#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 -1.04 -4.47 0.00 4.71 -1.26 -5.02 120.64 113.56 2nyx n GLU 11 Ca 0.00 1.15 -0.21 0.00 -0.01 0.00 0.00 57.16 58.09 2nyx n GLU 11 Cb 0.00 -1.08 -0.15 0.00 -1.01 0.00 0.00 31.44 29.20 2nyx n GLU 11 CO 0.00 0.00 0.00 -2.00 0.09 0.00 0.00 177.13 175.22 2nyx s GLU 12 N -2.12 1.06 -0.47 3.49 2.56 -1.26 -5.12 118.70 116.84 2nyx s GLU 12 Ca 0.00 -0.37 -0.02 0.00 0.00 0.00 0.00 54.97 54.58 2nyx s GLU 12 Cb 0.00 -0.98 -0.03 0.00 2.00 0.00 0.00 34.13 35.12 2nyx s GLU 12 CO 0.00 0.16 0.40 0.45 -0.56 0.00 0.00 175.26 175.72 2nyx n SER 13 N 3.15 -3.67 0.00 -1.70 2.88 -1.26 -5.03 113.62 107.99 2nyx n SER 13 Ca -0.17 -0.30 0.00 0.00 -1.33 0.00 0.00 58.87 57.07 2nyx n SER 13 Cb 0.55 -2.53 0.00 0.00 -0.75 0.00 0.00 64.21 61.47 2nyx n SER 13 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2nyx n VAL 14 N -2.27 0.00 0.00 2.46 0.31 -1.26 -4.46 118.33 113.12 2nyx n VAL 14 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 2nyx n VAL 14 Cb 0.56 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.49 2nyx n VAL 14 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2nyx n ASP 15 N 3.27 0.00 0.06 4.52 2.03 -1.26 -3.29 116.55 121.88 2nyx n ASP 15 Ca 0.00 0.00 -0.16 0.00 0.52 0.00 0.00 54.79 55.15 2nyx n ASP 15 Cb 0.00 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.33 2nyx n ASP 15 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 2nyx h VAL 16 N 0.00 1.36 -0.33 5.18 2.07 -1.99 -2.86 116.25 119.68 2nyx h VAL 16 Ca 0.00 -2.40 -0.04 0.00 0.82 0.00 0.00 66.70 65.09 2nyx h VAL 16 Cb 0.00 2.43 -0.01 0.00 -1.52 0.00 0.00 31.29 32.19 2nyx h VAL 16 CO 0.00 0.72 0.06 0.40 0.02 0.00 0.00 177.57 178.78 2nyx h ILE 17 N 0.28 1.23 -0.60 4.57 1.08 -1.86 -1.14 117.51 121.07 2nyx h ILE 17 Ca -0.10 -0.80 0.02 0.00 -0.39 0.00 0.00 64.86 63.58 2nyx h ILE 17 Cb 1.64 1.12 -0.03 0.00 -3.07 0.00 0.00 36.82 36.47 2nyx h ILE 17 CO 0.18 0.27 0.39 0.74 -0.69 0.00 0.00 178.15 179.03 2nyx h THR 18 N 0.38 1.12 -0.19 -0.27 2.02 -1.65 -0.47 112.91 113.85 2nyx h THR 18 Ca 0.10 -0.27 -0.01 0.00 0.77 0.00 0.00 66.41 67.01 2nyx h THR 18 Cb 0.33 0.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.01 2nyx h THR 18 CO 0.00 0.14 0.10 0.44 0.37 0.00 0.00 175.52 176.57 2nyx h ASP 19 N 0.77 0.25 -0.60 4.18 5.19 -1.37 -1.26 116.42 123.59 2nyx h ASP 19 Ca 0.23 -0.11 0.10 0.00 -0.62 0.00 0.00 57.03 56.64 2nyx h ASP 19 Cb -0.04 -0.06 -0.04 0.00 0.18 0.00 0.00 39.33 39.37 2nyx h ASP 19 CO -0.07 0.28 0.40 0.00 -3.12 0.00 0.00 179.24 176.73 2nyx h ALA 20 N 0.97 2.05 -0.03 3.45 0.00 -0.81 -1.99 119.26 122.90 2nyx h ALA 20 Ca 0.07 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.80 2nyx h ALA 20 Cb 0.10 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2nyx h ALA 20 CO -0.01 -0.19 -0.73 -0.07 0.00 0.00 0.00 179.25 178.25 2nyx h LEU 21 N 0.38 0.24 -0.46 0.00 4.07 -0.44 -1.05 115.31 118.05 2nyx h LEU 21 Ca 0.28 -0.17 -0.02 0.00 0.08 0.00 0.00 57.88 58.06 2nyx h LEU 21 Cb 0.58 -0.07 -0.02 0.00 1.08 0.00 0.00 40.66 42.23 2nyx h LEU 21 CO -0.07 0.89 0.23 -0.07 -1.08 0.00 0.00 178.44 178.33 2nyx h LEU 22 N 0.13 0.59 0.16 1.67 -0.00 -0.48 -2.35 115.31 115.05 2nyx h LEU 22 Ca -0.02 -0.12 -0.01 0.00 -0.00 0.00 0.00 57.88 57.73 2nyx h LEU 22 Cb 1.29 -0.15 0.00 0.00 -0.00 0.00 0.00 40.66 41.80 2nyx h LEU 22 CO 0.11 0.54 -0.08 0.74 -0.00 0.00 0.00 178.44 179.76 2nyx h THR 23 N 0.60 0.95 0.00 0.22 2.02 -1.50 -3.27 112.91 111.92 2nyx h THR 23 Ca 0.16 -0.52 -0.02 0.00 0.77 0.00 0.00 66.41 66.80 2nyx h THR 23 Cb 0.10 1.26 -0.00 0.00 -1.74 0.00 0.00 68.15 67.78 2nyx h THR 23 CO -0.02 0.12 -0.07 0.00 0.37 0.00 0.00 175.52 175.92 2nyx h ALA 24 N 0.31 1.27 -0.02 6.16 0.00 -1.17 -2.77 119.26 123.05 2nyx h ALA 24 Ca -0.02 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2nyx h ALA 24 Cb 0.37 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2nyx h ALA 24 CO 0.04 0.09 -0.30 -1.13 0.00 0.00 0.00 179.25 177.95 2nyx n SER 25 N -3.57 1.88 -0.16 0.00 3.41 -0.89 -4.52 113.62 109.77 2nyx n SER 25 Ca -0.02 -1.43 -0.04 0.00 -0.26 0.00 0.00 58.87 57.12 2nyx n SER 25 Cb 0.19 0.27 0.03 0.00 -0.26 0.00 0.00 64.21 64.44 2nyx n SER 25 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 2nyx h ARG 26 N 2.48 -0.07 0.19 4.33 3.08 -1.54 -1.80 114.38 121.05 2nyx h ARG 26 Ca 0.00 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 2nyx h ARG 26 Cb 0.71 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.78 2nyx h ARG 26 CO 0.00 -0.05 -0.09 1.25 -1.07 0.00 0.00 179.97 180.01 2nyx h LEU 27 N -0.08 -0.22 -0.74 3.04 5.85 -1.83 -1.12 115.31 120.22 2nyx h LEU 27 Ca 0.24 -0.13 0.10 0.00 0.84 0.00 0.00 57.88 58.93 2nyx h LEU 27 Cb 0.45 0.06 -0.08 0.00 0.37 0.00 0.00 40.66 41.46 2nyx h LEU 27 CO -0.56 0.00 0.37 0.25 -0.34 0.00 0.00 178.44 178.15 2nyx h LEU 28 N -0.44 0.47 -0.55 2.25 6.46 -1.81 0.09 115.31 121.78 2nyx h LEU 28 Ca -0.03 0.07 -0.02 0.00 -0.12 0.00 0.00 