#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k9s s ASP 2 N 0.00 6.85 0.57 6.12 -4.77 -1.26 -4.85 116.67 119.33 2k9s s ASP 2 Ca 0.00 1.77 0.28 0.00 -3.30 0.00 0.00 52.55 51.31 2k9s s ASP 2 Cb 0.00 -2.55 1.49 0.00 -1.09 0.00 0.00 42.92 40.77 2k9s s ASP 2 CO 0.00 -0.42 1.95 -0.55 0.70 0.00 0.00 175.17 176.85 2k9s h ASN 3 N 2.01 0.00 0.01 2.11 7.08 -2.05 0.85 115.58 125.59 2k9s h ASN 3 Ca -0.49 0.00 -0.00 0.00 -3.08 0.00 0.00 56.30 52.73 2k9s h ASN 3 Cb 1.19 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.43 2k9s h ASN 3 CO 0.61 0.00 -0.01 0.03 -2.08 0.00 0.00 177.43 175.98 2k9s h ARG 4 N 0.00 -0.02 -0.31 4.14 3.08 -1.99 -2.75 114.38 116.54 2k9s h ARG 4 Ca 0.23 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 60.12 2k9s h ARG 4 Cb 1.08 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.13 2k9s h ARG 4 CO -0.00 0.40 -0.44 0.28 -1.07 0.00 0.00 179.97 179.13 2k9s h VAL 5 N -0.44 1.28 -0.85 2.04 2.07 -1.58 -3.11 116.25 115.67 2k9s h VAL 5 Ca -0.00 -1.63 0.10 0.00 0.82 0.00 0.00 66.70 65.99 2k9s h VAL 5 Cb 0.42 1.51 -0.08 0.00 -1.52 0.00 0.00 31.29 31.63 2k9s h VAL 5 CO 0.00 0.53 0.49 -0.09 0.02 0.00 0.00 177.57 178.52 2k9s h ARG 6 N 0.64 0.78 -0.24 1.57 9.65 -0.92 -1.24 114.38 124.62 2k9s h ARG 6 Ca 0.04 -0.05 -0.01 0.00 -1.10 0.00 0.00 59.98 58.86 2k9s h ARG 6 Cb 1.01 -0.18 -0.01 0.00 -1.39 0.00 0.00 29.97 29.41 2k9s h ARG 6 CO 0.10 0.51 0.10 0.93 2.80 0.00 0.00 179.97 184.41 2k9s h GLU 7 N 0.80 0.35 -0.64 0.20 4.39 -1.43 -2.68 114.58 115.57 2k9s h GLU 7 Ca 0.42 -0.06 0.04 0.00 0.34 0.00 0.00 59.36 60.10 2k9s h GLU 7 Cb 0.41 -0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 28.97 2k9s h GLU 7 CO -0.26 0.38 0.42 0.00 -1.16 0.00 0.00 179.01 178.39 2k9s h ALA 8 N 0.95 1.68 -0.70 3.43 0.00 -1.30 -1.53 119.26 121.79 2k9s h ALA 8 Ca 0.08 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.98 2k9s h ALA 8 Cb 0.16 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 2k9s h ALA 8 CO -0.01 0.25 0.46 0.00 0.00 0.00 0.00 179.25 179.95 2k9s h GLN 10 N 0.91 0.79 -0.44 0.00 1.08 -1.16 -2.56 115.11 113.73 2k9s h GLN 10 Ca 0.26 -0.19 -0.11 0.00 -1.45 0.00 0.00 58.65 57.16 2k9s h GLN 10 Cb -0.05 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.27 2k9s h GLN 10 CO -0.06 0.77 -0.15 -0.92 -0.95 0.00 0.00 178.83 177.51 2k9s h TYR 11 N 0.74 1.00 -0.62 2.96 3.20 -1.25 -2.99 116.97 120.01 2k9s h TYR 11 Ca 0.15 -0.23 -0.01 0.00 3.14 0.00 0.00 58.73 61.78 2k9s h TYR 11 Cb 0.40 -0.24 -0.03 0.00 1.54 0.00 0.00 36.73 38.40 2k9s h TYR 11 CO 0.02 1.00 0.34 0.82 -1.64 0.00 0.00 178.16 178.70 2k9s h ILE 12 N 0.71 1.19 -0.58 1.81 2.04 -1.19 -1.99 117.51 119.49 2k9s h ILE 12 Ca 0.11 -0.47 0.06 0.00 1.00 0.00 0.00 64.86 65.56 2k9s h ILE 12 Cb 0.71 0.35 -0.03 0.00 -0.74 0.00 0.00 36.82 37.11 2k9s h ILE 12 CO 0.05 0.21 0.39 -1.28 0.00 0.00 0.00 178.15 177.52 2k9s h SER 13 N 0.86 0.48 -0.05 1.72 0.87 -1.31 -0.65 113.55 115.47 2k9s h SER 13 Ca 0.22 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.69 2k9s h SER 13 Cb 0.02 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 61.87 2k9s h SER 13 CO -0.04 0.31 -0.25 -0.78 -0.53 0.00 0.00 176.83 175.54 2k9s h ASP 14 N 0.54 0.48 -0.42 6.23 1.82 -1.37 -2.42 116.42 121.28 2k9s h ASP 14 Ca 0.25 -0.16 0.00 0.00 -0.39 0.00 0.00 57.03 56.73 2k9s h ASP 14 Cb 0.30 -0.13 0.00 0.00 0.68 0.00 0.00 39.33 40.18 2k9s h ASP 14 CO -0.07 0.72 0.00 1.41 -1.61 0.00 0.00 179.24 179.69 2k9s n HIS 15 N -4.12 1.28 0.17 0.28 8.25 -0.31 -4.32 115.22 116.45 2k9s n HIS 15 Ca -0.00 -0.47 0.06 0.00 -0.26 0.00 0.00 57.72 57.05 2k9s n HIS 15 Cb 0.40 -0.31 0.54 0.00 1.12 0.00 0.00 29.99 31.75 2k9s n HIS 15 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2k9s h LEU 16 N 2.81 0.16 0.00 2.41 5.85 -0.86 -1.99 115.31 123.68 2k9s h LEU 16 Ca 0.00 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 2k9s h LEU 16 Cb 1.35 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.33 2k9s h LEU 16 CO 0.27 0.15 -1.45 0.00 -0.34 0.00 0.00 178.44 177.07 2k9s n ALA 17 N -2.51 2.52 -1.76 1.25 0.00 -1.26 -4.54 120.51 114.21 2k9s n ALA 17 Ca -0.01 -0.41 -0.39 0.00 0.00 0.00 0.00 53.44 52.64 2k9s n ALA 17 Cb 0.11 -0.93 0.01 0.00 0.00 0.00 0.00 19.45 18.64 2k9s n ALA 17 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2k9s s ASP 18 N -5.11 5.85 -0.18 0.00 -1.08 -0.75 -4.86 116.67 110.54 2k9s s ASP 18 Ca -0.04 2.69 -0.22 0.00 -0.52 0.00 0.00 52.55 54.47 2k9s s ASP 18 Cb 0.11 -2.63 -0.19 0.00 -1.46 0.00 0.00 42.92 38.74 2k9s s ASP 18 CO 0.84 -1.17 0.34 0.28 0.52 0.00 0.00 175.17 175.98 2k9s h SER 19 N 2.09 0.00 -2.70 -0.34 0.02 -1.92 -3.43 113.55 107.27 2k9s h SER 19 Ca -0.50 -0.59 -0.62 0.00 -0.84 0.00 0.00 61.79 59.24 2k9s h SER 19 Cb 1.27 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 63.67 2k9s h SER 19 CO 0.60 1.23 0.59 0.20 -1.14 0.00 0.00 176.83 178.32 2k9s s ASN 20 N -6.51 6.19 0.03 3.07 0.01 -1.26 -5.02 114.94 111.46 2k9s s ASN 20 Ca -0.23 -0.86 -0.21 0.00 -0.71 0.00 0.00 52.86 50.84 2k9s s ASN 20 Cb 0.03 -2.43 -0.06 0.00 0.41 0.00 0.00 41.25 39.19 2k9s s ASN 20 CO 0.56 -1.45 0.62 0.12 -1.51 0.00 0.00 177.10 175.45 2k9s s PHE 21 N 4.20 3.74 -0.48 2.20 5.36 -1.26 -5.04 117.98 126.70 2k9s s PHE 21 Ca 0.24 1.29 0.00 0.00 -0.96 0.00 0.00 56.93 57.50 2k9s s PHE 21 Cb -0.16 -2.62 0.13 0.00 -0.34 0.00 0.00 43.02 40.03 2k9s s PHE 21 CO 0.12 0.41 0.24 0.34 -1.46 0.00 0.00 175.22 174.87 2k9s s ASP 22 N -0.46 4.93 0.62 6.13 -1.08 -1.26 -4.94 116.67 120.60 2k9s s ASP 22 Ca 0.32 -2.50 0.32 0.00 -0.52 0.00 0.00 52.55 50.17 2k9s s ASP 22 Cb -0.19 -1.75 1.81 0.00 -1.46 0.00 0.00 42.92 41.33 2k9s s ASP 22 CO 0.19 -0.39 2.13 -0.29 0.52 0.00 0.00 175.17 177.33 2k9s h ILE 23 N 5.94 0.32 -0.48 4.11 6.09 -2.01 -1.56 117.51 129.91 2k9s h ILE 23 Ca -0.07 0.00 -0.00 0.00 -1.37 0.00 0.00 64.86 63.42 2k9s h ILE 23 Cb 0.98 0.85 -0.02 0.00 0.47 0.00 0.00 36.82 39.10 2k9s h ILE 23 CO 0.66 0.00 0.30 0.00 -3.07 0.00 0.00 178.15 176.04 2k9s h ALA 24 N 1.76 0.62 0.00 0.18 0.00 -1.99 -2.05 119.26 117.78 2k9s h ALA 24 Ca 0.05 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2k9s h ALA 24 Cb 0.40 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2k9s h ALA 24 CO -0.00 0.09 -0.18 0.77 0.00 0.00 0.00 179.25 179.94 2k9s h SER 25 N 0.65 0.00 -0.05 0.00 0.02 -1.71 -1.39 113.55 111.07 2k9s h SER 25 Ca 0.17 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.12 2k9s h SER 25 Cb -0.02 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.52 2k9s h SER 25 CO -0.03 0.18 0.00 0.58 -1.14 0.00 0.00 176.83 176.42 2k9s h VAL 26 N 0.00 1.23 -0.41 2.27 2.07 -1.39 -0.87 116.25 119.15 2k9s h VAL 26 Ca -0.00 -0.70 -0.10 0.00 0.82 0.00 0.00 66.70 66.72 2k9s h VAL 26 Cb 0.32 1.