#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lnw n PRO 4 N 0.00 0.95 -3.51 -0.72 -0.02 -1.26 -4.98 135.00 125.47 1lnw n PRO 4 Ca 0.00 0.39 -0.39 0.00 -2.02 0.00 0.00 63.50 61.47 1lnw n PRO 4 Cb 0.00 -2.50 -0.10 0.00 -0.02 0.00 0.00 33.50 30.87 1lnw n PRO 4 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1lnw s VAL 5 N -1.51 5.26 -0.06 -1.45 0.11 -1.26 -5.04 120.40 116.45 1lnw s VAL 5 Ca 0.81 0.05 -0.29 0.00 -2.93 0.00 0.00 61.98 59.62 1lnw s VAL 5 Cb -0.37 -3.67 -0.07 0.00 -1.53 0.00 0.00 36.38 30.74 1lnw s VAL 5 CO 0.42 0.08 2.04 0.21 -3.33 0.00 0.00 175.10 174.52 1lnw s ASN 6 N 1.73 6.11 0.62 3.54 3.84 -1.26 -4.87 114.94 124.65 1lnw s ASN 6 Ca 0.08 2.37 0.33 0.00 0.21 0.00 0.00 52.86 55.85 1lnw s ASN 6 Cb -0.17 -2.52 1.83 0.00 -0.55 0.00 0.00 41.25 39.84 1lnw s ASN 6 CO 0.11 -1.37 2.13 -0.65 -2.79 0.00 0.00 177.10 174.53 1lnw h PRO 7 N 12.12 0.00 -0.01 0.43 0.11 -2.06 -2.22 132.00 140.38 1lnw h PRO 7 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1lnw h PRO 7 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1lnw h PRO 7 CO 0.95 0.00 -0.40 -0.25 -0.21 0.00 0.00 178.00 178.09 1lnw n ASP 8 N -3.46 1.38 -0.49 -2.05 10.43 -1.26 -4.50 116.55 116.60 1lnw n ASP 8 Ca -0.00 -1.10 0.00 0.00 2.57 0.00 0.00 54.79 56.26 1lnw n ASP 8 Cb 0.28 0.33 0.00 0.00 1.84 0.00 0.00 41.12 43.56 1lnw n ASP 8 CO 0.00 0.00 0.00 -0.11 -1.07 0.00 0.00 177.20 176.02 1lnw n LEU 9 N -0.51 0.51 0.00 0.64 7.94 -0.84 -1.58 117.00 123.16 1lnw n LEU 9 Ca 0.10 -0.25 0.00 0.00 -1.11 0.00 0.00 56.01 54.75 1lnw n LEU 9 Cb 0.39 -0.25 0.00 0.00 0.53 0.00 0.00 43.42 44.09 1lnw n LEU 9 CO 0.28 0.13 0.00 -2.65 -1.11 0.00 0.00 177.39 174.04 1lnw n PRO 11 N 0.23 0.00 -0.08 1.96 -0.02 -1.26 -1.53 135.00 134.30 1lnw n PRO 11 Ca 0.00 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.36 1lnw n PRO 11 Cb 0.13 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.56 1lnw n PRO 11 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1lnw h ALA 12 N 0.00 0.33 0.00 3.55 0.00 -1.66 0.05 119.26 121.53 1lnw h ALA 12 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1lnw h ALA 12 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1lnw h ALA 12 CO 0.00 0.09 0.00 1.28 0.00 0.00 0.00 179.25 180.62 1lnw n LEU 13 N -4.60 0.31 0.00 0.00 4.77 -0.58 -1.34 117.00 115.55 1lnw n LEU 13 Ca -0.04 -0.15 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 1lnw n LEU 13 Cb 0.27 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 1lnw n LEU 13 CO 0.38 0.05 0.00 0.00 -1.33 0.00 0.00 177.39 176.50 1lnw n ALA 15 N 0.77 0.00 -0.17 -1.18 0.00 0.00 -1.07 120.51 118.86 1lnw n ALA 15 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 1lnw n ALA 15 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.51 1lnw n ALA 15 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1lnw h VAL 16 N 0.00 1.24 -0.31 0.00 2.07 -1.47 -0.70 116.25 117.08 1lnw h VAL 16 Ca 0.00 -0.86 0.05 0.00 0.82 0.00 0.00 66.70 66.70 1lnw h VAL 16 Cb 0.00 0.89 -0.04 0.00 -1.52 0.00 0.00 31.29 30.62 1lnw h VAL 16 CO 0.00 0.31 0.05 0.15 0.02 0.00 0.00 177.57 178.10 1lnw h PHE 17 N 0.65 0.09 -0.54 1.57 3.57 -1.36 -1.03 116.94 119.88 1lnw h PHE 17 Ca 0.15 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.66 1lnw h PHE 17 Cb 0.35 0.01 -0.03 0.00 2.79 0.00 0.00 35.95 39.07 1lnw h PHE 17 CO 0.02 0.01 0.31 0.37 -2.23 0.00 0.00 178.31 176.79 1lnw h GLN 18 N 0.16 0.74 -0.43 1.11 4.15 -1.77 -1.26 115.11 117.82 1lnw h GLN 18 Ca 0.14 -0.08 0.02 0.00 0.77 0.00 0.00 58.65 59.50 1lnw h GLN 18 Cb 0.16 -0.15 -0.03 0.00 0.21 0.00 0.00 27.48 27.67 1lnw h GLN 18 CO -0.20 0.56 0.25 1.25 -1.93 0.00 0.00 178.83 178.76 1lnw h HIS 19 N 0.72 0.46 -0.36 3.99 2.76 -0.70 -1.51 115.15 120.52 1lnw h HIS 19 Ca 0.19 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.36 1lnw h HIS 19 Cb 0.03 -0.15 -0.02 0.00 1.55 0.00 0.00 27.41 28.82 1lnw h HIS 19 CO -0.02 0.26 0.18 0.28 -1.30 0.00 0.00 177.93 177.33 1lnw h VAL 20 N 0.50 1.16 -0.20 5.26 2.07 -0.94 -1.39 116.25 122.71 1lnw h VAL 20 Ca 0.17 -0.44 0.01 0.00 0.82 0.00 0.00 66.70 67.26 1lnw h VAL 20 Cb 0.02 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 1lnw h VAL 20 CO -0.08 0.17 0.09 -0.09 0.02 0.00 0.00 177.57 177.68 1lnw h ARG 21 N 0.44 0.20 -0.32 1.57 1.12 -1.02 0.25 114.38 116.63 1lnw h ARG 21 Ca 0.12 -0.01 -0.09 0.00 -1.11 0.00 0.00 59.98 58.89 1lnw h ARG 21 Cb 0.10 -0.04 -0.02 0.00 -0.01 0.00 0.00 29.97 30.00 1lnw h ARG 21 CO -0.02 0.13 -0.20 1.79 -3.11 0.00 0.00 179.97 178.57 1lnw h THR 22 N 0.20 1.26 -0.39 0.20 1.35 -1.18 -0.96 112.91 113.39 