#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wdv s ARG 9 N 0.00 4.07 0.34 3.69 0.52 -1.26 -5.06 118.95 121.25 2wdv s ARG 9 Ca 0.00 1.58 -0.07 0.00 -0.52 0.00 0.00 55.73 56.72 2wdv s ARG 9 Cb 0.00 -2.52 -0.06 0.00 0.52 0.00 0.00 34.95 32.89 2wdv s ARG 9 CO 0.00 -0.24 0.64 -1.25 0.02 0.00 0.00 175.30 174.48 2wdv s PRO 10 N -2.53 3.69 0.08 3.54 0.04 -1.26 -5.11 135.00 133.45 2wdv s PRO 10 Ca 0.59 0.19 0.04 0.00 0.04 0.00 0.00 61.00 61.85 2wdv s PRO 10 Cb -0.24 -2.54 -0.03 0.00 0.04 0.00 0.00 34.50 31.73 2wdv s PRO 10 CO 0.30 0.11 -0.11 0.14 0.04 0.00 0.00 177.00 177.47 2wdv s VAL 11 N -2.21 0.92 -0.54 -0.36 -7.23 -1.26 -5.11 120.40 104.61 2wdv s VAL 11 Ca 0.47 -1.42 -0.22 0.00 -1.81 0.00 0.00 61.98 59.00 2wdv s VAL 11 Cb -0.11 -1.12 0.05 0.00 0.56 0.00 0.00 36.38 35.77 2wdv s VAL 11 CO 0.31 -0.41 0.82 0.21 -0.31 0.00 0.00 175.10 175.71 2wdv s ASN 12 N -2.05 6.28 -0.01 4.85 2.47 -1.26 -4.78 114.94 120.45 2wdv s ASN 12 Ca -0.00 -0.62 0.23 0.00 0.42 0.00 0.00 52.86 52.89 2wdv s ASN 12 Cb -0.07 -2.38 0.39 0.00 -1.45 0.00 0.00 41.25 37.75 2wdv s ASN 12 CO 0.01 -1.11 1.16 -0.11 -3.72 0.00 0.00 177.10 173.33 2wdv n LEU 13 N 6.96 0.96 -4.56 3.21 7.94 -1.26 -5.03 117.00 125.23 2wdv n LEU 13 Ca -0.02 -1.96 -0.28 0.00 -1.11 0.00 0.00 56.01 52.63 2wdv n LEU 13 Cb 0.46 -0.01 -0.05 0.00 0.53 0.00 0.00 43.42 44.35 2wdv n LEU 13 CO 0.60 0.50 1.40 -0.62 -1.11 0.00 0.00 177.39 178.16 2wdv s ASP 14 N -1.95 5.11 0.61 1.96 -1.08 -1.26 -4.83 116.67 115.22 2wdv s ASP 14 Ca 0.31 -0.43 0.28 0.00 -0.52 0.00 0.00 52.55 52.20 2wdv s ASP 14 Cb 0.36 -2.55 1.48 0.00 -1.46 0.00 0.00 42.92 40.75 2wdv s ASP 14 CO -0.15 -2.72 1.88 -0.07 0.52 0.00 0.00 175.17 174.63 2wdv h LEU 15 N 17.81 0.00 -1.21 -1.34 3.38 -1.96 0.18 115.31 132.17 2wdv h LEU 15 Ca 0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2wdv h LEU 15 Cb 1.04 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.79 2wdv h LEU 15 CO 1.20 0.00 -0.07 1.56 0.09 0.00 0.00 178.44 181.22 2wdv h GLN 16 N 0.00 0.00 -0.64 1.13 4.20 -2.05 -3.19 115.11 114.57 2wdv h GLN 16 Ca 0.17 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.88 2wdv h GLN 16 Cb 1.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.87 2wdv h GLN 16 CO -0.00 0.07 0.00 0.25 -0.67 0.00 0.00 178.83 178.48 2wdv n THR 17 N -3.18 2.04 -4.68 -0.54 -2.24 0.62 -4.94 114.28 101.37 2wdv n THR 17 Ca 0.01 -1.16 -0.25 0.00 -2.27 0.00 0.00 64.05 60.38 2wdv n THR 17 Cb 0.37 -0.07 -0.16 0.00 -2.10 0.00 0.00 70.33 68.36 2wdv n THR 17 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2wdv s ILE 18 N -2.15 1.23 0.17 2.28 1.01 -1.21 -5.08 121.20 117.45 2wdv s ILE 18 Ca 0.48 -0.58 -0.30 0.00 0.00 0.00 0.00 60.65 60.26 2wdv s ILE 18 Cb 0.34 -1.08 -0.08 0.00 0.01 0.00 0.00 42.46 41.65 2wdv s ILE 18 CO 0.19 0.37 1.17 -0.13 0.00 0.00 0.00 174.94 176.54 2wdv s ARG 19 N 0.29 4.51 -0.20 2.79 1.81 -1.26 -5.03 118.95 121.87 2wdv s ARG 19 Ca -0.08 1.83 0.00 0.00 -1.72 0.00 0.00 55.73 55.76 2wdv s ARG 19 Cb -0.13 -3.26 0.02 0.00 -0.45 0.00 0.00 34.95 31.13 2wdv s ARG 19 CO 0.03 -0.06 -0.16 -0.06 -0.68 0.00 0.00 175.30 174.37 2wdv s PHE 20 N -0.01 2.86 1.17 -0.53 0.08 -1.26 -5.12 117.98 115.17 2wdv s PHE 20 Ca 0.52 -1.58 -0.18 0.00 0.12 0.00 0.00 56.93 55.81 2wdv s PHE 20 Cb -0.32 -1.96 0.27 0.00 -0.57 0.00 0.00 43.02 40.45 2wdv s PHE 20 CO 0.36 -0.77 1.11 -1.25 -0.10 0.00 0.00 175.22 174.57 2wdv s PRO 21 N 1.31 -1.00 0.21 0.24 0.04 -1.26 -4.81 135.00 129.73 2wdv s PRO 21 Ca 0.04 0.00 -0.05 0.00 0.04 0.00 0.00 61.00 61.03 2wdv s PRO 21 Cb -0.14 -1.62 0.17 0.00 0.04 0.00 0.00 34.50 32.95 2wdv s PRO 21 CO -0.10 -3.58 1.61 0.97 0.04 0.00 0.00 177.00 175.94 2wdv h ILE 22 N -2.49 1.27 -0.72 0.56 2.10 -1.99 -2.51 117.51 113.73 2wdv h ILE 22 Ca -0.46 -1.39 -0.01 0.00 1.08 0.00 0.00 64.86 64.08 2wdv h ILE 22 Cb 1.30 1.27 -0.04 0.00 -1.09 0.00 0.00 36.82 38.26 2wdv h ILE 22 CO 0.37 0.46 0.42 0.71 -1.08 0.00 0.00 178.15 179.04 2wdv h THR 23 N 0.66 1.21 0.11 2.19 1.35 -1.92 0.40 112.91 116.91 2wdv h THR 23 Ca 0.08 -0.48 -0.01 0.00 -0.55 0.00 0.00 66.41 65.46 2wdv h THR 23 Cb 0.78 0.20 0.00 0.00 -1.73 0.00 0.00 68.15 67.40 2wdv h THR 23 CO 