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 2k9s h VAL 26 CO 0.02 0.19 -0.15 0.00 0.02 0.00 0.00 177.57 177.66 2k9s h ALA 27 N 0.74 0.57 -0.63 1.67 0.00 -1.24 -3.02 119.26 117.36 2k9s h ALA 27 Ca 0.01 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 2k9s h ALA 27 Cb 0.30 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2k9s h ALA 27 CO 0.00 0.49 0.29 0.37 0.00 0.00 0.00 179.25 180.40 2k9s h GLN 28 N 0.65 0.90 -0.60 0.00 5.75 -1.18 0.11 115.11 120.73 2k9s h GLN 28 Ca 0.10 -0.12 0.06 0.00 -0.15 0.00 0.00 58.65 58.53 2k9s h GLN 28 Cb 0.69 -0.17 -0.04 0.00 1.07 0.00 0.00 27.48 29.04 2k9s h GLN 28 CO 0.05 0.70 0.40 1.25 -2.65 0.00 0.00 178.83 178.58 2k9s h HIS 29 N 0.89 0.60 -0.52 3.99 2.76 -1.02 0.27 115.15 122.11 2k9s h HIS 29 Ca 0.22 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.40 2k9s h HIS 29 Cb 0.11 -0.20 0.00 0.00 1.55 0.00 0.00 27.41 28.87 2k9s h HIS 29 CO 0.01 0.33 0.00 1.33 -1.30 0.00 0.00 177.93 178.30 2k9s n VAL 30 N -4.47 2.30 -3.51 5.26 0.24 -0.81 -4.91 118.33 112.43 2k9s n VAL 30 Ca 0.08 -1.20 -0.26 0.00 -2.04 0.00 0.00 64.34 60.92 2k9s n VAL 30 Cb 0.22 -0.24 0.01 0.00 -1.47 0.00 0.00 33.84 32.36 2k9s n VAL 30 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2k9s s LEU 32 N -6.75 2.07 0.63 0.00 2.96 0.31 -5.00 118.68 112.90 2k9s s LEU 32 Ca 0.47 -1.16 -0.12 0.00 -0.22 0.00 0.00 54.13 53.10 2k9s s LEU 32 Cb -0.24 0.04 -0.03 0.00 0.50 0.00 0.00 46.19 46.46 2k9s s LEU 32 CO 0.58 -0.60 1.04 -0.44 -1.32 0.00 0.00 176.35 175.61 2k9s s SER 33 N -3.12 5.98 0.16 3.68 0.01 -1.26 -3.07 113.70 116.07 2k9s s SER 33 Ca 0.22 1.51 -0.09 0.00 1.31 0.00 0.00 55.95 58.91 2k9s s SER 33 Cb 0.06 -2.48 0.01 0.00 0.21 0.00 0.00 66.02 63.82 2k9s s SER 33 CO 0.02 -1.04 1.50 1.55 0.41 0.00 0.00 173.24 175.68 2k9s h PRO 34 N -0.31 0.87 -0.18 12.44 0.13 -1.89 -0.51 132.00 142.54 2k9s h PRO 34 Ca -0.44 -0.46 -0.04 0.00 -0.87 0.00 0.00 66.00 64.19 2k9s h PRO 34 Cb 1.20 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 2k9s h PRO 34 CO 0.60 1.10 -0.04 0.77 -0.23 0.00 0.00 178.00 180.20 2k9s h SER 35 N 0.71 0.35 -0.42 1.44 0.02 -1.98 0.24 113.55 113.91 2k9s h SER 35 Ca 0.06 -0.36 -0.13 0.00 -0.84 0.00 0.00 61.79 60.52 2k9s h SER 35 Cb 0.98 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.41 2k9s h SER 35 CO 0.09 0.64 -0.23 0.03 -1.14 0.00 0.00 176.83 176.22 2k9s h ARG 36 N 0.07 0.90 -0.25 3.45 2.47 -1.96 -2.12 114.38 116.93 2k9s h ARG 36 Ca 0.05 -0.40 -0.08 0.00 -1.26 0.00 0.00 59.98 58.28 2k9s h ARG 36 Cb 0.48 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.77 2k9s h ARG 36 CO 0.02 1.05 -0.16 1.25 0.56 0.00 0.00 179.97 182.69 2k9s h LEU 37 N 0.72 0.58 -0.97 3.04 5.85 -1.07 -2.87 115.31 120.60 2k9s h LEU 37 Ca 0.09 -0.43 0.01 0.00 0.84 0.00 0.00 57.88 58.39 2k9s h LEU 37 Cb 0.80 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.62 2k9s h LEU 37 CO 0.07 0.89 0.64 0.77 -0.34 0.00 0.00 178.44 180.47 2k9s h SER 38 N 0.28 1.11 -0.14 1.25 4.64 -0.51 0.27 113.55 120.44 2k9s h SER 38 Ca 0.05 -0.03 0.01 0.00 -0.47 0.00 0.00 61.79 61.35 2k9s h SER 38 Cb 0.69 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 62.49 2k9s h SER 38 CO 0.05 0.80 0.08 -0.74 -0.87 0.00 0.00 176.83 176.14 2k9s h HIS 39 N 1.31 0.15 -0.04 4.77 -0.00 -1.32 -1.91 115.15 118.10 2k9s h HIS 39 Ca 0.36 0.01 -0.13 0.00 -0.00 0.00 0.00 60.37 60.60 2k9s h HIS 39 Cb -0.14 -0.04 -0.01 0.00 -0.00 0.00 0.00 27.41 27.21 2k9s h HIS 39 CO -0.00 0.09 -0.59 -0.07 -0.00 0.00 0.00 177.93 177.36 2k9s h LEU 40 N 0.17 0.15 0.01 0.26 3.38 -1.25 -2.80 115.31 115.22 2k9s h LEU 40 Ca 0.06 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 57.95 2k9s h LEU 40 Cb 0.00 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2k9s h LEU 40 CO -0.03 0.70 -0.04 0.15 0.09 0.00 0.00 178.44 179.31 2k9s h PHE 41 N 0.10 -0.09 0.00 1.13 3.04 -0.06 0.37 116.94 121.43 2k9s h PHE 41 Ca -0.00 0.00 -0.05 0.00 3.98 0.00 0.00 57.97 61.90 2k9s h PHE 41 Cb 1.06 0.04 -0.01 0.00 2.56 0.00 0.00 35.95 39.60 2k9s h PHE 41 CO 0.01 -0.06 -0.24 -0.09 -2.02 0.00 0.00 178.31 175.92 2k9s h ARG 42 N -0.07 0.00 0.12 1.11 1.12 -1.37 0.44 114.38 115.73 2k9s h ARG 42 Ca 0.01 0.00 -0.27 0.00 -1.11 0.00 0.00 59.98 58.61 2k9s h ARG 42 Cb 0.08 0.00 0.03 0.00 -0.01 0.00 0.00 29.97 30.07 2k9s h ARG 42 CO -0.03 0.24 -1.14 1.96 -3.11 0.00 0.00 179.97 177.88 2k9s h GLN 43 N 0.00 0.57 0.23 0.20 1.08 -1.10 0.50 115.11 116.58 2k9s h GLN 43 Ca -0.00 -0.77 -0.34 0.00 -1.45 0.00 0.00 58.65 56.09 2k9s h GLN 43 Cb 0.61 0.25 0.03 0.00 -0.05 0.00 0.00 27.48 28.33 2k9s h GLN 43 CO 0.03 1.34 -1.54 1.96 -0.95 0.00 0.00 178.83 179.67 2k9s h GLN 44 N 0.16 0.48 0.00 1.46 1.08 -0.13 -3.32 115.11 114.84 2k9s h GLN 44 Ca -0.18 -0.81 0.00 0.00 -1.45 0.00 0.00 58.65 56.21 2k9s h GLN 44 Cb 1.83 0.30 0.00 0.00 -0.05 0.00 0.00 27.48 29.57 2k9s h GLN 44 CO 0.22 1.39 -0.70 1.25 -0.95 0.00 0.00 178.83 180.03 2k9s h LEU 45 N 0.13 0.00 0.00 1.46 6.46 -0.25 -3.41 115.31 119.70 2k9s h LEU 45 Ca -0.27 -0.13 0.00 0.00 -0.12 0.00 0.00 57.88 57.36 2k9s h LEU 45 Cb 2.14 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 42.07 2k9s h LEU 45 CO 0.24 0.06 0.00 0.61 -0.62 0.00 0.00 178.44 178.74 2k9s n GLY 46 N 1.27 0.23 3.53 3.75 0.00 0.17 -4.93 105.19 109.21 2k9s n GLY 46 Ca 0.02 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.93 2k9s n GLY 46 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2k9s s ILE 47 N -1.54 0.00 0.40 -0.61 -4.36 -1.14 -4.96 121.20 108.99 2k9s s ILE 47 Ca 0.00 -1.52 -0.23 0.00 -0.26 0.00 0.00 60.65 58.64 2k9s s ILE 47 Cb 0.00 -2.43 -0.10 0.00 1.25 0.00 0.00 42.46 41.19 2k9s s ILE 47 CO 0.00 0.00 1.00 -0.94 0.24 0.00 0.00 174.94 175.24 2k9s s SER 48 N -3.11 6.89 0.23 4.36 1.04 -1.26 -3.82 113.70 118.03 2k9s s SER 48 Ca 0.27 1.89 -0.06 0.00 0.48 0.00 0.00 55.95 58.53 2k9s s SER 48 Cb -0.00 -2.57 0.36 0.00 0.10 0.00 0.00 66.02 63.91 2k9s s SER 48 CO 0.13 -0.39 1.77 0.58 0.98 0.00 0.00 173.24 176.31 2k9s h VAL 49 N 2.15 0.81 -0.37 5.02 2.07 -1.94 0.44 116.25 124.43 2k9s h VAL 49 Ca -0.48 -0.20 -0.02 0.00 0.82 0.00 0.00 66.70 66.82 2k9s h VAL 49 Cb 1.20 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 2k9s h VAL 49 CO 0.62 0.10 0.13 -0.07 0.02 0.00 0.00 177.57 178.37 2k9s h LEU 50 N 0.57 0.48 -0.12 2.57 3.38 -2.00 -2.12 115.31 118.06 2k9s h LEU 50 Ca 0.36 -0.05 -0.14 0.00 0.09 0.00 0.00 57.88 58.14 2k9s h LEU 50 Cb 0.42 -0.12 0.01 0.00 0.09 0.00 0.00 40.66 41.06 2k9s h LEU 50 CO -0.30 0.46 -0.46 -1.28 0.09 0.00 0.00 178.44 176.95 2k9s h SER 51 N 0.53 0.62 -0.98 -0.43 0.87 -1.42 -3.03 113.55 109.72 2k9s h SER 51 Ca 0.13 -0.62 0.04 0.00 -1.23 0.00 0.00 61.79 60.11 2k9s h SER 51 Cb 0.14 -0.18 -0.06 0.00 -0.44 0.00 0.00 62.40 61.86 2k9s h SER 51 CO -0.01 1.14 0.64 -0.25 -0.53 0.00 0.00 176.83 177.81 2k9s h TRP 52 N 0.15 1.20 -0.29 2.24 7.01 -0.68 0.30 115.95 125.88 2k9s h TRP 52 Ca -0.02 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.00 2k9s h TRP 52 Cb 1.10 -0.40 -0.01 0.00 -2.10 0.00 0.00 29.16 27.74 2k9s h TRP 52 CO 0.11 0.69 0.17 -0.09 -2.79 0.00 0.00 178.44 176.52 2k9s h ARG 53 N 1.23 0.39 -0.27 2.65 2.43 -1.41 0.15 114.38 119.55 2k9s h ARG 53 Ca 0.39 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.48 2k9s h ARG 53 Cb 0.01 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 2k9s h ARG 53 CO -0.13 0.31 0.01 1.49 -1.51 0.00 0.00 179.97 180.15 2k9s h GLU 54 N 0.36 0.48 -0.88 0.20 4.81 -1.32 -1.29 