#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 6.88 0.46 3.17 2.15 -1.26 -4.86 116.67 123.21 2k9s s ASP 2 Ca 0.00 1.80 0.18 0.00 0.43 0.00 0.00 52.55 54.96 2k9s s ASP 2 Cb 0.00 -2.56 1.15 0.00 -0.30 0.00 0.00 42.92 41.22 2k9s s ASP 2 CO 0.00 -0.40 1.95 -0.55 -0.17 0.00 0.00 175.17 176.00 2k9s h ASN 3 N 2.12 0.27 -0.17 -0.34 7.08 -2.04 0.22 115.58 122.72 2k9s h ASN 3 Ca -0.49 0.01 -0.10 0.00 -3.08 0.00 0.00 56.30 52.65 2k9s h ASN 3 Cb 1.19 -0.04 -0.00 0.00 -2.08 0.00 0.00 38.32 37.39 2k9s h ASN 3 CO 0.61 0.14 -0.27 -0.09 -2.08 0.00 0.00 177.43 175.74 2k9s h ARG 4 N 0.29 0.49 -0.42 4.14 9.65 -2.01 -3.00 114.38 123.51 2k9s h ARG 4 Ca 0.32 -0.30 -0.15 0.00 -1.10 0.00 0.00 59.98 58.76 2k9s h ARG 4 Cb 0.85 0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 29.45 2k9s h ARG 4 CO -0.08 0.89 -0.31 0.28 2.80 0.00 0.00 179.97 183.55 2k9s h VAL 5 N 0.13 1.27 -0.69 0.20 2.07 -1.61 -2.99 116.25 114.62 2k9s h VAL 5 Ca 0.01 -1.48 0.09 0.00 0.82 0.00 0.00 66.70 66.14 2k9s h VAL 5 Cb 0.85 1.28 -0.04 0.00 -1.52 0.00 0.00 31.29 31.86 2k9s h VAL 5 CO 0.06 0.50 0.46 -0.09 0.02 0.00 0.00 177.57 178.52 2k9s h ARG 6 N 0.79 0.57 -0.72 1.57 2.43 -0.64 -1.04 114.38 117.33 2k9s h ARG 6 Ca 0.08 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.19 2k9s h ARG 6 Cb 0.90 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 30.29 2k9s h ARG 6 CO 0.08 0.38 0.32 0.93 -1.51 0.00 0.00 179.97 180.17 2k9s h GLU 7 N 0.58 1.05 -0.22 0.20 3.07 -1.37 -2.52 114.58 115.37 2k9s h GLU 7 Ca 0.32 -0.17 -0.15 0.00 -0.50 0.00 0.00 59.36 58.86 2k9s h GLU 7 Cb 0.47 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 28.19 2k9s h GLU 7 CO -0.11 0.84 -0.47 0.00 -1.40 0.00 0.00 179.01 177.88 2k9s h ALA 8 N 1.16 0.76 -0.67 3.43 0.00 -1.26 -3.05 119.26 119.63 2k9s h ALA 8 Ca 0.24 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2k9s h ALA 8 Cb 0.15 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 2k9s h ALA 8 CO -0.03 0.67 0.43 0.00 0.00 0.00 0.00 179.25 180.32 2k9s h GLN 10 N 0.91 0.83 -0.30 0.00 5.75 -1.34 -1.23 115.11 119.73 2k9s h GLN 10 Ca 0.24 -0.09 -0.08 0.00 -0.15 0.00 0.00 58.65 58.58 2k9s h GLN 10 Cb -0.08 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 28.29 2k9s h GLN 10 CO -0.05 0.62 -0.12 -0.92 -2.65 0.00 0.00 178.83 175.72 2k9s h TYR 11 N 0.84 0.69 -0.51 3.99 3.20 -1.38 -2.13 116.97 121.66 2k9s h TYR 11 Ca 0.21 -0.16 -0.06 0.00 3.14 0.00 0.00 58.73 61.86 