#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 6.95 0.23 3.17 -1.08 -1.26 -4.89 116.67 119.79 2k9s s ASP 2 Ca 0.00 1.78 -0.06 0.00 -0.52 0.00 0.00 52.55 53.75 2k9s s ASP 2 Cb 0.00 -2.56 0.34 0.00 -1.46 0.00 0.00 42.92 39.25 2k9s s ASP 2 CO 0.00 -0.35 1.80 0.78 0.52 0.00 0.00 175.17 177.92 2k9s h ASN 3 N 2.22 0.59 -0.42 -0.34 2.35 -2.06 0.25 115.58 118.16 2k9s h ASN 3 Ca -0.48 0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.30 2k9s h ASN 3 Cb 1.19 -0.06 -0.02 0.00 0.05 0.00 0.00 38.32 39.48 2k9s h ASN 3 CO 0.62 0.35 0.22 0.03 -1.65 0.00 0.00 177.43 176.99 2k9s h ARG 4 N 0.72 0.60 -0.49 0.81 3.08 -1.98 -2.78 114.38 114.34 2k9s h ARG 4 Ca 0.36 -0.08 -0.11 0.00 0.07 0.00 0.00 59.98 60.22 2k9s h ARG 4 Cb 0.32 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 2k9s h ARG 4 CO -0.24 0.50 -0.14 0.28 -1.07 0.00 0.00 179.97 179.30 2k9s h VAL 5 N 0.55 1.27 -0.74 2.04 2.07 -1.75 -2.86 116.25 116.83 2k9s h VAL 5 Ca 0.15 -1.28 0.13 0.00 0.82 0.00 0.00 66.70 66.52 2k9s h VAL 5 Cb 0.09 1.04 -0.05 0.00 -1.52 0.00 0.00 31.29 30.85 2k9s h VAL 5 CO -0.02 0.44 0.49 -0.09 0.02 0.00 0.00 177.57 178.41 2k9s h ARG 6 N 0.83 0.48 -0.48 1.57 9.65 -0.29 0.02 114.38 126.16 2k9s h ARG 6 Ca 0.13 -0.03 -0.06 0.00 -1.10 0.00 0.00 59.98 58.92 2k9s h ARG 6 Cb 0.69 -0.11 -0.02 0.00 -1.39 0.00 0.00 29.97 29.14 2k9s h ARG 6 CO 0.05 0.31 0.05 0.93 2.80 0.00 0.00 179.97 184.12 2k9s h GLU 7 N 0.49 0.77 -0.83 0.20 4.39 -1.25 -2.72 114.58 115.62 2k9s h GLU 7 Ca 0.36 -0.18 -0.03 0.00 0.34 0.00 0.00 59.36 59.84 2k9s h GLU 7 Cb 0.70 -0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 29.21 2k9s h GLU 7 CO -0.12 0.74 0.39 0.00 -1.16 0.00 0.00 179.01 178.86 2k9s h ALA 8 N 1.33 1.11 -0.49 3.43 0.00 -1.03 -2.38 119.26 121.23 2k9s h ALA 8 Ca 0.15 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2k9s h ALA 8 Cb 0.37 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2k9s h ALA 8 CO 0.01 0.66 0.30 0.00 0.00 0.00 0.00 179.25 180.23 2k9s h GLN 10 N 0.67 0.74 -0.15 0.00 1.08 -1.34 0.05 115.11 116.15 2k9s h GLN 10 Ca 0.18 -0.15 -0.06 0.00 -1.45 0.00 0.00 58.65 57.17 2k9s h GLN 10 Cb -0.04 -0.11 -0.00 0.00 -0.05 0.00 0.00 27.48 27.27 2k9s h GLN 10 CO -0.04 0.68 -0.13 -0.92 -0.95 0.00 0.00 178.83 177.48 2k9s h TYR 11 N 0.64 0.42 -0.61 2.96 3.20 -1.30 -3.06 116.97 119.22 2k9s h TYR 11 Ca 0.16 -0.12 -0.01 0.00 3.14 0.00 0.00 58.73 61.90 2k9s h TYR 11 Cb 0.24 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.39 2k9s h TYR 11 CO 0.01 0.73 0.34 0.82 -1.64 0.00 0.00 178.16 178.42 2k9s h ILE 12 N -0.01 1.18 -0.55 1.81 2.04 -1.10 -2.37 117.51 118.51 2k9s h ILE 12 Ca 0.03 -0.45 0.03 0.00 1.00 0.00 0.00 64.86 65.46 2k9s h ILE 12 Cb 0.65 0.35 -0.04 0.00 -0.74 0.00 0.00 36.82 37.04 2k9s h ILE 12 CO 0.03 0.20 0.33 0.77 0.00 0.00 0.00 178.15 179.48 2k9s h SER 13 N 0.85 0.53 0.22 1.72 4.64 -0.93 -0.44 113.55 120.14 2k9s h SER 13 Ca 0.22 0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 61.46 2k9s h SER 13 Cb 0.01 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 2k9s h SER 13 CO -0.04 0.37 -0.33 -0.78 -0.87 0.00 0.00 176.83 175.18 2k9s h ASP 14 N 0.65 0.17 -0.43 4.97 3.58 -1.36 -2.28 116.42 121.71 2k9s h ASP 14 Ca 0.22 -0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.62 2k9s h ASP 14 Cb 0.04 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.04 2k9s h ASP 14 CO -0.10 0.49 0.00 1.41 -2.88 0.00 0.00 179.24 178.16 2k9s n HIS 15 N -4.11 1.31 0.23 0.28 8.25 -0.70 -4.26 