1lnw h THR 22 Ca 0.08 -1.22 -0.10 0.00 -0.55 0.00 0.00 66.41 64.63 1lnw h THR 22 Cb 0.03 1.23 -0.01 0.00 -1.73 0.00 0.00 68.15 67.67 1lnw h THR 22 CO -0.06 0.40 -0.15 0.03 -0.25 0.00 0.00 175.52 175.49 1lnw h ARG 23 N 0.53 0.79 -0.37 4.72 2.47 -0.86 -1.27 114.38 120.39 1lnw h ARG 23 Ca 0.08 -0.33 -0.02 0.00 -1.26 0.00 0.00 59.98 58.46 1lnw h ARG 23 Cb 0.63 -0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 28.90 1lnw h ARG 23 CO 0.04 0.95 0.17 0.82 0.56 0.00 0.00 179.97 182.51 1lnw h ILE 24 N 0.60 1.17 0.03 2.04 2.04 -0.74 -0.28 117.51 122.38 1lnw h ILE 24 Ca 0.09 -0.50 0.01 0.00 1.00 0.00 0.00 64.86 65.46 1lnw h ILE 24 Cb 0.69 0.82 -0.01 0.00 -0.74 0.00 0.00 36.82 37.58 1lnw h ILE 24 CO 0.05 0.18 -0.08 -0.61 0.00 0.00 0.00 178.15 177.70 1lnw h GLN 25 N 0.45 -0.14 -0.71 2.37 5.75 -1.11 0.20 115.11 121.91 1lnw h GLN 25 Ca 0.13 0.01 0.07 0.00 -0.15 0.00 0.00 58.65 58.71 1lnw h GLN 25 Cb 0.13 0.03 -0.06 0.00 1.07 0.00 0.00 27.48 28.66 1lnw h GLN 25 CO -0.01 -0.09 0.39 1.03 -2.65 0.00 0.00 178.83 177.49 1lnw h SER 26 N -0.15 0.57 -0.46 -0.69 0.87 -1.03 -0.04 113.55 112.63 1lnw h SER 26 Ca 0.02 0.04 -0.12 0.00 -1.23 0.00 0.00 61.79 60.50 1lnw h SER 26 Cb 0.17 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.04 1lnw h SER 26 CO -0.06 0.35 -0.17 -0.08 -0.53 0.00 0.00 176.83 176.35 1lnw h GLU 27 N 0.70 0.95 -0.62 2.24 4.57 -0.56 -1.47 114.58 120.39 1lnw h GLU 27 Ca 0.33 -0.38 -0.06 0.00 -1.18 0.00 0.00 59.36 58.08 1lnw h GLU 27 Cb 0.25 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.76 1lnw h GLU 27 CO -0.21 1.04 0.16 -0.07 -1.18 0.00 0.00 179.01 178.76 1lnw h LEU 28 N 0.83 0.93 -0.87 1.64 3.38 0.04 -1.81 115.31 119.46 1lnw h LEU 28 Ca 0.12 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.81 1lnw h LEU 28 Cb 0.73 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.20 1lnw h LEU 28 CO 0.06 0.91 0.20 0.44 0.09 0.00 0.00 178.44 180.14 1lnw h ASP 29 N 0.91 0.97 0.18 -0.43 3.32 -0.76 -1.10 116.42 119.51 1lnw h ASP 29 Ca 0.20 -0.18 -0.10 0.00 0.02 0.00 0.00 57.03 56.97 1lnw h ASP 29 Cb 0.34 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 1lnw h ASP 29 CO -0.00 0.91 -0.37 0.00 -1.72 0.00 0.00 179.24 178.06 1lnw n GLN 31 N -4.06 1.85 -4.02 0.00 6.02 -0.71 -4.95 117.38 111.51 1lnw n GLN 31 Ca -0.01 -1.28 -0.28 0.00 -0.01 0.00 0.00 57.00 55.42 1lnw n GLN 31 Cb 0.45 -1.39 -0.02 0.00 1.02 0.00 0.00 30.24 30.30 1lnw n GLN 31 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1lnw n ARG 32 N 0.51 -3.22 0.00 -1.09 1.74 -0.48 -4.88 116.66 109.24 1lnw n ARG 32 Ca 0.16 0.39 0.13 0.00 -0.77 0.00 0.00 57.85 57.76 1lnw n ARG 32 Cb 0.36 -4.61 0.40 0.00 -1.02 0.00 0.00 32.46 27.58 1lnw n ARG 32 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1lnw n LEU 33 N -4.42 0.84 -3.85 0.55 4.77 -0.81 -4.97 117.00 109.11 1lnw n LEU 33 Ca -0.23 -0.16 -0.29 0.00 -0.03 0.00 0.00 56.01 55.30 1lnw n LEU 33 Cb 0.65 -0.16 0.01 0.00 -2.33 0.00 0.00 43.42 41.58 1lnw n LEU 33 CO 0.78 0.16 -0.17 -0.67 -1.33 0.00 0.00 177.39 176.16 1lnw n ASP 34 N -0.85 -2.42 -4.12 -1.43 2.03 -1.26 -4.99 116.55 103.51 1lnw n ASP 34 Ca 0.11 -1.03 -0.10 0.00 0.52 0.00 0.00 54.79 54.30 1lnw n ASP 34 Cb 0.34 -3.11 -0.10 0.00 -0.72 0.00 0.00 41.12 37.53 1lnw n ASP 34 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1lnw s LEU 35 N -6.81 2.46 0.31 -2.67 1.43 -1.26 -5.16 118.68 106.98 1lnw s LEU 35 Ca 0.21 -0.92 0.08 0.00 -1.03 0.00 0.00 54.13 52.47 1lnw s LEU 35 Cb -0.08 0.02 -0.04 0.00 0.03 0.00 0.00 46.19 46.12 1lnw s LEU 35 CO 0.88 -0.47 0.11 0.42 0.23 0.00 0.00 176.35 177.52 1lnw s THR 36 N -3.35 3.27 0.28 5.49 -4.23 -1.26 -4.80 115.64 111.04 1lnw s THR 36 Ca 0.06 -1.73 0.01 0.00 -1.18 0.00 0.00 61.69 58.85 1lnw s THR 36 Cb 0.04 -2.98 0.27 0.00 1.34 0.00 0.00 72.50 71.17 1lnw s THR 36 CO -0.06 -0.25 1.82 -0.65 -0.54 0.00 0.00 174.62 174.94 1lnw h PRO 37 N 1.63 0.89 -0.85 3.99 0.11 -1.92 -0.97 132.00 134.88 1lnw h PRO 37 Ca -0.44 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 1lnw h PRO 37 Cb 1.25 -0.20 -0.04 0.00 0.11 0.00 0.00 31.00 32.12 1lnw h PRO 37 CO 0.62 0.59 0.51 -1.35 -0.21 0.00 0.00 178.00 178.16 1lnw h PRO 38 N 0.92 1.15 -0.58 1.05 0.11 -1.99 -1.65 132.00 131.01 1lnw h PRO 38 Ca 0.49 -0.10 0.00 0.00 0.11 0.00 0.00 66.00 66.50 1lnw h PRO 38 Cb 0.52 -0.24 -0.03 0.00 0.11 0.00 0.00 31.00 31.36 1lnw h PRO 38 CO -0.28 0.80 0.37 -0.44 -0.21 0.00 0.00 178.00 178.24 1lnw h ASP 39 N 1.17 0.68 -0.40 -2.05 3.32 -1.58 -0.44 116.42 117.12 1lnw h ASP 39 Ca 0.31 -0.04 0.04 0.00 0.02 0.00 0.00 57.03 57.36 1lnw h ASP 39 Cb -0.05 