#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v4w s GLU 2 N 0.00 3.40 -0.05 1.45 -1.05 -1.26 -4.96 118.70 116.23 1v4w s GLU 2 Ca 0.00 -0.17 0.04 0.00 -0.15 0.00 0.00 54.97 54.69 1v4w s GLU 2 Cb 0.00 -3.15 -0.02 0.00 -0.44 0.00 0.00 34.13 30.52 1v4w s GLU 2 CO 0.00 0.77 -0.16 -1.58 0.95 0.00 0.00 175.26 175.23 1v4w s TRP 3 N -1.03 2.65 0.69 4.83 0.52 -1.26 -5.14 118.94 120.19 1v4w s TRP 3 Ca 0.16 -0.27 -0.11 0.00 0.02 0.00 0.00 56.10 55.90 1v4w s TRP 3 Cb -0.12 -1.63 0.01 0.00 -1.15 0.00 0.00 33.47 30.58 1v4w s TRP 3 CO 0.05 0.10 1.07 0.95 0.02 0.00 0.00 176.95 179.14 1v4w s THR 4 N -0.58 3.58 0.38 2.01 -4.23 -1.26 -4.92 115.64 110.61 1v4w s THR 4 Ca 0.08 0.45 0.04 0.00 -1.18 0.00 0.00 61.69 61.09 1v4w s THR 4 Cb -0.11 -3.50 0.26 0.00 1.34 0.00 0.00 72.50 70.49 1v4w s THR 4 CO 0.01 -0.64 2.03 1.56 -0.54 0.00 0.00 174.62 177.04 1v4w h GLN 5 N -0.58 0.70 -0.49 3.99 1.08 -2.00 -1.59 115.11 116.23 1v4w h GLN 5 Ca -0.45 -0.04 -0.09 0.00 -1.45 0.00 0.00 58.65 56.62 1v4w h GLN 5 Cb 1.25 -0.16 -0.02 0.00 -0.05 0.00 0.00 27.48 28.50 1v4w h GLN 5 CO 0.63 0.47 -0.04 0.37 -0.95 0.00 0.00 178.83 179.31 1v4w h GLN 6 N 0.73 0.89 -0.47 1.46 5.75 -1.99 -1.41 115.11 120.07 1v4w h GLN 6 Ca 0.20 -0.30 -0.06 0.00 -0.15 0.00 0.00 58.65 58.33 1v4w h GLN 6 Cb -0.08 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.38 1v4w h GLN 6 CO -0.04 0.95 0.07 0.93 -2.65 0.00 0.00 178.83 178.08 1v4w h GLU 7 N 0.75 0.78 -0.66 1.69 5.08 -1.82 -0.75 114.58 119.65 1v4w h GLU 7 Ca 0.13 -0.21 0.05 0.00 -1.00 0.00 0.00 59.36 58.33 1v4w h GLU 7 Cb 0.57 -0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.68 1v4w h GLU 7 CO 0.03 0.80 0.37 0.00 -1.00 0.00 0.00 179.01 179.21 1v4w h ARG 8 N 0.64 0.68 -0.44 2.33 3.08 -1.20 -1.52 114.38 117.95 1v4w h ARG 8 Ca 0.14 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.11 1v4w h ARG 8 Cb 0.40 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 1v4w h ARG 8 CO 0.01 0.45 0.11 0.77 -1.07 0.00 0.00 179.97 180.24 1v4w h SER 9 N 0.70 0.66 -0.05 7.04 0.02 -0.91 -0.96 113.55 120.05 1v4w h SER 9 Ca 0.29 -0.23 0.01 0.00 -0.84 0.00 0.00 61.79 61.02 1v4w h SER 9 Cb 0.16 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 1v4w h SER 9 CO -0.17 0.72 0.01 0.40 -1.14 0.00 0.00 176.83 176.65 1v4w h ILE 10 N 0.58 0.98 -0.29 3.27 2.04 -0.90 -0.24 117.51 122.94 1v4w h ILE 10 Ca 0.14 -0.01 -0.02 0.00 1.00 0.00 0.00 64.86 65.97 1v4w h ILE 10 Cb 0.31 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.32 1v4w h ILE 10 CO 0.00 0.01 0.10 0.40 0.00 0.00 0.00 178.15 178.65 1v4w h ILE 11 N 0.03 1.20 -0.95 -0.67 1.08 -1.20 -1.35 117.51 115.65 1v4w h ILE 11 Ca 0.02 -0.62 0.02 0.00 -0.39 0.00 0.00 64.86 63.89 1v4w h ILE 11 Cb 0.02 1.05 -0.05 0.00 -3.07 0.00 0.00 36.82 34.77 1v4w h ILE 11 CO -0.03 0.21 0.63 0.00 -0.69 0.00 0.00 178.15 178.26 1v4w h ALA 12 N 0.93 1.35 -0.48 1.87 0.00 -1.12 -2.46 119.26 119.35 1v4w h ALA 12 Ca 0.10 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1v4w h ALA 12 Cb 0.23 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1v4w h ALA 12 CO -0.00 0.58 0.12 0.78 0.00 0.00 0.00 179.25 180.72 1v4w h GLY 13 N 1.25 0.83 0.98 0.00 0.00 -0.60 0.03 103.07 105.55 1v4w h GLY 13 Ca 0.36 -0.52 0.00 0.00 0.00 0.00 0.00 47.33 47.17 1v4w h GLY 13 CO -0.09 0.49 0.02 -2.22 0.00 0.00 0.00 176.54 174.74 1v4w h ILE 14 N 0.66 1.03 0.00 2.60 2.04 -0.90 -3.02 117.51 119.91 1v4w h ILE 14 Ca 0.15 -0.08 -0.18 0.00 1.00 0.00 0.00 64.86 65.75 1v4w h ILE 14 Cb 0.33 1.01 -0.02 0.00 -0.74 0.00 0.00 36.82 37.40 1v4w h ILE 14 CO 0.00 0.02 -0.84 -0.26 0.00 0.00 0.00 178.15 177.08 1v4w h PHE 15 N 0.03 0.13 -0.25 1.37 -1.00 -1.33 -2.60 116.94 113.28 1v4w h PHE 15 Ca 0.01 -0.07 0.02 0.00 2.81 0.00 0.00 57.97 60.74 1v4w h PHE 15 Cb 0.02 -0.01 -0.01 0.00 3.61 0.00 0.00 35.95 39.55 1v4w h PHE 15 CO -0.07 0.88 0.17 0.00 -1.61 0.00 0.00 178.31 177.68 1v4w h ALA 16 N 1.10 1.91 -0.13 2.45 0.00 -0.93 -2.93 119.26 120.72 1v4w h ALA 16 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1v4w h ALA 16 Cb 1.46 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1v4w h ALA 16 CO 0.12 0.06 0.00 0.09 0.00 0.00 0.00 179.25 179.52 1v4w n ASN 17 N -4.50 2.38 -4.74 0.00 3.02 -1.15 -5.01 115.26 105.27 1v4w n ASN 17 Ca 0.01 -1.68 -0.41 0.00 -0.03 0.00 0.00 54.58 52.47 1v4w n ASN 17 Cb 0.13 -0.08 -0.03 0.00 -0.61 0.00 0.00 39.78 39.19 1v4w n ASN 17 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1v4w s LEU 18 N -1.06 4.43 -0.79 3.41 2.96 -0.99 -4.97 118.68 121.67 1v4w s LEU 18 Ca 0.19 2.38 -0.20 0.00 -0.22 0.00 0.00 54.13 56.27 1v4w s LEU 18 Cb 0.12 -3.61 0.11 0.00 0.50 0.00 0.00 46.19 43.30 1v4w s LEU 18 CO 0.17 -0.48 1.01 0.21 -1.32 0.00 0.00 176.35 175.94 1v4w s ASN 19 N 0.20 6.41 0.40 3.68 3.84 -1.26 -4.91 114.94 123.30 1v4w s ASN 19 Ca 0.55 -1.59 0.09 0.00 0.21 0.00 0.00 52.86 52.11 1v4w s ASN 19 Cb -0.36 -2.39 0.84 0.00 -0.55 0.00 0.00 