2k9s h TYR 11 Cb 0.04 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.13 2k9s h TYR 11 CO 0.01 0.82 0.08 0.82 -1.64 0.00 0.00 178.16 178.25 2k9s h ILE 12 N 0.36 1.23 -0.32 1.81 2.04 -1.13 -1.64 117.51 119.86 2k9s h ILE 12 Ca 0.07 -0.88 -0.05 0.00 1.00 0.00 0.00 64.86 65.00 2k9s h ILE 12 Cb 0.62 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 2k9s h ILE 12 CO 0.04 0.32 -0.01 -1.28 0.00 0.00 0.00 178.15 177.22 2k9s h SER 13 N 0.77 0.56 0.54 1.72 0.87 -1.14 -1.76 113.55 115.12 2k9s h SER 13 Ca 0.16 -0.31 -0.04 0.00 -1.23 0.00 0.00 61.79 60.37 2k9s h SER 13 Cb 0.35 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.15 2k9s h SER 13 CO 0.01 0.74 -0.20 0.44 -0.53 0.00 0.00 176.83 177.29 2k9s h ASP 14 N 0.36 0.00 -0.60 6.23 5.19 -1.19 -2.12 116.42 124.29 2k9s h ASP 14 Ca 0.09 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.50 2k9s h ASP 14 Cb 0.46 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.97 2k9s h ASP 14 CO 0.02 0.20 0.00 1.41 -3.12 0.00 0.00 179.24 177.75 2k9s n HIS 15 N -3.63 1.85 0.26 4.55 8.25 -0.63 -4.42 115.22 121.45 2k9s n HIS 15 Ca -0.01 -0.69 0.11 0.00 -0.26 0.00 0.00 57.72 56.87 2k9s n HIS 15 Cb 0.33 -0.41 0.69 0.00 1.12 0.00 0.00 29.99 31.72 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 4.00 0.00 0.00 2.41 6.46 -0.61 -1.85 115.31 125.71 2k9s h LEU 16 Ca 0.00 0.00 -0.03 0.00 -0.12 0.00 0.00 57.88 57.73 2k9s h LEU 16 Cb 1.78 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.71 2k9s h LEU 16 CO 0.39 0.11 -1.12 0.00 -0.62 0.00 0.00 178.44 177.20 2k9s n ALA 17 N -2.36 2.43 -1.77 1.25 0.00 -1.26 -4.34 120.51 114.46 2k9s n ALA 17 Ca -0.02 -0.30 -0.40 0.00 0.00 0.00 0.00 53.44 52.72 2k9s n ALA 17 Cb 0.21 -1.06 0.01 0.00 0.00 0.00 0.00 19.45 18.60 2k9s n ALA 17 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2k9s s ASP 18 N -5.40 6.01 -0.12 0.00 1.11 -0.70 -4.83 116.67 112.75 2k9s s ASP 18 Ca -0.01 2.86 -0.26 0.00 0.18 0.00 0.00 52.55 55.32 2k9s s ASP 18 Cb 0.10 -2.65 -0.27 0.00 1.07 0.00 0.00 42.92 41.16 2k9s s ASP 18 CO 0.80 -1.08 0.78 -1.28 1.18 0.00 0.00 175.17 175.57 2k9s h SER 19 N 2.45 0.14 -2.33 0.27 0.87 -1.91 -3.42 113.55 109.62 2k9s h SER 19 Ca -0.51 -0.97 -0.60 0.00 -1.23 0.00 0.00 61.79 58.49 2k9s h SER 19 Cb 1.26 -0.04 -0.12 0.00 -0.44 0.00 0.00 62.40 63.05 2k9s h SER 19 CO 0.62 1.14 0.87 0.20 -0.53 0.00 0.00 176.83 179.13 2k9s s ASN 20 N -6.47 6.26 -0.37 6.23 0.01 -1.26 -4.98 