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 39.29 1lnw h ASP 39 CO -0.06 0.51 0.17 0.58 -1.72 0.00 0.00 179.24 178.73 1lnw h VAL 40 N 0.78 0.93 -0.42 -1.35 2.07 -1.02 0.43 116.25 117.68 1lnw h VAL 40 Ca 0.21 -0.12 0.04 0.00 0.82 0.00 0.00 66.70 67.64 1lnw h VAL 40 Cb -0.06 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 30.22 1lnw h VAL 40 CO -0.04 0.06 0.20 -0.74 0.02 0.00 0.00 177.57 177.07 1lnw h HIS 41 N 0.35 0.36 -0.44 1.57 -0.00 -0.76 -0.55 115.15 115.68 1lnw h HIS 41 Ca 0.18 0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.56 1lnw h HIS 41 Cb 0.12 -0.10 -0.02 0.00 -0.00 0.00 0.00 27.41 27.41 1lnw h HIS 41 CO -0.12 0.18 0.24 0.28 -0.00 0.00 0.00 177.93 178.50 1lnw h VAL 42 N 0.40 1.16 -0.65 5.26 2.07 -0.34 -1.57 116.25 122.58 1lnw h VAL 42 Ca 0.18 -0.42 -0.03 0.00 0.82 0.00 0.00 66.70 67.25 1lnw h VAL 42 Cb 0.10 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 1lnw h VAL 42 CO -0.14 0.17 0.29 -0.07 0.02 0.00 0.00 177.57 177.84 1lnw h LEU 43 N 0.58 0.84 -0.53 2.57 3.38 -0.51 -2.32 115.31 119.31 1lnw h LEU 43 Ca 0.15 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1lnw h LEU 43 Cb 0.06 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1lnw h LEU 43 CO -0.02 0.73 0.06 0.50 0.09 0.00 0.00 178.44 179.80 1lnw h LYS 44 N 0.92 0.90 -0.36 1.13 3.64 -0.67 -1.33 116.57 120.81 1lnw h LYS 44 Ca 0.22 -0.26 -0.11 0.00 -1.27 0.00 0.00 60.65 59.24 1lnw h LYS 44 Cb 0.13 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 1lnw h LYS 44 CO -0.03 0.89 -0.22 -0.07 -2.27 0.00 0.00 179.45 177.76 1lnw h LEU 45 N 0.78 0.70 -0.32 5.20 -0.00 -1.07 -0.99 115.31 119.63 1lnw h LEU 45 Ca 0.16 -0.24 -0.12 0.00 -0.00 0.00 0.00 57.88 57.68 1lnw h LEU 45 Cb 0.44 -0.19 -0.01 0.00 -0.00 0.00 0.00 40.66 40.90 1lnw h LEU 45 CO 0.02 0.91 -0.26 0.40 -0.00 0.00 0.00 178.44 179.51 1lnw h ILE 46 N 0.61 1.29 -0.28 1.22 2.04 -1.30 -2.11 117.51 118.98 1lnw h ILE 46 Ca 0.09 -1.41 -0.03 0.00 1.00 0.00 0.00 64.86 64.50 1lnw h ILE 46 Cb 0.70 1.50 -0.01 0.00 -0.74 0.00 0.00 36.82 38.27 1lnw h ILE 46 CO 0.05 0.46 0.04 -0.78 0.00 0.00 0.00 178.15 177.92 1lnw h ASP 47 N 0.49 0.46 1.09 1.72 3.58 -1.08 -3.20 116.42 119.49 1lnw h ASP 47 Ca 0.06 -0.26 0.00 0.00 0.42 0.00 0.00 57.03 57.24 1lnw h ASP 47 Cb 0.82 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 41.75 1lnw h ASP 47 CO 0.07 0.60 0.00 -0.62 -2.88 0.00 0.00 179.24 176.41 1lnw n GLU 48 N -4.65 0.10 -3.37 0.28 1.02 -0.39 -4.05 120.64 109.59 1lnw n GLU 48 Ca -0.03 0.12 -0.26 0.00 -0.02 0.00 0.00 57.16 56.98 1lnw n GLU 48 Cb 0.21 -1.63 -0.08 0.00 -0.02 0.00 0.00 31.44 29.93 1lnw n GLU 48 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1lnw n GLN 49 N -1.80 1.55 -1.60 3.49 6.02 -0.80 -5.08 117.38 119.16 1lnw n GLN 49 Ca 0.06 -3.95 -0.47 0.00 -0.01 0.00 0.00 57.00 52.63 1lnw n GLN 49 Cb 0.35 -1.79 -0.03 0.00 1.02 0.00 0.00 30.24 29.78 1lnw n GLN 49 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 177.06 178.94 1lnw n ARG 50 N 1.33 1.39 -0.77 -1.09 1.85 -1.24 -1.67 116.66 116.46 1lnw n ARG 50 Ca 0.26 0.49 0.00 0.00 -1.00 0.00 0.00 57.85 57.60 1lnw n ARG 50 Cb 0.46 -2.00 0.00 0.00 -1.05 0.00 0.00 32.46 29.87 1lnw n ARG 50 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1lnw n GLY 51 N 1.89 0.74 3.67 2.89 0.00 -1.25 -5.02 105.19 108.12 1lnw n GLY 51 Ca 0.13 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.71 1lnw n GLY 51 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1lnw n LEU 52 N 0.00 3.14 -4.93 0.99 7.94 -0.67 -4.33 117.00 119.14 1lnw n LEU 52 Ca 0.00 1.17 -0.20 0.00 -1.11 0.00 0.00 56.01 55.88 1lnw n LEU 52 Cb 0.00 -1.44 -0.02 0.00 0.53 0.00 0.00 43.42 42.50 1lnw n LEU 52 CO 0.00 -0.58 0.03 0.54 -1.11 0.00 0.00 177.39 176.26 1lnw s ASN 53 N -0.03 5.48 0.26 1.96 2.20 -1.26 0.16 114.94 123.71 1lnw s ASN 53 Ca 0.62 -0.47 -0.02 0.00 -0.94 0.00 0.00 52.86 52.06 1lnw s ASN 53 Cb -0.62 -0.86 0.53 0.00 -2.00 0.00 0.00 41.25 38.30 1lnw s ASN 53 CO 0.56 -0.54 1.73 -0.07 -2.94 0.00 0.00 177.10 175.84 1lnw h LEU 54 N 0.97 0.37 -0.80 3.54 3.38 -1.94 -1.88 115.31 118.94 1lnw h LEU 54 Ca -0.43 0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.58 1lnw h LEU 54 Cb 1.26 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 42.05 1lnw h LEU 54 CO 0.54 0.13 0.15 -0.61 0.09 0.00 0.00 178.44 178.73 1lnw h GLN 55 N 0.50 1.05 -0.26 1.13 4.15 -1.95 -0.56 115.11 119.16 1lnw h GLN 55 Ca 0.45 -0.25 -0.10 0.00 0.77 0.00 0.00 58.65 59.52 1lnw h GLN 55 Cb 0.71 -0.14 -0.00 0.00 0.21 0.00 0.00 27.48 28.25 1lnw h GLN 55 CO -0.41 0.93 -0.24 -0.44 -1.93 