41.25 38.79 1v4w s ASN 19 CO 0.39 -1.20 1.99 1.88 -2.79 0.00 0.00 177.10 177.36 1v4w h TYR 20 N 9.14 0.37 0.00 0.43 0.05 -1.96 -0.70 116.97 124.29 1v4w h TYR 20 Ca -0.06 -0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.70 1v4w h TYR 20 Cb 1.05 -0.11 0.00 0.00 1.01 0.00 0.00 36.73 38.67 1v4w h TYR 20 CO 1.05 0.34 0.00 0.93 -1.05 0.00 0.00 178.16 179.43 1v4w h GLU 21 N 0.36 0.00 0.00 4.88 3.07 -1.96 -0.75 114.58 120.18 1v4w h GLU 21 Ca 0.09 0.00 -0.32 0.00 -0.50 0.00 0.00 59.36 58.63 1v4w h GLU 21 Cb 0.16 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 28.03 1v4w h GLU 21 CO -0.00 0.00 -1.82 -3.47 -1.40 0.00 0.00 179.01 172.32 1v4w n ASP 22 N -2.49 1.91 -0.04 1.42 4.64 -0.81 -4.50 116.55 116.68 1v4w n ASP 22 Ca 0.03 0.39 -0.16 0.00 -1.38 0.00 0.00 54.79 53.67 1v4w n ASP 22 Cb 0.34 -0.88 -0.07 0.00 -1.04 0.00 0.00 41.12 39.46 1v4w n ASP 22 CO 0.00 0.00 0.00 0.40 -0.82 0.00 0.00 177.20 176.78 1v4w h ILE 23 N -1.00 1.34 0.40 5.18 1.08 -1.16 -3.02 117.51 120.33 1v4w h ILE 23 Ca -0.48 -1.78 -0.01 0.00 -0.39 0.00 0.00 64.86 62.20 1v4w h ILE 23 Cb 1.39 2.04 -0.01 0.00 -3.07 0.00 0.00 36.82 37.17 1v4w h ILE 23 CO -0.29 0.55 -0.28 1.23 -0.69 0.00 0.00 178.15 178.66 1v4w h GLY 24 N 0.26 -0.72 1.01 5.37 0.00 -1.35 -0.95 103.07 106.70 1v4w h GLY 24 Ca -0.02 0.32 0.01 0.00 0.00 0.00 0.00 47.33 47.63 1v4w h GLY 24 CO 0.11 -0.27 0.61 -2.55 0.00 0.00 0.00 176.54 174.44 1v4w h PRO 25 N -0.67 1.26 -0.66 4.80 0.11 -1.74 -1.95 132.00 133.15 1v4w h PRO 25 Ca -0.04 -0.09 -0.01 0.00 0.11 0.00 0.00 66.00 65.98 1v4w h PRO 25 Cb 0.57 -0.28 -0.03 0.00 0.11 0.00 0.00 31.00 31.37 1v4w h PRO 25 CO 0.02 0.85 0.39 0.87 -0.21 0.00 0.00 178.00 179.91 1v4w h LYS 26 N 1.29 0.90 -0.43 1.05 1.57 -1.37 -0.17 116.57 119.41 1v4w h LYS 26 Ca 0.35 -0.09 -0.08 0.00 -1.87 0.00 0.00 60.65 58.96 1v4w h LYS 26 Cb -0.12 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 31.99 1v4w h LYS 26 CO -0.07 0.65 -0.04 0.00 -0.57 0.00 0.00 179.45 179.42 1v4w h ALA 27 N 1.20 0.59 -0.10 3.86 0.00 -0.93 -1.47 119.26 122.41 1v4w h ALA 27 Ca 0.24 -0.29 -0.17 0.00 0.00 0.00 0.00 54.91 54.69 1v4w h ALA 27 Cb -0.01 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.63 1v4w h ALA 27 CO -0.04 0.41 -0.59 1.25 0.00 0.00 0.00 179.25 180.28 1v4w h LEU 28 N 0.63 0.70 -0.80 0.00 5.85 -1.19 -1.70 115.31 118.80 1v4w h LEU 28 Ca 0.12 -0.65 -0.01 0.00 0.84 0.00 0.00 57.88 58.18 1v4w h LEU 28 Cb 0.55 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 1v4w h LEU 28 CO 0.03 1.24 0.45 0.00 -0.34 0.00 0.00 178.44 179.82 1v4w h ALA 29 N 0.48 1.02 -0.77 1.25 0.00 -1.04 -1.35 119.26 118.85 1v4w h ALA 29 Ca -0.04 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1v4w h ALA 29 Cb 1.24 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 1v4w h ALA 29 CO 0.12 0.52 0.32 -0.09 0.00 0.00 0.00 179.25 180.12 1v4w h ARG 30 N 1.11 1.13 -0.45 0.00 2.43 -1.17 -1.74 114.38 115.69 1v4w h ARG 30 Ca 0.28 -0.20 0.01 0.00 -0.81 0.00 0.00 59.98 59.27 1v4w h ARG 30 Cb 0.01 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.34 1v4w h ARG 30 CO -0.05 0.91 0.28 0.00 -1.51 0.00 0.00 179.97 179.60 1v4w h LEU 32 N 0.56 0.00 0.04 0.00 4.07 -0.86 0.01 115.31 119.13 1v4w h LEU 32 Ca 0.17 0.00 -0.08 0.00 0.08 0.00 0.00 57.88 58.06 1v4w h LEU 32 Cb -0.02 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.72 1v4w h LEU 32 CO -0.06 0.36 -0.36 0.40 -1.08 0.00 0.00 178.44 177.70 1v4w h ILE 33 N 0.00 1.64 0.00 1.22 2.04 -0.99 -3.28 117.51 118.13 1v4w h ILE 33 Ca -0.00 -2.40 -0.17 0.00 1.00 0.00 0.00 64.86 63.29 1v4w h ILE 33 Cb 0.67 3.25 -0.02 0.00 -0.74 0.00 0.00 36.82 39.98 1v4w h ILE 33 CO 0.05 0.63 -0.81 0.58 0.00 0.00 0.00 178.15 178.60 1v4w h VAL 34 N -0.80 1.54 -2.30 1.67 2.07 -0.90 -3.37 116.25 114.16 1v4w h VAL 34 Ca -0.07 -2.80 -0.59 0.00 0.82 0.00 0.00 66.70 64.06 1v4w h VAL 34 Cb 1.23 2.52 -0.40 0.00 -1.52 0.00 0.00 31.29 33.12 1v4w h VAL 34 CO 0.03 0.79 -0.84 -1.22 0.02 0.00 0.00 177.57 176.35 1v4w n TYR 35 N -3.52 1.34 0.26 1.57 4.01 -0.02 -4.99 117.16 115.81 1v4w n TYR 35 Ca -0.00 -3.82 0.13 0.00 -0.16 0.00 0.00 57.90 54.05 1v4w n TYR 35 Cb 0.79 -0.34 0.64 0.00 -0.31 0.00 0.00 39.34 40.12 1v4w n TYR 35 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 1v4w h PRO 36 N 4.59 0.00 0.00 -0.72 0.11 -1.74 -1.52 132.00 132.72 1v4w h PRO 36 Ca 0.16 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.26 1v4w h PRO 36 Cb 0.80 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.91 1v4w h PRO 36 CO 0.60 0.00 -0.04 0.11 -0.21 0.00 0.00 178.00 178.46 1v4w h TRP 37 N 0.00 0.00 0.00 0.65 0.09 -1.91 -0.95 115.95 113.82 1v4w h TRP 37 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.98 1v4w h TRP 37 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.38 1v4w h TRP 37 CO 0.00 0.04 0.00 0.25 0.09 0.00 0.00 178.44 178.82 1v4w n THR 38 N -3.29 0.98 0.31 0.12 -2.24 -0.57 -1.86 114.28 107.72 