114.94 114.36 2k9s s ASN 20 Ca -0.18 -0.99 -0.08 0.00 -0.71 0.00 0.00 52.86 50.90 2k9s s ASN 20 Cb -0.01 -2.48 0.05 0.00 0.41 0.00 0.00 41.25 39.21 2k9s s ASN 20 CO 0.73 -1.54 0.17 0.12 -1.51 0.00 0.00 177.10 175.06 2k9s s PHE 21 N 4.59 3.28 -0.09 2.20 5.36 -1.26 -5.08 117.98 126.98 2k9s s PHE 21 Ca 0.31 -1.36 0.03 0.00 -0.96 0.00 0.00 56.93 54.94 2k9s s PHE 21 Cb -0.10 -2.49 -0.01 0.00 -0.34 0.00 0.00 43.02 40.07 2k9s s PHE 21 CO 0.07 -0.74 -0.19 0.16 -1.46 0.00 0.00 175.22 173.06 2k9s s ASP 22 N 1.61 3.58 0.49 6.13 -4.77 -1.26 -5.00 116.67 117.45 2k9s s ASP 22 Ca 0.00 -0.40 0.28 0.00 -3.30 0.00 0.00 52.55 49.13 2k9s s ASP 22 Cb -0.20 -1.25 1.20 0.00 -1.09 0.00 0.00 42.92 41.57 2k9s s ASP 22 CO 0.03 0.21 1.94 -0.29 0.70 0.00 0.00 175.17 177.77 2k9s h ILE 23 N 5.21 0.42 -0.93 2.11 2.10 -2.00 -2.97 117.51 121.44 2k9s h ILE 23 Ca -0.29 -0.82 0.03 0.00 1.08 0.00 0.00 64.86 64.86 2k9s h ILE 23 Cb 1.20 1.59 -0.05 0.00 -1.09 0.00 0.00 36.82 38.46 2k9s h ILE 23 CO 0.51 0.14 0.60 0.00 -1.08 0.00 0.00 178.15 178.32 2k9s h ALA 24 N 1.85 1.21 0.00 0.18 0.00 -2.00 -1.47 119.26 119.04 2k9s h ALA 24 Ca -0.00 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 2k9s h ALA 24 Cb 0.57 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2k9s h ALA 24 CO 0.02 0.49 -0.49 1.03 0.00 0.00 0.00 179.25 180.30 2k9s h SER 25 N 1.18 0.00 -0.14 0.00 0.87 -1.96 -2.65 113.55 110.85 2k9s h SER 25 Ca 0.36 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.89 2k9s h SER 25 Cb -0.02 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 61.93 2k9s h SER 25 CO -0.11 0.49 -0.06 0.58 -0.53 0.00 0.00 176.83 177.20 2k9s h VAL 26 N 0.00 1.31 -0.80 2.23 2.07 -1.35 -2.16 116.25 117.54 2k9s h VAL 26 Ca -0.00 -1.06 -0.04 0.00 0.82 0.00 0.00 66.70 66.41 2k9s h VAL 26 Cb 0.88 1.72 -0.04 0.00 -1.52 0.00 0.00 31.29 32.34 2k9s h VAL 26 CO 0.06 0.31 0.34 0.00 0.02 0.00 0.00 177.57 178.30 2k9s h ALA 27 N 0.68 1.04 -0.53 1.67 0.00 -1.32 -2.61 119.26 118.19 2k9s h ALA 27 Ca 0.03 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 2k9s h ALA 27 Cb 0.51 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2k9s h ALA 27 CO 0.02 0.66 0.11 0.37 0.00 0.00 0.00 179.25 180.40 2k9s h GLN 28 N 1.16 0.82 -0.58 0.00 4.15 -1.44 0.11 115.11 119.33 2k9s h GLN 28 Ca 0.27 -0.18 0.06 0.00 0.77 0.00 0.00 58.65 59.57 2k9s h GLN 28 Cb 0.19 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 27.73 2k9s h GLN 28 