115.22 116.23 2k9s n HIS 15 Ca -0.01 -0.48 0.09 0.00 -0.26 0.00 0.00 57.72 57.05 2k9s n HIS 15 Cb 0.40 -0.31 0.58 0.00 1.12 0.00 0.00 29.99 31.78 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 2.88 0.00 0.00 2.41 5.85 -0.49 -2.46 115.31 123.50 2k9s h LEU 16 Ca 0.00 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 2k9s h LEU 16 Cb 1.37 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.39 2k9s h LEU 16 CO 0.28 0.20 -1.39 0.00 -0.34 0.00 0.00 178.44 177.18 2k9s n ALA 17 N -2.37 2.51 -1.80 1.25 0.00 -1.26 -3.85 120.51 115.00 2k9s n ALA 17 Ca -0.02 -0.39 -0.41 0.00 0.00 0.00 0.00 53.44 52.62 2k9s n ALA 17 Cb 0.29 -0.96 -0.02 0.00 0.00 0.00 0.00 19.45 18.77 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 -5.16 6.45 -0.10 0.00 -1.08 -0.93 -4.75 116.67 111.11 2k9s s ASP 18 Ca -0.03 2.87 -0.25 0.00 -0.52 0.00 0.00 52.55 54.61 2k9s s ASP 18 Cb 0.11 -2.63 -0.22 0.00 -1.46 0.00 0.00 42.92 38.72 2k9s s ASP 18 CO 0.83 -0.85 0.83 0.28 0.52 0.00 0.00 175.17 176.78 2k9s h SER 19 N 4.88 -0.02 -2.37 -0.34 0.02 -1.91 -3.40 113.55 110.40 2k9s h SER 19 Ca -0.47 -0.74 -0.65 0.00 -0.84 0.00 0.00 61.79 59.09 2k9s h SER 19 Cb 1.22 0.01 -0.15 0.00 0.14 0.00 0.00 62.40 63.61 2k9s h SER 19 CO 0.79 0.78 0.79 0.20 -1.14 0.00 0.00 176.83 178.25 2k9s s ASN 20 N -5.97 6.42 0.16 3.07 0.01 -1.26 -5.01 114.94 112.36 2k9s s ASN 20 Ca -0.16 -1.53 -0.30 0.00 -0.71 0.00 0.00 52.86 50.16 2k9s s ASN 20 Cb -0.01 -2.43 -0.07 0.00 0.41 0.00 0.00 41.25 39.15 2k9s s ASN 20 CO 0.61 -1.28 0.94 0.12 -1.51 0.00 0.00 177.10 175.98 2k9s s PHE 21 N 3.53 3.88 -0.43 2.20 5.36 -1.26 -5.03 117.98 126.24 2k9s s PHE 21 Ca 0.30 1.83 0.00 0.00 -0.96 0.00 0.00 56.93 58.10 2k9s s PHE 21 Cb -0.09 -3.01 0.12 0.00 -0.34 0.00 0.00 43.02 39.69 2k9s s PHE 21 CO -0.01 0.32 0.19 0.34 -1.46 0.00 0.00 175.22 174.60 2k9s s ASP 22 N -0.51 5.00 0.53 6.13 -1.08 -1.26 -4.95 116.67 120.53 2k9s s ASP 22 Ca 0.44 -2.29 0.21 0.00 -0.52 0.00 0.00 52.55 50.39 2k9s s ASP 22 Cb -0.24 -1.75 1.38 0.00 -1.46 0.00 0.00 42.92 40.85 2k9s s ASP 22 CO 0.30 -0.44 2.10 -0.29 0.52 0.00 0.00 175.17 177.37 2k9s h ILE 23 N 6.20 0.83 -0.73 4.11 6.09 -2.01 -1.49 117.51 130.51 2k9s h ILE 23 Ca -0.08 0.00 -0.02 0.00 -1.37 0.00 0.00 64.86 63.39 2k9s h ILE 23 Cb 1.01 0.89 -0.03 0.00 0.47 0.00 0.00 36.82 39.16 2k9s h ILE 23 CO 0.64 0.00 0.37 0.00 -3.07 0.00 0.00 178.15 176.09 2k9s h ALA 24 N 1.88 0.94 -0.53 0.18 0.00 -1.99 -2.45 119.26 117.30 2k9s h ALA 24 Ca 0.10 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2k9s h ALA 24 Cb 0.40 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2k9s h ALA 24 CO -0.00 0.49 0.17 0.77 0.00 0.00 0.00 179.25 180.68 2k9s h SER 25 N 1.02 0.72 -0.31 0.00 0.02 -1.70 -0.80 113.55 112.50 2k9s h SER 25 Ca 0.25 -0.11 -0.02 0.00 -0.84 0.00 0.00 61.79 61.08 2k9s h SER 25 Cb 0.09 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.43 2k9s h SER 25 CO -0.03 0.68 0.12 0.58 -1.14 0.00 0.00 176.83 177.03 2k9s h VAL 26 N 0.77 1.19 -0.25 2.27 2.07 -1.38 -0.21 116.25 120.71 2k9s h VAL 26 Ca 0.18 -0.59 -0.05 0.00 0.82 0.00 0.00 66.70 67.06 2k9s h VAL 26 Cb 0.22 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 2k9s h VAL 26 CO -0.01 0.20 -0.06 0.00 0.02 0.00 0.00 177.57 177.73 2k9s h ALA 27 N 0.96 0.34 -0.65 1.67 0.00 -1.20 -3.04 119.26 117.33 2k9s h ALA 27 Ca 0.10 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 2k9s h ALA 27 Cb 0.20 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 2k9s h ALA 