114.58 116.94 2k9s h GLU 54 Ca 0.10 -0.14 -0.02 0.00 -0.13 0.00 0.00 59.36 59.17 2k9s h GLU 54 Cb 0.02 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.31 2k9s h GLU 54 CO -0.02 0.62 0.46 -0.44 -0.73 0.00 0.00 179.01 178.90 2k9s h ASP 55 N 0.27 1.11 -0.05 1.04 5.19 -0.80 -2.38 116.42 120.80 2k9s h ASP 55 Ca 0.08 -0.11 -0.11 0.00 -0.62 0.00 0.00 57.03 56.27 2k9s h ASP 55 Cb 0.40 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 39.61 2k9s h ASP 55 CO 0.01 0.90 -0.32 1.56 -3.12 0.00 0.00 179.24 178.27 2k9s h GLN 56 N 1.23 0.52 -0.54 3.56 1.08 -0.57 -2.89 115.11 117.51 2k9s h GLN 56 Ca 0.31 -0.23 0.03 0.00 -1.45 0.00 0.00 58.65 57.30 2k9s h GLN 56 Cb 0.05 -0.02 -0.04 0.00 -0.05 0.00 0.00 27.48 27.43 2k9s h GLN 56 CO -0.05 0.78 0.32 0.00 -0.95 0.00 0.00 178.83 178.94 2k9s h ARG 57 N 0.45 0.62 -0.73 1.46 3.08 -0.72 -2.32 114.38 116.23 2k9s h ARG 57 Ca 0.05 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 60.00 2k9s h ARG 57 Cb 0.78 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.66 2k9s h ARG 57 CO 0.06 0.41 0.20 0.82 -1.07 0.00 0.00 179.97 180.39 2k9s h ILE 58 N 0.64 1.26 -0.74 2.04 1.08 -1.40 -1.72 117.51 118.67 2k9s h ILE 58 Ca 0.22 -0.95 0.06 0.00 -0.39 0.00 0.00 64.86 63.80 2k9s h ILE 58 Cb 0.02 0.49 -0.06 0.00 -3.07 0.00 0.00 36.82 34.21 2k9s h ILE 58 CO -0.10 0.37 0.43 -1.28 -0.69 0.00 0.00 178.15 176.88 2k9s h SER 59 N 1.09 0.65 -0.15 1.72 0.87 -1.22 -1.09 113.55 115.42 2k9s h SER 59 Ca 0.23 0.03 -0.17 0.00 -1.23 0.00 0.00 61.79 60.64 2k9s h SER 59 Cb 0.35 -0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 62.20 2k9s h SER 59 CO -0.00 0.42 -0.54 -0.61 -0.53 0.00 0.00 176.83 175.56 2k9s h GLN 60 N 0.78 0.74 -0.42 2.24 5.75 -1.20 -1.95 115.11 121.06 2k9s h GLN 60 Ca 0.33 -0.46 0.02 0.00 -0.15 0.00 0.00 58.65 58.38 2k9s h GLN 60 Cb 0.19 0.05 -0.03 0.00 1.07 0.00 0.00 27.48 28.77 2k9s h GLN 60 CO -0.18 1.09 0.25 0.00 -2.65 0.00 0.00 178.83 177.34 2k9s h ALA 61 N 0.82 0.53 -0.10 3.38 0.00 -0.62 0.15 119.26 123.42 2k9s h ALA 61 Ca 0.01 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 2k9s h ALA 61 Cb 1.12 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 2k9s h ALA 61 CO 0.11 -0.07 -0.56 1.57 0.00 0.00 0.00 179.25 180.30 2k9s h LYS 62 N 0.51 0.29 0.01 0.00 2.10 -1.22 0.03 116.57 118.28 2k9s h LYS 62 Ca 0.17 -0.18 -0.00 0.00 -2.00 0.00 0.00 60.65 58.63 2k9s h LYS 62 Cb 0.00 0.02 0.00 0.00 -0.90 0.00 0.00 32.23 31.35 2k9s h LYS 62 CO -0.07 0.77 -0.00 1.25 -2.00 0.00 0.00 179.45 179.39 2k9s h LEU 63 N 0.22 -0.01 -0.52 7.07 7.12 -0.85 -2.91 115.31 125.44 2k9s h LEU 63 Ca 0.00 -0.39 -0.15 0.00 0.13 0.00 0.00 57.88 57.47 2k9s h LEU 63 Cb 1.05 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 41.17 2k9s h LEU 63 CO 0.09 0.39 -0.43 0.17 -0.13 0.00 0.00 178.44 178.53 2k9s h LEU 64 N -0.41 0.77 -2.04 2.25 8.10 -0.75 -2.90 115.31 120.33 2k9s h LEU 64 Ca -0.00 -0.36 0.10 0.00 0.11 0.00 0.00 57.88 57.72 2k9s h LEU 64 Cb 0.40 -0.22 -0.01 0.00 -0.44 0.00 0.00 40.66 40.39 2k9s h LEU 64 CO 0.00 1.10 0.26 -0.07 -4.11 0.00 0.00 178.44 175.62 2k9s h LEU 65 N 0.58 0.00 -0.57 0.17 3.38 -1.00 0.33 115.31 118.21 2k9s h LEU 65 Ca 0.04 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.85 2k9s h LEU 65 Cb 0.98 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 2k9s h LEU 65 CO 0.09 0.00 -0.68 0.28 0.09 0.00 0.00 178.44 178.22 2k9s h SER 66 N 0.00 0.20 -0.48 -0.43 0.02 -1.30 -3.06 113.55 108.50 2k9s h SER 66 Ca 0.16 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 2k9s h SER 