0.06 0.22 -0.05 0.00 -0.25 0.00 0.00 175.52 175.50 2wdv h ALA 24 N 1.47 -0.15 -0.49 6.62 0.00 -1.87 -2.73 119.26 122.09 2wdv h ALA 24 Ca 0.26 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.09 2wdv h ALA 24 Cb -0.02 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 2wdv h ALA 24 CO -0.05 -0.46 0.21 0.82 0.00 0.00 0.00 179.25 179.77 2wdv h ILE 25 N -0.40 0.90 -0.85 0.00 1.08 -0.96 -1.15 117.51 116.13 2wdv h ILE 25 Ca -0.02 -0.14 0.19 0.00 -0.39 0.00 0.00 64.86 64.50 2wdv h ILE 25 Cb 0.32 0.44 -0.12 0.00 -3.07 0.00 0.00 36.82 34.40 2wdv h ILE 25 CO 0.03 0.08 0.35 0.00 -0.69 0.00 0.00 178.15 177.92 2wdv h ALA 26 N 1.30 1.30 -0.04 1.87 0.00 -0.18 -1.58 119.26 121.93 2wdv h ALA 26 Ca 0.23 0.15 -0.11 0.00 0.00 0.00 0.00 54.91 55.18 2wdv h ALA 26 Cb 0.19 0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.12 2wdv h ALA 26 CO -0.20 -0.29 -0.40 1.03 0.00 0.00 0.00 179.25 179.40 2wdv h SER 27 N 0.42 0.42 -0.60 0.00 0.87 -0.92 -1.61 113.55 112.12 2wdv h SER 27 Ca 0.51 -0.70 -0.00 0.00 -1.23 0.00 0.00 61.79 60.36 2wdv h SER 27 Cb 0.90 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 62.71 2wdv h SER 27 CO -0.49 1.06 0.37 -0.29 -0.53 0.00 0.00 176.83 176.94 2wdv h ILE 28 N -0.19 1.17 -0.61 2.23 6.09 -1.07 -0.36 117.51 124.77 2wdv h ILE 28 Ca -0.04 -0.38 -0.04 0.00 -1.37 0.00 0.00 64.86 63.03 2wdv h ILE 28 Cb 1.08 0.31 -0.03 0.00 0.47 0.00 0.00 36.82 38.66 2wdv h ILE 28 CO 0.08 0.18 0.21 -0.07 -3.07 0.00 0.00 178.15 175.48 2wdv h LEU 29 N 0.84 0.87 -0.82 2.19 3.38 -1.27 -1.44 115.31 119.07 2wdv h LEU 29 Ca 0.22 -0.19 0.03 0.00 0.09 0.00 0.00 57.88 58.03 2wdv h LEU 29 Cb -0.03 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.44 2wdv h LEU 29 CO -0.04 0.83 0.52 -0.74 0.09 0.00 0.00 178.44 179.10 2wdv h HIS 30 N 0.86 0.98 -0.09 1.13 2.76 -0.10 0.36 115.15 121.05 2wdv h HIS 30 Ca 0.20 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.39 2wdv h HIS 30 Cb 0.26 -0.32 -0.00 0.00 1.55 0.00 0.00 27.41 28.89 2wdv h HIS 30 CO 0.02 0.56 0.04 -0.09 -1.30 0.00 0.00 177.93 177.16 2wdv h ARG 31 N 1.02 0.13 -0.34 5.26 2.43 -1.02 -2.49 114.38 119.37 2wdv h ARG 31 Ca 0.33 -0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.52 2wdv h ARG 31 Cb 0.01 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.50 2wdv h ARG 31 CO -0.11 0.23 0.11 0.28 -1.51 0.00 0.00 179.97 178.97 2wdv h VAL 32 N 0.01 0.89 0.00 0.20 2.07 -0.62 -2.20 116.25 116.59 2wdv h VAL 32 Ca 0.03 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 2wdv h VAL 32 Cb 0.14 0.62 -0.00 0.00 -1.52 0.00 0.00 31.29 30.53 2wdv h VAL 32 CO -0.00 0.05 -0.07 0.77 0.02 0.00 0.00 177.57 178.34 2wdv h SER 33 N 0.25 0.00 -0.08 0.57 4.64 -0.23 -1.52 113.55 117.18 2wdv h SER 33 Ca 0.16 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.42 2wdv h SER 33 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 2wdv h SER 33 CO -0.17 0.07 -0.17 1.23 -0.87 0.00 0.00 176.83 176.92 2wdv h GLY 34 N 0.24 0.29 1.00 -0.77 0.00 -0.94 -1.65 103.07 101.25 2wdv h GLY 34 Ca -0.00 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 46.99 2wdv h GLY 34 CO 0.01 0.31 0.22 -2.08 0.00 0.00 0.00 176.54 174.99 2wdv h VAL 35 N -0.20 1.08 -0.02 4.60 2.07 -1.06 -0.39 116.25 122.33 2wdv h VAL 35 Ca 0.00 -0.15 0.03 0.00 0.82 0.00 0.00 66.70 67.40 2wdv h VAL 35 Cb 0.75 0.60 -0.05 0.00 -1.52 0.00 0.00 31.29 31.08 2wdv h VAL 35 CO 0.04 0.08 -0.26 0.40 0.02 0.00 0.00 177.57 177.85 2wdv h ILE 36 N 0.44 0.42 -0.25 4.57 2.04 -1.34 -2.08 117.51 121.31 2wdv h ILE 36 Ca 0.12 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.03 2wdv h ILE 36 Cb -0.05 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 36.44 2wdv h ILE 36 CO -0.03 0.00 0.17 0.74 0.00 0.00 0.00 178.15 179.03 2wdv h THR 37 N -0.39 0.95 -0.10 -0.27 2.02 -0.68 0.13 112.91 114.57 2wdv h THR 37 Ca 0.07 -0.05 -0.00 0.00 0.77 0.00 0.00 66.41 67.20 2wdv h THR 37 Cb 0.48 0.80 -0.00 0.00 -1.74 0.00 0.00 68.15 67.68 2wdv h THR 37 CO -0.24 0.03 0.06 0.15 0.37 0.00 0.00 175.52 175.89 2wdv h PHE 38 N 0.14 0.14 -0.13 3.16 3.57 -0.39 -1.79 116.94 121.64 2wdv h PHE 38 Ca 0.11 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.55 2wdv h PHE 