0.00 0.00 178.83 176.74 1lnw h ASP 56 N 0.99 0.67 -0.49 -0.69 3.32 -1.80 -1.28 116.42 117.14 1lnw h ASP 56 Ca 0.21 -0.47 0.02 0.00 0.02 0.00 0.00 57.03 56.81 1lnw h ASP 56 Cb 0.37 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.70 1lnw h ASP 56 CO 0.00 1.00 0.30 0.25 -1.72 0.00 0.00 179.24 179.07 1lnw h LEU 57 N 0.36 0.48 -0.62 1.55 5.85 -1.25 -0.37 115.31 121.30 1lnw h LEU 57 Ca 0.04 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.82 1lnw h LEU 57 Cb 0.80 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.68 1lnw h LEU 57 CO 0.06 0.34 0.34 1.23 -0.34 0.00 0.00 178.44 180.07 1lnw h GLY 58 N 0.59 0.90 0.98 3.75 0.00 -0.95 -2.55 103.07 105.79 1lnw h GLY 58 Ca 0.20 -0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.27 1lnw h GLY 58 CO -0.09 0.15 0.27 3.21 0.00 0.00 0.00 176.54 180.09 1lnw h ARG 59 N 0.64 0.74 -1.62 4.80 3.08 -0.34 -0.69 114.38 121.00 1lnw h ARG 59 Ca 0.28 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 60.23 1lnw h ARG 59 Cb 0.16 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.07 1lnw h ARG 59 CO -0.17 0.59 0.00 1.04 -1.07 0.00 0.00 179.97 180.36 1lnw n GLN 60 N -4.61 0.55 0.00 0.04 6.02 -0.23 -4.68 117.38 114.46 1lnw n GLN 60 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.01 1lnw n GLN 60 Cb 0.10 -1.23 0.00 0.00 1.02 0.00 0.00 30.24 30.13 1lnw n GLN 60 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1lnw s ARG 63 N 0.00 0.96 0.64 0.00 1.81 -0.83 -5.14 118.95 116.39 1lnw s ARG 63 Ca 0.00 -1.17 -0.16 0.00 -1.72 0.00 0.00 55.73 52.68 1lnw s ARG 63 Cb 0.00 -0.85 -0.01 0.00 -0.45 0.00 0.00 34.95 33.64 1lnw s ARG 63 CO 0.00 0.16 1.11 0.16 -0.68 0.00 0.00 175.30 176.05 1lnw s ASP 64 N -2.31 5.26 0.28 0.23 -4.77 -1.26 -4.47 116.67 109.63 1lnw s ASP 64 Ca 0.06 2.00 0.02 0.00 -3.30 0.00 0.00 52.55 51.33 1lnw s ASP 64 Cb -0.06 -2.55 0.62 0.00 -1.09 0.00 0.00 42.92 39.84 1lnw s ASP 64 CO 0.02 -1.52 1.77 0.07 0.70 0.00 0.00 175.17 176.21 1lnw h LYS 65 N 0.22 0.69 -0.37 2.11 -0.00 -1.93 -1.89 116.57 115.39 1lnw h LYS 65 Ca -0.47 -0.04 0.05 0.00 -0.00 0.00 0.00 60.65 60.19 1lnw h LYS 65 Cb 1.25 -0.15 -0.05 0.00 -0.00 0.00 0.00 32.23 33.27 1lnw h LYS 65 CO 0.55 0.45 0.08 0.00 -0.00 0.00 0.00 179.45 180.53 1lnw h ALA 66 N 1.59 0.41 -0.42 0.07 0.00 -1.99 0.64 119.26 119.56 1lnw h ALA 66 Ca 0.51 0.07 -0.10 0.00 0.00 0.00 0.00 54.91 55.39 1lnw h ALA 66 Cb 0.74 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1lnw h ALA 66 CO -0.37 -0.32 -0.14 1.25 0.00 0.00 0.00 179.25 179.67 1lnw h LEU 67 N 0.21 0.85 -0.73 0.00 6.46 -1.76 -2.70 115.31 117.64 1lnw h LEU 67 Ca 0.18 -0.38 -0.10 0.00 -0.12 0.00 0.00 57.88 57.46 1lnw h LEU 67 Cb 0.20 -0.23 -0.02 0.00 -0.73 0.00 0.00 40.66 39.88 1lnw h LEU 67 CO -0.23 1.04 -0.13 0.40 -0.62 0.00 0.00 178.44 178.91 1lnw h ILE 68 N 0.66 1.26 -0.46 4.05 1.08 -0.91 -2.10 117.51 121.09 1lnw h ILE 68 Ca 0.10 -1.22 0.00 0.00 -0.39 0.00 0.00 64.86 63.36 1lnw h ILE 68 Cb 0.69 1.05 -0.02 0.00 -3.07 0.00 0.00 36.82 35.46 1lnw h ILE 68 CO 0.05 0.42 0.30 0.74 -0.69 0.00 0.00 178.15 178.97 1lnw h THR 69 N 0.75 1.12 -0.63 -0.27 2.02 0.36 -1.04 112.91 115.22 1lnw h THR 69 Ca 0.12 -0.21 -0.04 0.00 0.77 0.00 0.00 66.41 67.05 1lnw h THR 69 Cb 0.63 0.44 -0.03 0.00 -1.74 0.00 0.00 68.15 67.46 1lnw h THR 69 CO 0.04 0.11 0.24 0.03 0.37 0.00 0.00 175.52 176.32 1lnw h ARG 70 N 0.62 0.96 -0.58 6.66 3.08 -1.23 -0.83 114.38 123.06 1lnw h ARG 70 Ca 0.17 -0.18 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 1lnw h ARG 70 Cb -0.07 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 29.80 1lnw h ARG 70 CO -0.04 0.81 0.27 -0.22 -1.07 0.00 0.00 179.97 179.73 1lnw h LYS 71 N 0.89 0.84 -0.45 0.04 1.63 -1.04 -1.56 116.57 116.93 1lnw h LYS 71 Ca 0.21 -0.13 -0.10 0.00 -0.85 0.00 0.00 60.65 59.78 1lnw h LYS 71 Cb 0.22 -0.15 -0.02 0.00 -0.60 0.00 0.00 32.23 31.69 1lnw h LYS 71 CO -0.02 0.69 -0.14 0.82 -3.45 0.00 0.00 179.45 177.36 1lnw h ILE 72 N 0.79 1.26 -0.58 2.00 1.08 -0.96 -0.60 117.51 120.50 1lnw h ILE 72 Ca 0.20 -1.23 -0.02 0.00 -0.39 0.00 0.00 64.86 63.41 1lnw h ILE 72 Cb 0.13 1.07 -0.03 0.00 -3.07 0.00 0.00 36.82 34.92 1lnw h ILE 72 CO -0.02 0.42 0.27 -0.09 -0.69 0.00 0.00 178.15 178.03 1lnw h ARG 73 N 0.74 0.83 -0.18 2.37 2.43 -0.83 0.36 114.38 120.09 1lnw h ARG 73 Ca 0.12 -0.11 -0.06 0.00 -0.81 0.00 0.00 59.98 59.11 1lnw h ARG 73 Cb 0.65 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 30.04 1lnw h ARG 73 CO 0.05 0.65 -0.14 1.49 -1.51 0.00 0.00 179.97 180.51 1lnw h GLU 74 N 0.82 0.41 -0.14 0.20 4.81 -0.88 -1.19 114.58 118.62 1lnw h GLU 74 Ca 