66 Cb 0.69 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.17 2k9s h SER 66 CO -0.00 0.82 0.00 1.07 -1.14 0.00 0.00 176.83 177.58 2k9s n THR 67 N -3.79 0.69 -4.22 -2.27 5.66 0.19 -4.95 114.28 105.58 2k9s n THR 67 Ca -0.02 -0.84 -0.13 0.00 -3.05 0.00 0.00 64.05 60.01 2k9s n THR 67 Cb 0.67 0.80 -0.10 0.00 -1.55 0.00 0.00 70.33 70.15 2k9s n THR 67 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2k9s s THR 68 N -1.27 0.97 -0.10 1.09 -4.23 0.93 -5.05 115.64 107.99 2k9s s THR 68 Ca 0.40 -2.01 0.14 0.00 -1.18 0.00 0.00 61.69 59.04 2k9s s THR 68 Cb 0.22 -1.80 0.21 0.00 1.34 0.00 0.00 72.50 72.48 2k9s s THR 68 CO 0.30 -0.78 1.10 -2.11 -0.54 0.00 0.00 174.62 172.59 2k9s n ARG 69 N -0.14 1.36 -1.66 3.99 0.00 -1.26 -4.72 116.66 114.22 2k9s n ARG 69 Ca -0.11 -2.23 -0.32 0.00 -0.00 0.00 0.00 57.85 55.19 2k9s n ARG 69 Cb 0.61 -1.31 0.05 0.00 -0.00 0.00 0.00 32.46 31.81 2k9s n ARG 69 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.63 175.99 2k9s s MET 70 N -2.27 2.73 0.87 2.89 -1.94 -1.26 -5.02 119.30 115.30 2k9s s MET 70 Ca 0.24 1.31 -0.11 0.00 -1.71 0.00 0.00 55.69 55.41 2k9s s MET 70 Cb 0.21 -1.95 0.12 0.00 2.01 0.00 0.00 34.83 35.21 2k9s s MET 70 CO 0.02 -1.29 1.09 -1.25 -0.01 0.00 0.00 175.02 173.58 2k9s s PRO 71 N -4.31 1.45 0.50 2.03 0.04 -1.26 -4.77 135.00 128.67 2k9s s PRO 71 Ca 0.65 0.88 0.15 0.00 0.04 0.00 0.00 61.00 62.72 2k9s s PRO 71 Cb -0.19 -1.83 1.19 0.00 0.04 0.00 0.00 34.50 33.72 2k9s s PRO 71 CO 0.45 -2.13 2.12 0.82 0.04 0.00 0.00 177.00 178.30 2k9s h ILE 72 N -1.47 1.00 -0.19 0.56 2.04 -1.98 -1.35 117.51 116.11 2k9s h ILE 72 Ca -0.48 -0.04 -0.02 0.00 1.00 0.00 0.00 64.86 65.31 2k9s h ILE 72 Cb 1.27 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 38.22 2k9s h ILE 72 CO 0.54 0.02 0.02 0.00 0.00 0.00 0.00 178.15 178.73 2k9s h ALA 73 N 1.92 0.25 0.01 1.87 0.00 -1.92 -1.06 119.26 120.33 2k9s h ALA 73 Ca 0.06 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 2k9s h ALA 73 Cb 0.08 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2k9s h ALA 73 CO -0.01 -0.07 -0.00 1.15 0.00 0.00 0.00 179.25 180.32 2k9s h THR 74 N 0.10 1.26 -0.96 0.00 2.02 -1.78 -3.11 112.91 110.43 2k9s h THR 74 Ca 0.06 -0.80 0.08 0.00 0.77 0.00 0.00 66.41 66.52 2k9s h THR 74 Cb 0.33 1.80 -0.07 0.00 -1.74 0.00 0.00 68.15 68.47 2k9s h THR 74 CO 0.01 0.21 0.60 0.58 0.37 0.00 0.00 175.52 177.29 2k9s h VAL 75 N -0.36 1.02 -0.53 3.16 2.07 -1.30 -1.10 116.25 119.21 2k9s h VAL 75 Ca -0.00 -0.36 0.10 0.00 0.82 0.00 0.00 66.70 67.26 2k9s h VAL 75 Cb 0.35 -0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 29.96 2k9s h VAL 75 CO 0.00 0.19 0.36 1.23 0.02 0.00 0.00 177.57 179.37 2k9s h GLY 76 N 1.05 0.40 1.77 2.17 0.00 -1.12 -0.45 103.07 106.88 2k9s h GLY 76 Ca 0.44 -0.12 -0.13 0.00 0.00 0.00 0.00 47.33 47.52 2k9s h GLY 76 CO -0.21 0.07 -0.53 -0.09 0.00 0.00 0.00 176.54 175.78 2k9s h ARG 77 N 0.28 0.24 -0.15 4.80 2.43 -0.67 0.41 114.38 121.72 2k9s h ARG 77 Ca 0.24 -0.15 -0.00 0.00 -0.81 0.00 0.00 59.98 59.27 2k9s h ARG 77 Cb 0.59 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.14 2k9s h ARG 77 CO -0.05 0.72 0.09 -0.91 -1.51 0.00 0.00 179.97 178.30 2k9s h ASN 78 N 0.19 0.18 -0.07 -3.80 2.35 -0.98 0.17 115.58 113.62 2k9s h ASN 78 Ca 0.00 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2k9s h ASN 78 Cb 1.00 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.32 2k9s h ASN 78 CO 0.08 0.14 0.00 1.33 -1.65 0.00 0.00 177.43 177.33 2k9s n VAL 79 N -4.50 0.07 -0.43 2.81 0.24 -1.11 -4.91 118.33 110.50 2k9s