77 N 0.47 0.98 -2.02 2.16 0.00 -0.38 -1.57 103.07 102.71 2nyx h GLY 77 Ca 0.13 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.30 2nyx h GLY 77 CO -0.02 -0.01 0.00 0.54 0.00 0.00 0.00 176.54 177.05 2nyx n ARG 78 N -4.95 0.52 0.00 4.80 1.74 -0.93 -1.96 116.66 115.88 2nyx n ARG 78 Ca 0.10 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.18 2nyx n ARG 78 Cb 0.30 -1.24 0.00 0.00 -1.02 0.00 0.00 32.46 30.50 2nyx n ARG 78 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2nyx n VAL 80 N 0.75 0.00 -0.11 1.55 0.31 -0.59 -2.03 118.33 118.21 2nyx n VAL 80 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.28 2nyx n VAL 80 Cb 0.26 0.00 0.03 0.00 -0.91 0.00 0.00 33.84 33.21 2nyx n VAL 80 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 2nyx h ASP 81 N 0.00 0.01 -0.66 4.52 3.32 -1.66 0.31 116.42 122.26 2nyx h ASP 81 Ca 0.00 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.11 2nyx h ASP 81 Cb 0.00 0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.60 2nyx h ASP 81 CO 0.00 0.04 0.40 0.03 -1.72 0.00 0.00 179.24 177.99 2nyx h ARG 82 N 0.20 0.89 -0.07 3.56 3.08 -1.70 -0.01 114.38 120.33 2nyx h ARG 82 Ca 0.18 -0.08 -0.12 0.00 0.07 0.00 0.00 59.98 60.03 2nyx h ARG 82 Cb 0.21 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 2nyx h ARG 82 CO -0.24 0.63 -0.52 -0.07 -1.07 0.00 0.00 179.97 178.70 2nyx h LEU 83 N 0.89 0.20 -0.06 3.04 3.38 -1.75 0.47 115.31 121.48 2nyx h LEU 83 Ca 0.24 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 2nyx h LEU 83 Cb -0.04 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 2nyx h LEU 83 CO -0.05 0.69 0.02 0.58 0.09 0.00 0.00 178.44 179.77 2nyx h VAL 84 N 0.14 1.17 -0.82 1.22 2.07 -0.08 -0.25 116.25 119.70 2nyx h VAL 84 Ca 0.00 -0.51 0.08 0.00 0.82 0.00 0.00 66.70 67.09 2nyx h VAL 84 Cb 0.97 1.40 -0.05 0.00 -1.52 0.00 0.00 31.29 32.08 2nyx h VAL 84 CO 0.08 0.14 0.53 1.23 0.02 0.00 0.00 177.57 179.57 2nyx h GLY 85 N -0.09 1.13 0.96 2.17 0.00 -0.84 -0.84 103.07 105.56 2nyx h GLY 85 Ca 0.02 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.01 2nyx h GLY 85 CO -0.00 0.23 0.00 0.00 0.00 0.00 0.00 176.54 176.77 2nyx n ALA 86 N -2.43 2.66 -2.70 3.60 0.00 0.14 -4.91 120.51 116.88 2nyx n ALA 86 Ca 0.13 -0.19 -0.22 0.00 0.00 0.00 0.00 53.44 53.16 2nyx n ALA 86 Cb 0.26 -1.49 0.01 0.00 0.00 0.00 0.00 19.45 18.23 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 -0.98 -3.23 -0.01 0.00 1.02 -0.32 -4.87 120.64 112.26 2nyx n GLU 87 Ca 0.23 0.97 0.11 0.00 -0.02 0.00 0.00 57.16 58.44 2nyx n GLU 87 Cb 0.10 -5.73 -0.17 0.00 -0.02 0.00 0.00 31.44 25.63 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 -3.51 0.09 -4.07 -4.62 4.77 -0.18 -4.35 117.00 105.13 2nyx n LEU 88 Ca -0.19 -0.04 -0.23 0.00 -0.03 0.00 0.00 56.01 55.52 2nyx n LEU 88 Cb 0.66 -0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.59 2nyx n LEU 88 CO 0.38 0.02 -0.47 -0.63 -1.33 0.00 0.00 177.39 175.36 2nyx s ILE 89 N -3.48 1.13 -0.00 -0.08 1.01 -1.05 -1.74 121.20 116.99 2nyx s ILE 89 Ca -0.07 -0.55 -0.01 0.00 0.00 0.00 0.00 60.65 60.02 2nyx s ILE 89 Cb 0.14 -0.98 -0.04 0.00 0.01 0.00 0.00 42.46 41.60 2nyx s ILE 89 CO 0.91 0.33 0.12 -1.81 0.00 0.00 0.00 174.94 174.49 2nyx s ASP 90 N 0.08 5.96 -0.22 3.58 1.01 0.33 -4.20 116.67 123.21 2nyx s ASP 90 Ca -0.03 0.23 -0.11 0.00 0.71 0.00 0.00 52.55 53.35 2nyx s ASP 90 Cb -0.10 -1.78 -0.05 0.00 1.01 0.00 0.00 42.92 42.00 2nyx s ASP 90 CO 0.01 0.27 0.16 -0.13 0.21 0.00 0.00 175.17 175.69 2nyx s ARG 91 N -1.84 4.13 0.03 8.23 0.52 -1.26 -1.31 118.95 127.45 2nyx s ARG 91 Ca 0.25 -0.23 0.06 0.00 -0.52 0.00 0.00 55.73 55.29 2nyx s ARG 91 Cb -0.12 -3.49 -0.02 0.00 0.52 0.00 0.00 34.95 31.84 2nyx s ARG 91 CO 0.16 0.16 -0.17 -0.51 0.02 0.00 0.00 175.30 174.96 2nyx s LEU 92 N 0.77 2.14 0.00 2.53 1.43 0.85 -4.92 118.68 121.48 2nyx s LEU 92 Ca 0.08 -0.45 0.00 0.00 -1.03 0.00 0.00 54.13 52.74 2nyx s LEU 92 Cb -0.13 -0.80 0.00 0.00 0.03 0.00 0.00 46.19 45.29 2nyx s LEU 92 CO 0.02 0.12 0.00 -2.65 0.23 0.00 0.00 176.35 174.07 2nyx n PRO 93 N 2.05 0.00 -3.65 1.29 -0.02 -1.26 0.08 135.00 133.49 2nyx n PRO 93 Ca -0.17 0.00 0.01 0.00 -2.02 0.00 0.00 63.50 61.32 2nyx n PRO 93 Cb 0.54 -0.08 -0.06 0.00 -0.02 0.00 0.00 33.50 33.88 2nyx n PRO 93 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 2nyx s HIS 94 N 0.00 -0.00 0.19 6.00 -0.00 -1.26 -3.75 115.29 116.47 2nyx s HIS 94 Ca 0.00 0.01 0.01 0.00 -0.00 0.00 0.00 55.06 55.07 2nyx s HIS 94 Cb 0.00 0.17 0.09 0.00 -0.00 0.00 0.00 32.58 32.84 2nyx s HIS 94 CO 0.00 -0.00 1.45 -1.35 -0.00 0.00 0.00 174.74 174.84 2nyx h PRO 95 N 4.33 0.32 -3.17 -0.38 0.11 -1.96 -3.42 132.00 127.82 2nyx h PRO 95 Ca -0.26 -0.27 0.00 0.00 0.11 0.00 0.00 66.00 65.58 2nyx h PRO 95 Cb 1.17 0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2nyx h PRO 95 CO 0.22 0.92 -0.04 2.41 -0.21 0.00 0.00 178.00 181.30 2nyx n THR 96 N -3.81 -2.67 0.08 -1.15 -1.04 -1.26 -4.99 114.28 99.44 2nyx n THR 96 Ca -0.04 0.07 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 2nyx n THR 96 Cb 0.70 -4.24 0.00 0.00 -1.82 0.00 0.00 70.33 64.97 2nyx n THR 96 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 2nyx n SER 97 N -0.49 -0.01 -0.58 8.00 2.88 -1.26 -4.82 113.62 117.33 2nyx n SER 97 Ca 0.01 0.27 0.00 0.00 -1.33 0.00 0.00 58.87 57.82 2nyx n SER 97 Cb 0.04 0.19 0.00 0.00 -0.75 0.00 0.00 64.21 63.69 2nyx n SER 