1v4w n THR 38 Ca -0.02 0.30 0.14 0.00 -2.27 0.00 0.00 64.05 62.20 1v4w n THR 38 Cb 0.19 -1.18 0.62 0.00 -2.10 0.00 0.00 70.33 67.86 1v4w n THR 38 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1v4w h GLN 39 N 0.00 0.00 -0.40 -0.78 4.20 -1.39 -3.18 115.11 113.55 1v4w h GLN 39 Ca 0.00 0.00 0.11 0.00 0.06 0.00 0.00 58.65 58.82 1v4w h GLN 39 Cb 0.27 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 1v4w h GLN 39 CO 0.00 0.00 0.29 -0.09 -0.67 0.00 0.00 178.83 178.36 1v4w h ARG 40 N 0.00 0.03 -0.01 1.46 2.43 -1.57 -1.62 114.38 115.10 1v4w h ARG 40 Ca 0.00 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1v4w h ARG 40 Cb 0.26 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 1v4w h ARG 40 CO 0.00 0.02 -0.18 0.66 -1.51 0.00 0.00 179.97 178.96 1v4w n TYR 41 N -4.43 0.00 -1.72 2.20 4.01 -1.20 -4.14 117.16 111.88 1v4w n TYR 41 Ca 0.07 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.86 1v4w n TYR 41 Cb 0.46 -0.17 0.18 0.00 -0.31 0.00 0.00 39.34 39.50 1v4w n TYR 41 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1v4w n PHE 42 N -0.86 0.04 0.26 -0.72 3.72 -0.61 -4.74 117.46 114.55 1v4w n PHE 42 Ca 0.13 -1.39 0.14 0.00 -0.05 0.00 0.00 57.45 56.28 1v4w n PHE 42 Cb 0.31 -0.24 0.70 0.00 -0.94 0.00 0.00 39.48 39.30 1v4w n PHE 42 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1v4w h GLY 43 N 1.02 0.00 -2.26 1.37 0.00 -1.72 -1.73 103.07 99.75 1v4w h GLY 43 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.31 1v4w h GLY 43 CO 0.02 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.56 1v4w n ALA 44 N -1.86 2.42 0.92 3.60 0.00 -1.26 -4.43 120.51 119.89 1v4w n ALA 44 Ca -0.01 -1.02 0.12 0.00 0.00 0.00 0.00 53.44 52.53 1v4w n ALA 44 Cb 0.10 -0.92 0.21 0.00 0.00 0.00 0.00 19.45 18.85 1v4w n ALA 44 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1v4w n TYR 45 N 1.41 0.14 -0.66 0.00 4.02 -0.65 -5.06 117.16 116.36 1v4w n TYR 45 Ca 0.20 -0.07 0.00 0.00 -0.01 0.00 0.00 57.90 58.02 1v4w n TYR 45 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.90 1v4w n TYR 45 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1v4w n GLY 46 N 1.35 -0.13 3.63 2.72 0.00 -1.26 -4.77 105.19 106.72 1v4w n GLY 46 Ca 0.16 -1.71 -0.43 0.00 0.00 0.00 0.00 46.02 44.05 1v4w n GLY 46 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1v4w s ASP 47 N -4.00 6.39 -0.11 1.61 2.15 -1.26 -4.85 116.67 116.60 1v4w s ASP 47 Ca 0.00 1.59 0.14 0.00 0.43 0.00 0.00 52.55 54.71 1v4w s ASP 47 Cb 0.00 -2.53 0.29 0.00 -0.30 0.00 0.00 42.92 40.38 1v4w s ASP 47 CO 0.00 -1.26 1.14 0.18 -0.17 0.00 0.00 175.17 175.07 1v4w n LEU 48 N 8.43 1.87 0.17 -1.34 4.77 -1.26 -4.24 117.00 125.41 1v4w n LEU 48 Ca 0.19 -2.81 0.03 0.00 -0.03 0.00 0.00 56.01 53.38 1v4w n LEU 48 Cb 0.45 -0.33 0.30 0.00 -2.33 0.00 0.00 43.42 41.51 1v4w n LEU 48 CO 0.65 0.79 0.64 0.77 -1.33 0.00 0.00 177.39 178.91 1v4w h SER 49 N 0.38 0.00 -4.48 -1.43 4.64 -1.93 -3.45 113.55 107.28 1v4w h SER 49 Ca -0.03 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.03 1v4w h SER 49 Cb 1.17 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.10 1v4w h SER 49 CO 0.01 0.45 -0.71 0.42 -0.87 0.00 0.00 176.83 176.13 1v4w s THR 50 N -3.78 0.80 0.27 2.95 -4.23 -1.26 -5.03 115.64 105.36 1v4w s THR 50 Ca -0.01 -1.83 -0.01 0.00 -1.18 0.00 0.00 61.69 58.66 1v4w s THR 50 Cb 0.12 -1.56 0.26 0.00 1.34 0.00 0.00 72.50 72.67 1v4w s THR 50 CO 0.72 -0.76 1.69 -0.65 -0.54 0.00 0.00 174.62 175.08 1v4w h PRO 51 N 3.18 0.32 -0.90 3.99 0.11 -1.99 -0.97 132.00 135.74 1v4w h PRO 51 Ca -0.36 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1v4w h PRO 51 Cb 1.18 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.17 1v4w h PRO 51 CO 0.60 0.21 0.57 -0.44 -0.21 0.00 0.00 178.00 178.74 1v4w h ASP 52 N 0.33 1.05 -0.51 -2.05 3.32 -1.98 -0.71 116.42 115.86 1v4w h ASP 52 Ca 0.48 -0.04 -0.04 0.00 0.02 0.00 0.00 57.03 57.45 1v4w h ASP 52 Cb 0.87 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 40.13 1v4w h ASP 52 CO -0.52 0.78 0.16 0.00 -1.72 0.00 0.00 179.24 177.93 1v4w h ALA 53 N 1.31 0.67 -0.26 3.45 0.00 -1.62 -1.98 119.26 120.83 1v4w h ALA 53 Ca 0.33 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1v4w h ALA 53 Cb -0.11 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1v4w h ALA 53 CO -0.07 0.32 0.07 0.82 0.00 0.00 0.00 179.25 180.39 1v4w h ILE 54 N 0.69 1.21 -0.01 0.00 2.04 -0.98 -1.72 117.51 118.74 1v4w h ILE 54 Ca 0.16 -0.68 -0.02 0.00 1.00 0.00 0.00 64.86 65.32 1v4w h ILE 54 Cb 0.27 1.16 -0.00 0.00 -0.74 0.00 0.00 36.82 37.51 1v4w h ILE 54 CO -0.01 0.22 -0.10 0.11 0.00 0.00 0.00 178.15 178.38 1v4w h LYS 55 N 0.25 0.01 -0.01 2.37 1.57 -1.01 -2.56 116.57 117.18 1v4w h LYS 55 Ca 0.08 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1v4w h LYS 55 Cb 0.27 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1v4w h LYS 55 CO -0.00 0.11 -0.37 0.41 -0.57 0.00 0.00 179.45 179.03 1v4w n GLY 