n VAL 79 Ca -0.01 -0.36 0.00 0.00 -2.04 0.00 0.00 64.34 61.94 2k9s n VAL 79 Cb 0.09 0.72 0.00 0.00 -1.47 0.00 0.00 33.84 33.18 2k9s n VAL 79 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2k9s n GLY 80 N 1.23 0.72 3.59 7.63 0.00 0.05 -4.70 105.19 113.70 2k9s n GLY 80 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 2k9s n GLY 80 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2k9s s PHE 81 N -2.78 3.21 0.07 1.61 0.08 0.14 -4.93 117.98 115.38 2k9s s PHE 81 Ca 0.00 0.46 0.05 0.00 0.12 0.00 0.00 56.93 57.56 2k9s s PHE 81 Cb 0.00 -2.93 -0.23 0.00 -0.57 0.00 0.00 43.02 39.29 2k9s s PHE 81 CO 0.00 -0.47 1.09 0.38 -0.10 0.00 0.00 175.22 176.13 2k9s h ASP 82 N 8.26 0.10 -3.35 1.36 2.03 -1.92 -2.43 116.42 120.47 2k9s h ASP 82 Ca -0.27 -0.13 -0.60 0.00 -0.73 0.00 0.00 57.03 55.30 2k9s h ASP 82 Cb 1.12 -0.03 -0.09 0.00 -0.83 0.00 0.00 39.33 39.50 2k9s h ASP 82 CO 0.78 1.10 0.43 -1.81 -1.03 0.00 0.00 179.24 178.71 2k9s s ASP 83 N -6.69 6.75 0.29 4.15 1.01 -1.26 -4.91 116.67 116.01 2k9s s ASP 83 Ca -0.02 0.88 -0.01 0.00 0.71 0.00 0.00 52.55 54.11 2k9s s ASP 83 Cb 0.09 -2.42 0.42 0.00 1.01 0.00 0.00 42.92 42.02 2k9s s ASP 83 CO 0.83 -0.55 1.87 -0.61 0.21 0.00 0.00 175.17 176.93 2k9s h GLN 84 N 7.86 0.89 -0.15 8.23 4.15 -1.88 -2.26 115.11 131.95 2k9s h GLN 84 Ca -0.24 -0.14 -0.10 0.00 0.77 0.00 0.00 58.65 58.94 2k9s h GLN 84 Cb 1.10 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 28.62 2k9s h GLN 84 CO 0.87 0.73 -0.35 -0.07 -1.93 0.00 0.00 178.83 178.09 2k9s h LEU 85 N 0.88 0.31 -0.23 -2.39 3.38 -1.95 -2.60 115.31 112.71 2k9s h LEU 85 Ca 0.21 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2k9s h LEU 85 Cb 0.17 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2k9s h LEU 85 CO -0.02 0.64 0.15 0.22 0.09 0.00 0.00 178.44 179.53 2k9s h TYR 86 N 0.26 0.29 -0.46 1.13 5.03 -1.82 -0.17 116.97 121.25 2k9s h TYR 86 Ca 0.03 0.01 -0.09 0.00 2.58 0.00 0.00 58.73 61.26 2k9s h TYR 86 Cb 0.74 -0.10 -0.02 0.00 1.55 0.00 0.00 36.73 38.90 2k9s h TYR 86 CO 0.02 0.19 -0.08 0.35 -1.32 0.00 0.00 178.16 177.31 2k9s h PHE 87 N 0.32 0.88 -0.48 -3.82 3.57 -1.44 -2.67 116.94 113.30 2k9s h PHE 87 Ca 0.09 -0.15 -0.08 0.00 3.53 0.00 0.00 57.97 61.35 2k9s h PHE 87 Cb -0.04 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 38.46 2k9s h PHE 87 CO -0.06 0.85 -0.03 0.77 -2.23 0.00 0.00 178.31 177.61 2k9s h SER 88 N 0.73 0.78 0.05 0.41 0.02 -1.09 0.29 113.55 114.74 2k9s h SER 88 Ca 0.13 -0.20 -0.00 0.00 -0.84 0.00 0.00 61.79 60.87 2k9s h SER 88 Cb 0.57 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.90 2k9s h SER 88 CO 0.03 0.86 -0.02 0.03 -1.14 0.00 0.00 176.83 176.60 2k9s h ARG 89 N 0.75 -0.06 -0.25 3.45 3.08 -0.79 0.26 114.38 120.81 2k9s h ARG 89 Ca 0.14 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.08 2k9s h ARG 89 Cb 0.49 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.56 2k9s h ARG 89 CO 0.02 0.15 -0.31 0.28 -1.07 0.00 0.00 179.97 179.05 2k9s h VAL 90 N -0.26 1.31 -0.46 2.04 2.07 -1.40 -3.07 116.25 116.47 2k9s h VAL 90 Ca -0.01 -1.49 -0.06 0.00 0.82 0.00 0.00 66.70 65.96 2k9s h VAL 90 Cb 0.24 1.