27 CO -0.01 0.14 0.35 0.37 0.00 0.00 0.00 179.25 180.10 2k9s h GLN 28 N 0.23 0.90 -0.58 0.00 4.15 -1.04 0.16 115.11 118.93 2k9s h GLN 28 Ca 0.06 -0.10 0.05 0.00 0.77 0.00 0.00 58.65 59.44 2k9s h GLN 28 Cb 0.52 -0.18 -0.03 0.00 0.21 0.00 0.00 27.48 28.00 2k9s h GLN 28 CO 0.02 0.67 0.39 1.25 -1.93 0.00 0.00 178.83 179.23 2k9s h HIS 29 N 0.91 0.59 -0.54 3.99 2.76 -0.92 -0.00 115.15 121.93 2k9s h HIS 29 Ca 0.23 0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.41 2k9s h HIS 29 Cb 0.04 -0.19 -0.00 0.00 1.55 0.00 0.00 27.41 28.80 2k9s h HIS 29 CO 0.01 0.32 0.00 1.33 -1.30 0.00 0.00 177.93 178.29 2k9s n VAL 30 N -4.47 2.61 -3.50 5.26 0.24 -0.76 -4.91 118.33 112.79 2k9s n VAL 30 Ca 0.08 -1.32 -0.26 0.00 -2.04 0.00 0.00 64.34 60.80 2k9s n VAL 30 Cb 0.21 -0.30 0.01 0.00 -1.47 0.00 0.00 33.84 32.29 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 -6.74 2.10 0.56 0.00 2.01 0.50 -5.00 118.68 112.12 2k9s s LEU 32 Ca 0.47 -1.16 -0.09 0.00 0.01 0.00 0.00 54.13 53.36 2k9s s LEU 32 Cb -0.24 0.00 -0.04 0.00 0.01 0.00 0.00 46.19 45.92 2k9s s LEU 32 CO 0.58 -0.59 0.93 -0.44 1.01 0.00 0.00 176.35 177.84 2k9s s SER 33 N -3.14 6.24 0.16 2.29 0.01 -1.26 -2.97 113.70 115.03 2k9s s SER 33 Ca 0.23 1.22 -0.09 0.00 1.31 0.00 0.00 55.95 58.62 2k9s s SER 33 Cb 0.06 -2.38 0.01 0.00 0.21 0.00 0.00 66.02 63.93 2k9s s SER 33 CO 0.03 -0.75 1.50 1.55 0.41 0.00 0.00 173.24 175.98 2k9s h PRO 34 N -0.10 0.86 -0.34 12.44 0.13 -1.90 0.19 132.00 143.28 2k9s h PRO 34 Ca -0.45 -0.45 -0.07 0.00 -0.87 0.00 0.00 66.00 64.15 2k9s h PRO 34 Cb 1.20 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 2k9s h PRO 34 CO 0.62 1.09 -0.08 1.03 -0.23 0.00 0.00 178.00 180.44 2k9s h SER 35 N 0.70 0.66 -0.14 1.44 0.87 -1.98 -0.74 113.55 114.36 2k9s h SER 35 Ca 0.06 -0.36 -0.12 0.00 -1.23 0.00 0.00 61.79 60.14 2k9s h SER 35 Cb 0.97 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.75 2k9s h SER 35 CO 0.09 0.86 -0.36 -0.09 -0.53 0.00 0.00 176.83 176.80 2k9s h ARG 36 N 0.44 0.50 -0.52 2.24 1.12 -1.96 -2.78 114.38 113.42 2k9s h ARG 36 Ca 0.09 -0.35 -0.00 0.00 -1.11 0.00 0.00 59.98 58.61 2k9s h ARG 36 Cb 0.57 0.05 -0.03 0.00 -0.01 0.00 0.00 29.97 30.56 2k9s h ARG 36 CO 0.03 0.96 0.32 1.25 -3.11 0.00 0.00 179.97 179.42 2k9s h LEU 37 N 0.12 0.62 -1.02 3.80 5.85 -0.96 -2.42 115.31 121.29 2k9s h LEU 37 Ca -0.00 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.67 2k9s h LEU 37 Cb 0.97 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.80 2k9s h LEU 37 CO 0.08 0.48 0.65 -1.28 -0.34 0.00 0.00 178.44 178.04 2k9s h SER 38 N 0.69 1.14 -0.14 1.25 0.87 -1.17 0.18 113.55 116.38 2k9s h SER 38 Ca 0.19 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.72 2k9s h SER 38 Cb -0.02 -0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 61.64 2k9s h SER 38 CO -0.04 0.83 0.08 -0.74 -0.53 0.00 0.00 176.83 176.44 2k9s h HIS 39 N 1.35 0.15 -0.07 2.24 -0.00 -1.16 -1.35 115.15 116.32 2k9s h HIS 39 Ca 0.36 0.01 -0.13 0.00 -0.00 0.00 0.00 60.37 60.61 2k9s h HIS 39 Cb -0.15 -0.05 -0.01 0.00 -0.00 0.00 0.00 27.41 27.20 2k9s h HIS 39 CO 0.00 0.09 -0.53 -0.07 -0.00 0.00 0.00 177.93 177.42 2k9s h LEU 40 N 0.17 0.21 -1.17 0.26 3.38 -1.10 -2.99 115.31 114.08 2k9s h LEU 40 Ca 0.05 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 2k9s h LEU 40 Cb -0.01 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 2k9s h LEU 40 CO -0.03 0.70 0.01 0.15 0.09 0.00 0.00 178.44 179.37 2k9s h PHE 41 N 0.15 0.61 -0.27 1.13 3.57 -0.25 0.57 116.94 122.45 2k9s h PHE 41 Ca 0.00 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.43 2k9s h PHE 41 Cb 0.99 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.54 2k9s h PHE 41 CO 0.01 0.58 0.12 -0.09 -2.23 0.00 0.00 178.31 176.71 2k9s h ARG 42 N 0.56 0.39 0.08 1.11 2.43 -1.10 0.39 114.38 118.23 2k9s h ARG 42 Ca 0.12 -0.06 -0.25 0.00 -0.81 0.00 0.00 59.98 58.98 2k9s h ARG 42 Cb 0.34 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 2k9s h ARG 42 CO 0.01 0.40 -1.14 0.37 -1.51 0.00 0.00 179.97 178.10 2k9s h GLN 43 N 0.29 0.16 -0.35 0.20 4.15 -1.52 0.81 115.11 118.86 2k9s h GLN 43 Ca 0.09 -0.28 -0.16 0.00 0.77 0.00 0.00 58.65 59.08 2k9s h GLN 43 Cb 0.14 0.10 -0.00 0.00 0.21 0.00 0.00 27.48 27.93 2k9s h GLN 43 CO -0.01 1.13 -0.40 1.96 -1.93 0.00 0.00 178.83 179.58 2k9s h GLN 44 N 0.05 0.88 -0.00 1.69 1.08 0.24 -3.21 115.11 115.84 2k9s h GLN 44 Ca -0.08 -0.49 0.00 0.00 -1.45 0.00 0.00 58.65 56.63 2k9s h GLN 44 Cb 1.89 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 29.34 2k9s h GLN 44 CO 0.17 1.13 -0.93 1.28 -0.95 0.00 0.00 178.83 179.54 2k9s n LEU 45 N -4.09 1.04 0.00 1.46 7.99 0.14 -4.81 117.00 118.72 2k9s n LEU 45 Ca -0.03 -0.52 0.00 0.00 -0.01 0.00 0.00 56.01 55.45 2k9s n LEU 45 Cb 0.55 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.86 2k9s n LEU 45 CO 0.48 0.25 0.00 0.61 -1.51 0.00 0.00 177.39 177.22 2k9s n GLY 46 N 1.47 0.63 3.55 -0.72 0.00 0.28 -4.93 105.19 105.47 2k9s n GLY 46 Ca 0.04 0.00 -0.13 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 -2.88 0.00 0.36 -0.61 -4.36 -0.72 -4.91 121.20 108.08 2k9s s ILE 47 Ca 0.00 -1.49 -0.25 0.00 -0.26 0.00 0.00 60.65 58.64 2k9s s ILE 47 Cb 0.00 -2.64 -0.09 0.00 1.25 0.00 0.00 42.46 40.98 2k9s s ILE 47 CO 0.00 0.00 1.04 -0.94 0.24 0.00 0.00 174.94 175.28 2k9s s SER 48 N -3.19 6.97 0.40 4.36 1.04 -1.26 -3.82 113.70 118.19 2k9s s SER 48 Ca 0.28 2.05 0.14 0.00 0.48 0.00 0.00 55.95 58.89 2k9s s SER 48 Cb -0.01 -2.59 0.98 0.00 0.10 0.00 0.00 66.02 64.50 2k9s s SER 48 CO 0.18 -0.34 1.88 1.62 0.98 0.00 0.00 173.24 177.56 2k9s h VAL 49 N 2.45 0.76 -0.46 5.02 3.04 -1.91 0.14 116.25 125.29 2k9s h VAL 49 Ca -0.48 -0.17 -0.02 0.00 -1.01 0.00 0.00 66.70 65.02 2k9s h VAL 49 Cb 1.21 0.22 -0.02 0.00 -2.01 0.00 0.00 31.29 30.68 2k9s h VAL 49 CO 0.64 0.09 0.21 -0.07 -1.01 0.00 0.00 177.57 177.43 2k9s h LEU 50 N 0.50 0.62 -0.21 3.16 3.38 -2.01 -1.65 115.31 119.10 2k9s h LEU 50 Ca 0.43 -0.14 -0.21 0.00 0.09 0.00 0.00 57.88 58.05 2k9s h LEU 50 Cb 0.92 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 41.52 2k9s h LEU 50 CO -0.17 0.59 -0.74 -1.28 0.09 0.00 0.00 178.44 176.93 2k9s h SER 51 N 0.61 0.90 -1.01 -0.43 0.87 -1.52 -3.19 113.55 109.77 2k9s h SER 51 Ca 0.16 -0.57 0.04 0.00 -1.23 0.00 0.00 61.79 60.19 2k9s h SER 51 Cb 0.15 -0.26 -0.06 0.00 -0.44 0.00 0.00 62.40 61.78 2k9s h SER 51 CO -0.02 1.36 0.66 -0.25 -0.53 0.00 0.00 176.83 178.06 2k9s h TRP 52 N 0.53 1.23 -0.49 2.24 7.01 -0.65 -1.38 115.95 124.44 2k9s h TRP 52 Ca -0.04 0.03 0.03 0.00 2.11 0.00 0.00 58.89 61.02 2k9s h TRP 52 Cb 1.36 -0.41 -0.04 0.00 -2.10 0.00 0.00 29.16 27.97 2k9s h TRP 52 CO 0.08 0.70 0.28 -0.09 -2.79 0.00 0.00 178.44 176.61 2k9s h ARG 53 N 1.26 0.53 -0.49 2.65 9.65 -1.29 -1.28 114.38 125.40 2k9s h ARG 53 Ca 0.41 -0.03 -0.07 0.00 -1.10 0.00 0.00 59.98 59.18 2k9s h ARG 53 Cb 0.03 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 28.47 2k9s h ARG 53 CO -0.13 0.35 0.03 1.49 2.80 0.00 0.00 179.97 