38 Cb 0.27 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 38.95 2wdv h PHE 38 CO -0.00 0.13 -0.20 0.28 -2.23 0.00 0.00 178.31 176.29 2wdv h VAL 39 N 0.10 1.21 -0.63 1.41 2.07 -0.86 -3.10 116.25 116.44 2wdv h VAL 39 Ca 0.04 -0.94 -0.06 0.00 0.82 0.00 0.00 66.70 66.55 2wdv h VAL 39 Cb 0.04 1.33 -0.03 0.00 -1.52 0.00 0.00 31.29 31.11 2wdv h VAL 39 CO -0.01 0.29 0.16 0.00 0.02 0.00 0.00 177.57 178.03 2wdv h ALA 40 N 1.60 1.09 -0.86 1.67 0.00 -0.23 -2.89 119.26 119.64 2wdv h ALA 40 Ca 0.04 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 2wdv h ALA 40 Cb 0.47 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 2wdv h ALA 40 CO 0.03 0.61 0.46 0.28 0.00 0.00 0.00 179.25 180.64 2wdv h VAL 41 N 0.95 1.25 -0.08 0.00 2.07 -1.26 0.51 116.25 119.68 2wdv h VAL 41 Ca 0.20 -0.64 -0.00 0.00 0.82 0.00 0.00 66.70 67.08 2wdv h VAL 41 Cb 0.33 0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 30.19 2wdv h VAL 41 CO -0.00 0.29 0.05 1.23 0.02 0.00 0.00 177.57 179.15 2wdv h GLY 42 N 1.21 0.12 0.99 2.17 0.00 -1.64 0.36 103.07 106.29 2wdv h GLY 42 Ca 0.30 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.58 2wdv h GLY 42 CO -0.05 0.05 0.04 -2.22 0.00 0.00 0.00 176.54 174.37 2wdv h ILE 43 N 0.05 1.01 -0.97 2.60 2.04 -1.23 -1.93 117.51 119.08 2wdv h ILE 43 Ca 0.03 -0.03 0.06 0.00 1.00 0.00 0.00 64.86 65.92 2wdv h ILE 43 Cb 0.07 0.91 -0.06 0.00 -0.74 0.00 0.00 36.82 37.00 2wdv h ILE 43 CO -0.00 0.02 0.63 -0.07 0.00 0.00 0.00 178.15 178.72 2wdv h LEU 44 N 0.09 1.01 -0.10 1.44 3.38 0.12 -2.74 115.31 118.51 2wdv h LEU 44 Ca 0.03 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2wdv h LEU 44 Cb -0.01 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.53 2wdv h LEU 44 CO -0.01 0.65 0.03 -0.07 0.09 0.00 0.00 178.44 179.13 2wdv h LEU 45 N 1.15 0.15 -0.93 1.67 3.38 0.08 -1.21 115.31 119.60 2wdv h LEU 45 Ca 0.41 -0.21 0.12 0.00 0.09 0.00 0.00 57.88 58.29 2wdv h LEU 45 Cb 0.13 -0.04 -0.08 0.00 0.09 0.00 0.00 40.66 40.76 2wdv h LEU 45 CO -0.16 0.32 0.56 -0.25 0.09 0.00 0.00 178.44 179.00 2wdv h TRP 46 N -0.03 1.02 -0.07 1.13 7.01 -1.26 0.16 115.95 123.90 2wdv h TRP 46 Ca 0.03 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.06 2wdv h TRP 46 Cb 0.23 -0.31 -0.00 0.00 -2.10 0.00 0.00 29.16 26.97 2wdv h TRP 46 CO 0.00 0.38 0.02 1.25 -2.79 0.00 0.00 178.44 177.31 2wdv h LEU 47 N 0.88 0.10 -0.80 0.65 5.85 -1.30 -2.04 115.31 118.66 2wdv h LEU 47 Ca 0.47 -0.19 0.05 0.00 0.84 0.00 0.00 57.88 59.05 2wdv h LEU 47 Cb 0.49 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.44 2wdv h LEU 47 CO -0.28 0.27 0.50 0.25 -0.34 0.00 0.00 178.44 178.84 2wdv h LEU 48 N -0.07 0.79 -0.96 2.25 5.85 -0.43 -1.86 115.31 120.88 2wdv h LEU 48 Ca 0.02 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.70 2wdv h LEU 48 Cb 0.20 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 2wdv h LEU 48 CO -0.00 0.52 0.17 1.23 -0.34 0.00 0.00 178.44 180.02 2wdv h GLY 49 N 0.93 0.99 0.90 3.75 0.00 -0.58 -2.32 103.07 106.75 2wdv h GLY 49 Ca 0.34 -0.57 -0.01 0.00 0.00 0.00 0.00 47.33 47.09 2wdv h GLY 49 CO -0.15 0.53 0.09 -0.84 0.00 0.00 0.00 176.54 176.18 2wdv h THR 50 N 0.89 1.16 0.00 4.70 2.02 -1.00 -3.00 112.91 117.69 2wdv h THR 50 Ca 0.20 -0.49 0.00 0.00 0.77 0.00 0.00 66.41 66.88 2wdv h THR 50 Cb 0.28 1.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.76 2wdv h THR 50 CO -0.01 0.16 0.00 -1.54 0.37 0.00 0.00 175.52 174.51 2wdv n SER 51 N -4.81 0.00 0.00 4.18 3.41 -0.73 -3.02 113.62 112.65 2wdv n SER 51 Ca -0.03 -1.39 0.00 0.00 -0.26 0.00 0.00 58.87 57.19 2wdv n SER 51 Cb 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 2wdv n SER 51 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2wdv n LEU 52 N -0.71 0.00 0.18 1.04 4.77 -1.12 -4.41 117.00 116.75 2wdv n LEU 52 Ca 0.09 -0.24 0.05 0.00 -0.03 0.00 0.00 56.01 55.88 2wdv n LEU 52 Cb 0.04 0.00 0.29 0.00 -2.33 0.00 0.00 43.42 41.42 2wdv n LEU 52 CO 0.06 0.00 0.65 0.77 -1.33 0.00 0.00 177.39 177.54 2wdv h SER 53 N 0.00 0.00 -5.32 -1.43 4.64 -1.43 -3.47 113.55 106.53 2wdv h SER 53 Ca 0.00 0.00 0.17 0.00 -0.47 0.00 0.00 61.79 61.49 2wdv h SER 53 Cb 0.00 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.01 