57.88 57.79 2nyx h LEU 28 Cb 0.33 -0.01 -0.03 0.00 -0.73 0.00 0.00 40.66 40.23 2nyx h LEU 28 CO 0.04 0.25 0.28 0.58 -0.62 0.00 0.00 178.44 178.98 2nyx h VAL 29 N 0.60 1.19 -0.57 1.05 2.07 -1.18 0.54 116.25 119.96 2nyx h VAL 29 Ca 0.37 -0.52 -0.08 0.00 0.82 0.00 0.00 66.70 67.30 2nyx h VAL 29 Cb 0.43 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 2nyx h VAL 29 CO -0.29 0.21 0.02 0.00 0.02 0.00 0.00 177.57 177.54 2nyx h ALA 30 N 1.12 0.98 -0.44 1.67 0.00 -0.26 0.82 119.26 123.14 2nyx h ALA 30 Ca 0.19 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 2nyx h ALA 30 Cb 0.08 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2nyx h ALA 30 CO -0.03 0.63 0.10 0.82 0.00 0.00 0.00 179.25 180.77 2nyx h ILE 31 N 0.88 1.24 -0.12 0.00 2.04 -0.71 -0.16 117.51 120.68 2nyx h ILE 31 Ca 0.17 -0.84 -0.00 0.00 1.00 0.00 0.00 64.86 65.19 2nyx h ILE 31 Cb 0.48 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 2nyx h ILE 31 CO 0.02 0.30 0.08 0.28 0.00 0.00 0.00 178.15 178.82 2nyx h SER 32 N 0.58 0.14 -0.64 1.72 0.02 -0.60 -1.41 113.55 113.37 2nyx h SER 32 Ca 0.14 -0.03 -0.04 0.00 -0.84 0.00 0.00 61.79 61.01 2nyx h SER 32 Cb 0.34 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 62.82 2nyx h SER 32 CO 0.00 0.14 0.24 0.00 -1.14 0.00 0.00 176.83 176.07 2nyx h ALA 33 N 1.01 0.83 -0.90 3.77 0.00 -0.70 -2.17 119.26 121.11 2nyx h ALA 33 Ca 0.04 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 2nyx h ALA 33 Cb 0.02 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.52 2nyx h ALA 33 CO -0.01 0.46 0.48 1.25 0.00 0.00 0.00 179.25 181.44 2nyx h HIS 34 N 0.90 1.24 -0.43 0.00 6.17 -0.93 -2.14 115.15 119.97 2nyx h HIS 34 Ca 0.21 -0.03 -0.07 0.00 0.71 0.00 0.00 60.37 61.19 2nyx h HIS 34 Cb 0.23 -0.39 -0.02 0.00 2.52 0.00 0.00 27.41 29.74 2nyx h HIS 34 CO 0.01 0.86 -0.02 0.66 0.71 0.00 0.00 177.93 180.15 2nyx h SER 35 N 1.26 0.68 -0.04 3.26 4.64 -0.63 -0.74 113.55 121.98 2nyx h SER 35 Ca 0.31 -0.16 -0.01 0.00 -0.47 0.00 0.00 61.79 61.47 2nyx h SER 35 Cb 0.04 -0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 61.95 2nyx h SER 35 CO -0.05 0.76 0.00 0.40 -0.87 0.00 0.00 176.83 177.08 2nyx h ILE 36 N 0.66 1.23 0.00 0.95 2.04 -1.30 -3.20 117.51 117.89 2nyx h ILE 36 Ca 0.13 -0.70 -0.02 0.00 1.00 0.00 0.00 64.86 65.27 2nyx h ILE 36 Cb 0.45 1.63 -0.00 0.00 -0.74 0.00 0.00 36.82 38.15 2nyx h ILE 36 CO 0.02 0.19 -0.10 0.00 0.00 0.00 0.00 178.15 178.26 2nyx h ALA 37 N 0.73 1.33 0.00 1.87 0.00 -0.97 -2.51 119.26 119.72 2nyx h ALA 37 Ca 0.01 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2nyx h ALA 37 Cb 0.30 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2nyx h ALA 37 CO 0.00 0.12 0.00 -0.56 0.00 0.00 0.00 179.25 178.81 2nyx h GLN 38 N 0.00 0.00 0.00 0.00 3.07 -1.14 -3.23 115.11 113.81 2nyx h GLN 38 Ca -0.00 0.00 -0.33 0.00 0.09 0.00 0.00 58.65 58.41 2nyx h GLN 38 Cb 0.27 0.00 -0.05 0.00 0.08 0.00 0.00 27.48 27.79 2nyx h GLN 38 CO 0.01 0.00 -1.87 0.28 0.09 0.00 0.00 178.83 177.34 2nyx n VAL 39 N -2.88 1.53 -3.89 1.86 0.31 -0.97 -4.87 118.33 109.43 2nyx n VAL 39 Ca 0.04 -0.19 -0.27 0.00 -0.01 0.00 0.00 64.34 63.91 2nyx n VAL 39 Cb 0.49 -1.99 -0.17 0.00 -0.91 0.00 0.00 33.84 31.26 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 -7.10 2.39 0.53 4.52 -1.08 -1.08 -5.02 116.67 109.84 2nyx s ASP 40 Ca -0.33 -0.43 0.18 0.00 -0.52 0.00 0.00 52.55 51.45 2nyx s ASP 40 Cb 0.10 -0.85 1.34 0.00 -1.46 0.00 0.00 42.92 42.06 2nyx s ASP 40 CO 0.52 -0.15 2.15 -0.33 0.52 0.00 0.00 175.17 177.88 2nyx h GLU 41 N 8.16 0.00 -0.00 4.34 5.08 -1.82 -3.15 114.58 127.19 2nyx h GLU 41 Ca -0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 2nyx h GLU 41 Cb 1.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.37 2nyx h GLU 41 CO 0.40 0.00 -0.78 0.09 -1.00 0.00 0.00 179.01 177.72 2nyx n ASN 42 N -4.45 0.90 -4.67 1.42 5.03 -1.26 -4.92 115.26 107.31 2nyx n ASN 42 Ca -0.02 -0.79 -0.41 0.00 0.87 0.00 0.00 54.58 54.23 2nyx n ASN 42 Cb 0.13 0.70 -0.04 0.00 -1.02 0.00 0.00 39.78 39.54 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 -2.95 4.88 0.79 2.41 2.07 -1.19 -5.04 121.20 122.16 2nyx s ILE 43 Ca 0.10 1.66 -0.11 0.00 -1.41 0.00 0.00 60.65 60.89 2nyx s ILE 43 Cb 0.17 -4.15 0.06 0.00 0.13 0.00 0.00 42.46 38.67 2nyx s ILE 43 CO 0.78 0.03 1.09 0.42 -1.91 0.00 0.00 174.94 175.36 2nyx s THR 44 N 2.10 3.21 0.10 4.00 -4.23 -1.26 -4.83 115.64 114.73 2nyx s THR 44 Ca 0.39 0.39 -0.19 0.00 -1.18 0.00 0.00 61.69 61.10 2nyx s THR 44 Cb -0.17 -3.10 -0.08 0.00 1.34 0.00 0.00 72.50 70.50 2nyx s THR 44 CO 0.13 -0.51 1.63 0.40 -0.54 0.00 0.00 174.62 175.73 2nyx h ILE 45 N -1.07 1.18 -0.76 2.99 2.04 -1.99 -0.79 117.51 119.10 2nyx h ILE 45 Ca -0.47 -0.54 0.08 0.00 1.00 0.00 0.00 64.86 64.93 2nyx h ILE 45 Cb 1.26 1.10 -0.07 0.00 -0.74 0.00 0.00 36.82 38.38 2nyx h ILE 45 CO 0.58 0.18 0.43 -0.65 0.00 0.00 0.00 178.15 178.68 2nyx h PRO 46 N 0.22 0.72 -0.31 2.37 0.11 -2.00 -0.92 132.00 