CO -0.02 0.75 0.38 1.25 -1.93 0.00 0.00 178.83 179.26 2k9s h HIS 29 N 0.79 0.56 -0.60 3.99 2.76 -0.99 0.36 115.15 122.02 2k9s h HIS 29 Ca 0.17 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.35 2k9s h HIS 29 Cb 0.32 -0.19 0.00 0.00 1.55 0.00 0.00 27.41 29.09 2k9s h HIS 29 CO 0.02 0.30 0.00 1.33 -1.30 0.00 0.00 177.93 178.28 2k9s n VAL 30 N -4.47 1.94 -3.48 5.26 0.24 -0.92 -4.92 118.33 111.97 2k9s n VAL 30 Ca 0.08 -1.16 -0.25 0.00 -2.04 0.00 0.00 64.34 60.97 2k9s n VAL 30 Cb 0.23 -0.00 0.01 0.00 -1.47 0.00 0.00 33.84 32.60 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 -6.72 2.06 0.58 0.00 2.96 0.32 -5.00 118.68 112.87 2k9s s LEU 32 Ca 0.46 -1.17 -0.10 0.00 -0.22 0.00 0.00 54.13 53.10 2k9s s LEU 32 Cb -0.24 0.03 -0.04 0.00 0.50 0.00 0.00 46.19 46.44 2k9s s LEU 32 CO 0.57 -0.60 0.96 -0.44 -1.32 0.00 0.00 176.35 175.52 2k9s s SER 33 N -3.14 6.26 0.16 3.68 0.01 -1.26 -3.45 113.70 115.96 2k9s s SER 33 Ca 0.23 1.30 -0.09 0.00 1.31 0.00 0.00 55.95 58.70 2k9s s SER 33 Cb 0.06 -2.41 0.01 0.00 0.21 0.00 0.00 66.02 63.89 2k9s s SER 33 CO 0.03 -0.78 1.50 1.55 0.41 0.00 0.00 173.24 175.95 2k9s h PRO 34 N -0.10 0.86 -0.23 12.44 0.13 -1.90 -0.36 132.00 142.84 2k9s h PRO 34 Ca -0.45 -0.46 -0.02 0.00 -0.87 0.00 0.00 66.00 64.20 2k9s h PRO 34 Cb 1.19 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 2k9s h PRO 34 CO 0.62 1.10 0.05 1.03 -0.23 0.00 0.00 178.00 180.57 2k9s h SER 35 N 0.70 0.35 0.14 1.44 0.87 -1.99 0.11 113.55 115.17 2k9s h SER 35 Ca 0.06 -0.23 -0.16 0.00 -1.23 0.00 0.00 61.79 60.23 2k9s h SER 35 Cb 0.98 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.84 2k9s h SER 35 CO 0.09 0.49 -0.58 -0.09 -0.53 0.00 0.00 176.83 176.22 2k9s h ARG 36 N 0.19 0.45 -0.26 2.24 9.65 -1.97 -2.84 114.38 121.85 2k9s h ARG 36 Ca 0.07 -0.30 -0.08 0.00 -1.10 0.00 0.00 59.98 58.58 2k9s h ARG 36 Cb 0.28 0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 28.89 2k9s h ARG 36 CO 0.00 0.90 -0.14 1.25 2.80 0.00 0.00 179.97 184.79 2k9s h LEU 37 N 0.34 0.57 -1.02 3.80 5.85 -0.93 -2.90 115.31 121.02 2k9s h LEU 37 Ca 0.00 -0.42 0.02 0.00 0.84 0.00 0.00 57.88 58.33 2k9s h LEU 37 Cb 1.11 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.93 2k9s h LEU 37 CO 0.10 0.86 0.66 0.28 -0.34 0.00 0.00 178.44 180.00 2k9s h SER 38 N 0.27 1.13 -0.12 1.25 0.02 -0.77 0.28 113.55 115.62 2k9s h SER 38 Ca 0.06 -0.02 0.01 0.00 -0.84 0.00 0.00 61.79 60.99 2k9s h SER 38 Cb 