97 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2nyx n ARG 98 N -3.09 -1.66 -3.38 -1.46 1.74 -1.26 -4.99 116.66 102.56 2nyx n ARG 98 Ca 0.00 1.24 -0.15 0.00 -0.77 0.00 0.00 57.85 58.17 2nyx n ARG 98 Cb 0.00 -1.42 0.02 0.00 -1.02 0.00 0.00 32.46 30.05 2nyx n ARG 98 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 2nyx n ARG 99 N -1.09 -1.50 0.00 5.56 -4.01 -1.25 -3.98 116.66 110.40 2nyx n ARG 99 Ca 0.00 0.99 0.00 0.00 -1.04 0.00 0.00 57.85 57.80 2nyx n ARG 99 Cb 0.02 -4.76 0.00 0.00 -3.04 0.00 0.00 32.46 24.68 2nyx n ARG 99 CO 0.00 0.00 0.00 0.39 -3.04 0.00 0.00 177.63 174.98 2nyx n GLU 100 N -2.80 0.00 -0.72 2.89 -0.58 -1.26 -5.16 120.64 113.01 2nyx n GLU 100 Ca -0.09 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.65 2nyx n GLU 100 Cb 0.58 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.45 2nyx n GLU 100 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2nyx n LEU 101 N 0.00 0.00 -4.76 -4.62 4.32 -1.26 -5.06 117.00 105.63 2nyx n LEU 101 Ca 0.00 0.00 -0.34 0.00 -0.02 0.00 0.00 56.01 55.65 2nyx n LEU 101 Cb 0.00 0.00 -0.08 0.00 -1.62 0.00 0.00 43.42 41.72 2nyx n LEU 101 CO 0.00 -0.42 -0.26 -0.76 -1.22 0.00 0.00 177.39 174.73 2nyx s LEU 102 N 0.00 3.84 -0.07 2.23 1.43 0.11 -4.38 118.68 121.84 2nyx s LEU 102 Ca 0.00 0.19 -0.15 0.00 -1.03 0.00 0.00 54.13 53.14 2nyx s LEU 102 Cb 0.00 -2.06 -0.05 0.00 0.03 0.00 0.00 46.19 44.11 2nyx s LEU 102 CO 0.00 0.33 0.40 0.00 0.23 0.00 0.00 176.35 177.31 2nyx s ALA 103 N -1.05 3.62 0.07 4.21 0.00 0.43 -0.11 121.76 128.94 2nyx s ALA 103 Ca 0.18 -0.27 -0.09 0.00 0.00 0.00 0.00 51.96 51.78 2nyx s ALA 103 Cb -0.12 -2.44 0.00 0.00 0.00 0.00 0.00 23.12 20.56 2nyx s ALA 103 CO 0.08 0.28 0.20 0.00 0.00 0.00 0.00 175.76 176.32 2nyx s ALA 104 N -0.31 -0.29 0.37 0.00 0.00 -0.43 -2.29 121.76 118.80 2nyx s ALA 104 Ca 0.23 -0.48 -0.26 0.00 0.00 0.00 0.00 51.96 51.45 2nyx s ALA 104 Cb -0.15 0.41 -0.09 0.00 0.00 0.00 0.00 23.12 23.29 2nyx s ALA 104 CO 0.10 -0.46 1.11 -0.51 0.00 0.00 0.00 175.76 176.01 2nyx s LEU 105 N -2.57 4.28 0.64 0.00 1.02 -1.26 -0.51 118.68 120.27 2nyx s LEU 105 Ca 0.01 2.22 -0.02 0.00 0.02 0.00 0.00 54.13 56.36 2nyx s LEU 105 Cb 0.03 -3.96 0.06 0.00 0.02 0.00 0.00 46.19 42.33 2nyx s LEU 105 CO -0.08 -0.46 0.90 0.42 0.02 0.00 0.00 176.35 177.15 2nyx s THR 106 N -1.42 2.43 0.23 5.49 -4.23 -0.71 -4.66 115.64 112.76 2nyx s THR 106 Ca 0.54 -0.50 -0.07 0.00 -1.18 0.00 0.00 61.69 60.48 2nyx s THR 106 Cb -0.28 -2.94 0.19 0.00 1.34 0.00 0.00 72.50 70.81 2nyx s THR 106 CO 0.36 0.00 1.83 0.50 -0.54 0.00 0.00 174.62 176.77 2nyx h LYS 107 N -0.30 0.82 -0.68 3.99 3.64 -1.89 -0.81 116.57 121.35 2nyx h LYS 107 Ca -0.42 