132.19 2nyx h PRO 46 Ca 0.08 -0.04 0.04 0.00 0.11 0.00 0.00 66.00 66.18 2nyx h PRO 46 Cb 0.20 -0.16 -0.04 0.00 0.11 0.00 0.00 31.00 31.11 2nyx h PRO 46 CO -0.01 0.48 0.08 1.96 -0.21 0.00 0.00 178.00 180.31 2nyx h GLN 47 N 0.74 0.20 -0.76 1.05 4.20 -1.89 -1.73 115.11 116.93 2nyx h GLN 47 Ca 0.36 -0.01 -0.05 0.00 0.06 0.00 0.00 58.65 59.00 2nyx h GLN 47 Cb 0.29 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.99 2nyx h GLN 47 CO -0.22 0.13 0.27 0.35 -0.67 0.00 0.00 178.83 178.69 2nyx h PHE 48 N 0.21 1.18 -0.58 2.96 3.57 -0.65 -2.54 116.94 121.08 2nyx h PHE 48 Ca 0.14 -0.10 0.03 0.00 3.53 0.00 0.00 57.97 61.57 2nyx h PHE 48 Cb 0.13 -0.35 -0.04 0.00 2.79 0.00 0.00 35.95 38.48 2nyx h PHE 48 CO -0.15 0.91 0.35 -0.09 -2.23 0.00 0.00 178.31 177.10 2nyx h ARG 49 N 1.12 0.68 -0.79 1.11 9.65 -0.94 -1.80 114.38 123.40 2nyx h ARG 49 Ca 0.25 -0.04 0.19 0.00 -1.10 0.00 0.00 59.98 59.28 2nyx h ARG 49 Cb 0.25 -0.15 -0.12 0.00 -1.39 0.00 0.00 29.97 28.56 2nyx h ARG 49 CO -0.02 0.45 0.17 1.15 2.80 0.00 0.00 179.97 184.53 2nyx h THR 50 N 0.70 0.42 -0.58 0.20 2.02 -0.91 0.43 112.91 115.19 2nyx h THR 50 Ca 0.24 -0.08 -0.09 0.00 0.77 0.00 0.00 66.41 67.24 2nyx h THR 50 Cb 0.03 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 66.59 2nyx h THR 50 CO -0.10 0.04 -0.00 -0.07 0.37 0.00 0.00 175.52 175.75 2nyx h LEU 51 N 0.23 1.01 -0.41 2.58 3.38 -1.05 -1.79 115.31 119.26 2nyx h LEU 51 Ca 0.46 -0.31 -0.09 0.00 0.09 0.00 0.00 57.88 58.03 2nyx h LEU 51 Cb 0.84 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 2nyx h LEU 51 CO -0.58 1.07 -0.11 0.58 0.09 0.00 0.00 178.44 179.50 2nyx h VAL 52 N 0.92 1.27 -0.99 1.22 2.07 -0.75 -1.62 116.25 118.38 2nyx h VAL 52 Ca 0.16 -1.21 0.05 0.00 0.82 0.00 0.00 66.70 66.53 2nyx h VAL 52 Cb 0.56 1.20 -0.06 0.00 -1.52 0.00 0.00 31.29 31.47 2nyx h VAL 52 CO 0.03 0.41 0.64 0.40 0.02 0.00 0.00 177.57 179.07 2nyx h ILE 53 N 0.62 1.12 -0.19 4.57 2.04 -0.86 -1.41 117.51 123.40 2nyx h ILE 53 Ca 0.10 -0.41 -0.11 0.00 1.00 0.00 0.00 64.86 65.44 2nyx h ILE 53 Cb 0.64 -0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.52 2nyx h ILE 53 CO 0.04 0.22 -0.37 -0.07 0.00 0.00 0.00 178.15 177.97 2nyx h LEU 54 N 1.20 0.44 -0.59 1.44 3.38 -0.81 0.44 115.31 120.81 2nyx h LEU 54 Ca 0.42 -0.18 -0.15 0.00 0.09 0.00 0.00 57.88 58.05 2nyx h LEU 54 Cb 0.10 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2nyx h LEU 54 CO -0.15 0.77 -0.61 0.77 0.09 0.00 0.00 178.44 179.31 2nyx h SER 55 N 0.35 0.38 0.38 -0.43 4.64 -0.87 -1.57 113.55 116.43 2nyx h SER 55 Ca 0.04 -0.22 -0.25 0.00 -0.47 0.00 0.00 61.79 60.88 2nyx h SER 55 Cb 0.82 -0.11 0.01 0.00 -0.31 0.00 0.00 62.40 62.81 2nyx h SER 55 CO 0.07 0.90 -1.09 0.78 -0.87 0.00 0.00 176.83 176.62 2nyx h ASN 56 N 0.25 0.57 0.00 4.97 2.35 -1.02 -3.38 115.58 119.32 2nyx h ASN 56 Ca -0.01 -0.51 0.00 0.00 -0.55 0.00 0.00 56.30 55.23 2nyx h ASN 56 Cb 1.13 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 39.32 2nyx h ASN 56 CO 0.10 1.34 -1.20 1.41 -1.65 0.00 0.00 177.43 177.43 2nyx n HIS 57 N -3.70 0.00 -3.15 1.19 8.25 0.15 -5.09 115.22 112.88 2nyx n HIS 57 Ca -0.09 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.37 2nyx n HIS 57 Cb 0.92 -0.15 0.00 0.00 1.12 0.00 0.00 29.99 31.88 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 -1.64 3.72 -1.41 0.00 -0.59 -4.78 105.19 101.91 2nyx n GLY 58 Ca 0.01 -1.47 -0.42 0.00 0.00 0.00 0.00 46.02 44.14 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 4.35 0.06 1.61 0.02 -1.26 -4.69 135.00 135.09 2nyx s PRO 59 Ca 0.00 2.01 -0.04 0.00 0.02 0.00 0.00 61.00 62.99 2nyx s PRO 59 Cb 0.00 -3.26 -0.02 0.00 0.02 0.00 0.00 34.50 31.23 2nyx s PRO 59 CO 0.00 -0.39 0.06 0.96 -0.33 0.00 0.00 177.00 177.31 2nyx s ILE 60 N 1.02 0.18 0.78 2.83 -4.36 -1.02 -4.92 121.20 115.72 2nyx s ILE 60 Ca 0.63 -1.50 -0.10 0.00 -0.26 0.00 0.00 60.65 59.42 2nyx s ILE 60 Cb -0.35 -1.37 0.09 0.00 1.25 0.00 0.00 42.46 42.07 2nyx s ILE 60 CO 0.31 -0.83 1.13 0.54 0.24 0.00 0.00 174.94 176.33 2nyx s ASN 61 N -2.80 4.48 0.25 4.36 4.22 -1.26 -0.36 114.94 123.83 2nyx s ASN 61 Ca 0.05 0.58 -0.06 0.00 -2.14 0.00 0.00 52.86 51.29 2nyx s ASN 61 Cb 0.06 -1.08 0.27 0.00 1.28 0.00 0.00 41.25 41.78 2nyx s ASN 61 CO -0.10 -1.87 1.93 -0.07 -2.04 0.00 0.00 177.10 174.95 2nyx h LEU 62 N -0.93 1.15 -0.79 3.54 4.07 -1.97 -1.68 115.31 118.70 2nyx h LEU 62 Ca -0.45 -0.03 -0.00 0.00 0.08 0.00 0.00 57.88 57.48 2nyx h LEU 62 Cb 1.31 -0.28 -0.04 0.00 1.08 0.00 0.00 40.66 42.73 2nyx h LEU 62 CO 0.60 0.83 0.48 0.00 -1.08 0.00 0.00 178.44 179.27 2nyx h ALA 63 N 1.38 1.01 -0.33 1.53 0.00 -1.96 -0.07 119.26 120.82 2nyx h ALA 63 Ca 0.37 -0.09 -0.16 0.00 0.00 0.00 0.00 54.91 55.03 2nyx h ALA 63 Cb -0.14 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.33 2nyx h ALA 63 CO -0.08 0.47 -0.42 1.15 0.00 0.00 0.00 179.25 180.36 2nyx h THR 64 N 1.08 1.28 0.10 0.00 2.02 -1.89 -2.50 112.91 113.01 2nyx h THR 64 Ca 0.28 -1.60 -0.00 0.00 0.77 0.00 0.00 66.41 65.85 2nyx h THR 64 Cb -0.04 1.47 0.00 0.00 -1.74 0.00 0.00 68.15 67.84 2nyx h THR 64 CO -0.05 0.53 -0.05 0.25 0.37 0.00 0.00 175.52 176.57 2nyx h LEU 65 N 0.67 -0.11 -1.41 2.58 6.46 -0.82 -1.61 115.31 121.07 2nyx h LEU 65 Ca 0.05 -0.08 0.05 0.00 -0.12 0.00 0.00 57.88 57.78 2nyx h LEU 65 Cb 1.00 0.03 -0.04 0.00 -0.73 0.00 0.00 40.66 40.92 2nyx h LEU 65 CO 0.10 0.01 0.45 0.00 -0.62 0.00 0.00 178.44 178.37 2nyx h ALA 66 N 0.66 1.69 -0.11 1.25 0.00 -1.02 0.16 119.26 121.89 2nyx h ALA 66 Ca -0.01 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.72 2nyx h ALA 66 Cb 0.19 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.79 2nyx h ALA 66 CO 0.02 0.22 -0.52 1.15 0.00 0.00 0.00 179.25 180.12 2nyx h THR 67 N 0.74 1.36 -0.35 0.00 2.02 -1.23 -0.93 112.91 114.52 2nyx h THR 67 Ca 0.28 -1.83 -0.12 0.00 0.77 0.00 0.00 66.41 65.51 2nyx h THR 67 Cb 0.18 2.16 -0.01 0.00 -1.74 0.00 0.00 68.15 68.74 2nyx h THR 67 CO -0.09 0.55 -0.29 -0.07 0.37 0.00 0.00 175.52 176.00 2nyx h LEU 68 N 0.16 0.75 -1.23 2.58 3.38 -0.96 -2.70 115.31 117.30 2nyx h LEU 68 Ca -0.03 -0.29 -0.07 0.00 0.09 0.00 0.00 57.88 57.57 2nyx h LEU 68 Cb 1.16 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 2nyx h LEU 68 CO 0.11 0.99 -0.28 -0.07 0.09 0.00 0.00 178.44 179.28 2nyx h LEU 69 N 0.62 0.17 0.63 1.67 3.38 -0.69 -3.47 115.31 117.62 2nyx h LEU 69 Ca 0.08 -0.05 -0.18 0.00 0.09 0.00 0.00 57.88 57.81 2nyx h LEU 69 Cb 0.80 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 41.52 2nyx h LEU 69 CO 0.07 0.45 -0.25 0.61 0.09 0.00 0.00 178.44 179.41 2nyx n GLY 70 N -0.56 0.09 3.39 0.83 0.00 -0.42 -5.05 105.19 103.46 2nyx n GLY 70 Ca -0.01 -0.43 -0.28 0.00 0.00 0.00 0.00 46.02 45.29 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 -2.66 2.23 0.32 1.61 1.01 -0.79 -5.05 120.40 117.06 2nyx s VAL 71 Ca 0.08 -1.81 -0.29 0.00 0.00 0.00 0.00 61.98 59.95 2nyx s VAL 71 Cb -0.03 -1.99 -0.12 0.00 0.00 0.00 0.00 36.38 34.24 2nyx s VAL 71 CO 0.10 0.02 1.55 1.67 0.00 0.00 0.00 175.10 178.43 2nyx n GLN 72 N 0.75 2.66 -0.35 2.72 7.27 -1.26 -4.56 117.38 124.60 2nyx n GLN 72 Ca -0.17 0.94 0.03 0.00 0.07 0.00 0.00 57.00 57.88 2nyx n GLN 72 Cb 0.54 -2.70 0.18 0.00 2.41 0.00 0.00 30.24 30.67 2nyx n GLN 72 CO 0.00 0.00 0.00 -1.00 0.07 0.00 0.00 177.06 176.13 2nyx h PRO 73 N 4.14 1.05 -0.31 3.69 0.13 -1.95 -1.38 132.00 137.37 2nyx h PRO 73 Ca -0.48 -0.06 0.03 0.00 -0.87 0.00 0.00 66.00 64.62 2nyx h PRO 73 Cb 1.23 -0.24 -0.03 0.00 0.13 0.00 0.00 31.00 32.09 2nyx h PRO 73 CO 0.74 0.69 0.11 0.77 -0.23 0.00 0.00 178.00 180.08 2nyx h SER 74 N 1.08 0.13 -0.43 1.44 0.02 -1.99 0.17 113.55 113.96 2nyx h SER 74 Ca 0.44 0.03 -0.05 0.00 -0.84 0.00 0.00 61.79 61.37 2nyx h SER 74 Cb 0.25 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.79 2nyx h SER 74 CO -0.20 0.11 0.08 0.00 -1.14 0.00 0.00 176.83 175.68 2nyx h ALA 75 N 1.19 0.58 -0.23 3.77 0.00 -1.90 -1.92 119.26 120.75 2nyx h ALA 75 Ca 0.14 -0.21 0.05 0.00 0.00 0.00 0.00 54.91 54.88 2nyx h ALA 75 Cb 0.10 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 2nyx h ALA 75 CO -0.14 0.28 -0.09 1.15 0.00 0.00 0.00 179.25 180.46 2nyx h THR 76 N 0.57 0.70 -0.63 0.00 2.02 -0.82 -2.56 112.91 112.20 2nyx h THR 76 Ca 0.13 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.40 2nyx h THR 76 Cb 0.36 0.70 -0.07 0.00 -1.74 0.00 0.00 68.15 67.40 2nyx h THR 76 CO 0.01 0.00 0.26 1.23 0.37 0.00 0.00 175.52 177.39 2nyx h GLY 77 N -0.05 0.89 -1.33 2.16 0.00 -0.48 -0.98 103.07 103.27 2nyx h GLY 77 Ca 0.12 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.30 2nyx h GLY 77 CO -0.26 0.01 0.00 0.54 0.00 0.00 0.00 176.54 176.82 2nyx n ARG 78 N -4.96 0.11 0.00 4.80 1.74 -0.74 -1.83 116.66 115.79 2nyx n ARG 78 Ca 0.09 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.17 2nyx n ARG 78 Cb 0.26 -1.18 0.00 0.00 -1.02 0.00 0.00 32.46 30.52 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 0.61 0.00 -0.22 1.55 0.31 -0.37 -2.15 118.33 118.06 2nyx n VAL 80 Ca 0.00 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.35 2nyx n VAL 80 Cb 0.04 0.00 0.14 0.00 -0.91 0.00 0.00 33.84 33.11 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 0.10 -0.37 4.52 3.32 -1.62 0.25 116.42 122.63 2nyx h ASP 81 Ca 0.00 0.11 -0.03 0.00 0.02 0.00 0.00 57.03 57.13 2nyx h ASP 81 Cb 0.00 0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 2nyx h ASP 81 CO 0.00 0.04 0.11 0.03 -1.72 0.00 0.00 179.24 177.70 2nyx h ARG 82 N 0.33 0.57 0.00 3.56 3.08 -1.72 -0.24 114.38 119.96 2nyx h ARG 82 Ca 0.35 -0.13 -0.08 0.00 0.07 0.00 0.00 59.98 60.19 2nyx h ARG 82 Cb 0.53 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 2nyx h ARG 82 CO -0.41 0.60 -0.39 -0.07 -1.07 0.00 0.00 179.97 178.62 2nyx h LEU 83 N 0.44 0.00 -0.25 3.04 3.38 -1.71 -0.42 115.31 119.80 2nyx h LEU 83 Ca 0.12 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 2nyx h LEU 83 Cb 0.27 