184.50 2k9s h GLU 54 N 0.55 0.85 -0.71 0.20 4.81 -1.44 -2.36 114.58 116.49 2k9s h GLU 54 Ca 0.21 -0.26 0.04 0.00 -0.13 0.00 0.00 59.36 59.22 2k9s h GLU 54 Cb 0.06 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 29.31 2k9s h GLU 54 CO -0.11 0.88 0.43 0.22 -0.73 0.00 0.00 179.01 179.69 2k9s h ASP 55 N 0.72 0.67 -0.14 1.04 3.58 -0.84 -1.65 116.42 119.80 2k9s h ASP 55 Ca 0.14 0.01 -0.08 0.00 0.42 0.00 0.00 57.03 57.53 2k9s h ASP 55 Cb 0.48 -0.13 -0.02 0.00 1.72 0.00 0.00 39.33 41.38 2k9s h ASP 55 CO 0.02 0.45 -0.15 1.56 -2.88 0.00 0.00 179.24 178.24 2k9s h GLN 56 N 0.81 0.52 -0.29 0.28 1.08 -1.10 -1.98 115.11 114.43 2k9s h GLN 56 Ca 0.30 -0.16 -0.01 0.00 -1.45 0.00 0.00 58.65 57.33 2k9s h GLN 56 Cb 0.10 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.47 2k9s h GLN 56 CO -0.14 0.66 0.15 0.00 -0.95 0.00 0.00 178.83 178.54 2k9s h ARG 57 N 0.47 0.41 -0.29 1.46 3.08 -0.78 0.14 114.38 118.87 2k9s h ARG 57 Ca 0.08 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 60.03 2k9s h ARG 57 Cb 0.54 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 2k9s h ARG 57 CO 0.03 0.38 0.00 0.82 -1.07 0.00 0.00 179.97 180.13 2k9s h ILE 58 N 0.33 1.26 -0.59 2.04 1.08 -1.26 -0.45 117.51 119.93 2k9s h ILE 58 Ca 0.10 -0.93 -0.05 0.00 -0.39 0.00 0.00 64.86 63.60 2k9s h ILE 58 Cb 0.10 1.28 -0.03 0.00 -3.07 0.00 0.00 36.82 35.10 2k9s h ILE 58 CO -0.01 0.30 0.18 -1.28 -0.69 0.00 0.00 178.15 176.64 2k9s h SER 59 N 0.31 0.83 -0.18 1.72 0.87 -1.25 -2.71 113.55 113.14 2k9s h SER 59 Ca 0.08 -0.14 -0.18 0.00 -1.23 0.00 0.00 61.79 60.33 2k9s h SER 59 Cb 0.43 -0.22 -0.00 0.00 -0.44 0.00 0.00 62.40 62.17 2k9s h SER 59 CO 0.01 0.79 -0.55 -0.61 -0.53 0.00 0.00 176.83 175.94 2k9s h GLN 60 N 0.87 0.78 -0.85 2.24 5.75 -0.58 -3.11 115.11 120.20 2k9s h GLN 60 Ca 0.19 -0.50 0.09 0.00 -0.15 0.00 0.00 58.65 58.28 2k9s h GLN 60 Cb 0.26 0.06 -0.06 0.00 1.07 0.00 0.00 27.48 28.81 2k9s h GLN 60 CO -0.01 1.12 0.55 0.00 -2.65 0.00 0.00 178.83 177.85 2k9s h ALA 61 N 0.77 1.64 -0.80 3.38 0.00 -0.77 -1.29 119.26 122.20 2k9s h ALA 61 Ca 0.01 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2k9s h ALA 61 Cb 1.14 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 2k9s h ALA 61 CO 0.12 0.20 0.34 0.87 0.00 0.00 0.00 179.25 180.77 2k9s h LYS 62 N 0.87 1.19 -0.37 0.00 1.57 -1.44 0.20 116.57 118.59 2k9s h LYS 62 Ca 0.38 -0.20 -0.03 0.00 -1.87 0.00 0.00 60.65 58.93 2k9s h LYS 62 Cb 0.35 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 2k9s h LYS 62 CO -0.15 0.95 0.13 1.25 -0.57 0.00 0.00 179.45 181.05 2k9s h LEU 63 N 1.16 0.53 -0.22 2.94 6.46 -1.27 0.18 115.31 125.09 2k9s h LEU 63 Ca 0.27 -0.19 -0.10 0.00 -0.12 0.00 0.00 57.88 57.74 2k9s h LEU 63 Cb 0.19 -0.14 -0.00 0.00 -0.73 0.00 0.00 40.66 39.98 2k9s h LEU 63 CO -0.03 0.58 -0.24 -0.07 -0.62 0.00 0.00 178.44 178.07 2k9s h LEU 64 N 0.45 0.59 -1.59 2.25 3.38 -1.20 0.25 115.31 119.44 2k9s h LEU 64 Ca 0.12 -0.48 -0.04 0.00 0.09 0.00 0.00 57.88 57.57 2k9s h LEU 64 Cb 0.23 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2k9s h LEU 64 CO -0.01 0.95 -0.19 -0.07 0.09 0.00 0.00 178.44 179.22 2k9s h LEU 65 N 0.24 0.00 0.00 1.67 3.38 -0.53 0.60 115.31 120.67 2k9s h LEU 65 Ca 0.03 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.80 2k9s h LEU 65 Cb 0.79 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.51 2k9s h LEU 65 CO 0.06 0.19 -1.53 -1.20 0.09 0.00 0.00 178.44 176.05 2k9s n SER 66 N -3.64 0.81 0.01 -0.43 7.64 0.61 -4.01 113.62 114.61 