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 58.86 2nyx h LYS 107 Cb 1.30 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 32.91 2nyx h LYS 107 CO 0.53 0.54 0.23 -0.09 -2.27 0.00 0.00 179.45 178.39 2nyx h ARG 108 N 0.84 1.04 -0.87 1.90 2.43 -1.90 -1.75 114.38 116.07 2nyx h ARG 108 Ca 0.35 -0.21 0.07 0.00 -0.81 0.00 0.00 59.98 59.38 2nyx h ARG 108 Cb 0.19 -0.16 -0.07 0.00 -0.42 0.00 0.00 29.97 29.52 2nyx h ARG 108 CO -0.18 0.89 0.53 0.78 -1.51 0.00 0.00 179.97 180.48 2nyx h GLY 109 N 0.98 1.33 1.68 2.80 0.00 -1.40 -1.61 103.07 106.85 2nyx h GLY 109 Ca 0.22 -0.38 -0.14 0.00 0.00 0.00 0.00 47.33 47.03 2nyx h GLY 109 CO -0.01 0.23 -0.55 3.21 0.00 0.00 0.00 176.54 179.42 2nyx h ARG 110 N 0.94 0.34 -0.40 4.80 3.08 -0.75 -2.76 114.38 119.63 2nyx h ARG 110 Ca 0.39 -0.21 -0.11 0.00 0.07 0.00 0.00 59.98 60.12 2nyx h ARG 110 Cb 0.24 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 2nyx h ARG 110 CO -0.20 0.80 -0.19 -0.44 -1.07 0.00 0.00 179.97 178.87 2nyx h ASP 111 N 0.26 0.86 0.03 7.04 3.32 -0.90 -0.52 116.42 126.51 2nyx h ASP 111 Ca 0.00 -0.40 0.03 0.00 0.02 0.00 0.00 57.03 56.68 2nyx h ASP 111 Cb 1.05 -0.24 -0.05 0.00 0.22 0.00 0.00 39.33 40.31 2nyx h ASP 111 CO 0.09 1.07 -0.37 0.58 -1.72 0.00 0.00 179.24 178.89 2nyx h VAL 112 N 0.64 0.22 -0.04 -1.35 2.07 -1.25 0.16 116.25 116.71 2nyx h VAL 112 Ca 0.09 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.65 2nyx h VAL 112 Cb 0.75 0.22 -0.05 0.00 -1.52 0.00 0.00 31.29 30.69 2nyx h VAL 112 CO 0.06 0.00 -0.33 0.58 0.02 0.00 0.00 177.57 177.90 2nyx h VAL 113 N -0.55 0.28 -0.15 2.57 2.07 -1.38 -0.61 116.25 118.49 2nyx h VAL 113 Ca 0.05 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.60 2nyx h VAL 113 Cb 0.62 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.64 2nyx h VAL 113 CO -0.27 0.00 -0.05 0.03 0.02 0.00 0.00 177.57 177.29 2nyx h ARG 114 N -0.46 -0.03 -0.26 1.57 3.08 -0.94 -2.03 114.38 115.31 2nyx h ARG 114 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 2nyx h ARG 114 Cb 0.56 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.61 2nyx h ARG 114 CO -0.30 -0.02 0.17 1.96 -1.07 0.00 0.00 179.97 180.71 2nyx h GLN 115 N -0.03 0.34 -0.71 0.04 4.20 -0.43 0.15 115.11 118.66 2nyx h GLN 115 Ca 0.08 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.76 2nyx h GLN 115 Cb 0.14 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.81 2nyx h GLN 115 CO -0.17 0.22 0.43 0.28 -0.67 0.00 0.00 178.83 178.93 2nyx h VAL 116 N 0.35 1.20 -0.17 -0.54 2.07 -1.07 -1.83 116.25 116.25 2nyx h VAL 116 Ca 0.10 -0.44 -0.05 0.00 0.82 0.00 0.00 66.70 67.12 2nyx h VAL 116 Cb -0.03 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 