2wdv h SER 53 CO 0.00 0.39 0.48 -0.94 -0.87 0.00 0.00 176.83 175.90 2wdv s SER 54 N -6.43 -0.16 0.40 4.97 1.04 -1.26 -4.97 113.70 107.28 2wdv s SER 54 Ca 0.01 -0.44 0.08 0.00 0.48 0.00 0.00 55.95 56.08 2wdv s SER 54 Cb 0.10 0.50 0.81 0.00 0.10 0.00 0.00 66.02 67.53 2wdv s SER 54 CO 0.69 -0.93 1.98 -0.65 0.98 0.00 0.00 173.24 175.31 2wdv h PRO 55 N 2.00 0.39 0.02 4.02 0.11 -1.94 -2.68 132.00 133.92 2wdv h PRO 55 Ca -0.24 -0.06 -0.26 0.00 0.11 0.00 0.00 66.00 65.55 2wdv h PRO 55 Cb 1.23 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.23 2wdv h PRO 55 CO 0.26 0.38 -1.41 1.49 -0.21 0.00 0.00 178.00 178.51 2wdv h GLU 56 N 0.39 0.03 -0.29 1.05 4.81 -1.95 -2.71 114.58 115.91 2wdv h GLU 56 Ca 0.09 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.26 2wdv h GLU 56 Cb 0.18 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 2wdv h GLU 56 CO -0.00 0.78 0.17 0.78 -0.73 0.00 0.00 179.01 180.01 2wdv h GLY 57 N 3.04 0.43 0.48 1.92 0.00 -1.77 -2.30 103.07 104.88 2wdv h GLY 57 Ca -0.17 -0.19 0.06 0.00 0.00 0.00 0.00 47.33 47.03 2wdv h GLY 57 CO 0.11 0.18 0.06 -2.75 0.00 0.00 0.00 176.54 174.14 2wdv h PHE 58 N 0.36 0.10 -0.92 5.60 3.57 -1.46 0.16 116.94 124.35 2wdv h PHE 58 Ca 0.10 0.03 0.15 0.00 3.53 0.00 0.00 57.97 61.77 2wdv h PHE 58 Cb 0.04 0.02 -0.09 0.00 2.79 0.00 0.00 35.95 38.70 2wdv h PHE 58 CO -0.04 -0.01 0.53 0.93 -2.23 0.00 0.00 178.31 177.50 2wdv h GLU 59 N 0.19 0.74 -0.16 1.11 5.08 -1.37 0.18 114.58 120.35 2wdv h GLU 59 Ca 0.19 -0.04 -0.18 0.00 -1.00 0.00 0.00 59.36 58.33 2wdv h GLU 59 Cb 0.24 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.32 2wdv h GLU 59 CO -0.27 0.49 -0.63 0.37 -1.00 0.00 0.00 179.01 177.98 2wdv h GLN 60 N 0.77 0.57 -0.81 2.33 4.15 -0.63 -1.62 115.11 119.86 2wdv h GLN 60 Ca 0.50 -0.40 -0.03 0.00 0.77 0.00 0.00 58.65 59.48 2wdv h GLN 60 Cb 0.65 0.06 -0.04 0.00 0.21 0.00 0.00 27.48 28.36 2wdv h GLN 60 CO -0.33 1.02 0.37 0.00 -1.93 0.00 0.00 178.83 177.95 2wdv h ALA 61 N 0.89 1.12 -0.87 3.38 0.00 0.41 0.12 119.26 124.31 2wdv h ALA 61 Ca -0.01 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 2wdv h ALA 61 Cb 1.19 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.62 2wdv h ALA 61 CO 0.12 0.65 0.48 0.77 0.00 0.00 0.00 179.25 181.27 2wdv h SER 62 N 1.16 1.09 -0.46 0.00 0.02 -0.41 -1.58 113.55 113.39 2wdv h SER 62 Ca 0.28 -0.10 -0.11 0.00 -0.84 0.00 0.00 61.79 61.02 2wdv h SER 62 Cb 0.14 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 2wdv h SER 62 CO -0.03 0.88 -0.13 0.00 -1.14 0.00 0.00 176.83 176.41 2wdv h ALA 63 N 1.30 0.63 -0.59 3.77 0.00 -0.68 -2.82 119.26 120.87 2wdv h ALA 63 Ca 0.31 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2wdv h ALA 63 Cb 0.03 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2wdv h ALA 63 CO -0.05 0.54 0.35 0.82 0.00 0.00 0.00 179.25 180.92 2wdv h ILE 64 N 0.73 1.17 0.00 0.00 2.04 -0.28 -0.97 117.51 120.20 2wdv h ILE 64 Ca 0.11 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.59 2wdv h ILE 64 Cb 0.68 0.34 -0.00 0.00 -0.74 0.00 0.00 36.82 37.10 2wdv h ILE 64 CO 0.05 0.18 -0.03 0.24 0.00 0.00 0.00 178.15 178.58 2wdv h MET 65 N 0.82 0.00 -0.26 2.37 2.86 -1.15 -3.23 114.93 116.34 2wdv h MET 65 Ca 0.21 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.70 2wdv h MET 65 Cb -0.03 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.63 2wdv h MET 65 CO -0.04 0.03 -0.45 0.78 1.06 0.00 0.00 176.91 178.29 2wdv h GLY 66 N 1.79 0.72 -5.55 8.32 0.00 -0.92 -3.41 103.07 104.02 2wdv h GLY 66 Ca -0.00 -0.76 -0.66 0.00 0.00 0.00 0.00 47.33 45.91 2wdv h GLY 66 CO 0.00 0.69 0.71 -1.26 0.00 0.00 0.00 176.54 176.68 2wdv n SER 67 N -4.01 2.36 -0.13 0.19 2.88 -1.22 -4.90 113.62 108.79 2wdv n SER 67 Ca -0.02 1.08 -0.05 0.00 -1.33 0.00 0.00 58.87 58.55 2wdv n SER 67 Cb 0.55 -1.26 0.03 0.00 -0.75 0.00 0.00 64.21 62.79 2wdv n SER 67 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 2wdv h PHE 68 N 5.99 0.29 -0.94 0.66 3.57 -1.92 -1.42 116.94 123.18 2wdv h PHE 68 Ca -0.47 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.13 2wdv h PHE 68 Cb 1.30 -0.07 -0.07 0.00 2.79 0.00 0.00 35.95 39.90 2wdv h PHE 68 CO 