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 2nyx h LEU 83 CO -0.00 0.39 0.01 0.58 0.09 0.00 0.00 178.44 179.51 2nyx h VAL 84 N 0.00 1.25 -0.31 1.22 2.07 -0.25 -0.49 116.25 119.73 2nyx h VAL 84 Ca -0.00 -0.87 0.05 0.00 0.82 0.00 0.00 66.70 66.70 2nyx h VAL 84 Cb 0.78 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.85 2nyx h VAL 84 CO 0.05 0.27 0.22 1.23 0.02 0.00 0.00 177.57 179.36 2nyx h GLY 85 N 0.23 0.25 -2.55 2.17 0.00 -0.27 -1.90 103.07 101.00 2nyx h GLY 85 Ca 0.07 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.32 2nyx h GLY 85 CO 0.01 0.07 0.00 0.00 0.00 0.00 0.00 176.54 176.62 2nyx n ALA 86 N -2.54 3.09 -2.10 3.60 0.00 -0.24 -4.93 120.51 117.39 2nyx n ALA 86 Ca 0.03 -1.24 -0.19 0.00 0.00 0.00 0.00 53.44 52.04 2nyx n ALA 86 Cb 0.24 -1.04 -0.04 0.00 0.00 0.00 0.00 19.45 18.61 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 0.72 -1.66 0.01 0.00 4.71 -0.71 -4.86 120.64 118.84 2nyx n GLU 87 Ca 0.20 1.00 0.11 0.00 -0.01 0.00 0.00 57.16 58.46 2nyx n GLU 87 Cb 0.76 -5.55 -0.10 0.00 -1.01 0.00 0.00 31.44 25.54 2nyx n GLU 87 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 2nyx n LEU 88 N -2.72 0.41 -3.88 -4.62 4.77 -0.21 -4.35 117.00 106.39 2nyx n LEU 88 Ca -0.22 -0.08 -0.16 0.00 -0.03 0.00 0.00 56.01 55.53 2nyx n LEU 88 Cb 0.66 -0.03 -0.15 0.00 -2.33 0.00 0.00 43.42 41.57 2nyx n LEU 88 CO 0.27 0.04 -0.38 -0.63 -1.33 0.00 0.00 177.39 175.37 2nyx s ILE 89 N -3.33 0.23 -0.01 -0.08 1.01 -1.08 -2.14 121.20 115.80 2nyx s ILE 89 Ca -0.02 -0.04 -0.01 0.00 0.00 0.00 0.00 60.65 60.58 2nyx s ILE 89 Cb 0.14 -0.25 -0.04 0.00 0.01 0.00 0.00 42.46 42.32 2nyx s ILE 89 CO 0.87 0.11 0.11 -1.81 0.00 0.00 0.00 174.94 174.21 2nyx s ASP 90 N 0.41 5.89 -0.16 3.58 1.01 -0.07 -4.23 116.67 123.10 2nyx s ASP 90 Ca -0.04 0.22 -0.16 0.00 0.71 0.00 0.00 52.55 53.28 2nyx s ASP 90 Cb -0.07 -1.75 -0.04 0.00 1.01 0.00 0.00 42.92 42.07 2nyx s ASP 90 CO -0.01 0.28 0.40 -0.13 0.21 0.00 0.00 175.17 175.92 2nyx s ARG 91 N -1.73 4.25 0.14 8.23 1.81 -1.26 -1.43 118.95 128.97 2nyx s ARG 91 Ca 0.23 0.26 0.11 0.00 -1.72 0.00 0.00 55.73 54.61 2nyx s ARG 91 Cb -0.12 -3.47 -0.04 0.00 -0.45 0.00 0.00 34.95 30.86 2nyx s ARG 91 CO 0.14 0.10 -0.23 -0.51 -0.68 0.00 0.00 175.30 174.12 2nyx s LEU 92 N 0.86 2.46 0.46 2.53 1.43 0.72 -4.92 118.68 122.22 2nyx s LEU 92 Ca 0.21 -0.73 -0.24 0.00 -1.03 0.00 0.00 54.13 52.34 2nyx s LEU 92 Cb -0.14 -1.30 -0.07 0.00 0.03 0.00 0.00 46.19 44.70 2nyx s LEU 92 CO 0.08 0.16 1.30 -2.84 0.23 0.00 0.00 176.35 175.28 2nyx s PRO 93 N -2.26 3.66 0.15 1.29 0.02 -1.26 0.15 135.00 136.75 2nyx s PRO 93 Ca 0.17 2.12 -0.30 0.00 0.02 0.00 0.00 61.00 63.00 2nyx s PRO 93 Cb -0.10 -2.53 -0.08 0.00 0.02 0.00 0.00 34.50 31.82 2nyx s PRO 93 CO 0.08 -0.73 1.28 -1.58 -0.33 0.00 0.00 177.00 175.72 2nyx s HIS 94 N -1.33 3.34 0.20 6.54 2.46 -1.25 -4.68 115.29 120.55 2nyx s HIS 94 Ca 0.63 1.23 -0.11 0.00 0.47 0.00 0.00 55.06 57.27 2nyx s HIS 94 Cb -0.37 -3.54 0.22 0.00 -0.13 0.00 0.00 32.58 28.76 2nyx s HIS 94 CO 0.46 -1.70 1.75 -1.00 -2.47 0.00 0.00 174.74 171.78 2nyx h PRO 95 N 5.97 0.38 0.00 2.88 0.13 -1.93 -3.43 132.00 136.00 2nyx h PRO 95 Ca -0.43 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2nyx h PRO 95 Cb 1.21 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2nyx h PRO 95 CO 0.79 0.25 0.00 2.41 -0.23 0.00 0.00 178.00 181.22 2nyx n THR 96 N -4.99 0.00 0.00 1.56 -1.04 -1.26 -5.08 114.28 103.46 2nyx n THR 96 Ca 0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.08 2nyx n THR 96 Cb 0.23 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.74 2nyx n THR 96 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2nyx n SER 97 N 0.00 0.00 -1.82 8.00 7.64 -1.26 -5.00 113.62 121.18 2nyx n SER 97 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2nyx n SER 97 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2nyx n SER 97 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2nyx n ARG 98 N 0.00 -3.66 0.00 1.43 1.74 -1.26 -4.64 116.66 110.27 2nyx n ARG 98 Ca 0.00 2.63 0.00 0.00 -0.77 0.00 0.00 57.85 59.71 2nyx n ARG 98 Cb 0.00 -3.05 0.00 0.00 -1.02 0.00 0.00 32.46 28.39 2nyx n ARG 98 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2nyx n ARG 99 N 0.77 0.00 -2.80 5.56 0.63 -1.26 -4.24 116.66 115.32 2nyx n ARG 99 Ca 0.00 0.00 -0.39 0.00 -0.92 0.00 0.00 57.85 56.54 2nyx n ARG 99 Cb 0.00 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 32.85 2nyx n ARG 99 CO 0.00 0.00 0.00 -1.83 -2.51 0.00 0.00 177.63 173.29 2nyx s GLU 100 N 0.00 4.76 0.31 -0.14 1.03 -1.26 -5.04 118.70 118.36 2nyx s GLU 100 Ca 0.00 1.40 -0.14 0.00 0.03 0.00 0.00 54.97 56.26 2nyx s GLU 100 Cb 0.00 -3.20 -0.09 0.00 -0.80 0.00 0.00 34.13 30.04 2nyx s GLU 100 CO 0.00 0.49 0.71 -0.51 -1.33 0.00 0.00 175.26 174.62 2nyx s LEU 101 N -1.32 4.07 0.24 1.83 1.02 -1.26 -3.96 118.68 119.30 2nyx s LEU 101 Ca 0.41 1.22 -0.05 0.00 0.02 0.00 0.00 54.13 55.73 2nyx s LEU 101 Cb -0.24 -4.02 -0.06 