2k9s n SER 66 Ca -0.01 0.36 0.11 0.00 1.01 0.00 0.00 58.87 60.34 2k9s n SER 66 Cb 0.32 0.19 0.05 0.00 -1.01 0.00 0.00 64.21 63.75 2k9s n SER 66 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 2k9s n THR 67 N -2.90 0.08 -4.39 0.44 5.66 0.86 -4.96 114.28 109.07 2k9s n THR 67 Ca -0.12 -0.12 -0.20 0.00 -3.05 0.00 0.00 64.05 60.56 2k9s n THR 67 Cb 0.89 0.42 -0.09 0.00 -1.55 0.00 0.00 70.33 69.99 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 -3.10 0.58 -0.12 1.09 -4.23 0.21 -5.03 115.64 105.04 2k9s s THR 68 Ca 0.07 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 58.73 2k9s s THR 68 Cb 0.16 -2.55 0.25 0.00 1.34 0.00 0.00 72.50 71.70 2k9s s THR 68 CO 0.79 0.00 1.14 -2.11 -0.54 0.00 0.00 174.62 173.90 2k9s n ARG 69 N -0.65 1.64 -1.36 3.99 0.00 -1.26 -4.61 116.66 114.42 2k9s n ARG 69 Ca -0.01 -2.41 -0.33 0.00 -0.00 0.00 0.00 57.85 55.09 2k9s n ARG 69 Cb 0.65 -1.43 0.10 0.00 -0.00 0.00 0.00 32.46 31.78 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 -2.56 2.09 0.93 2.89 -1.94 -1.26 -5.01 119.30 114.44 2k9s s MET 70 Ca 0.27 1.60 -0.12 0.00 -1.71 0.00 0.00 55.69 55.74 2k9s s MET 70 Cb 0.24 -1.84 0.15 0.00 2.01 0.00 0.00 34.83 35.38 2k9s s MET 70 CO 0.03 -1.84 1.09 -1.25 -0.01 0.00 0.00 175.02 173.04 2k9s s PRO 71 N -4.16 0.99 0.46 2.03 0.04 -1.26 -4.80 135.00 128.30 2k9s s PRO 71 Ca 0.70 0.72 0.13 0.00 0.04 0.00 0.00 61.00 62.60 2k9s s PRO 71 Cb -0.25 -1.79 1.04 0.00 0.04 0.00 0.00 34.50 33.54 2k9s s PRO 71 CO 0.48 -2.40 2.04 0.82 0.04 0.00 0.00 177.00 177.97 2k9s h ILE 72 N -1.66 1.09 -0.18 0.56 2.04 -1.99 -1.83 117.51 115.55 2k9s h ILE 72 Ca -0.51 -0.41 -0.02 0.00 1.00 0.00 0.00 64.86 64.92 2k9s h ILE 72 Cb 1.30 1.13 -0.01 0.00 -0.74 0.00 0.00 36.82 38.50 2k9s h ILE 72 CO 0.55 0.13 0.02 0.00 0.00 0.00 0.00 178.15 178.85 2k9s h ALA 73 N 1.84 0.24 0.02 1.87 0.00 -1.93 -0.88 119.26 120.41 2k9s h ALA 73 Ca 0.02 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 2k9s h ALA 73 Cb 0.19 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2k9s h ALA 73 CO 0.01 -0.08 -0.01 1.15 0.00 0.00 0.00 179.25 180.32 2k9s h THR 74 N 0.08 1.20 -1.01 0.00 2.02 -1.84 -3.06 112.91 110.30 2k9s h THR 74 Ca 0.05 -0.66 0.06 0.00 0.77 0.00 0.00 66.41 66.64 2k9s h THR 74 Cb 0.33 1.64 -0.07 0.00 -1.74 0.00 0.00 68.15 68.32 2k9s h THR 74 CO 0.01 0.17 0.65 0.58 0.37 0.00 0.00 175.52 177.30 2k9s h VAL 75 N -0.30 1.09 -0.55 3.16 2.07 -1.37 -1.37 116.25 118.98 2k9s h VAL 75 Ca -0.00 -0.41 0.12 0.00 0.82 0.00 0.00 66.70 67.23 2k9s h VAL 75 Cb 0.29 -0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 29.84 2k9s h VAL 75 CO 0.00 0.22 0.38 1.23 0.02 0.00 0.00 177.57 179.42 2k9s h GLY 76 N 1.19 0.33 1.69 2.17 0.00 -1.06 -0.18 103.07 107.21 2k9s h GLY 76 Ca 0.43 -0.09 -0.13 0.00 0.00 0.00 0.00 47.33 47.53 2k9s h GLY 76 CO -0.17 0.05 -0.51 3.21 0.00 0.00 0.00 176.54 179.12 2k9s h ARG 77 N 0.22 0.33 -0.15 4.80 2.47 -0.63 0.38 114.38 121.81 2k9s h ARG 77 Ca 0.26 -0.19 -0.04 0.00 -1.26 0.00 0.00 59.98 58.75 2k9s h ARG 77 Cb 0.73 0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 29.06 2k9s h ARG 77 CO -0.05 0.76 -0.08 -0.91 0.56 0.00 0.00 179.97 180.26 2k9s h ASN 78 N 0.26 0.21 -0.37 7.04 2.35 -0.98 -1.08 115.58 123.01 2k9s h ASN 78 Ca 0.01 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 2k9s h ASN 78 Cb 0.99 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 39.31 2k9s h ASN 78 CO 0.08 0.32 0.00 1.33 -1.65 0.00 0.00 177.43 177.51 2k9s n VAL 79 N -4.33 