56 N -1.24 -0.35 3.63 3.86 0.00 -0.76 -4.92 105.19 105.41 1v4w n GLY 56 Ca -0.03 -0.51 -0.43 0.00 0.00 0.00 0.00 46.02 45.05 1v4w n GLY 56 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1v4w s ASN 57 N -2.51 6.74 0.34 1.61 3.84 -0.66 -4.90 114.94 119.39 1v4w s ASN 57 Ca 0.21 1.21 0.13 0.00 0.21 0.00 0.00 52.86 54.62 1v4w s ASN 57 Cb 0.19 -2.54 0.60 0.00 -0.55 0.00 0.00 41.25 38.95 1v4w s ASN 57 CO 0.55 -1.02 1.74 0.00 -2.79 0.00 0.00 177.10 175.59 1v4w h ALA 58 N 8.98 1.18 0.02 1.71 0.00 -1.90 -1.61 119.26 127.64 1v4w h ALA 58 Ca -0.25 -0.42 -0.24 0.00 0.00 0.00 0.00 54.91 54.01 1v4w h ALA 58 Cb 1.09 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.81 1v4w h ALA 58 CO 1.03 0.57 -1.00 0.87 0.00 0.00 0.00 179.25 180.72 1v4w h LYS 59 N 0.00 0.42 -0.52 0.00 1.57 -1.91 -1.51 116.57 114.62 1v4w h LYS 59 Ca -0.00 -0.49 -0.09 0.00 -1.87 0.00 0.00 60.65 58.20 1v4w h LYS 59 Cb 0.84 0.15 -0.02 0.00 0.08 0.00 0.00 32.23 33.28 1v4w h LYS 59 CO 0.06 1.15 -0.01 0.82 -0.57 0.00 0.00 179.45 180.90 1v4w h ILE 60 N 0.22 1.26 -0.34 1.86 1.08 -1.82 -1.86 117.51 117.92 1v4w h ILE 60 Ca -0.10 -1.11 0.03 0.00 -0.39 0.00 0.00 64.86 63.29 1v4w h ILE 60 Cb 1.65 0.94 -0.03 0.00 -3.07 0.00 0.00 36.82 36.31 1v4w h ILE 60 CO 0.18 0.39 0.14 0.00 -0.69 0.00 0.00 178.15 178.17 1v4w h ALA 61 N 0.94 0.41 -0.51 1.87 0.00 -1.19 -0.84 119.26 119.94 1v4w h ALA 61 Ca 0.15 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 1v4w h ALA 61 Cb 0.54 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1v4w h ALA 61 CO 0.03 -0.24 0.17 0.00 0.00 0.00 0.00 179.25 179.20 1v4w h ALA 62 N 1.20 1.33 -0.28 0.00 0.00 -1.13 -1.68 119.26 118.70 1v4w h ALA 62 Ca 0.15 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 1v4w h ALA 62 Cb 0.10 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1v4w h ALA 62 CO -0.13 0.49 -0.25 1.25 0.00 0.00 0.00 179.25 180.60 1v4w h HIS 63 N 0.74 0.61 -0.86 0.00 6.17 -0.67 -1.87 115.15 119.27 1v4w h HIS 63 Ca 0.17 -0.13 0.00 0.00 0.71 0.00 0.00 60.37 61.12 1v4w h HIS 63 Cb 0.21 -0.15 -0.04 0.00 2.52 0.00 0.00 27.41 29.95 1v4w h HIS 63 CO 0.01 0.75 0.55 0.78 0.71 0.00 0.00 177.93 180.73 1v4w h GLY 64 N 1.01 1.22 0.91 5.26 0.00 -0.27 0.47 103.07 111.68 1v4w h GLY 64 Ca 0.07 -0.48 -0.05 0.00 0.00 0.00 0.00 47.33 46.87 1v4w h GLY 64 CO 0.05 0.47 0.04 -2.08 0.00 0.00 0.00 176.54 175.02 1v4w h VAL 65 N 1.17 1.24 -0.47 4.60 2.07 -1.15 -1.67 116.25 122.05 1v4w h VAL 65 Ca 0.31 -0.88 0.00 0.00 0.82 0.00 0.00 66.70 66.96 1v4w h VAL 65 Cb -0.10 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 1v4w h VAL 65 CO -0.06 0.29 0.30 0.50 0.02 0.00 0.00 177.57 178.62 1v4w h LYS 66 N 0.41 0.62 -0.74 1.57 3.64 -0.50 -0.56 116.57 121.01 1v4w h LYS 66 Ca 0.10 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.45 1v4w h LYS 66 Cb 0.39 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 32.03 1v4w h LYS 66 CO 0.01 0.42 0.49 0.28 -2.27 0.00 0.00 179.45 178.38 1v4w h VAL 67 N 0.63 1.18 -0.26 2.00 2.07 -0.89 -0.46 116.25 120.53 1v4w h VAL 67 Ca 0.17 -0.34 -0.15 0.00 0.82 0.00 0.00 66.70 67.20 1v4w h VAL 67 Cb -0.06 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 29.80 1v4w h VAL 67 CO -0.04 0.18 -0.43 0.25 0.02 0.00 0.00 177.57 177.55 1v4w h LEU 68 N 1.00 0.69 -1.62 2.57 6.46 -0.89 -0.57 115.31 122.95 1v4w h LEU 68 Ca 0.27 -0.32 -0.03 0.00 -0.12 0.00 0.00 57.88 57.69 1v4w h LEU 68 Cb -0.11 -0.19 -0.00 0.00 -0.73 0.00 0.00 40.66 39.63 1v4w h LEU 68 CO -0.06 1.03 -0.12 0.45 -0.62 0.00 0.00 178.44 179.11 1v4w h HIS 69 N 0.52 0.00 -0.16 1.25 3.86 -0.93 -1.39 115.15 118.31 1v4w h HIS 69 Ca 0.04 0.00 0.05 0.00 -1.16 0.00 0.00 60.37 59.29 1v4w h HIS 69 Cb 0.96 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.43 1v4w h HIS 69 CO 0.04 0.12 0.26 0.78 0.86 0.00 0.00 177.93 180.00 1v4w h GLY 70 N 1.48 0.00 2.00 2.45 0.00 0.60 -0.69 103.07 108.91 1v4w h GLY 70 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1v4w h GLY 70 CO 0.02 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.60 1v4w n LEU 71 N -3.45 0.51 -0.00 3.11 4.77 -0.52 -4.01 117.00 117.41 1v4w n LEU 71 Ca 0.01 0.55 -0.03 0.00 -0.03 0.00 0.00 56.01 56.51 1v4w n LEU 71 Cb 0.37 -0.39 0.21 0.00 -2.33 0.00 0.00 43.42 41.28 1v4w n LEU 71 CO 0.23 -0.12 0.78 0.44 -1.33 0.00 0.00 177.39 177.39 1v4w h ASP 72 N 0.00 0.52 0.18 -1.43 3.32 -1.25 -1.69 116.42 116.08 1v4w h ASP 72 Ca 0.00 -0.16 -0.05 0.00 0.02 0.00 0.00 57.03 56.84 1v4w h ASP 72 Cb 0.64 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 1v4w h ASP 72 CO 0.00 0.72 -0.22 0.08 -1.72 0.00 0.00 179.24 178.10 1v4w h ARG 73 N 0.48 0.07 -0.36 3.56 0.11 -1.75 -1.65 114.38 114.84 1v4w h ARG 73 Ca 0.08 -0.02 -0.13 0.00 0.10 0.00 0.00 59.98 60.01 1v4w h ARG 73 Cb 0.59 -0.01 -0.01 0.00 1.11 0.00 0.00 29.97 31.66 1v4w h ARG 73 CO 0.04 0.29 -0.28 0.00 0.10 0.00 0.00 179.97 180.13 1v4w h ALA 74 N 1.71 0.52 -0.92 0.08 0.00 -1.56 -1.89 