0.00 0.02 0.00 0.00 46.19 41.89 2nyx s LEU 101 CO 0.30 -0.20 0.50 -0.76 0.02 0.00 0.00 176.35 176.21 2nyx s LEU 102 N -3.00 4.13 -0.11 1.79 1.02 0.12 -4.35 118.68 118.28 2nyx s LEU 102 Ca 0.53 0.70 -0.02 0.00 0.02 0.00 0.00 54.13 55.36 2nyx s LEU 102 Cb -0.10 -3.49 -0.03 0.00 0.02 0.00 0.00 46.19 42.59 2nyx s LEU 102 CO 0.19 -0.11 -0.02 0.00 0.02 0.00 0.00 176.35 176.43 2nyx s ALA 103 N -1.93 3.16 0.07 4.21 0.00 0.51 -0.20 121.76 127.58 2nyx s ALA 103 Ca 0.44 -0.82 -0.09 0.00 0.00 0.00 0.00 51.96 51.48 2nyx s ALA 103 Cb -0.11 -1.50 0.00 0.00 0.00 0.00 0.00 23.12 21.52 2nyx s ALA 103 CO 0.27 0.44 0.20 0.00 0.00 0.00 0.00 175.76 176.68 2nyx s ALA 104 N -0.41 -0.30 0.44 0.00 0.00 -0.52 -2.44 121.76 118.53 2nyx s ALA 104 Ca 0.07 -0.48 -0.23 0.00 0.00 0.00 0.00 51.96 51.32 2nyx s ALA 104 Cb -0.12 0.43 -0.08 0.00 0.00 0.00 0.00 23.12 23.35 2nyx s ALA 104 CO 0.02 -0.47 1.11 -0.51 0.00 0.00 0.00 175.76 175.91 2nyx s LEU 105 N -2.62 4.05 0.40 0.00 1.43 -1.26 -0.89 118.68 119.79 2nyx s LEU 105 Ca 0.02 2.17 0.00 0.00 -1.03 0.00 0.00 54.13 55.29 2nyx s LEU 105 Cb 0.03 -4.24 -0.02 0.00 0.03 0.00 0.00 46.19 41.99 2nyx s LEU 105 CO -0.09 -0.74 0.62 -0.89 0.23 0.00 0.00 176.35 175.48 2nyx s THR 106 N -1.62 4.49 0.17 5.49 2.01 -0.91 -4.68 115.64 120.59 2nyx s THR 106 Ca 0.62 -0.48 -0.15 0.00 0.31 0.00 0.00 61.69 61.99 2nyx s THR 106 Cb -0.25 -3.65 0.10 0.00 0.01 0.00 0.00 72.50 68.71 2nyx s THR 106 CO 0.31 -0.44 1.69 0.50 -0.69 0.00 0.00 174.62 175.98 2nyx h LYS 107 N 0.56 0.08 -0.96 4.92 3.11 -1.89 0.04 116.57 122.43 2nyx h LYS 107 Ca -0.48 -0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.36 2nyx h LYS 107 Cb 1.24 -0.02 -0.05 0.00 -1.00 0.00 0.00 32.23 32.40 2nyx h LYS 107 CO 0.59 0.05 0.60 -0.09 -2.81 0.00 0.00 179.45 177.79 2nyx h ARG 108 N 0.09 1.28 -0.47 1.90 2.43 -1.92 -0.74 114.38 116.95 2nyx h ARG 108 Ca 0.21 -0.10 0.08 0.00 -0.81 0.00 0.00 59.98 59.37 2nyx h ARG 108 Cb 0.31 -0.28 -0.07 0.00 -0.42 0.00 0.00 29.97 29.52 2nyx h ARG 108 CO -0.37 0.88 0.05 0.78 -1.51 0.00 0.00 179.97 179.80 2nyx h GLY 109 N 1.31 0.53 1.41 2.80 0.00 -1.37 -1.01 103.07 106.74 2nyx h GLY 109 Ca 0.35 0.01 -0.10 0.00 0.00 0.00 0.00 47.33 47.59 2nyx h GLY 109 CO -0.07 -0.09 -0.19 3.21 0.00 0.00 0.00 176.54 179.40 2nyx h ARG 110 N 0.18 0.69 -0.44 4.80 3.08 -0.12 -2.28 114.38 120.28 2nyx h ARG 110 Ca 0.23 -0.25 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 2nyx h ARG 110 Cb 0.33 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.31 2nyx h ARG 110 CO -0.34 0.83 0.20 -0.44 -1.07 0.00 0.00 179.97 179.15 2nyx h ASP 111 N 0.61 0.59 -0.03 7.04 3.32 -0.89 -0.15 116.42 126.91 2nyx h ASP 111 Ca 0.09 -0.14 0.03 0.00 0.02 0.00 0.00 57.03 57.03 2nyx h ASP 111 Cb 0.66 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 40.02 2nyx h ASP 111 CO 0.05 0.57 -0.21 0.58 -1.72 0.00 0.00 179.24 178.51 2nyx h VAL 112 N 0.57 0.50 -0.57 -1.35 2.07 -0.91 0.35 116.25 116.91 2nyx h VAL 112 Ca 0.15 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.70 2nyx h VAL 112 Cb 0.15 0.50 -0.04 0.00 -1.52 0.00 0.00 31.29 30.38 2nyx h VAL 112 CO -0.02 0.00 0.34 0.58 0.02 0.00 0.00 177.57 178.50 2nyx h VAL 113 N -0.32 1.05 -0.41 2.57 2.07 -1.32 -1.37 116.25 118.52 2nyx h VAL 113 Ca 0.07 -0.23 -0.06 0.00 0.82 0.00 0.00 66.70 67.30 2nyx h VAL 113 Cb 0.41 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 2nyx h VAL 113 CO -0.21 0.12 0.03 -0.09 0.02 0.00 0.00 177.57 177.45 2nyx h ARG 114 N 0.67 0.70 -0.02 1.57 2.43 -0.64 -2.08 114.38 117.02 2nyx h ARG 114 Ca 0.23 -0.21 -0.00 0.00 -0.81 0.00 0.00 59.98 59.20 2nyx h ARG 114 Cb 0.04 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.52 2nyx h ARG 114 CO -0.11 0.77 0.01 1.96 -1.51 0.00 0.00 179.97 181.09 2nyx h GLN 115 N 0.54 0.03 -0.68 0.20 4.20 -0.08 -0.85 115.11 118.48 2nyx h GLN 115 Ca 0.12 -0.01 0.04 0.00 0.06 0.00 0.00 58.65 58.86 2nyx h GLN 115 Cb 0.43 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.16 2nyx h GLN 115 CO 0.01 0.20 0.41 0.28 -0.67 0.00 0.00 178.83 179.06 2nyx h VAL 116 N -0.14 1.05 -0.23 -0.54 2.07 -1.31 -1.89 116.25 115.26 2nyx h VAL 116 Ca 0.01 -0.27 -0.02 0.00 0.82 0.00 0.00 66.70 67.23 2nyx h VAL 116 Cb 0.18 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.14 2nyx h VAL 116 CO -0.00 0.14 0.05 0.74 0.02 0.00 0.00 177.57 178.52 2nyx h THR 117 N 0.78 1.22 -0.54 2.57 2.02 -1.25 -2.03 112.91 115.68 2nyx h THR 117 Ca 0.28 -0.71 -0.08 0.00 0.77 0.00 0.00 66.41 66.67 2nyx h THR 117 Cb 0.08 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.71 2nyx h THR 117 CO -0.13 0.22 -0.00 1.05 0.37 0.00 0.00 175.52 177.03 2nyx h GLU 118 N 0.19 0.93 -0.43 6.66 -0.00 -1.01 -1.31 114.58 119.60 2nyx h GLU 118 Ca 0.07 -0.27 -0.12 0.00 -0.00 0.00 0.00 59.36 59.04 2nyx h GLU 118 Cb 0.29 -0.10 -0.01 0.00 -0.00 0.00 0.00 28.75 28.94 2nyx h GLU 118 CO 0.00 0.92 -0.22 0.45 -0.00 0.00 0.00 179.01 180.16 2nyx h HIS 119 N 0.85 0.98 -0.45 