0.67 0.12 0.59 0.35 -2.23 0.00 0.00 178.31 177.81 2wdv h PHE 69 N 0.34 1.08 -0.41 0.41 3.57 -1.97 -1.21 116.94 118.75 2wdv h PHE 69 Ca 0.19 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.61 2wdv h PHE 69 Cb 0.16 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 38.54 2wdv h PHE 69 CO -0.14 0.50 -0.16 0.28 -2.23 0.00 0.00 178.31 176.56 2wdv h VAL 70 N 1.02 1.28 -0.80 1.41 2.07 -1.78 -2.62 116.25 116.83 2wdv h VAL 70 Ca 0.43 -1.29 0.05 0.00 0.82 0.00 0.00 66.70 66.70 2wdv h VAL 70 Cb 0.28 1.24 -0.05 0.00 -1.52 0.00 0.00 31.29 31.24 2wdv h VAL 70 CO -0.21 0.44 0.53 0.11 0.02 0.00 0.00 177.57 178.45 2wdv h LYS 71 N 0.66 0.91 0.24 1.57 1.57 -0.36 0.21 116.57 121.37 2wdv h LYS 71 Ca 0.10 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 2wdv h LYS 71 Cb 0.72 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.82 2wdv h LYS 71 CO 0.05 0.60 -0.12 0.35 -0.57 0.00 0.00 179.45 179.77 2wdv h PHE 72 N 0.94 -0.30 -0.59 -1.35 3.57 -1.23 -1.54 116.94 116.43 2wdv h PHE 72 Ca 0.33 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.91 2wdv h PHE 72 Cb 0.12 0.10 -0.07 0.00 2.79 0.00 0.00 35.95 38.90 2wdv h PHE 72 CO -0.00 0.06 0.23 0.82 -2.23 0.00 0.00 178.31 177.19 2wdv h ILE 73 N -0.75 0.81 -0.87 1.41 2.04 -1.19 -1.06 117.51 117.90 2wdv h ILE 73 Ca -0.03 -0.15 0.04 0.00 1.00 0.00 0.00 64.86 65.72 2wdv h ILE 73 Cb 0.50 0.34 -0.05 0.00 -0.74 0.00 0.00 36.82 36.87 2wdv h ILE 73 CO 0.05 0.08 0.56 -0.03 0.00 0.00 0.00 178.15 178.81 2wdv h MET 74 N 0.43 1.04 -0.41 2.37 4.05 -0.60 -0.67 114.93 121.14 2wdv h MET 74 Ca 0.29 -0.06 -0.06 0.00 -0.28 0.00 0.00 59.70 59.59 2wdv h MET 74 Cb 0.33 -0.24 -0.02 0.00 -0.80 0.00 0.00 31.60 30.88 2wdv h MET 74 CO -0.28 0.69 0.04 2.35 0.23 0.00 0.00 176.91 179.94 2wdv h TRP 75 N 1.08 0.75 0.08 1.39 7.01 -0.34 -1.14 115.95 124.78 2wdv h TRP 75 Ca 0.35 -0.12 -0.00 0.00 2.11 0.00 0.00 58.89 61.23 2wdv h TRP 75 Cb 0.02 -0.20 0.00 0.00 -2.10 0.00 0.00 29.16 26.88 2wdv h TRP 75 CO -0.02 0.75 -0.04 0.78 -2.79 0.00 0.00 178.44 177.12 2wdv h GLY 76 N 0.54 -0.12 -0.30 2.65 0.00 -0.89 0.46 103.07 105.41 2wdv h GLY 76 Ca 0.12 0.04 0.12 0.00 0.00 0.00 0.00 47.33 47.61 2wdv h GLY 76 CO 0.01 -0.04 -0.22 -2.22 0.00 0.00 0.00 176.54 174.07 2wdv h ILE 77 N -0.17 0.30 0.00 2.60 2.04 -1.08 0.21 117.51 121.41 2wdv h ILE 77 Ca -0.01 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.80 2wdv h ILE 77 Cb 0.14 0.30 -0.01 0.00 -0.74 0.00 0.00 36.82 36.50 2wdv h ILE 77 CO 0.02 0.00 -0.25 -0.07 0.00 0.00 0.00 178.15 177.85 2wdv h LEU 78 N -0.07 0.00 -0.07 1.44 3.38 -0.61 -1.31 115.31 118.07 2wdv h LEU 78 Ca 0.27 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 58.09 2wdv h LEU 78 Cb 0.50 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.26 2wdv h LEU 78 CO -0.65 0.25 -0.57 0.74 0.09 0.00 0.00 178.44 178.30 2wdv h THR 79 N 0.00 1.37 -0.22 0.22 2.02 0.18 -1.48 112.91 115.00 2wdv h THR 79 Ca -0.00 -1.92 0.04 0.00 0.77 0.00 0.00 66.41 65.29 2wdv h THR 79 Cb 0.58 2.31 -0.04 0.00 -1.74 0.00 0.00 68.15 69.26 2wdv h THR 79 CO 0.03 0.57 -0.02 0.00 0.37 0.00 0.00 175.52 176.48 2wdv h ALA 80 N 0.43 0.18 -0.23 6.16 0.00 -0.48 0.58 119.26 125.89 2wdv h ALA 80 Ca -0.05 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2wdv h ALA 80 Cb 1.23 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 2wdv h ALA 80 CO 0.12 -0.44 0.15 1.25 0.00 0.00 0.00 179.25 180.32 2wdv h LEU 81 N 0.05 0.27 -0.41 0.00 5.85 -1.26 0.11 115.31 119.93 2wdv h LEU 81 Ca 0.10 -0.03 0.07 0.00 0.84 0.00 0.00 57.88 58.86 2wdv h LEU 81 Cb 0.14 -0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.04 2wdv h LEU 81 CO -0.19 0.22 0.05 0.00 -0.34 0.00 0.00 178.44 178.19 2wdv h ALA 82 N 1.06 0.42 0.13 1.25 0.00 -1.06 -0.06 119.26 121.00 2wdv h ALA 82 Ca 0.08 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 2wdv h ALA 82 Cb -0.01 0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2wdv h ALA 82 CO -0.02 -0.35 -0.06 -0.92 0.00 0.00 0.00 179.25 177.90 2wdv h TYR 83 N 0.17 -0.16 -0.32 0.00 3.20 -0.43 -1.27 116.97 118.16 2wdv h TYR 83 Ca 0.20 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.14 2wdv h TYR 83 Cb 0.26 0.05 -0.08 