119.26 117.20 1v4w h ALA 74 Ca 0.01 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1v4w h ALA 74 Cb 0.43 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 1v4w h ALA 74 CO 0.03 0.54 0.59 0.28 0.00 0.00 0.00 179.25 180.69 1v4w h VAL 75 N 0.62 1.24 0.00 0.00 2.07 -1.17 -2.03 116.25 116.98 1v4w h VAL 75 Ca 0.07 -0.48 0.00 0.00 0.82 0.00 0.00 66.70 67.11 1v4w h VAL 75 Cb 0.85 -0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 1v4w h VAL 75 CO 0.07 0.24 0.00 0.11 0.02 0.00 0.00 177.57 178.02 1v4w h LYS 76 N 1.26 0.00 -1.50 1.57 1.57 -1.23 -3.36 116.57 114.88 1v4w h LYS 76 Ca 0.34 0.00 -0.45 0.00 -1.87 0.00 0.00 60.65 58.67 1v4w h LYS 76 Cb -0.11 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 31.80 1v4w h LYS 76 CO -0.07 0.00 -1.10 0.09 -0.57 0.00 0.00 179.45 177.80 1v4w n ASN 77 N -2.83 1.87 0.24 0.86 4.13 -0.72 -4.95 115.26 113.85 1v4w n ASN 77 Ca 0.04 -3.01 0.09 0.00 1.68 0.00 0.00 54.58 53.37 1v4w n ASN 77 Cb 0.44 -0.55 0.60 0.00 -1.54 0.00 0.00 39.78 38.72 1v4w n ASN 77 CO 0.00 0.00 0.00 0.24 0.28 0.00 0.00 177.26 177.78 1v4w h MET 78 N 2.95 0.00 -0.01 3.52 2.86 -1.59 -0.93 114.93 121.73 1v4w h MET 78 Ca 0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1v4w h MET 78 Cb 1.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.68 1v4w h MET 78 CO 0.57 0.17 -0.10 -0.25 1.06 0.00 0.00 176.91 178.36 1v4w n ASP 79 N -3.97 1.09 -2.44 1.22 8.00 -1.26 -4.21 116.55 114.98 1v4w n ASP 79 Ca -0.02 -1.13 -0.08 0.00 0.71 0.00 0.00 54.79 54.28 1v4w n ASP 79 Cb 0.26 0.03 0.04 0.00 -0.02 0.00 0.00 41.12 41.43 1v4w n ASP 79 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1v4w n ASN 80 N -0.34 2.66 -0.18 -2.24 5.03 -0.37 -4.92 115.26 114.90 1v4w n ASN 80 Ca 0.16 -2.64 -0.09 0.00 0.87 0.00 0.00 54.58 52.88 1v4w n ASN 80 Cb 0.32 -0.43 0.01 0.00 -1.02 0.00 0.00 39.78 38.67 1v4w n ASN 80 CO 0.00 0.00 0.00 0.40 -1.83 0.00 0.00 177.26 175.83 1v4w h ILE 81 N 4.42 1.24 -0.31 2.41 2.04 -1.70 -1.31 117.51 124.30 1v4w h ILE 81 Ca 0.03 -0.85 0.06 0.00 1.00 0.00 0.00 64.86 65.10 1v4w h ILE 81 Cb 1.38 0.84 -0.06 0.00 -0.74 0.00 0.00 36.82 38.24 1v4w h ILE 81 CO 0.36 0.31 -0.10 0.78 0.00 0.00 0.00 178.15 179.50 1v4w h ASN 82 N 0.69 -0.36 -0.09 1.72 2.35 -1.91 -2.24 115.58 115.75 1v4w h ASN 82 Ca 0.16 0.10 -0.11 0.00 -0.55 0.00 0.00 56.30 55.90 1v4w h ASN 82 Cb 0.34 0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.91 1v4w h ASN 82 CO 0.00 -0.13 -0.28 -0.33 -1.65 0.00 0.00 177.43 175.04 1v4w h GLU 83 N -0.03 0.54 -0.27 0.81 3.07 -1.93 -2.42 114.58 114.34 1v4w h GLU 83 Ca 0.15 -0.22 0.08 0.00 -0.50 0.00 0.00 59.36 58.87 1v4w h GLU 83 Cb 0.27 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.14 1v4w h GLU 83 CO -0.34 0.78 0.21 0.00 -1.40 0.00 0.00 179.01 178.25 1v4w h ALA 84 N 1.22 2.20 -0.03 3.43 0.00 -0.66 -2.99 119.26 122.43 1v4w h ALA 84 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1v4w h ALA 84 Cb 0.74 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1v4w h ALA 84 CO 0.06 -0.35 0.00 0.66 0.00 0.00 0.00 179.25 179.62 1v4w n TYR 85 N -4.34 0.01 -0.09 0.00 4.02 -0.96 -4.65 117.16 111.15 1v4w n TYR 85 Ca 0.04 -0.01 -0.06 0.00 -0.01 0.00 0.00 57.90 57.85 1v4w n TYR 85 Cb 0.36 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.69 1v4w n TYR 85 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 176.86 176.62 1v4w h SER 86 N 3.11 -0.20 -0.47 7.72 0.02 -1.29 0.51 113.55 122.94 1v4w h SER 86 Ca 0.00 0.08 -0.07 0.00 -0.84 0.00 0.00 61.79 60.96 1v4w h SER 86 Cb 0.66 0.16 -0.02 0.00 0.14 0.00 0.00 62.40 63.35 1v4w h SER 86 CO 0.00 -0.06 0.02 -0.08 -1.14 0.00 0.00 176.83 175.57 1v4w h GLU 87 N 0.05 0.82 -0.22 3.45 4.81 -1.82 -1.58 114.58 120.09 1v4w h GLU 87 Ca 0.15 -0.25 -0.08 0.00 -0.13 0.00 0.00 59.36 59.06 1v4w h GLU 87 Cb 0.22 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 1v4w h GLU 87 CO -0.29 0.86 -0.20 1.25 -0.73 0.00 0.00 179.01 179.89 1v4w h LEU 88 N 0.68 0.38 -0.24 1.64 5.85 -1.70 -1.04 115.31 120.88 1v4w h LEU 88 Ca 0.14 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 1v4w h LEU 88 Cb 0.47 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 1v4w h LEU 88 CO 0.02 0.60 0.11 -1.28 -0.34 0.00 0.00 178.44 177.55 1v4w h SER 89 N 0.35 0.31 -0.73 1.25 0.87 0.39 -1.68 113.55 114.31 1v4w h SER 89 Ca 0.06 -0.13 0.03 0.00 -1.23 0.00 0.00 61.79 60.52 1v4w h SER 89 Cb 0.56 -0.08 -0.05 0.00 -0.44 0.00 0.00 62.40 62.39 1v4w h SER 89 CO 0.04 0.36 0.46 0.58 -0.53 0.00 0.00 176.83 177.73 1v4w h VAL 90 N 0.25 1.09 -0.11 2.23 2.07 -1.05 -0.33 116.25 120.40 1v4w h VAL 90 Ca 0.08 -0.30 0.04 0.00 0.82 0.00 0.00 66.70 67.34 1v4w h VAL 90 Cb 0.13 0.13 -0.05 0.00 -1.52 0.00 0.00 31.29 29.98 1v4w h VAL 90 CO -0.01 0.16 -0.19 0.25 0.02 0.00 0.00 177.57 177.81 1v4w h LEU 91 N 0.89 -0.57 -0.92 2.57 5.85 -1.05 0.18 115.31 122.25 1v4w h LEU 91 Ca 0.30 0.10 -0.11 0.00 0.84 0.00 0.00 57.88 59.01 1v4w h