0.20 -0.20 -0.05 0.00 -0.13 0.00 0.00 59.36 59.18 1lnw h GLU 74 Cb 0.11 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 1lnw h GLU 74 CO -0.02 0.75 -0.13 -0.07 -0.73 0.00 0.00 179.01 178.81 1lnw h LEU 75 N 0.08 0.21 -0.06 1.64 3.38 -0.49 -1.01 115.31 119.06 1lnw h LEU 75 Ca 0.03 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1lnw h LEU 75 Cb 0.66 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 1lnw h LEU 75 CO 0.04 0.36 -0.02 -0.33 0.09 0.00 0.00 178.44 178.58 1lnw h GLU 76 N 0.21 0.12 -0.08 1.13 5.08 -0.18 -1.51 114.58 119.35 1lnw h GLU 76 Ca 0.04 -0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1lnw h GLU 76 Cb 0.36 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.60 1lnw h GLU 76 CO 0.02 0.46 0.09 0.78 -1.00 0.00 0.00 179.01 179.36 1lnw h GLY 77 N -0.24 0.00 -0.87 -3.84 0.00 -0.77 0.34 103.07 97.69 1lnw h GLY 77 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1lnw h GLY 77 CO 0.01 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.09 1lnw n ARG 78 N -3.85 1.77 -3.40 4.80 1.74 -0.42 -4.94 116.66 112.36 1lnw n ARG 78 Ca -0.01 -1.16 -0.23 0.00 -0.77 0.00 0.00 57.85 55.68 1lnw n ARG 78 Cb 0.19 -1.41 0.07 0.00 -1.02 0.00 0.00 32.46 30.28 1lnw n ARG 78 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1lnw n ASN 79 N 0.38 -6.29 -0.04 0.55 5.15 0.12 -4.88 115.26 110.25 1lnw n ASN 79 Ca 0.17 -0.45 -0.02 0.00 -0.60 0.00 0.00 54.58 53.67 1lnw n ASN 79 Cb 0.35 -4.97 -0.09 0.00 -0.53 0.00 0.00 39.78 34.54 1lnw n ASN 79 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1lnw n LEU 80 N -4.65 0.00 -4.07 1.20 4.77 -0.60 -4.23 117.00 109.42 1lnw n LEU 80 Ca -0.03 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.82 1lnw n LEU 80 Cb 0.58 0.20 -0.11 0.00 -2.33 0.00 0.00 43.42 41.75 1lnw n LEU 80 CO 0.59 0.20 -0.40 -0.69 -1.33 0.00 0.00 177.39 175.75 1lnw s VAL 81 N -2.43 0.56 0.03 4.08 1.01 -1.14 -1.66 120.40 120.85 1lnw s VAL 81 Ca -0.05 -1.13 0.02 0.00 0.00 0.00 0.00 61.98 60.81 1lnw s VAL 81 Cb 0.05 -0.68 -0.02 0.00 0.00 0.00 0.00 36.38 35.73 1lnw s VAL 81 CO 0.47 -0.41 -0.06 0.00 0.00 0.00 0.00 175.10 175.10 1lnw s ARG 82 N -1.71 0.45 0.05 2.72 1.70 -0.50 -3.97 118.95 117.70 1lnw s ARG 82 Ca -0.09 -0.59 0.01 0.00 -0.47 0.00 0.00 55.73 54.59 1lnw s ARG 82 Cb -0.09 -0.25 -0.04 0.00 -0.57 0.00 0.00 34.95 34.00 1lnw s ARG 82 CO 0.00 0.05 0.15 1.03 -1.08 0.00 0.00 175.30 175.45 1lnw s ARG 83 N -1.20 3.22 -0.36 3.89 0.52 -1.26 -1.87 118.95 121.88 1lnw s ARG 83 Ca -0.08 -0.51 0.05 0.00 -0.52 0.00 0.00 55.73 54.67 1lnw s ARG 83 Cb -0.08 -2.92 0.19 0.00 0.52 0.00 0.00 34.95 32.65 1lnw s ARG 83 CO 0.00 0.61 0.68 -2.00 0.02 0.00 0.00 175.30 174.61 1lnw s GLU 84 N -2.31 0.64 0.06 3.54 2.12 0.06 -4.95 118.70 117.85 1lnw s GLU 84 Ca 0.31 0.02 0.00 0.00 0.36 0.00 0.00 54.97 55.66 1lnw s GLU 84 Cb -0.13 0.13 0.00 0.00 0.26 0.00 0.00 34.13 34.40 1lnw s GLU 84 CO 0.23 -1.00 0.09 -2.13 -0.54 0.00 0.00 175.26 171.91 1lnw n ARG 91 N 4.68 0.00 -4.09 4.30 0.63 -1.26 0.28 116.66 121.21 1lnw n ARG 91 Ca 0.09 0.08 -0.11 0.00 -0.92 0.00 0.00 57.85 56.99 1lnw n ARG 91 Cb 0.57 -0.24 -0.11 0.00 0.45 0.00 0.00 32.46 33.13 1lnw n ARG 91 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 1lnw s SER 92 N -1.86 0.82 -0.19 6.15 1.04 -1.26 -5.15 113.70 113.26 1lnw s SER 92 Ca 0.00 -0.74 -0.10 0.00 0.48 0.00 0.00 55.95 55.59 1lnw s SER 92 Cb 0.00 0.08 -0.05 0.00 0.10 0.00 0.00 66.02 66.15 1lnw s SER 92 CO 0.00 -0.35 0.14 -0.36 0.98 0.00 0.00 173.24 173.66 1lnw s PHE 93 N -2.41 3.44 0.26 5.02 0.40 -1.26 -5.07 117.98 118.36 1lnw s PHE 93 Ca -0.02 0.38 -0.12 0.00 -0.60 0.00 0.00 56.93 56.57 1lnw s PHE 93 Cb -0.03 -2.15 -0.08 0.00 0.51 0.00 0.00 43.02 41.27 1lnw s PHE 93 CO -0.03 0.34 0.63 -0.65 0.70 0.00 0.00 175.22 176.21 1lnw s GLN 94 N 0.19 3.90 -0.12 0.44 -0.21 0.81 -3.30 119.66 121.37 1lnw s GLN 94 Ca 0.09 0.45 -0.02 0.00 0.02 0.00 0.00 55.36 55.91 1lnw s GLN 94 Cb -0.11 -2.58 -0.03 0.00 1.00 0.00 0.00 33.01 31.29 1lnw s GLN 94 CO -0.01 0.26 -0.03 -0.51 -2.12 0.00 0.00 175.29 172.88 1lnw s LEU 95 N -2.83 3.32 0.05 2.90 1.43 0.43 -0.76 118.68 123.22 1lnw s LEU 95 Ca 0.50 -0.04 0.03 0.00 -1.03 0.00 0.00 54.13 53.59 1lnw s LEU 95 Cb -0.11 -1.77 -0.02 0.00 0.03 0.00 0.00 46.19 44.31 1lnw s LEU 95 CO 0.20 0.26 -0.09 -0.36 0.23 0.00 0.00 176.35 176.58 1lnw s PHE 96 N -0.21 0.81 0.31 0.29 0.40 -0.78 -3.78 117.98 115.02 1lnw s PHE 96 Ca 0.04 -0.46 -0.19 0.00 -0.60 0.00 0.00 56.93 55.72 1lnw s PHE 96 Cb -0.13 -0.48 -0.09 0.00 0.51 0.00 0.00 43.02 42.83 1lnw s PHE 96 CO 0.02 -0.04 0.81 -0.51 0.70 0.00 