0.00 1.54 0.00 0.00 36.73 38.51 2wdv h TYR 83 CO -0.23 -0.01 -0.22 1.25 -1.64 0.00 0.00 178.16 177.32 2wdv h HIS 84 N -0.27 -0.57 0.00 -3.82 2.76 -0.58 -1.31 115.15 111.36 2wdv h HIS 84 Ca -0.02 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.20 2wdv h HIS 84 Cb 0.22 0.30 -0.00 0.00 1.55 0.00 0.00 27.41 29.48 2wdv h HIS 84 CO -0.04 -0.30 -0.01 0.28 -1.30 0.00 0.00 177.93 176.57 2wdv h VAL 85 N -0.19 0.98 0.71 5.26 2.07 -0.84 0.10 116.25 124.34 2wdv h VAL 85 Ca 0.16 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.65 2wdv h VAL 85 Cb 0.44 0.98 0.01 0.00 -1.52 0.00 0.00 31.29 31.19 2wdv h VAL 85 CO -0.43 0.00 -0.34 0.58 0.02 0.00 0.00 177.57 177.40 2wdv h VAL 86 N -0.02 0.29 0.00 2.57 2.07 -0.99 -1.54 116.25 118.63 2wdv h VAL 86 Ca 0.00 -0.04 -0.02 0.00 0.82 0.00 0.00 66.70 67.46 2wdv h VAL 86 Cb 0.02 0.31 -0.00 0.00 -1.52 0.00 0.00 31.29 30.09 2wdv h VAL 86 CO -0.01 0.01 -0.11 0.58 0.02 0.00 0.00 177.57 178.06 2wdv h VAL 87 N -0.98 0.88 -0.47 2.57 2.07 -1.20 -0.45 116.25 118.67 2wdv h VAL 87 Ca -0.10 -0.39 -0.10 0.00 0.82 0.00 0.00 66.70 66.94 2wdv h VAL 87 Cb 0.74 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 2wdv h VAL 87 CO 0.16 0.10 -0.10 1.23 0.02 0.00 0.00 177.57 178.98 2wdv h GLY 88 N 0.42 0.92 1.55 2.17 0.00 -0.55 -0.66 103.07 106.92 2wdv h GLY 88 Ca -0.00 -0.71 -0.12 0.00 0.00 0.00 0.00 47.33 46.50 2wdv h GLY 88 CO 0.01 0.65 -0.38 -2.22 0.00 0.00 0.00 176.54 174.60 2wdv h ILE 89 N 0.77 1.30 0.06 2.60 2.04 -0.06 -0.30 117.51 123.92 2wdv h ILE 89 Ca 0.13 -1.52 0.00 0.00 1.00 0.00 0.00 64.86 64.47 2wdv h ILE 89 Cb 0.61 1.54 -0.01 0.00 -0.74 0.00 0.00 36.82 38.22 2wdv h ILE 89 CO 0.04 0.48 -0.06 -0.09 0.00 0.00 0.00 178.15 178.52 2wdv h ARG 90 N 0.42 -0.12 -0.14 2.37 2.43 -1.11 0.10 114.38 118.32 2wdv h ARG 90 Ca 0.04 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.27 2wdv h ARG 90 Cb 0.86 0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 30.38 2wdv h ARG 90 CO 0.07 -0.08 -0.24 1.25 -1.51 0.00 0.00 179.97 179.46 2wdv h HIS 91 N -0.13 -0.63 0.00 2.20 2.76 -0.94 -2.09 115.15 116.33 2wdv h HIS 91 Ca 0.00 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.18 2wdv h HIS 91 Cb 0.12 0.30 -0.00 0.00 1.55 0.00 0.00 27.41 29.38 2wdv h HIS 91 CO -0.10 -0.32 -0.09 0.52 -1.30 0.00 0.00 177.93 176.64 2wdv h MET 92 N -0.29 0.00 0.00 5.26 2.86 -0.76 -1.43 114.93 120.56 2wdv h MET 92 Ca 0.10 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.64 2wdv h MET 92 Cb 0.45 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.09 2wdv h MET 92 CO -0.31 0.09 -0.50 0.52 1.06 0.00 0.00 176.91 177.77 2wdv h MET 93 N 0.00 0.00 -0.07 1.72 2.07 -0.28 -2.16 114.93 116.21 2wdv h MET 93 Ca -0.00 0.00 -0.20 0.00 -2.07 0.00 0.00 59.70 57.43 2wdv h MET 93 Cb 0.19 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 29.92 2wdv h MET 93 CO 0.01 0.50 -0.78 0.52 1.07 0.00 0.00 176.91 178.23 2wdv h MET 94 N 0.00 0.46 0.00 1.72 2.86 -0.68 0.26 114.93 119.54 2wdv h MET 94 Ca -0.00 -0.39 -0.02 0.00 -2.06 0.00 0.00 59.70 57.22 2wdv h MET 94 Cb 1.14 0.09 -0.00 0.00 0.06 0.00 0.00 31.60 32.88 2wdv h MET 94 CO 0.06 1.03 -0.10 -0.44 1.06 0.00 0.00 176.91 178.52 2wdv h ASP 95 N 0.30 0.00 -0.47 1.22 3.32 -0.96 -2.27 116.42 117.56 2wdv h ASP 95 Ca -0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.01 2wdv h ASP 95 Cb 1.37 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.92 2wdv h ASP 95 CO 0.14 0.10 0.00 0.49 -1.72 0.00 0.00 179.24 178.25 2wdv n PHE 96 N -3.47 0.62 -0.87 4.55 3.72 -0.84 -4.96 117.46 116.21 2wdv n PHE 96 Ca -0.01 -0.45 0.00 0.00 -0.05 0.00 0.00 57.45 56.94 2wdv n PHE 96 Cb 0.25 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.78 2wdv n PHE 96 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2wdv n GLY 97 N 1.00 0.83 0.17 1.37 0.00 -0.86 -4.91 105.19 102.80 2wdv n GLY 97 Ca 0.16 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.17 2wdv n GLY 97 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2wdv h TYR 98 N 0.00 0.15 -3.42 1.61 0.05 -0.82 -3.42 116.97 111.12 2wdv h TYR 98 Ca 0.00 -0.05 -0.66 0.00 0.05 0.00 0.00 58.73 58.08 2wdv h TYR 98 Cb 0.00 -0.03 -0.23 0.00 1.01 0.00 