LEU 91 Cb 0.03 0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 1v4w h LEU 91 CO -0.12 -0.24 -0.38 0.45 -0.34 0.00 0.00 178.44 177.82 1v4w h HIS 92 N -0.25 0.37 0.37 1.25 3.86 -0.83 -0.92 115.15 119.00 1v4w h HIS 92 Ca 0.09 -0.10 -0.02 0.00 -1.16 0.00 0.00 60.37 59.19 1v4w h HIS 92 Cb 0.38 -0.08 0.00 0.00 1.06 0.00 0.00 27.41 28.77 1v4w h HIS 92 CO -0.29 0.66 -0.18 1.03 0.86 0.00 0.00 177.93 180.01 1v4w h SER 93 N 0.27 -0.42 0.56 2.45 0.87 -0.85 -0.12 113.55 116.31 1v4w h SER 93 Ca 0.03 0.01 -0.28 0.00 -1.23 0.00 0.00 61.79 60.32 1v4w h SER 93 Cb 0.79 0.11 -0.05 0.00 -0.44 0.00 0.00 62.40 62.81 1v4w h SER 93 CO 0.06 -0.03 -1.61 0.44 -0.53 0.00 0.00 176.83 175.16 1v4w h ASP 94 N -1.03 0.00 0.01 6.23 3.45 -0.72 -2.96 116.42 121.40 1v4w h ASP 94 Ca -0.05 0.00 -0.40 0.00 0.43 0.00 0.00 57.03 57.01 1v4w h ASP 94 Cb 0.38 0.00 -0.06 0.00 -0.56 0.00 0.00 39.33 39.09 1v4w h ASP 94 CO 0.08 0.99 -2.22 1.17 -1.57 0.00 0.00 179.24 177.69 1v4w n LYS 95 N -3.08 0.61 0.06 3.56 3.00 -0.89 -4.69 118.16 116.73 1v4w n LYS 95 Ca -0.15 0.31 0.10 0.00 -0.00 0.00 0.00 58.31 58.57 1v4w n LYS 95 Cb 1.03 -1.57 -0.06 0.00 0.00 0.00 0.00 35.03 34.43 1v4w n LYS 95 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1v4w n LEU 96 N -4.05 0.58 -3.91 3.14 4.77 -0.40 -4.98 117.00 112.14 1v4w n LEU 96 Ca -0.47 0.23 -0.28 0.00 -0.03 0.00 0.00 56.01 55.46 1v4w n LEU 96 Cb 0.88 -0.01 0.01 0.00 -2.33 0.00 0.00 43.42 41.97 1v4w n LEU 96 CO 0.14 -0.08 -0.00 1.41 -1.33 0.00 0.00 177.39 177.53 1v4w n HIS 97 N -2.58 -2.04 -2.85 -1.77 8.25 -0.32 -4.94 115.22 108.97 1v4w n HIS 97 Ca -0.03 0.85 -0.41 0.00 -0.26 0.00 0.00 57.72 57.87 1v4w n HIS 97 Cb 0.60 -3.92 -0.04 0.00 1.12 0.00 0.00 29.99 27.76 1v4w n HIS 97 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1v4w s VAL 98 N -3.49 4.90 -0.01 1.59 1.01 -0.21 -5.00 120.40 119.20 1v4w s VAL 98 Ca 0.41 1.77 -0.30 0.00 0.00 0.00 0.00 61.98 63.86 1v4w s VAL 98 Cb -0.21 -4.19 -0.07 0.00 0.00 0.00 0.00 36.38 31.91 1v4w s VAL 98 CO 0.85 0.11 1.74 -0.62 0.00 0.00 0.00 175.10 177.18 1v4w s ASP 99 N 1.02 6.60 0.15 3.32 -1.08 -1.26 -4.74 116.67 120.67 1v4w s ASP 99 Ca 0.43 2.39 0.19 0.00 -0.52 0.00 0.00 52.55 55.05 1v4w s ASP 99 Cb -0.18 -2.54 0.81 0.00 -1.46 0.00 0.00 42.92 39.55 1v4w s ASP 99 CO 0.19 -0.96 1.58 -0.81 0.52 0.00 0.00 175.17 175.70 1v4w n PRO 100 N 7.02 0.11 0.27 4.34 -0.04 -1.26 -1.22 135.00 144.23 1v4w n PRO 100 Ca 0.18 0.38 0.15 0.00 -0.04 0.00 0.00 63.50 64.17 1v4w n PRO 100 Cb 0.42 -1.72 0.89 0.00 -0.04 0.00 0.00 33.50 33.04 1v4w n PRO 100 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 1v4w h ASP 101 N 0.00 0.00 0.84 3.54 1.82 -2.00 -1.82 116.42 118.79 1v4w h ASP 101 Ca 0.00 0.00 -0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1v4w h ASP 101 Cb 0.28 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.29 1v4w h ASP 101 CO 0.00 0.00 -0.01 0.78 -1.61 0.00 0.00 179.24 178.40 1v4w h ASN 102 N 0.00 0.00 -0.39 2.28 2.35 -1.54 -2.54 115.58 115.74 1v4w h ASN 102 Ca 0.02 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.66 1v4w h ASN 102 Cb 0.13 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.49 1v4w h ASN 102 CO -0.00 0.01 -0.18 -0.26 -1.65 0.00 0.00 177.43 175.35 1v4w h PHE 103 N 0.00 0.94 -0.29 1.19 0.05 -1.51 -0.63 116.94 116.70 1v4w h PHE 103 Ca -0.00 -0.23 0.02 0.00 3.82 0.00 0.00 57.97 61.57 1v4w h PHE 103 Cb 0.44 -0.22 -0.02 0.00 2.00 0.00 0.00 35.95 38.15 1v4w h PHE 103 CO 0.00 0.99 0.15 -0.09 -0.18 0.00 0.00 178.31 179.18 1v4w h ARG 104 N 0.63 0.31 -0.60 1.51 2.43 -1.56 -1.10 114.38 116.00 1v4w h ARG 104 Ca 0.09 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.16 1v4w h ARG 104 Cb 0.73 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.19 1v4w h ARG 104 CO 0.06 0.21 0.07 0.82 -1.51 0.00 0.00 179.97 179.62 1v4w h ILE 105 N 0.32 1.26 -0.88 1.20 2.04 -1.38 -1.40 117.51 118.67 1v4w h ILE 105 Ca 0.12 -1.04 -0.02 0.00 1.00 0.00 0.00 64.86 64.92 1v4w h ILE 105 Cb 0.02 0.76 -0.04 0.00 -0.74 0.00 0.00 36.82 36.82 1v4w h ILE 105 CO -0.07 0.38 0.46 0.25 0.00 0.00 0.00 178.15 179.17 1v4w h LEU 106 N 0.91 1.13 -0.88 1.44 6.46 -0.94 -1.86 115.31 121.56 1v4w h LEU 106 Ca 0.18 -0.12 0.03 0.00 -0.12 0.00 0.00 57.88 57.86 1v4w h LEU 106 Cb 0.46 -0.29 -0.05 0.00 -0.73 0.00 0.00 40.66 40.05 1v4w h LEU 106 CO 0.02 0.92 0.57 1.23 -0.62 0.00 0.00 178.44 180.56 1v4w h GLY 107 N 1.25 1.29 1.19 3.75 0.00 -0.58 0.17 103.07 110.14 1v4w h GLY 107 Ca 0.31 -0.44 -0.10 0.00 0.00 0.00 0.00 47.33 47.10 1v4w h GLY 107 CO -0.05 0.37 -0.07 -0.55 0.00 0.00 0.00 176.54 176.25 1v4w h ASP 108 N 1.11 0.94 -0.47 0.19 3.45 -0.90 -0.01 116.42 120.74 1v4w h ASP 108 Ca 0.35 -0.28 -0.12 0.00 0.43 0.00 0.00 57.03 57.41 1v4w h ASP 108 Cb 0.00 -0.25 -0.02 0.00 -0.56 0.00 0.00 39.33 38.50 1v4w h ASP 108 CO -0.12 1.04 -0.16 0.00 -1.57 0.00 0.00 179.24 178.43 1v4w h LEU 110 N 0.84 0.83 -0.35 0.00 5.85 -0.41 -1.55 115.31 120.52 1v4w h LEU 110 Ca 0.12 -0.11 0.05 0.00 0.84 0.00 0.00 57.88 58.78 1v4w h LEU 110 Cb 0.71 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.49 1v4w h LEU 110 CO 0.05 0.70 0.08 0.74 -0.34 0.00 0.00 178.44 179.68 1v4w h THR 111 N 0.89 0.84 -0.50 1.05 2.02 -0.78 0.30 112.91 116.72 1v4w h THR 111 Ca 0.23 -0.07 0.01 0.00 0.77 0.00 0.00 66.41 67.35 1v4w h THR 111 Cb 0.07 0.61 -0.03 0.00 -1.74 0.00 0.00 68.15 67.07 1v4w h THR 111 CO -0.03 0.04 0.32 0.58 0.37 0.00 0.00 175.52 176.79 1v4w h VAL 112 N 0.21 1.09 -0.51 3.16 2.07 -1.12 0.07 116.25 121.21 1v4w h VAL 112 Ca 0.17 -0.22 -0.10 0.00 0.82 0.00 0.00 66.70 67.36 1v4w h VAL 112 Cb 0.18 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 1v4w h VAL 112 CO -0.21 0.12 -0.09 0.58 0.02 0.00 0.00 177.57 177.98 1v4w h VAL 113 N 0.64 1.26 -0.37 2.57 2.07 -0.92 -1.18 116.25 120.33 1v4w h VAL 113 Ca 0.19 -1.22 -0.16 0.00 0.82 0.00 0.00 66.70 66.34 1v4w h VAL 113 Cb -0.03 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 1v4w h VAL 113 CO -0.07 0.43 -0.38 0.40 0.02 0.00 0.00 177.57 177.97 1v4w h ILE 114 N 0.85 1.27 -0.68 4.57 2.04 -0.68 -1.72 117.51 123.16 1v4w h ILE 114 Ca 0.14 -1.55 -0.01 0.00 1.00 0.00 0.00 64.86 64.43 1v4w h ILE 114 Cb 0.63 1.39 -0.03 0.00 -0.74 0.00 0.00 36.82 38.07 1v4w h ILE 114 CO 0.04 0.52 0.39 0.00 0.00 0.00 0.00 178.15 179.10 1v4w h ALA 115 N 0.83 0.87 -0.58 1.87 0.00 -0.83 -0.18 119.26 121.24 1v4w h ALA 115 Ca 0.06 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1v4w h ALA 115 Cb 0.96 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 1v4w h ALA 115 CO 0.09 0.37 0.26 0.00 0.00 0.00 0.00 179.25 179.98 1v4w h ALA 116 N 1.20 1.37 -0.11 0.00 0.00 -1.01 -1.98 119.26 118.73 1v4w h ALA 116 Ca 0.24 -0.13 -0.23 0.00 0.00 0.00 0.00 54.91 54.79 1v4w h ALA 116 Cb 0.02 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.58 1v4w h ALA 116 CO -0.04 0.49 -0.84 -0.97 0.00 0.00 0.00 179.25 177.88 1v4w h ASN 117 N 0.83 0.92 1.02 0.00 -0.73 -0.54 -3.33 115.58 113.74 1v4w h ASN 117 Ca 0.20 -0.63 0.00 0.00 1.87 0.00 0.00 56.30 57.74 1v4w h ASN 117 Cb 0.11 -0.27 0.00 0.00 0.27 0.00 0.00 38.32 38.43 1v4w h ASN 117 CO -0.02 1.43 -0.74 -0.07 -0.37 0.00 0.00 177.43 177.66 1v4w h LEU 118 N 0.50 0.00 0.00 0.34 3.38 -0.96 -3.49 115.31 115.07 1v4w h LEU 118 Ca -0.07 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1v4w h LEU 118 Cb 1.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.23 1v4w h LEU 118 CO 0.17 0.05 0.00 0.61 0.09 0.00 0.00 178.44 179.36 1v4w n GLY 119 N 1.25 2.95 0.33 0.83 0.00 -0.75 -1.54 105.19 108.26 1v4w n GLY 119 Ca 0.02 0.04 0.19 0.00 0.00 0.00 0.00 46.02 46.27 1v4w n GLY 119 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1v4w h ASP 120 N 0.00 0.00 1.14 1.61 3.32 -1.95 0.14 116.42 120.68 1v4w h ASP 120 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1v4w h ASP 120 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1v4w h ASP 120 CO 0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 1v4w h ALA 121 N 1.83 1.00 -0.57 3.45 0.00 -1.68 -3.34 119.26 119.94 1v4w h ALA 121 Ca 0.02 0.00 -0.71 0.00 0.00 0.00 0.00 54.91 54.22 1v4w h ALA 121 Cb 0.23 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 17.94 1v4w h ALA 121 CO -0.00 0.00 2.50 0.34 0.00 0.00 0.00 179.25 182.09 1v4w n PHE 122 N -2.48 3.90 -1.27 0.00 7.35 0.50 -4.89 117.46 120.58 1v4w n PHE 122 Ca 0.03 -2.95 -0.29 0.00 -0.76 0.00 0.00 57.45 53.49 1v4w n PHE 122 Cb 0.33 -2.44 0.17 0.00 0.35 0.00 0.00 39.48 37.90 1v4w n PHE 122 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1v4w s THR 123 N 2.83 1.99 0.20 -2.13 -4.23 -1.26 -4.79 115.64 108.26 1v4w s THR 123 Ca 0.47 0.00 -0.11 0.00 -1.18 0.00 0.00 61.69 60.88 1v4w s THR 123 Cb 0.09 -2.56 0.12 0.00 1.34 0.00 0.00 72.50 71.49 1v4w s THR 123 CO -0.02 0.00 1.76 0.58 -0.54 0.00 0.00 174.62 176.41 1v4w h VAL 124 N -1.83 0.84 -0.95 2.29 2.07 -1.94 -1.23 116.25 115.51 1v4w h VAL 124 Ca -0.54 -0.16 0.04 0.00 0.82 0.00 0.00 66.70 66.87 1v4w h VAL 124 Cb 1.33 0.34 -0.06 0.00 -1.52 0.00 0.00 31.29 31.39 1v4w h VAL 124 CO 0.59 0.08 0.62 -0.08 0.02 0.00 0.00 177.57 178.80 1v4w h GLU 125 N 0.46 1.15 -0.22 1.57 4.81 -1.98 0.15 114.58 120.52 1v4w h GLU 125 Ca 0.28 -0.07 -0.06 0.00 -0.13 0.00 0.00 59.36 59.38 1v4w h GLU 125 Cb 0.29 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 1v4w h GLU 125 CO -0.25 0.76 -0.12 1.15 -0.73 0.00 0.00 179.01 179.82 1v4w h THR 126 N 1.18 1.31 -0.69 0.32 2.02 -1.80 -1.83 112.91 113.42 1v4w h THR 126 Ca 0.38 -1.19 -0.05 0.00 0.77 0.00 0.00 66.41 66.32 1v4w h THR 126 Cb 0.03 1.62 -0.03 0.00 -1.74 0.00 0.00 68.15 68.03 1v4w h THR 126 CO -0.12 0.37 0.24 -0.61 0.37 0.00 0.00 175.52 175.77 1v4w h GLN 127 N 0.17 1.05 -0.22 6.66 4.15 -0.68 0.40 115.11 126.63 1v4w h GLN 127 Ca 0.05 -0.20 0.03 0.00 0.77 0.00 0.00 58.65 59.30 1v4w h GLN 127 Cb 0.62 -0.17 -0.03 0.00 0.21 0.00 0.00 