0.00 175.22 176.20 1lnw s LEU 97 N -1.51 4.17 0.00 -0.37 1.02 -1.26 -1.41 118.68 119.31 1lnw s LEU 97 Ca -0.07 1.49 -0.06 0.00 0.02 0.00 0.00 54.13 55.51 1lnw s LEU 97 Cb -0.09 -4.01 0.18 0.00 0.02 0.00 0.00 46.19 42.28 1lnw s LEU 97 CO 0.01 -0.14 1.13 0.35 0.02 0.00 0.00 176.35 177.72 1lnw n THR 98 N 0.05 0.00 -0.25 5.49 -2.24 -0.67 -4.80 114.28 111.87 1lnw n THR 98 Ca 0.02 -1.38 -0.05 0.00 -2.27 0.00 0.00 64.05 60.37 1lnw n THR 98 Cb 0.52 -1.10 0.09 0.00 -2.10 0.00 0.00 70.33 67.74 1lnw n THR 98 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 1lnw h ASP 99 N -1.02 1.03 -0.40 3.42 1.82 -1.89 0.61 116.42 119.99 1lnw h ASP 99 Ca -0.37 -0.17 -0.10 0.00 -0.39 0.00 0.00 57.03 56.00 1lnw h ASP 99 Cb 1.22 -0.27 -0.02 0.00 0.68 0.00 0.00 39.33 40.95 1lnw h ASP 99 CO 0.34 0.93 -0.10 -0.08 -1.61 0.00 0.00 179.24 178.72 1lnw h GLU 100 N 1.08 0.85 -0.83 0.28 4.81 -1.90 -2.61 114.58 116.26 1lnw h GLU 100 Ca 0.24 -0.29 -0.02 0.00 -0.13 0.00 0.00 59.36 59.16 1lnw h GLU 100 Cb 0.24 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.52 1lnw h GLU 100 CO -0.02 0.91 0.43 0.78 -0.73 0.00 0.00 179.01 180.39 1lnw h GLY 101 N 0.97 1.26 0.96 1.92 0.00 -1.35 -0.15 103.07 106.69 1lnw h GLY 101 Ca 0.13 -0.60 -0.05 0.00 0.00 0.00 0.00 47.33 46.81 1lnw h GLY 101 CO 0.04 0.57 0.10 1.41 0.00 0.00 0.00 176.54 178.67 1lnw h LEU 102 N 1.17 0.71 -0.05 3.11 3.38 -0.73 -0.42 115.31 122.48 1lnw h LEU 102 Ca 0.29 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1lnw h LEU 102 Cb 0.08 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 1lnw h LEU 102 CO -0.04 0.76 -0.01 0.00 0.09 0.00 0.00 178.44 179.24 1lnw h ALA 103 N 0.97 0.06 -0.47 1.53 0.00 -1.20 -0.41 119.26 119.75 1lnw h ALA 103 Ca 0.14 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.86 1lnw h ALA 103 Cb 0.34 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1lnw h ALA 103 CO 0.00 -0.23 0.30 0.97 0.00 0.00 0.00 179.25 180.30 1lnw h ILE 104 N -0.26 1.10 -0.84 0.00 6.09 -1.01 -1.28 117.51 121.32 1lnw h ILE 104 Ca 0.01 -0.21 0.07 0.00 -1.37 0.00 0.00 64.86 63.36 1lnw h ILE 104 Cb 0.40 0.43 -0.06 0.00 0.47 0.00 0.00 36.82 38.06 1lnw h ILE 104 CO 0.00 0.11 0.51 -0.74 -3.07 0.00 0.00 178.15 174.97 1lnw h HIS 105 N 0.61 0.95 -0.27 2.19 2.76 -1.00 -0.92 115.15 119.46 1lnw h HIS 105 Ca 0.18 0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 58.32 1lnw h HIS 105 Cb -0.04 -0.30 -0.02 0.00 1.55 0.00 0.00 27.41 28.60 1lnw h HIS 105 CO -0.05 0.47 -0.09 0.37 -1.30 0.00 0.00 177.93 177.32 1lnw h GLN 106 N 0.93 0.45 0.32 5.26 5.75 -0.09 -0.84 115.11 126.89 1lnw h GLN 106 Ca 0.37 -0.11 -0.02 0.00 -0.15 0.00 0.00 58.65 58.74 1lnw h GLN 106 Cb 0.20 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 28.69 1lnw h GLN 106 CO -0.18 0.55 -0.16 0.45 -2.65 0.00 0.00 178.83 176.84 1lnw h HIS 107 N 0.42 -0.40 -0.98 3.99 3.86 -0.13 -2.44 115.15 119.46 1lnw h HIS 107 Ca 0.08 -0.01 0.11 0.00 -1.16 0.00 0.00 60.37 59.39 1lnw h HIS 107 Cb 0.43 0.13 -0.08 0.00 1.06 0.00 0.00 27.41 28.95 1lnw h HIS 107 CO 0.01 -0.18 0.62 0.00 0.86 0.00 0.00 177.93 179.24 1lnw h ALA 108 N 0.10 1.53 -0.52 2.45 0.00 -0.95 -1.95 119.26 119.93 1lnw h ALA 108 Ca -0.04 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.89 1lnw h ALA 108 Cb 0.40 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1lnw h ALA 108 CO 0.07 0.25 0.33 1.49 0.00 0.00 0.00 179.25 181.39 1lnw h GLU 109 N 1.00 0.65 -0.67 0.00 4.57 -0.86 -2.37 114.58 116.89 1lnw h GLU 109 Ca 0.47 -0.04 -0.05 0.00 -1.18 0.00 0.00 59.36 58.56 1lnw h GLU 109 Cb 0.42 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.84 1lnw h GLU 109 CO -0.23 0.43 0.21 0.00 -1.18 0.00 0.00 179.01 178.24 1lnw h ALA 110 N 1.21 0.88 0.00 2.92 0.00 -0.91 -1.57 119.26 121.78 1lnw h ALA 110 Ca 0.20 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1lnw h ALA 110 Cb -0.03 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.50 1lnw h ALA 110 CO -0.07 0.55 0.00 -0.89 0.00 0.00 0.00 179.25 178.84 1lnw n ILE 111 N -4.34 0.17 0.00 0.00 5.41 -0.81 -1.74 119.36 118.05 1lnw n ILE 111 Ca 0.05 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.80 1lnw n ILE 111 Cb 0.21 -0.47 0.00 0.00 -0.71 0.00 0.00 39.64 38.67 1lnw n ILE 111 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1lnw n SER 113 N 0.74 0.00 -0.19 4.38 3.41 -0.59 -1.56 113.62 119.81 1lnw n SER 113 Ca 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.52 1lnw n SER 113 Cb 0.10 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.06 1lnw n SER 113 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1lnw h