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 2k9s h VAL 90 CO 0.01 0.47 0.04 0.15 0.02 0.00 0.00 177.57 178.26 2k9s h PHE 91 N 0.37 0.76 -0.34 1.57 3.04 -0.42 -0.73 116.94 121.19 2k9s h PHE 91 Ca 0.03 -0.09 0.03 0.00 3.98 0.00 0.00 57.97 61.92 2k9s h PHE 91 Cb 0.88 -0.22 -0.03 0.00 2.56 0.00 0.00 35.95 39.15 2k9s h PHE 91 CO 0.08 0.69 0.16 -0.22 -2.02 0.00 0.00 178.31 177.00 2k9s h LYS 92 N 0.69 0.32 0.00 1.11 3.64 -0.43 -2.01 116.57 119.89 2k9s h LYS 92 Ca 0.14 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.42 2k9s h LYS 92 Cb 0.37 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.10 2k9s h LYS 92 CO 0.01 0.21 -0.39 1.57 -2.27 0.00 0.00 179.45 178.58 2k9s h LYS 93 N 0.33 0.00 -0.22 1.90 2.10 -1.42 0.78 116.57 120.04 2k9s h LYS 93 Ca 0.14 0.00 0.04 0.00 -2.00 0.00 0.00 60.65 58.84 2k9s h LYS 93 Cb 0.07 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 31.36 2k9s h LYS 93 CO -0.11 0.39 -0.05 0.00 -2.00 0.00 0.00 179.45 177.68 2k9s n THR 95 N -5.20 0.00 -0.07 0.00 -2.24 -1.10 -4.98 114.28 100.69 2k9s n THR 95 Ca -0.02 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 2k9s n THR 95 Cb 0.13 1.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.38 2k9s n THR 95 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2k9s n GLY 96 N 1.20 0.59 3.00 3.38 0.00 0.24 -5.04 105.19 108.57 2k9s n GLY 96 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 2k9s n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k9s s ALA 97 N -2.27 0.34 0.90 4.61 0.00 0.42 -4.83 121.76 120.95 2k9s s ALA 97 Ca 0.00 -0.56 -0.11 0.00 0.00 0.00 0.00 51.96 51.30 2k9s s ALA 97 Cb 0.00 0.05 0.14 0.00 0.00 0.00 0.00 23.12 23.31 2k9s s ALA 97 CO 0.00 -0.05 1.10 -1.54 0.00 0.00 0.00 175.76 175.28 2k9s s SER 98 N -1.18 3.23 0.29 0.00 1.04 -1.26 -4.03 113.70 111.78 2k9s s SER 98 Ca -0.09 1.85 0.08 0.00 0.48 0.00 0.00 55.95 58.27 2k9s s SER 98 Cb -0.08 -2.44 0.44 0.00 0.10 0.00 0.00 66.02 64.04 2k9s s SER 98 CO -0.00 -2.85 1.68 1.55 0.98 0.00 0.00 173.24 174.60 2k9s h PRO 99 N -1.70 0.17 -0.23 4.02 0.13 -1.89 -2.61 132.00 129.89 2k9s h PRO 99 Ca -0.47 -0.09 -0.10 0.00 -0.87 0.00 0.00 66.00 64.47 2k9s h PRO 99 Cb 1.27 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 2k9s h PRO 99 CO 0.48 0.61 -0.27 0.66 -0.23 0.00 0.00 178.00 179.25 2k9s h SER 100 N 0.14 0.45 -0.02 1.44 4.64 -1.99 -1.94 113.55 116.27 2k9s h SER 100 Ca 0.01 -0.16 -0.06 0.00 -0.47 0.00 0.00 61.79 61.11 2k9s h SER 100 Cb 0.88 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 2k9s h SER 100 CO 0.07 0.71 -0.22 -0.08 -0.87 0.00 0.00 176.83 176.44 2k9s h GLU 101 N 0.40 0.18 -0.82 4.77 4.57 -1.90 -3.15 114.58 118.62 2k9s h GLU 101 Ca 0.06 -0.17 0.04 0.00 -1.18 0.00 0.00 59.36 58.11 2k9s h GLU 101 Cb 0.68 0.04 -0.05 0.00 -0.16 0.00 0.00 28.75 29.26 2k9s h GLU 101 CO 0.05 0.87 0.54 0.35 -1.18 0.00 0.00 179.01 179.64 2k9s h PHE 102 N -0.44 0.97 -0.89 0.92 3.04 -1.44 -0.96 116.94 118.14 2k9s h PHE 102 Ca -0.02 0.02 0.01 0.00 3.98 0.00 0.00 57.97 61.96 2k9s h PHE 102 Cb 0.93 -0.32 -0.04 0.00 2.56 0.00 0.00 35.95 39.08 2k9s h PHE 102 CO 0.16 0.55 0.58 -0.09 -2.02 0.00 0.00 178.31 177.50 2k9s h ARG 103 N 1.00 1.17 0.00 1.11 9.65 -1.40 -2.03 114.38 123.89 2k9s h ARG 103 Ca 0.33 -0.07 -0.12 0.00 -1.10 0.00 0.00 59.98 59.02 2k9s h ARG 103 Cb 0.07 -0.26 -0.02 0.00 -1.39 0.00 0.00 29.97 28.37 2k9s h ARG 103 CO -0.10 0.78 -0.56 0.00 2.80 0.00 0.00 179.97 182.88 2k9s h ALA 104 N 1.32 0.83 0.00 2.80 0.00 -1.30 -3.47 119.26 119.44 2k9s h ALA 104 Ca 0.32 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2k9s h ALA 104 Cb -0.13 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.57 2k9s h ALA 104 CO -0.07 0.70 0.00 0.41 0.00 0.00 0.00 179.25 180.29 2k9s n GLY 105 N 0.59 0.64 3.73 0.00 0.00 -0.45 -5.04 105.19 104.67 2k9s n GLY 105 Ca -0.00 -0.15 -0.40 0.00 0.00 0.00 0.00 46.02 45.47 2k9s n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32