0.00 36.73 37.48 2wdv h TYR 98 CO 0.00 0.59 -0.71 -0.51 -1.05 0.00 0.00 178.16 176.49 2wdv s LEU 99 N -8.01 3.04 0.50 3.88 1.43 -0.17 -4.95 118.68 114.41 2wdv s LEU 99 Ca -0.03 -0.17 -0.22 0.00 -1.03 0.00 0.00 54.13 52.68 2wdv s LEU 99 Cb 0.13 -1.70 -0.06 0.00 0.03 0.00 0.00 46.19 44.59 2wdv s LEU 99 CO 0.76 0.22 1.22 -1.61 0.23 0.00 0.00 176.35 177.18 2wdv s GLU 100 N 0.05 3.47 -0.68 1.70 2.02 -1.26 -4.46 118.70 119.54 2wdv s GLU 100 Ca -0.02 1.90 -0.02 0.00 0.02 0.00 0.00 54.97 56.85 2wdv s GLU 100 Cb -0.14 -2.29 0.44 0.00 0.10 0.00 0.00 34.13 32.24 2wdv s GLU 100 CO 0.03 -0.83 2.04 0.39 0.02 0.00 0.00 175.26 176.92 2wdv n GLU 101 N -0.81 2.68 -3.67 1.61 1.02 -1.26 -4.40 120.64 115.81 2wdv n GLU 101 Ca 0.09 -3.29 -0.26 0.00 -0.02 0.00 0.00 57.16 53.68 2wdv n GLU 101 Cb 0.47 -2.28 -0.03 0.00 -0.02 0.00 0.00 31.44 29.59 2wdv n GLU 101 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2wdv s THR 102 N -4.82 5.19 0.38 2.62 -4.23 -1.26 -4.99 115.64 108.53 2wdv s THR 102 Ca 0.63 -0.46 0.11 0.00 -1.18 0.00 0.00 61.69 60.80 2wdv s THR 102 Cb 0.50 -3.77 0.12 0.00 1.34 0.00 0.00 72.50 70.69 2wdv s THR 102 CO -0.05 -0.27 1.86 0.15 -0.54 0.00 0.00 174.62 175.78 2wdv h PHE 103 N 1.66 0.10 0.26 3.99 3.57 -1.99 -0.58 116.94 123.95 2wdv h PHE 103 Ca -0.49 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 60.98 2wdv h PHE 103 Cb 1.20 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.91 2wdv h PHE 103 CO 0.53 0.37 -0.15 0.93 -2.23 0.00 0.00 178.31 177.76 2wdv h GLU 104 N 0.09 -0.36 -0.09 1.11 4.39 -1.97 -2.53 114.58 115.21 2wdv h GLU 104 Ca 0.01 0.02 0.03 0.00 0.34 0.00 0.00 59.36 59.76 2wdv h GLU 104 Cb 0.54 0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 29.27 2wdv h GLU 104 CO 0.04 -0.24 0.13 0.00 -1.16 0.00 0.00 179.01 177.78 2wdv h ALA 105 N -1.70 1.57 0.35 3.43 0.00 -1.83 -0.44 119.26 120.64 2wdv h ALA 105 Ca -0.03 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2wdv h ALA 105 Cb 0.30 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2wdv h ALA 105 CO 0.04 -0.18 -0.17 0.78 0.00 0.00 0.00 179.25 179.72 2wdv h GLY 106 N 0.00 -0.49 1.02 0.00 0.00 -1.04 -1.81 103.07 100.75 2wdv h GLY 106 Ca 0.04 0.18 -0.00 0.00 0.00 0.00 0.00 47.33 47.55 2wdv h GLY 106 CO -0.00 -0.18 0.56 0.50 0.00 0.00 0.00 176.54 177.42 2wdv h LYS 107 N -0.61 1.23 -0.57 4.80 1.57 -0.66 -1.39 116.57 120.94 2wdv h LYS 107 Ca -0.05 -0.10 -0.11 0.00 -1.87 0.00 0.00 60.65 58.52 2wdv h LYS 107 Cb 0.44 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 2wdv h LYS 107 CO 0.08 0.85 -0.06 -0.09 -0.57 0.00 0.00 179.45 179.65 2wdv h ARG 108 N 1.25 1.04 -0.01 3.15 2.43 -1.30 -1.88 114.38 119.06 2wdv h ARG 108 Ca 0.33 -0.37 -0.18 0.00 -0.81 0.00 0.00 59.98 58.95 2wdv h ARG 108 Cb -0.07 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.39 2wdv h ARG 108 CO -0.06 1.06 -0.82 0.66 -1.51 0.00 0.00 179.97 179.30 2wdv h SER 109 N 0.93 0.21 -0.67 -3.80 4.64 -1.17 -2.41 113.55 111.28 2wdv h SER 109 Ca 0.15 -0.16 -0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2wdv h SER 109 Cb 0.63 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 62.62 2wdv h SER 109 CO 0.04 0.94 0.41 0.00 -0.87 0.00 0.00 176.83 177.35 2wdv h ALA 110 N 1.05 0.85 -0.36 5.18 0.00 -0.98 -1.12 119.26 123.89 2wdv h ALA 110 Ca -0.03 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 2wdv h ALA 110 Cb 1.42 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 2wdv h ALA 110 CO 0.12 0.32 -0.12 0.87 0.00 0.00 0.00 179.25 180.44 2wdv h LYS 111 N 0.91 0.72 0.00 0.00 1.57 -1.32 -2.22 116.57 116.22 2wdv h LYS 111 Ca 0.24 -0.29 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 2wdv h LYS 111 Cb -0.04 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.24 2wdv h LYS 111 CO -0.05 0.89 -0.10 0.82 -0.57 0.00 0.00 179.45 180.45 2wdv h ILE 112 N 0.51 0.88 -0.13 1.86 2.04 -1.31 -1.82 117.51 119.54 2wdv h ILE 112 Ca 0.09 -0.35 -0.03 0.00 1.00 0.00 0.00 64.86 65.56 2wdv h ILE 112 Cb 0.65 1.20 -0.00 0.00 -0.74 0.00 0.00 36.82 37.92 2wdv h ILE 112 CO 0.04 0.09 -0.04 0.28 0.00 0.00 0.00 178.15 178.52 2wdv h SER 113 N 0.00 0.27 -0.68 1.72 0.02 -0.95 -2.42 113.55 111.51 2wdv