2.06 3.86 -1.30 -2.15 115.15 119.00 2nyx h HIS 119 Ca 0.16 -0.23 -0.14 0.00 -1.16 0.00 0.00 60.37 59.00 2nyx h HIS 119 Cb 0.51 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.73 2nyx h HIS 119 CO 0.03 0.99 -0.27 -0.09 0.86 0.00 0.00 177.93 179.46 2nyx h ARG 120 N 0.74 0.97 -0.91 2.45 2.43 -1.17 -2.64 114.38 116.26 2nyx h ARG 120 Ca 0.10 -0.44 -0.00 0.00 -0.81 0.00 0.00 59.98 58.83 2nyx h ARG 120 Cb 0.75 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.24 2nyx h ARG 120 CO 0.06 1.11 0.55 -0.09 -1.51 0.00 0.00 179.97 180.09 2nyx h ARG 121 N 0.82 1.23 -0.76 0.20 2.43 -1.07 -0.28 114.38 116.95 2nyx h ARG 121 Ca 0.10 -0.11 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 2nyx h ARG 121 Cb 0.85 -0.26 -0.03 0.00 -0.42 0.00 0.00 29.97 30.10 2nyx h ARG 121 CO 0.07 0.86 0.31 1.15 -1.51 0.00 0.00 179.97 180.85 2nyx h THR 122 N 1.25 1.25 -0.23 0.20 2.02 -1.22 -1.56 112.91 114.63 2nyx h THR 122 Ca 0.33 -0.79 -0.14 0.00 0.77 0.00 0.00 66.41 66.58 2nyx h THR 122 Cb -0.06 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 66.68 2nyx h THR 122 CO -0.06 0.32 -0.44 -0.33 0.37 0.00 0.00 175.52 175.38 2nyx h GLU 123 N 1.10 0.57 -0.04 6.66 4.39 -1.09 -2.82 114.58 123.34 2nyx h GLU 123 Ca 0.25 -0.31 -0.01 0.00 0.34 0.00 0.00 59.36 59.64 2nyx h GLU 123 Cb 0.20 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.86 2nyx h GLU 123 CO -0.02 0.90 -0.00 0.82 -1.16 0.00 0.00 179.01 179.54 2nyx h ILE 124 N 0.46 1.28 -0.55 3.13 2.04 -0.66 -2.88 117.51 120.32 2nyx h ILE 124 Ca 0.03 -0.84 -0.05 0.00 1.00 0.00 0.00 64.86 65.01 2nyx h ILE 124 Cb 0.96 1.77 -0.03 0.00 -0.74 0.00 0.00 36.82 38.78 2nyx h ILE 124 CO 0.09 0.23 0.15 0.00 0.00 0.00 0.00 178.15 178.61 2nyx h ALA 125 N 0.67 1.23 -0.81 1.87 0.00 -1.37 0.61 119.26 121.47 2nyx h ALA 125 Ca 0.01 -0.19 0.08 0.00 0.00 0.00 0.00 54.91 54.81 2nyx h ALA 125 Cb 0.37 -0.22 -0.07 0.00 0.00 0.00 0.00 17.79 17.86 2nyx h ALA 125 CO 0.00 0.54 0.47 -0.09 0.00 0.00 0.00 179.25 180.17 2nyx h ARG 126 N 0.81 0.79 -0.03 0.00 2.43 -1.50 0.73 114.38 117.61 2nyx h ARG 126 Ca 0.18 -0.05 -0.19 0.00 -0.81 0.00 0.00 59.98 59.11 2nyx h ARG 126 Cb 0.27 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 2nyx h ARG 126 CO -0.01 0.52 -0.81 0.82 -1.51 0.00 0.00 179.97 178.99 2nyx h ILE 127 N 0.82 1.42 -0.07 1.20 2.04 -1.13 -3.20 117.51 118.59 2nyx h ILE 127 Ca 0.38 -2.34 -0.08 0.00 1.00 0.00 0.00 64.86 63.82 2nyx h ILE 127 Cb 0.29 2.28 -0.01 0.00 -0.74 0.00 0.00 36.82 38.64 2nyx h ILE 127 CO -0.22 0.69 -0.33 0.58 0.00 0.00 0.00 178.15 178.88 2nyx h VAL 128 N 0.20 1.26 0.00 1.67 2.07 -0.27 -2.30 116.25 118.88 2nyx h VAL 128 Ca -0.04 -1.23 -0.01 0.00 0.82 0.00 0.00 66.70 66.23 2nyx h VAL 128 Cb 1.41 1.57 -0.00 0.00 -1.52 0.00 0.00 31.29 32.75 2nyx h VAL 128 CO 0.13 0.36 -0.04 -0.33 0.02 0.00 0.00 177.57 177.72 2nyx h GLU 129 N 0.12 0.00 -4.45 1.57 4.39 -0.87 -3.46 114.58 111.88 2nyx h GLU 129 Ca 0.01 0.00 -0.73 0.00 0.34 0.00 0.00 59.36 58.98 2nyx h GLU 129 Cb 0.64 0.00 -0.14 0.00 -0.10 0.00 0.00 28.75 29.15 2nyx h GLU 129 CO 0.05 0.04 1.83 1.04 -1.16 0.00 0.00 179.01 180.81 2nyx n GLN 130 N -3.51 3.38 -4.79 2.33 6.02 -0.87 -4.98 117.38 114.96 2nyx n GLN 130 Ca -0.02 -3.57 -0.33 0.00 -0.01 0.00 0.00 57.00 53.07 2nyx n GLN 130 Cb 0.14 -3.09 -0.13 0.00 1.02 0.00 0.00 30.24 28.19 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 1.69 2.76 0.46 -1.58 0.00 -1.26 -5.14 121.76 118.70 2nyx s ALA 132 Ca 0.44 -0.94 0.20 0.00 0.00 0.00 0.00 51.96 51.65 2nyx s ALA 132 Cb 0.03 -1.08 1.19 0.00 0.00 0.00 0.00 23.12 23.26 2nyx s ALA 132 CO 0.01 0.52 1.93 -1.35 0.00 0.00 0.00 175.76 176.87 2nyx h PRO 133 N 5.49 0.25 -0.09 0.00 0.11 -1.96 -1.80 132.00 134.01 2nyx h PRO 133 Ca -0.45 -0.02 0.02 0.00 0.11 0.00 0.00 66.00 65.67 2nyx h PRO 133 Cb 1.17 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 2nyx h PRO 133 CO 0.52 0.17 0.06 0.00 -0.21 0.00 0.00 178.00 178.54 2nyx h ALA 134 N 1.66 2.06 -0.51 -0.75 0.00 -2.04 -2.53 119.26 117.14 2nyx h ALA 134 Ca 0.35 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.26 2nyx h ALA 134 Cb 0.99 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2nyx h ALA 134 CO -0.08 -0.11 0.00 -0.85 0.00 0.00 0.00 179.25 178.21 2nyx n GLU 135 N -4.48 2.55 -1.82 0.00 0.28 -0.68 -4.66 120.64 111.83 2nyx n GLU 135 Ca -0.01 -2.37 -0.40 0.00 -0.16 0.00 0.00 57.16 54.22 2nyx n GLU 135 Cb 0.17 -1.53 -0.01 0.00 1.43 0.00 0.00 31.44 31.50 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 1.51 4.05 -3.95 3.44 1.74 -0.96 -4.86 116.66 117.64 2nyx n ARG 136 Ca 0.21 -3.03 -0.13 0.00 -0.77 0.00 0.00 57.85 54.14 2nyx n ARG 136 Cb 0.60 -2.78 -0.14 0.00 -1.02 0.00 0.00 32.46 29.12 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 0.41 0.14 -0.19 -1.55 3.76 -1.26 -4.89 115.29 111.71 2nyx s HIS 137 Ca 0.56 -0.06 0.00 0.00 -0.15 0.00 0.00 55.06 55.41 2nyx s HIS 137 Cb 0.17 -0.09 0.00 0.00 1.11 0.00 0.00 32.58 33.77 2nyx s