0.69 -1.95 2.81 0.24 -1.11 -4.65 118.33 110.03 2k9s n VAL 79 Ca -0.01 -0.55 -0.05 0.00 -2.04 0.00 0.00 64.34 61.68 2k9s n VAL 79 Cb 0.22 0.13 -0.01 0.00 -1.47 0.00 0.00 33.84 32.72 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 0.96 0.25 3.03 7.63 0.00 -0.41 -4.86 105.19 111.80 2k9s n GLY 80 Ca 0.13 -0.68 -0.31 0.00 0.00 0.00 0.00 46.02 45.16 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 -2.26 2.49 0.11 1.61 0.08 0.13 -4.99 117.98 115.16 2k9s s PHE 81 Ca 0.00 -1.56 0.04 0.00 0.12 0.00 0.00 56.93 55.53 2k9s s PHE 81 Cb 0.00 -1.71 -0.22 0.00 -0.57 0.00 0.00 43.02 40.52 2k9s s PHE 81 CO 0.00 -0.75 1.25 -0.44 -0.10 0.00 0.00 175.22 175.18 2k9s h ASP 82 N 7.97 0.12 -3.47 1.36 3.32 -1.92 -2.28 116.42 121.53 2k9s h ASP 82 Ca -0.34 -0.13 -0.61 0.00 0.02 0.00 0.00 57.03 55.98 2k9s h ASP 82 Cb 1.11 -0.04 -0.11 0.00 0.22 0.00 0.00 39.33 40.51 2k9s h ASP 82 CO 0.52 1.09 0.24 -1.81 -1.72 0.00 0.00 179.24 177.56 2k9s s ASP 83 N -6.83 6.59 0.21 6.45 1.11 -1.26 -4.90 116.67 118.04 2k9s s ASP 83 Ca -0.00 0.64 -0.08 0.00 0.18 0.00 0.00 52.55 53.28 2k9s s ASP 83 Cb 0.09 -2.36 0.15 0.00 1.07 0.00 0.00 42.92 41.87 2k9s s ASP 83 CO 0.84 -0.47 1.79 0.06 1.18 0.00 0.00 175.17 178.57 2k9s h GLN 84 N 8.01 1.14 -0.24 8.23 3.07 -1.88 -2.37 115.11 131.08 2k9s h GLN 84 Ca -0.26 -0.19 -0.04 0.00 0.09 0.00 0.00 58.65 58.25 2k9s h GLN 84 Cb 1.11 -0.20 -0.01 0.00 0.08 0.00 0.00 27.48 28.46 2k9s h GLN 84 CO 0.81 0.91 -0.03 -0.07 0.09 0.00 0.00 178.83 180.54 2k9s h LEU 85 N 1.11 0.33 -0.20 0.06 -0.00 -1.95 -2.19 115.31 112.47 2k9s h LEU 85 Ca 0.26 -0.05 0.00 0.00 -0.00 0.00 0.00 57.88 58.09 2k9s h LEU 85 Cb 0.16 -0.09 -0.01 0.00 -0.00 0.00 0.00 40.66 40.73 2k9s h LEU 85 CO -0.03 0.41 0.13 0.22 -0.00 0.00 0.00 178.44 179.18 2k9s h TYR 86 N 0.35 0.25 -0.57 1.13 5.03 -1.84 0.13 116.97 121.44 2k9s h TYR 86 Ca 0.08 0.01 -0.11 0.00 2.58 0.00 0.00 58.73 61.28 2k9s h TYR 86 Cb 0.28 -0.08 -0.02 0.00 1.55 0.00 0.00 36.73 38.46 2k9s h TYR 86 CO 0.01 0.15 -0.07 0.35 -1.32 0.00 0.00 178.16 177.28 2k9s h PHE 87 N 0.27 1.16 -0.44 -3.82 3.57 -1.41 -2.60 116.94 113.66 2k9s h PHE 87 Ca 0.08 -0.22 -0.07 0.00 3.53 0.00 0.00 57.97 61.28 2k9s h PHE 87 Cb -0.03 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 38.40 2k9s h PHE 87 CO -0.07 1.05 -0.03 0.77 -2.23 0.00 0.00 178.31 177.80 2k9s h SER 88 N 0.94 0.71 0.10 0.41 0.02 -1.10 0.29 113.55 114.92 2k9s h SER 88 Ca 0.15 -0.18 -0.00 0.00 -0.84 0.00 0.00 61.79 60.92 2k9s h SER 88 Cb 0.64 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.99 2k9s h SER 88 CO 0.04 0.80 -0.05 0.03 -1.14 0.00 0.00 176.83 176.52 2k9s h ARG 89 N 0.69 -0.13 -0.32 3.45 2.47 -0.56 0.30 114.38 120.28 2k9s h ARG 89 Ca 0.13 0.01 -0.17 0.00 -1.26 0.00 0.00 59.98 58.69 2k9s h ARG 89 Cb 0.47 0.03 -0.00 0.00 -1.65 0.00 0.00 29.97 28.82 2k9s h ARG 89 CO 0.02 0.09 -0.45 -0.24 0.56 0.00 0.00 179.97 179.95 2k9s h VAL 90 N -0.33 1.28 -0.35 2.04 3.04 -1.39 -3.12 116.25 117.42 2k9s h VAL 90 Ca -0.01 -1.63 -0.09 0.00 -1.01 0.00 0.00 66.70 63.96 2k9s h VAL 90 Cb 0.27 1.55 -0.02 0.00 -2.01 0.00 0.00 31.29 31.09 2k9s h VAL 90 CO 0.02 0.53 -0.14 0.15 -1.01 0.00 0.00 177.57 177.12 2k9s h PHE 91 N 0.65 0.69 -0.45 3.17 3.04 -0.39 -1.55 116.94 122.10 2k9s h PHE 91 Ca 0.03 -0.12 0.04 0.00 3.98 0.00 0.00 57.97 61.90 2k9s h PHE 91 Cb 1.05 -0.18 -0.04 0.00 2.56 0.00 0.00 35.95 39.34 2k9s h PHE 91 CO 0.07 0.74 0.23 -0.22 -2.02 0.00 0.00 178.31 177.11 2k9s h LYS 92 N 0.57 0.44 0.00 