ARG 114 N 0.00 0.89 -0.53 4.33 2.43 -1.61 0.48 114.38 120.38 1lnw h ARG 114 Ca 0.00 -0.25 -0.05 0.00 -0.81 0.00 0.00 59.98 58.87 1lnw h ARG 114 Cb 0.00 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.43 1lnw h ARG 114 CO 0.00 0.89 0.14 0.28 -1.51 0.00 0.00 179.97 179.76 1lnw h VAL 115 N 0.77 1.24 -0.14 0.20 2.07 -1.55 -1.95 116.25 116.88 1lnw h VAL 115 Ca 0.16 -0.84 -0.10 0.00 0.82 0.00 0.00 66.70 66.73 1lnw h VAL 115 Cb 0.44 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 1lnw h VAL 115 CO 0.02 0.31 -0.35 0.45 0.02 0.00 0.00 177.57 178.01 1lnw h HIS 116 N 0.74 0.34 -0.49 1.57 3.86 -1.79 -2.29 115.15 117.09 1lnw h HIS 116 Ca 0.17 -0.08 -0.05 0.00 -1.16 0.00 0.00 60.37 59.24 1lnw h HIS 116 Cb 0.32 -0.08 -0.02 0.00 1.06 0.00 0.00 27.41 28.69 1lnw h HIS 116 CO 0.02 0.61 0.10 -0.44 0.86 0.00 0.00 177.93 179.08 1lnw h ASP 117 N 0.26 0.77 0.02 2.45 3.32 -0.59 -1.08 116.42 121.57 1lnw h ASP 117 Ca 0.03 -0.25 -0.07 0.00 0.02 0.00 0.00 57.03 56.76 1lnw h ASP 117 Cb 0.74 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.08 1lnw h ASP 117 CO 0.06 0.82 -0.20 1.05 -1.72 0.00 0.00 179.24 179.25 1lnw h GLU 118 N 0.69 0.32 -0.40 3.56 4.11 -1.23 0.17 114.58 121.79 1lnw h GLU 118 Ca 0.15 -0.10 -0.08 0.00 0.07 0.00 0.00 59.36 59.40 1lnw h GLU 118 Cb 0.37 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 1lnw h GLU 118 CO 0.01 0.51 -0.08 1.25 0.07 0.00 0.00 179.01 180.77 1lnw h LEU 119 N 0.29 0.75 0.00 3.06 5.85 -0.99 -3.31 115.31 120.97 1lnw h LEU 119 Ca 0.05 -0.35 0.00 0.00 0.84 0.00 0.00 57.88 58.42 1lnw h LEU 119 Cb 0.52 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.35 1lnw h LEU 119 CO 0.03 0.93 -1.07 0.49 -0.34 0.00 0.00 178.44 178.48 1lnw n PHE 120 N -4.36 0.53 -0.29 1.25 0.99 -0.45 -4.48 117.46 110.65 1lnw n PHE 120 Ca -0.01 0.16 0.07 0.00 -0.00 0.00 0.00 57.45 57.67 1lnw n PHE 120 Cb 0.34 -0.67 0.23 0.00 -1.00 0.00 0.00 39.48 38.39 1lnw n PHE 120 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1lnw h ALA 121 N 2.28 1.28 0.00 4.37 0.00 -0.75 -1.45 119.26 124.98 1lnw h ALA 121 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1lnw h ALA 121 Cb 0.86 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1lnw h ALA 121 CO 0.00 -0.11 0.00 -1.00 0.00 0.00 0.00 179.25 178.14 1lnw h PRO 122 N 0.60 0.00 -6.52 0.00 0.13 -1.78 -3.43 132.00 121.00 1lnw h PRO 122 Ca 0.47 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 65.07 1lnw h PRO 122 Cb 0.68 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.78 1lnw h PRO 122 CO -0.37 0.00 0.07 -0.51 -0.23 0.00 0.00 178.00 176.95 1lnw s LEU 123 N -4.70 4.33 0.82 1.56 1.43 -0.55 -5.06 118.68 116.51 1lnw s LEU 123 Ca -0.01 1.34 -0.11 0.00 -1.03 0.00 0.00 54.13 54.31 1lnw s LEU 123 Cb 0.07 -3.53 0.08 0.00 0.03 0.00 0.00 46.19 42.85 1lnw s LEU 123 CO 0.26 0.04 1.09 0.28 0.23 0.00 0.00 176.35 178.25 1lnw s THR 124 N -1.52 3.08 0.36 5.49 -1.32 -1.26 -4.77 115.64 115.70 1lnw s THR 124 Ca 0.42 0.35 0.07 0.00 -1.21 0.00 0.00 61.69 61.32 1lnw s THR 124 Cb -0.16 -2.92 0.30 0.00 -1.51 0.00 0.00 72.50 68.22 1lnw s THR 124 CO 0.20 -0.46 1.93 -0.65 -2.21 0.00 0.00 174.62 173.44 1lnw h PRO 125 N -1.25 0.70 -0.31 7.08 0.11 -1.97 -0.68 132.00 135.69 1lnw h PRO 125 Ca -0.47 -0.04 -0.18 0.00 0.11 0.00 0.00 66.00 65.42 1lnw h PRO 125 Cb 1.26 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 1lnw h PRO 125 CO 0.55 0.46 -0.51 0.28 -0.21 0.00 0.00 178.00 178.57 1lnw h VAL 126 N 0.72 1.27 -0.74 3.15 2.07 -1.99 -2.00 116.25 118.73 1lnw h VAL 126 Ca 0.35 -1.70 -0.06 0.00 0.82 0.00 0.00 66.70 66.11 1lnw h VAL 126 Cb 0.42 1.58 -0.03 0.00 -1.52 0.00 0.00 31.29 31.74 1lnw h VAL 126 CO -0.13 0.56 0.22 -0.33 0.02 0.00 0.00 177.57 177.91 1lnw h GLU 127 N 0.68 1.16 0.15 1.57 5.08 -1.71 -1.61 114.58 119.90 1lnw h GLU 127 Ca 0.02 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.12 1lnw h GLU 127 Cb 1.12 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.20 1lnw h GLU 127 CO 0.12 0.99 -0.07 1.96 -1.00 0.00 0.00 179.01 181.00 1lnw h GLN 128 N 1.11 -0.19 -0.97 2.33 4.20 -1.08 0.14 115.11 120.65 1lnw h GLN 128 Ca 0.24 0.01 0.05 0.00 0.06 0.00 0.00 58.65 59.01 1lnw h GLN 128 Cb 0.32 0.04 -0.06 0.00 0.30 0.00 0.00 27.48 28.09 1lnw h GLN 128 CO -0.01 -0.06 0.63 0.00 -0.67 0.00 0.00 178.83 178.72 1lnw h ALA 129 N 0.56 1.41 -0.49 3.87 0.00 -1.30 -0.65 119.26 122.66 1lnw h ALA 129 Ca -0.02 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 1lnw h ALA 129 Cb 0.22 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1lnw h ALA 129 CO 0.03 0.47 -0.21 1.15 0.00 0.00 0.00 179.25 