h SER 113 Ca -0.00 -0.38 -0.01 0.00 -0.84 0.00 0.00 61.79 60.56 2wdv h SER 113 Cb 0.19 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 62.63 2wdv h SER 113 CO 0.01 0.59 0.40 -0.26 -1.14 0.00 0.00 176.83 176.44 2wdv h PHE 114 N -0.06 0.90 0.22 3.45 0.04 -0.77 -0.73 116.94 119.99 2wdv h PHE 114 Ca 0.03 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.79 2wdv h PHE 114 Cb 0.48 -0.29 0.00 0.00 2.20 0.00 0.00 35.95 38.34 2wdv h PHE 114 CO 0.06 0.61 -0.11 0.28 -0.60 0.00 0.00 178.31 178.55 2wdv h VAL 115 N 0.92 0.79 -0.04 -0.55 2.07 -1.41 0.10 116.25 118.13 2wdv h VAL 115 Ca 0.24 -0.03 0.01 0.00 0.82 0.00 0.00 66.70 67.75 2wdv h VAL 115 Cb -0.02 0.81 -0.00 0.00 -1.52 0.00 0.00 31.29 30.55 2wdv h VAL 115 CO -0.04 0.01 0.04 0.40 0.02 0.00 0.00 177.57 177.99 2wdv h ILE 116 N -0.31 0.72 0.07 4.57 2.04 -1.23 -1.39 117.51 121.98 2wdv h ILE 116 Ca -0.03 0.00 -0.20 0.00 1.00 0.00 0.00 64.86 65.63 2wdv h ILE 116 Cb 0.24 0.97 0.02 0.00 -0.74 0.00 0.00 36.82 37.31 2wdv h ILE 116 CO 0.05 0.00 -0.82 0.74 0.00 0.00 0.00 178.15 178.12 2wdv h THR 117 N 0.00 1.42 -0.40 -0.27 2.02 -0.65 -2.31 112.91 112.73 2wdv h THR 117 Ca 0.02 -2.31 0.03 0.00 0.77 0.00 0.00 66.41 64.92 2wdv h THR 117 Cb 0.10 2.82 -0.03 0.00 -1.74 0.00 0.00 68.15 69.29 2wdv h THR 117 CO -0.00 0.67 0.20 0.58 0.37 0.00 0.00 175.52 177.35 2wdv h VAL 118 N -0.10 0.98 -0.51 3.16 2.07 -0.36 0.25 116.25 121.74 2wdv h VAL 118 Ca -0.12 -0.14 0.08 0.00 0.82 0.00 0.00 66.70 67.34 2wdv h VAL 118 Cb 1.56 0.54 -0.07 0.00 -1.52 0.00 0.00 31.29 31.80 2wdv h VAL 118 CO 0.16 0.07 0.12 0.58 0.02 0.00 0.00 177.57 178.53 2wdv h VAL 119 N 0.41 0.74 0.00 2.57 2.07 -1.32 -1.11 116.25 119.60 2wdv h VAL 119 Ca 0.17 -0.09 -0.09 0.00 0.82 0.00 0.00 66.70 67.50 2wdv h VAL 119 Cb 0.07 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 2wdv h VAL 119 CO -0.11 0.05 -0.45 -0.07 0.02 0.00 0.00 177.57 177.01 2wdv h LEU 120 N 0.27 0.00 -0.72 2.57 3.38 -1.00 -2.43 115.31 117.39 2wdv h LEU 120 Ca 0.26 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.09 2wdv h LEU 120 Cb 0.33 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 2wdv h LEU 120 CO -0.32 0.45 -0.52 -1.28 0.09 0.00 0.00 178.44 176.87 2wdv h SER 121 N 0.00 0.35 -0.12 -0.43 0.87 0.54 -0.78 113.55 113.98 2wdv h SER 121 Ca -0.00 -0.18 -0.11 0.00 -1.23 0.00 0.00 61.79 60.26 2wdv h SER 121 Cb 0.98 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.84 2wdv h SER 121 CO 0.06 0.81 -0.36 -0.07 -0.53 0.00 0.00 176.83 176.73 2wdv h LEU 122 N 0.25 0.53 -2.06 2.23 3.38 -1.15 -1.82 115.31 116.68 2wdv h LEU 122 Ca 0.01 -0.60 0.01 0.00 0.09 0.00 0.00 57.88 57.38 2wdv h LEU 122 Cb 1.00 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.59 2wdv h LEU 122 CO 0.08 1.04 0.01 -0.07 0.09 0.00 0.00 178.44 179.59 2wdv h LEU 123 N 0.04 0.00 -0.23 1.67 3.38 -1.31 0.16 115.31 119.02 2wdv h LEU 123 Ca -0.01 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.74 2wdv h LEU 123 Cb 0.99 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.74 2wdv h LEU 123 CO 0.08 0.00 -0.80 0.00 0.09 0.00 0.00 178.44 177.81 2wdv h ALA 124 N 1.99 0.40 0.00 1.53 0.00 -1.09 -1.71 119.26 120.38 2wdv h ALA 124 Ca 0.01 -0.62 -0.00 0.00 0.00 0.00 0.00 54.91 54.30 2wdv h ALA 124 Cb 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2wdv h ALA 124 CO -0.00 0.72 -0.00 0.78 0.00 0.00 0.00 179.25 180.75 2wdv h GLY 125 N 0.86 -0.01 0.35 0.00 0.00 -0.03 -2.71 103.07 101.53 2wdv h GLY 125 Ca -0.05 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.30 2wdv h GLY 125 CO 0.15 -0.00 -0.35 -2.08 0.00 0.00 0.00 176.54 174.26 2wdv h VAL 126 N -0.12 0.26 0.00 4.60 2.07 -0.85 -0.99 116.25 121.22 2wdv h VAL 126 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2wdv h VAL 126 Cb 0.12 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 2wdv h VAL 126 CO 0.00 0.00 0.03 -0.11 0.02 0.00 0.00 177.57 177.51 2wdv n LEU 127 N -5.43 0.00 -0.14 2.57 0.00 -0.65 -5.11 117.00 108.25 2wdv n LEU 127 Ca -0.06 0.08 0.02 0.00 0.00 0.00 0.00 56.01 56.05 2wdv n LEU 127 Cb 0.34 -0.08 0.01 0.00 0.00 0.00 0.00 43.42 43.70 2wdv n LEU 127 CO 0.21 -0.08 0.31 0.52 0.00 0.00 0.00 177.39 178.34