29.94 2nyx h VAL 116 CO -0.03 0.21 -0.09 0.74 0.02 0.00 0.00 177.57 178.42 2nyx h THR 117 N 0.97 1.32 -0.82 2.57 2.02 -1.03 -1.35 112.91 116.59 2nyx h THR 117 Ca 0.26 -1.16 0.04 0.00 0.77 0.00 0.00 66.41 66.31 2nyx h THR 117 Cb -0.04 1.71 -0.05 0.00 -1.74 0.00 0.00 68.15 68.04 2nyx h THR 117 CO -0.05 0.34 0.54 -0.08 0.37 0.00 0.00 175.52 176.64 2nyx h GLU 118 N 0.04 0.98 0.06 6.66 4.81 -0.61 -0.95 114.58 125.57 2nyx h GLU 118 Ca 0.04 -0.06 -0.28 0.00 -0.13 0.00 0.00 59.36 58.93 2nyx h GLU 118 Cb 0.58 -0.22 0.02 0.00 0.63 0.00 0.00 28.75 29.76 2nyx h GLU 118 CO 0.03 0.65 -1.13 0.45 -0.73 0.00 0.00 179.01 178.27 2nyx h HIS 119 N 1.01 0.94 -0.81 0.92 3.86 -1.25 -2.95 115.15 116.87 2nyx h HIS 119 Ca 0.33 -0.55 -0.03 0.00 -1.16 0.00 0.00 60.37 58.95 2nyx h HIS 119 Cb 0.05 -0.09 -0.04 0.00 1.06 0.00 0.00 27.41 28.39 2nyx h HIS 119 CO -0.00 1.39 0.37 -0.09 0.86 0.00 0.00 177.93 180.46 2nyx h ARG 120 N 0.30 1.17 -0.44 2.45 2.43 -0.95 -2.97 114.38 116.38 2nyx h ARG 120 Ca -0.15 -0.18 -0.09 0.00 -0.81 0.00 0.00 59.98 58.75 2nyx h ARG 120 Cb 1.79 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 31.11 2nyx h ARG 120 CO 0.21 0.91 -0.07 -0.09 -1.51 0.00 0.00 179.97 179.43 2nyx h ARG 121 N 1.16 0.77 -0.76 0.20 2.43 -1.15 -0.80 114.38 116.23 2nyx h ARG 121 Ca 0.28 -0.24 -0.04 0.00 -0.81 0.00 0.00 59.98 59.17 2nyx h ARG 121 Cb 0.15 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.59 2nyx h ARG 121 CO -0.03 0.83 0.32 1.15 -1.51 0.00 0.00 179.97 180.73 2nyx h THR 122 N 0.71 1.25 -0.17 0.20 2.02 -1.38 -0.31 112.91 115.23 2nyx h THR 122 Ca 0.13 -0.77 -0.20 0.00 0.77 0.00 0.00 66.41 66.34 2nyx h THR 122 Cb 0.54 0.34 0.00 0.00 -1.74 0.00 0.00 68.15 67.28 2nyx h THR 122 CO 0.03 0.32 -0.68 -0.08 0.37 0.00 0.00 175.52 175.48 2nyx h GLU 123 N 1.10 0.68 -0.10 6.66 4.57 -1.33 -1.13 114.58 125.02 2nyx h GLU 123 Ca 0.26 -0.50 -0.01 0.00 -1.18 0.00 0.00 59.36 57.93 2nyx h GLU 123 Cb 0.19 0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 28.86 2nyx h GLU 123 CO -0.02 1.12 0.03 0.82 -1.18 0.00 0.00 179.01 179.78 2nyx h ILE 124 N 0.49 1.17 -0.22 2.32 2.04 -1.04 -2.62 117.51 119.65 2nyx h ILE 124 Ca -0.02 -0.52 -0.02 0.00 1.00 0.00 0.00 64.86 65.29 2nyx h ILE 124 Cb 1.27 1.33 -0.01 0.00 -0.74 0.00 0.00 36.82 38.67 2nyx h ILE 124 CO 0.13 0.15 0.04 0.00 0.00 0.00 0.00 178.15 178.48 2nyx h ALA 125 N 0.85 1.68 -0.43 1.87 0.00 -1.00 0.53 119.26 122.75 2nyx h ALA 125 Ca 0.03 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2nyx h ALA 125 Cb 0.21 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2nyx h ALA 125 CO -0.00 0.25 0.20 -0.09 0.00 0.00 0.00 179.25 179.61 2nyx h ARG 126 N 0.31 0.63 -0.12 0.00 2.43 -1.10 -2.27 114.38 114.25 2nyx h ARG 126 Ca 0.07 -0.10 -0.19 0.00 -0.81 0.00 0.00 59.98 58.96 2nyx h ARG 126 Cb 0.14 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.57 2nyx h ARG 126 CO -0.00 0.56 -0.70 0.82 -1.51 0.00 0.00 179.97 179.14 2nyx h ILE 127 N 0.56 1.34 -0.26 1.20 2.04 -0.87 -3.13 117.51 118.40 2nyx h ILE 127 Ca 0.15 -2.02 -0.05 0.00 1.00 0.00 0.00 64.86 63.94 2nyx h ILE 127 Cb 0.14 1.99 -0.01 0.00 -0.74 0.00 0.00 36.82 38.20 2nyx h ILE 127 CO -0.02 0.62 -0.05 0.58 0.00 0.00 0.00 178.15 179.28 2nyx h VAL 128 N 0.38 1.19 0.00 1.67 2.07 -0.86 -1.41 116.25 119.28 2nyx h VAL 128 Ca -0.03 -0.77 -0.03 0.00 0.82 0.00 0.00 66.70 66.69 2nyx h VAL 128 Cb 1.28 1.05 -0.00 0.00 -1.52 0.00 0.00 31.29 32.10 2nyx h VAL 128 CO 0.13 0.25 -0.15 -0.08 0.02 0.00 0.00 177.57 177.74 2nyx h GLU 129 N 0.38 0.00 -4.02 1.57 4.57 -1.35 -3.45 114.58 112.28 2nyx h GLU 129 Ca 0.08 0.00 -0.69 0.00 -1.18 0.00 0.00 59.36 57.57 2nyx h GLU 129 Cb 0.34 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.92 2nyx h GLU 129 CO 0.01 0.15 3.02 1.04 -1.18 0.00 0.00 179.01 182.06 2nyx n GLN 130 N -3.55 2.63 -4.97 1.92 1.13 -0.53 -4.98 117.38 109.03 2nyx n GLN 130 Ca -0.01 -2.41 -0.32 0.00 -1.94 0.00 0.00 57.00 52.31 2nyx n GLN 130 Cb 0.30 -3.18 -0.16 0.00 0.11 0.00 0.00 30.24 27.31 2nyx n GLN 130 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2nyx s ALA 132 N 3.48 2.27 0.52 -1.58 0.00 -1.26 -5.12 121.76 120.07 2nyx s ALA 132 Ca 0.50 -1.00 0.40 0.00 0.00 0.00 0.00 51.96 51.87 2nyx s ALA 132 Cb 0.14 -0.94 1.58 0.00 0.00 0.00 0.00 23.12 23.91 2nyx s ALA 132 CO -0.05 0.18 1.67 -1.35 0.00 0.00 0.00 175.76 176.22 2nyx h PRO 133 N 6.91 0.04 0.00 0.00 0.11 -1.95 0.13 132.00 137.23 2nyx h PRO 133 Ca -0.24 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.86 2nyx h PRO 133 Cb 1.22 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 2nyx h PRO 133 CO 0.51 0.02 -0.04 0.00 -0.21 0.00 0.00 178.00 178.29 2nyx h ALA 134 N 1.29 1.20 -0.30 -0.75 0.00 -2.04 -2.70 119.26 115.96 2nyx h ALA 134 Ca 0.77 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.65 2nyx h ALA 134 Cb 2.91 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 20.70 2nyx h ALA 134 CO -0.10 0.05 0.00 -0.85 0.00 0.00 0.00 179.25 178.35 2nyx n GLU 135 N -3.42 2.66 -1.51 0.00 0.28 0.45 -4.75 120.64 114.35 2nyx n GLU 135 Ca -0.02 -1.93 -0.34 0.00 -0.16 0.00 0.00 57.16 54.71 2nyx n GLU 135 Cb 0.16 -1.25 -0.05 0.00 1.43 0.00 0.00 31.44 31.74 2nyx n GLU 135 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2nyx n ARG 136 N 0.46 3.61 -4.27 3.44 1.74 -1.02 -4.84 116.66 115.78 2nyx n ARG 136 Ca 0.10 -2.45 -0.18 0.00 -0.77 0.00 