27.48 28.11 1v4w h GLN 127 CO 0.03 0.88 0.06 0.00 -1.93 0.00 0.00 178.83 177.87 1v4w h ALA 129 N 1.15 0.65 -0.51 0.00 0.00 -1.05 -2.19 119.26 117.31 1v4w h ALA 129 Ca 0.10 -0.33 -0.11 0.00 0.00 0.00 0.00 54.91 54.57 1v4w h ALA 129 Cb 0.09 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1v4w h ALA 129 CO -0.12 0.53 -0.12 0.35 0.00 0.00 0.00 179.25 179.90 1v4w h PHE 130 N 0.74 1.10 -0.53 0.00 3.57 -0.76 -0.96 116.94 120.11 1v4w h PHE 130 Ca 0.12 -0.23 -0.05 0.00 3.53 0.00 0.00 57.97 61.34 1v4w h PHE 130 Cb 0.64 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 1v4w h PHE 130 CO 0.05 1.04 0.13 0.37 -2.23 0.00 0.00 178.31 177.66 1v4w h GLN 131 N 0.85 0.84 -0.82 1.11 5.75 -1.09 0.87 115.11 122.62 1v4w h GLN 131 Ca 0.13 -0.20 0.00 0.00 -0.15 0.00 0.00 58.65 58.43 1v4w h GLN 131 Cb 0.68 -0.11 -0.04 0.00 1.07 0.00 0.00 27.48 29.08 1v4w h GLN 131 CO 0.05 0.80 0.52 -0.22 -2.65 0.00 0.00 178.83 177.33 1v4w h LYS 132 N 0.74 1.10 -0.18 1.69 3.64 -1.10 -0.02 116.57 122.44 1v4w h LYS 132 Ca 0.16 -0.08 -0.02 0.00 -1.27 0.00 0.00 60.65 59.44 1v4w h LYS 132 Cb 0.34 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 1v4w h LYS 132 CO 0.00 0.76 0.03 0.35 -2.27 0.00 0.00 179.45 178.32 1v4w h PHE 133 N 1.13 0.31 -0.70 1.91 3.57 -0.85 -2.21 116.94 120.10 1v4w h PHE 133 Ca 0.30 -0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.71 1v4w h PHE 133 Cb -0.08 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 38.54 1v4w h PHE 133 CO -0.01 0.44 0.26 -0.07 -2.23 0.00 0.00 178.31 176.71 1v4w h LEU 134 N 0.09 0.96 -0.98 0.59 3.38 -0.47 -1.36 115.31 117.52 1v4w h LEU 134 Ca 0.05 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 1v4w h LEU 134 Cb 0.30 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 1v4w h LEU 134 CO 0.00 0.87 0.31 0.00 0.09 0.00 0.00 178.44 179.71 1v4w h ALA 135 N 1.27 1.19 -0.23 1.53 0.00 -0.86 0.22 119.26 122.38 1v4w h ALA 135 Ca 0.23 -0.17 -0.18 0.00 0.00 0.00 0.00 54.91 54.80 1v4w h ALA 135 Cb 0.22 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1v4w h ALA 135 CO -0.02 0.60 -0.56 0.28 0.00 0.00 0.00 179.25 179.55 1v4w h VAL 136 N 1.03 1.29 -0.32 0.00 2.07 -0.92 -1.39 116.25 118.01 1v4w h VAL 136 Ca 0.24 -1.76 -0.07 0.00 0.82 0.00 0.00 66.70 65.94 1v4w h VAL 136 Cb 0.16 1.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 1v4w h VAL 136 CO -0.03 0.56 -0.06 0.58 0.02 0.00 0.00 177.57 178.65 1v4w h VAL 137 N 0.53 1.28 -0.57 2.57 2.07 -0.96 -0.53 116.25 120.65 1v4w h VAL 137 Ca -0.00 -1.09 -0.06 0.00 0.82 0.00 0.00 66.70 66.37 1v4w h VAL 137 Cb 1.17 1.34 -0.03 0.00 -1.52 0.00 0.00 31.29 32.26 1v4w h VAL 137 CO 0.12 0.35 0.12 0.58 0.02 0.00 0.00 177.57 178.76 1v4w h VAL 138 N 0.37 1.24 -0.20 2.57 2.07 -0.51 -0.22 116.25 121.57 1v4w h VAL 138 Ca 0.08 -0.88 -0.01 0.00 0.82 0.00 0.00 66.70 66.71 1v4w h VAL 138 Cb 0.54 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1v4w h VAL 138 CO 0.03 0.33 0.08 0.15 0.02 0.00 0.00 177.57 178.18 1v4w h PHE 139 N 0.85 0.31 -0.78 1.57 3.04 -1.10 -2.49 116.94 118.35 1v4w h PHE 139 Ca 0.18 -0.02 0.02 0.00 3.98 0.00 0.00 57.97 62.13 1v4w h PHE 139 Cb 0.34 -0.09 -0.04 0.00 2.56 0.00 0.00 35.95 38.71 1v4w h PHE 139 CO 0.02 0.36 0.52 0.00 -2.02 0.00 0.00 178.31 177.19 1v4w h ALA 140 N 0.92 1.48 0.00 2.41 0.00 -0.42 -1.07 119.26 122.58 1v4w h ALA 140 Ca 0.07 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1v4w h ALA 140 Cb 0.18 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1v4w h ALA 140 CO -0.01 0.46 -0.14 -0.07 0.00 0.00 0.00 179.25 179.49 1v4w h LEU 141 N 1.01 0.00 -0.50 0.00 3.38 -0.88 -2.85 115.31 115.48 1v4w h LEU 141 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 1v4w h LEU 141 Cb -0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1v4w h LEU 141 CO -0.08 0.14 -0.24 0.61 0.09 0.00 0.00 178.44 178.96 1v4w n GLY 142 N -0.10 -0.61 0.25 0.83 0.00 -0.43 -4.47 105.19 100.66 1v4w n GLY 142 Ca -0.00 -0.40 -0.01 0.00 0.00 0.00 0.00 46.02 45.60 1v4w n GLY 142 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1v4w h ARG 143 N 1.21 0.49 -0.60 1.61 3.08 -1.25 -2.81 114.38 116.10 1v4w h ARG 143 Ca 0.00 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 59.91 1v4w h ARG 143 Cb 0.50 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.50 1v4w h ARG 143 CO 0.00 0.61 0.00 1.63 -1.07 0.00 0.00 179.97 181.14 1v4w n LYS 144 N -4.21 2.59 -2.52 0.04 4.76 -1.26 -4.87 118.16 112.69 1v4w n LYS 144 Ca 0.01 -2.18 -0.41 0.00 -2.87 0.00 0.00 58.31 52.85 1v4w n LYS 144 Cb 0.32 -1.54 -0.04 0.00 -1.84 0.00 0.00 35.03 31.93 1v4w n LYS 144 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1v4w s TYR 145 N -1.36 3.59 0.00 2.13 1.51 -1.06 -4.77 117.35 117.39 1v4w s TYR 145 Ca 0.40 1.57 0.00 0.00 -1.01 0.00 0.00 57.07 58.03 1v4w s TYR 145 Cb 0.22 -3.28 0.00 0.00 -0.11 0.00 0.00 41.96 38.80 1v4w s TYR 145 CO 0.25 -0.63 0.00 -2.39 -1.11 0.00 0.00 175.55 171.67