1.11 3.64 -0.34 -1.78 116.57 120.22 2k9s h LYS 92 Ca 0.10 -0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.38 2k9s h LYS 92 Cb 0.57 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 2k9s h LYS 92 CO 0.04 0.29 -0.36 1.57 -2.27 0.00 0.00 179.45 178.72 2k9s h LYS 93 N 0.45 0.00 -0.23 1.90 2.10 -1.47 0.79 116.57 120.11 2k9s h LYS 93 Ca 0.19 0.00 0.05 0.00 -2.00 0.00 0.00 60.65 58.89 2k9s h LYS 93 Cb 0.09 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 31.38 2k9s h LYS 93 CO -0.13 0.36 -0.06 0.00 -2.00 0.00 0.00 179.45 177.62 2k9s n THR 95 N -5.22 0.00 -0.05 0.00 -2.24 -1.12 -4.99 114.28 100.67 2k9s n THR 95 Ca -0.02 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 2k9s n THR 95 Cb 0.14 1.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.40 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 1.12 0.58 3.07 3.38 0.00 0.25 -5.04 105.19 108.54 2k9s n GLY 96 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.24 0.53 0.94 4.61 0.00 0.22 -4.82 121.76 121.00 2k9s s ALA 97 Ca 0.00 -0.92 -0.11 0.00 0.00 0.00 0.00 51.96 50.93 2k9s s ALA 97 Cb 0.00 0.14 0.16 0.00 0.00 0.00 0.00 23.12 23.41 2k9s s ALA 97 CO 0.00 -0.16 1.10 -1.54 0.00 0.00 0.00 175.76 175.16 2k9s s SER 98 N -2.10 2.89 0.33 0.00 1.04 -1.26 -4.01 113.70 110.59 2k9s s SER 98 Ca -0.04 1.83 0.12 0.00 0.48 0.00 0.00 55.95 58.34 2k9s s SER 98 Cb -0.04 -2.41 0.56 0.00 0.10 0.00 0.00 66.02 64.24 2k9s s SER 98 CO -0.03 -3.06 1.73 1.55 0.98 0.00 0.00 173.24 174.41 2k9s h PRO 99 N -1.84 0.00 -0.20 4.02 0.13 -1.89 -2.96 132.00 129.26 2k9s h PRO 99 Ca -0.49 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.55 2k9s h PRO 99 Cb 1.28 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.40 2k9s h PRO 99 CO 0.48 0.48 -0.28 0.66 -0.23 0.00 0.00 178.00 179.11 2k9s h SER 100 N 0.00 0.39 -0.05 1.44 4.64 -1.99 -2.27 113.55 115.71 2k9s h SER 100 Ca -0.00 -0.14 -0.04 0.00 -0.47 0.00 0.00 61.79 61.14 2k9s h SER 100 Cb 0.86 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 2k9s h SER 100 CO 0.06 0.67 -0.13 -0.08 -0.87 0.00 0.00 176.83 176.48 2k9s h GLU 101 N 0.34 0.18 -0.81 4.77 4.22 -1.89 -2.65 114.58 118.75 2k9s h GLU 101 Ca 0.05 -0.12 0.04 0.00 0.08 0.00 0.00 59.36 59.41 2k9s h GLU 101 Cb 0.68 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.90 2k9s h GLU 101 CO 0.05 0.73 0.53 0.35 -2.18 0.00 0.00 179.01 178.49 2k9s h PHE 102 N -0.33 0.94 -0.21 0.92 3.57 -1.47 -1.40 116.94 118.96 2k9s h PHE 102 Ca -0.00 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.42 2k9s h PHE 102 Cb 0.73 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 39.14 2k9s h PHE 102 CO 0.12 0.54 -0.32 0.00 -2.23 0.00 0.00 178.31 176.41 2k9s h ARG 103 N 0.96 0.44 -0.26 1.11 2.47 -1.41 -2.85 114.38 114.83 2k9s h ARG 103 Ca 0.33 -0.19 -0.06 0.00 -1.26 0.00 0.00 59.98 58.80 2k9s h ARG 103 Cb 0.09 -0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.38 2k9s h ARG 103 CO -0.10 0.71 -0.11 0.00 0.56 0.00 0.00 179.97 181.03 2k9s h ALA 104 N 1.28 1.33 0.00 0.04 0.00 -0.88 -3.47 119.26 117.56 2k9s h ALA 104 Ca 0.05 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2k9s h ALA 104 Cb 0.75 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2k9s h ALA 104 CO 0.06 0.45 0.00 0.41 0.00 0.00 0.00 179.25 180.17 2k9s n GLY 105 N -0.73 0.64 3.68 0.00 0.00 -1.00 -5.02 105.19 102.77 2k9s n GLY 105 Ca 0.00 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 2k9s n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32