0.00 57.85 54.55 2nyx n ARG 136 Cb 0.40 -2.55 -0.15 0.00 -1.02 0.00 0.00 32.46 29.14 2nyx n ARG 136 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 2nyx s HIS 137 N 0.48 0.71 -0.10 -1.55 3.76 -1.26 -4.85 115.29 112.48 2nyx s HIS 137 Ca 0.63 -0.15 0.00 0.00 -0.15 0.00 0.00 55.06 55.39 2nyx s HIS 137 Cb 0.22 -0.50 0.00 0.00 1.11 0.00 0.00 32.58 33.41 2nyx s HIS 137 CO -0.08 -0.06 0.00 0.41 -0.85 0.00 0.00 174.74 174.16 2nyx n GLY 138 N 3.18 0.46 0.07 -2.22 0.00 -1.26 -4.92 105.19 100.48 2nyx n GLY 138 Ca -0.16 -0.16 -0.10 0.00 0.00 0.00 0.00 46.02 45.59 2nyx n GLY 138 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2nyx h LEU 139 N 0.00 0.00 -0.27 0.99 3.38 -1.91 -3.33 115.31 114.17 2nyx h LEU 139 Ca -0.02 -0.61 0.03 0.00 0.09 0.00 0.00 57.88 57.37 2nyx h LEU 139 Cb 0.25 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 2nyx h LEU 139 CO 0.03 0.90 0.07 0.58 0.09 0.00 0.00 178.44 180.11 2nyx h VAL 140 N -1.00 0.90 -0.50 1.22 2.07 -1.97 -2.33 116.25 114.63 2nyx h VAL 140 Ca -0.04 -0.06 0.10 0.00 0.82 0.00 0.00 66.70 67.52 2nyx h VAL 140 Cb 0.73 0.70 -0.10 0.00 -1.52 0.00 0.00 31.29 31.09 2nyx h VAL 140 CO -0.02 0.03 -0.19 -0.09 0.02 0.00 0.00 177.57 177.33 2nyx h ARG 141 N 0.18 -0.07 -0.52 1.57 1.12 -1.99 0.14 114.38 114.81 2nyx h ARG 141 Ca 0.12 0.00 -0.06 0.00 -1.11 0.00 0.00 59.98 58.94 2nyx h ARG 141 Cb 0.11 0.02 -0.02 0.00 -0.01 0.00 0.00 29.97 30.07 2nyx h ARG 141 CO -0.15 -0.05 0.08 0.00 -3.11 0.00 0.00 179.97 176.75 2nyx h ALA 142 N 1.33 0.69 -0.45 2.80 0.00 -1.60 -1.61 119.26 120.42 2nyx h ALA 142 Ca 0.24 -0.24 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 2nyx h ALA 142 Cb 0.44 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2nyx h ALA 142 CO -0.55 0.43 -0.25 -0.07 0.00 0.00 0.00 179.25 178.82 2nyx h LEU 143 N 0.75 0.97 -1.12 0.00 3.38 -0.87 -2.18 115.31 116.24 2nyx h LEU 143 Ca 0.16 -0.38 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 2nyx h LEU 143 Cb 0.41 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 2nyx h LEU 143 CO 0.01 1.16 0.24 0.74 0.09 0.00 0.00 178.44 180.68 2nyx h THR 144 N 0.81 1.21 -0.23 0.22 2.02 -0.66 -1.83 112.91 114.45 2nyx h THR 144 Ca 0.10 -0.66 -0.14 0.00 0.77 0.00 0.00 66.41 66.48 2nyx h THR 144 Cb 0.81 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.72 2nyx h THR 144 CO 0.07 0.26 -0.45 0.00 0.37 0.00 0.00 175.52 175.77 2nyx h ALA 145 N 1.41 0.78 -0.65 6.16 0.00 -0.98 0.16 119.26 126.14 2nyx h ALA 145 Ca 0.20 -0.47 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 2nyx h ALA 145 Cb 0.16 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2nyx h ALA 145 CO -0.02 0.66 0.28 0.35 0.00 0.00 0.00 179.25 