HIS 137 CO -0.07 -0.01 0.00 0.41 -0.85 0.00 0.00 174.74 174.22 2nyx n GLY 138 N 2.93 0.45 0.07 -2.22 0.00 -1.26 -4.91 105.19 100.25 2nyx n GLY 138 Ca -0.13 -0.13 -0.15 0.00 0.00 0.00 0.00 46.02 45.62 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 0.12 0.99 3.38 -1.91 -3.33 115.31 114.57 2nyx h LEU 139 Ca -0.04 -0.88 -0.00 0.00 0.09 0.00 0.00 57.88 57.05 2nyx h LEU 139 Cb 0.46 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 2nyx h LEU 139 CO 0.05 1.05 -0.07 0.58 0.09 0.00 0.00 178.44 180.15 2nyx h VAL 140 N -1.00 0.86 -0.77 1.22 2.07 -1.98 -2.19 116.25 114.46 2nyx h VAL 140 Ca -0.05 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.59 2nyx h VAL 140 Cb 1.00 0.86 -0.13 0.00 -1.52 0.00 0.00 31.29 31.50 2nyx h VAL 140 CO -0.03 0.00 -0.37 -0.09 0.02 0.00 0.00 177.57 177.09 2nyx h ARG 141 N -0.18 -0.09 -0.38 1.57 2.43 -2.00 0.10 114.38 115.84 2nyx h ARG 141 Ca -0.01 0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.13 2nyx h ARG 141 Cb 0.15 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.70 2nyx h ARG 141 CO 0.02 -0.06 0.09 0.00 -1.51 0.00 0.00 179.97 178.51 2nyx h ALA 142 N 1.11 0.50 -0.71 2.80 0.00 -1.62 -1.92 119.26 119.41 2nyx h ALA 142 Ca 0.27 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 2nyx h ALA 142 Cb 0.57 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 2nyx h ALA 142 CO -0.82 0.17 0.23 -0.07 0.00 0.00 0.00 179.25 178.75 2nyx h LEU 143 N 0.46 1.04 -0.80 0.00 3.38 -0.78 -2.27 115.31 116.35 2nyx h LEU 143 Ca 0.12 -0.21 -0.08 0.00 0.09 0.00 0.00 57.88 57.80 2nyx h LEU 143 Cb 0.30 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2nyx h LEU 143 CO 0.00 0.97 0.04 0.74 0.09 0.00 0.00 178.44 180.28 2nyx h THR 144 N 1.05 1.25 -0.49 0.22 2.02 -0.73 -2.03 112.91 114.21 2nyx h THR 144 Ca 0.23 -1.04 -0.06 0.00 0.77 0.00 0.00 66.41 66.31 2nyx h THR 144 Cb 0.30 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.46 2nyx h THR 144 CO -0.01 0.38 0.05 0.00 0.37 0.00 0.00 175.52 176.31 2nyx h ALA 145 N 1.15 1.16 -0.21 6.16 0.00 -1.20 -0.53 119.26 125.81 2nyx h ALA 145 Ca 0.17 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2nyx h ALA 145 Cb 0.46 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2nyx h ALA 145 CO 0.02 0.55 0.10 0.35 0.00 0.00 0.00 179.25 180.27 2nyx h PHE 146 N 0.75 0.29 -0.03 0.00 3.57 -1.01 -1.82 116.94 118.68 2nyx h PHE 146 Ca 0.15 -0.01 -0.21 0.00 3.53 0.00 0.00 57.97 61.43 2nyx h PHE 146 Cb 0.39 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.03 2nyx h PHE 146 CO 0.02 0.30 -0.87 1.79 -2.23 0.00 0.00 178.31 177.32 2nyx h THR 147 N 0.21 1.39 -0.04 4.41 1.35 -1.18 -1.08 112.91 117.95 2nyx h THR 147 Ca 0.07 -2.33 -0.00 0.00 -0.55 0.00 0.00 66.41 63.60 2nyx h THR 147 Cb 0.11 2.30 -0.00 0.00 -1.73 0.00 0.00 68.15 68.83 2nyx h THR 147 CO -0.01 0.70 0.02 -0.33 -0.25 0.00 0.00 175.52 175.65 2nyx h GLU 148 N 0.26 0.06 -0.86 4.72 3.07 -1.14 0.12 114.58 120.81 2nyx h GLU 148 Ca -0.06 -0.01 0.09 0.00 -0.50 0.00 0.00 59.36 58.88 2nyx h GLU 148 Cb 1.49 -0.01 -0.06 0.00 -0.84 0.00 0.00 28.75 29.32 2nyx h GLU 148 CO 0.15 0.11 0.56 0.00 -1.40 0.00 0.00 179.01 178.43 2nyx h ALA 149 N 0.94 1.64 -0.00 3.43 0.00 -1.30 -2.09 119.26 121.88 2nyx h ALA 149 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2nyx h ALA 149 Cb 0.07 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.65 2nyx h ALA 149 CO -0.00 0.20 -0.12 0.41 0.00 0.00 0.00 179.25 179.74 2nyx n GLY 150 N -1.42 -1.28 2.27 0.00 0.00 -0.42 -4.94 105.19 99.42 2nyx n GLY 150 Ca 0.14 -0.19 -0.07 0.00 0.00 0.00 0.00 46.02 45.90 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 1.41 0.89 3.68 -0.02 0.00 0.25 -5.00 105.19 106.39 2nyx n GLY 151 Ca 0.10 -0.53 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 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 -2.35 4.35 0.60 1.61 2.56 -0.13 -5.00 118.70 120.34 2nyx s GLU 152 Ca 0.00 1.18 -0.18 0.00 0.00 0.00 0.00 54.97 55.97 2nyx s GLU 152 Cb 0.00 -3.56 -0.03 0.00 2.00 0.00 0.00 34.13 32.54 2nyx s GLU 152 CO 0.00 -0.33 1.14 -2.14 -0.56 0.00 0.00 175.26 173.38 2nyx s PRO 153 N 2.11 3.03 0.36 4.30 0.02 -1.26 -4.65 135.00 138.91 2nyx s PRO 153 Ca 0.43 1.59 -0.28 0.00 0.02 0.00 0.00 61.00 62.76 2nyx s PRO 153 Cb -0.17 -1.96 -0.12 0.00 0.02 0.00 0.00 34.50 32.27 2nyx s PRO 153 CO 0.14 -1.10 1.36 -3.47 -0.33 0.00 0.00 177.00 173.60 2nyx n ASP 154 N -1.79 3.10 -0.17 2.53 4.64 -1.26 -4.94 116.55 118.65 2nyx n ASP 154 Ca 0.12 1.21 -0.05 0.00 -1.38 0.00 0.00 54.79 54.69 2nyx n ASP 154 Cb 0.51 -1.53 0.05 0.00 -1.04 0.00 0.00 41.12 39.11 2nyx n ASP 154 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2nyx h ALA 155 N 2.65 0.67 -0.01 -1.67 0.00 -2.06 -3.53 119.26 115.31 2nyx h ALA 155 Ca -0.48 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2nyx h ALA 155 Cb 1.27 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2nyx h ALA 155 CO 0.63 -0.04 0.00 0.54 0.00 0.00 0.00 179.25 180.38