180.70 1lnw h THR 130 N 1.17 1.27 -0.90 0.00 2.02 -1.03 -2.61 112.91 112.83 1lnw h THR 130 Ca 0.40 -1.37 0.01 0.00 0.77 0.00 0.00 66.41 66.22 1lnw h THR 130 Cb 0.10 1.10 -0.05 0.00 -1.74 0.00 0.00 68.15 67.56 1lnw h THR 130 CO -0.14 0.48 0.59 0.25 0.37 0.00 0.00 175.52 177.07 1lnw h LEU 131 N 0.87 1.02 -0.49 2.58 6.46 0.41 -1.45 115.31 124.71 1lnw h LEU 131 Ca 0.11 -0.02 -0.00 0.00 -0.12 0.00 0.00 57.88 57.85 1lnw h LEU 131 Cb 0.78 -0.25 -0.02 0.00 -0.73 0.00 0.00 40.66 40.44 1lnw h LEU 131 CO 0.07 0.73 0.29 0.58 -0.62 0.00 0.00 178.44 179.49 1lnw h VAL 132 N 1.20 1.15 -0.28 1.05 2.07 -0.98 0.39 116.25 120.85 1lnw h VAL 132 Ca 0.33 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 1lnw h VAL 132 Cb -0.12 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 1lnw h VAL 132 CO -0.08 0.15 0.15 0.45 0.02 0.00 0.00 177.57 178.27 1lnw h HIS 133 N 0.65 0.39 -0.71 1.57 3.86 -1.05 0.18 115.15 120.05 1lnw h HIS 133 Ca 0.18 -0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.36 1lnw h HIS 133 Cb -0.01 -0.12 -0.03 0.00 1.06 0.00 0.00 27.41 28.31 1lnw h HIS 133 CO -0.03 0.33 0.38 -0.07 0.86 0.00 0.00 177.93 179.40 1lnw h LEU 134 N 0.34 0.89 -0.45 2.43 3.38 -1.07 -1.34 115.31 119.49 1lnw h LEU 134 Ca 0.10 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1lnw h LEU 134 Cb 0.07 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1lnw h LEU 134 CO -0.02 0.74 0.14 -0.07 0.09 0.00 0.00 178.44 179.32 1lnw h LEU 135 N 0.98 0.65 -1.48 1.67 3.38 -0.57 -1.78 115.31 118.16 1lnw h LEU 135 Ca 0.25 -0.21 0.07 0.00 0.09 0.00 0.00 57.88 58.08 1lnw h LEU 135 Cb 0.06 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 1lnw h LEU 135 CO -0.04 0.69 0.43 0.44 0.09 0.00 0.00 178.44 180.06 1lnw h ASP 136 N 0.59 0.54 -0.33 -0.43 3.32 -0.33 -0.93 116.42 118.85 1lnw h ASP 136 Ca 0.14 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.17 1lnw h ASP 136 Cb 0.27 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 1lnw h ASP 136 CO -0.00 0.35 0.13 1.56 -1.72 0.00 0.00 179.24 179.56 1lnw h GLN 137 N 0.62 0.55 0.00 3.56 1.08 -0.37 -2.32 115.11 118.22 1lnw h GLN 137 Ca 0.29 -0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.41 1lnw h GLN 137 Cb 0.34 -0.10 0.00 0.00 -0.05 0.00 0.00 27.48 27.67 1lnw h GLN 137 CO -0.09 0.48 0.00 0.00 -0.95 0.00 0.00 178.83 178.27 1lnw s LEU 139 N -2.42 4.06 0.02 0.00 1.43 -0.88 -4.98 118.68 115.91 1lnw s LEU 139 Ca 0.19 0.95 -0.09 0.00 -1.03 0.00 0.00 54.13 54.14 1lnw s LEU 139 Cb 0.12 -3.75 -0.05 0.00 0.03 0.00 0.00 46.19 42.54 1lnw s LEU 139 CO 0.24 -0.18 0.22 0.00 0.23 0.00 0.00 176.35 176.86 1lnw n ALA 140 N -0.60 -1.34 -0.93 4.21 0.00 -1.26 -4.83 120.51 115.75 1lnw n ALA 140 Ca 0.01 0.14 -0.36 0.00 0.00 0.00 0.00 53.44 53.22 1lnw n ALA 140 Cb 0.53 -0.43 0.06 0.00 0.00 0.00 0.00 19.45 19.62 1lnw n ALA 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1lnw n ALA 141 N 0.26 -5.00 -1.36 0.00 0.00 -1.26 -4.65 120.51 108.49 1lnw n ALA 141 Ca 0.05 -0.92 -0.52 0.00 0.00 0.00 0.00 53.44 52.04 1lnw n ALA 141 Cb 0.03 -1.19 -0.11 0.00 0.00 0.00 0.00 19.45 18.18 1lnw n ALA 141 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1lnw n GLN 142 N 1.37 0.25 0.00 0.00 3.00 -1.26 -4.88 117.38 115.86 1lnw n GLN 142 Ca -0.00 0.05 0.00 0.00 -0.01 0.00 0.00 57.00 57.04 1lnw n GLN 142 Cb 0.62 -1.77 0.00 0.00 0.00 0.00 0.00 30.24 29.09 1lnw n GLN 142 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.06 176.71 1lnw n PRO 143 N 7.96 0.00 0.00 -1.09 -0.04 -1.26 -5.06 135.00 135.51 1lnw n PRO 143 Ca 0.55 0.04 0.00 0.00 -0.04 0.00 0.00 63.50 64.05 1lnw n PRO 143 Cb 0.05 -0.32 0.00 0.00 -0.04 0.00 0.00 33.50 33.19 1lnw n PRO 143 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1lnw n LEU 144 N -1.82 0.00 -3.02 1.53 4.77 -1.26 -5.00 117.00 112.20 1lnw n LEU 144 Ca 0.00 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.01 1lnw n LEU 144 Cb 0.00 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1lnw n LEU 144 CO 0.00 0.00 0.33 -0.70 -1.33 0.00 0.00 177.39 175.69 1lnw s GLU 145 N 0.00 0.39 0.00 3.23 2.12 -1.26 -4.99 118.70 118.19 1lnw s GLU 145 Ca 0.00 0.02 0.24 0.00 0.36 0.00 0.00 54.97 55.59 1lnw s GLU 145 Cb 0.00 0.08 0.37 0.00 0.26 0.00 0.00 34.13 34.84 1lnw s GLU 145 CO 0.00 -0.61 1.36 -0.40 -0.54 0.00 0.00 175.26 175.07 1lnw n ASP 146 N 4.44 2.98 0.00 -1.70 5.68 -1.26 -5.37 116.55 121.32 1lnw n ASP 146 Ca 0.08 -1.95 0.00 0.00 -0.50 0.00 0.00 54.79 52.42 1lnw n ASP 146 Cb 0.59 -0.09 0.00 0.00 -1.14 0.00 0.00 41.12 40.48 1lnw n ASP 146 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87