180.53 2nyx h PHE 146 N 0.47 0.96 0.11 0.00 3.57 -1.19 -1.43 116.94 119.41 2nyx h PHE 146 Ca 0.03 -0.06 -0.26 0.00 3.53 0.00 0.00 57.97 61.20 2nyx h PHE 146 Cb 0.98 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 39.43 2nyx h PHE 146 CO 0.04 0.74 -1.19 0.00 -2.23 0.00 0.00 178.31 175.67 2nyx h THR 147 N 0.90 1.51 -0.20 4.41 1.03 -1.10 -0.39 112.91 119.07 2nyx h THR 147 Ca 0.22 -3.02 -0.13 0.00 -0.01 0.00 0.00 66.41 63.46 2nyx h THR 147 Cb 0.17 2.89 0.00 0.00 -1.07 0.00 0.00 68.15 70.13 2nyx h THR 147 CO -0.02 0.88 -0.40 -0.08 -0.01 0.00 0.00 175.52 175.89 2nyx h GLU 148 N 0.08 0.62 -0.94 0.00 4.57 -0.99 -0.76 114.58 117.16 2nyx h GLU 148 Ca -0.12 -0.41 0.05 0.00 -1.18 0.00 0.00 59.36 57.71 2nyx h GLU 148 Cb 1.91 0.05 -0.06 0.00 -0.16 0.00 0.00 28.75 30.50 2nyx h GLU 148 CO 0.19 1.02 0.61 0.00 -1.18 0.00 0.00 179.01 179.66 2nyx h ALA 149 N 0.60 1.44 0.00 2.92 0.00 -1.17 -1.67 119.26 121.37 2nyx h ALA 149 Ca 0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2nyx h ALA 149 Cb 1.00 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2nyx h ALA 149 CO 0.09 0.44 0.00 0.41 0.00 0.00 0.00 179.25 180.19 2nyx n GLY 150 N -1.39 -1.45 2.24 0.00 0.00 -0.17 -4.91 105.19 99.51 2nyx n GLY 150 Ca 0.14 -0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.04 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 0.74 0.15 3.66 -0.02 0.00 -0.63 -5.00 105.19 104.09 2nyx n GLY 151 Ca 0.04 -0.43 -0.39 0.00 0.00 0.00 0.00 46.02 45.24 2nyx n GLY 151 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2nyx s GLU 152 N -4.27 4.17 0.68 1.61 2.56 -0.37 -5.03 118.70 118.05 2nyx s GLU 152 Ca 0.00 0.40 -0.14 0.00 0.00 0.00 0.00 54.97 55.23 2nyx s GLU 152 Cb 0.00 -3.57 0.01 0.00 2.00 0.00 0.00 34.13 32.57 2nyx s GLU 152 CO 0.00 -0.18 1.09 -2.14 -0.56 0.00 0.00 175.26 173.48 2nyx s PRO 153 N 1.73 2.74 0.59 4.30 0.02 -1.26 -4.67 135.00 138.45 2nyx s PRO 153 Ca 0.24 1.28 -0.19 0.00 0.02 0.00 0.00 61.00 62.35 2nyx s PRO 153 Cb -0.15 -1.95 -0.05 0.00 0.02 0.00 0.00 34.50 32.37 2nyx s PRO 153 CO 0.09 -1.29 0.98 -0.25 -0.33 0.00 0.00 177.00 176.21 2nyx n ASP 154 N -2.70 0.86 -3.14 2.53 8.00 -1.26 -5.00 116.55 115.83 2nyx n ASP 154 Ca 0.10 0.82 -0.24 0.00 0.71 0.00 0.00 54.79 56.18 2nyx n ASP 154 Cb 0.52 -1.39 -0.05 0.00 -0.02 0.00 0.00 41.12 40.18 2nyx n ASP 154 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2nyx n ALA 155 N -1.65 3.51 -0.40 2.24 0.00 -1.26 -5.14 120.51 117.81 2nyx n ALA 155 Ca 0.13 -4.18 0.00 0.00 0.00 0.00 0.00 53.44 49.39 2nyx n ALA 155 Cb 0.47 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 19.09 2nyx n ALA 155 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04