0.65 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 2k9s h SER 38 CO 0.04 0.80 0.05 -0.74 -1.14 0.00 0.00 176.83 175.84 2k9s h HIS 39 N 1.32 0.10 -0.05 3.45 -0.00 -1.43 -1.23 115.15 117.32 2k9s h HIS 39 Ca 0.38 0.00 -0.14 0.00 -0.00 0.00 0.00 60.37 60.62 2k9s h HIS 39 Cb -0.09 -0.03 -0.01 0.00 -0.00 0.00 0.00 27.41 27.28 2k9s h HIS 39 CO -0.00 0.06 -0.60 -0.07 -0.00 0.00 0.00 177.93 177.32 2k9s h LEU 40 N 0.12 0.20 0.06 0.26 3.38 -1.26 -2.49 115.31 115.58 2k9s h LEU 40 Ca 0.05 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 2k9s h LEU 40 Cb 0.01 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2k9s h LEU 40 CO -0.03 0.75 -0.03 0.15 0.09 0.00 0.00 178.44 179.37 2k9s h PHE 41 N 0.13 -0.08 0.00 1.13 3.57 -0.07 0.32 116.94 121.95 2k9s h PHE 41 Ca -0.01 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.45 2k9s h PHE 41 Cb 1.08 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.84 2k9s h PHE 41 CO 0.02 0.01 -0.19 -0.09 -2.23 0.00 0.00 178.31 175.82 2k9s h ARG 42 N -0.14 0.00 0.12 1.11 2.43 -1.25 0.51 114.38 117.16 2k9s h ARG 42 Ca -0.01 0.00 -0.21 0.00 -0.81 0.00 0.00 59.98 58.95 2k9s h ARG 42 Cb 0.12 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 29.69 2k9s h ARG 42 CO 0.01 0.19 -0.89 0.37 -1.51 0.00 0.00 179.97 178.15 2k9s h GLN 43 N 0.00 0.39 0.22 0.20 5.75 -0.96 0.33 115.11 121.05 2k9s h GLN 43 Ca -0.00 -0.58 -0.33 0.00 -0.15 0.00 0.00 58.65 57.59 2k9s h GLN 43 Cb 0.64 0.20 0.03 0.00 1.07 0.00 0.00 27.48 29.42 2k9s h GLN 43 CO 0.02 1.25 -1.52 1.96 -2.65 0.00 0.00 178.83 177.89 2k9s h GLN 44 N -0.18 0.47 0.00 1.69 1.08 -0.29 -3.32 115.11 114.57 2k9s h GLN 44 Ca -0.14 -0.81 0.00 0.00 -1.45 0.00 0.00 58.65 56.24 2k9s h GLN 44 Cb 1.66 0.30 0.00 0.00 -0.05 0.00 0.00 27.48 29.39 2k9s h GLN 44 CO 0.17 1.39 -0.58 -0.11 -0.95 0.00 0.00 178.83 178.74 2k9s n LEU 45 N -3.72 0.68 0.00 1.46 0.00 0.18 -4.58 117.00 111.03 2k9s n LEU 45 Ca -0.20 0.23 0.00 0.00 0.00 0.00 0.00 56.01 56.05 2k9s n LEU 45 Cb 1.07 -0.20 0.00 0.00 0.00 0.00 0.00 43.42 44.30 2k9s n LEU 45 CO 0.56 -0.05 0.00 0.61 0.00 0.00 0.00 177.39 178.51 2k9s n GLY 46 N 1.35 0.40 3.35 -3.96 0.00 0.12 -4.94 105.19 101.50 2k9s n GLY 46 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.96 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 -2.08 0.07 0.41 -0.61 -4.36 -1.10 -4.92 121.20 108.60 2k9s s ILE 47 Ca 0.00 -1.09 -0.24 0.00 -0.26 0.00 0.00 60.65 59.06 2k9s s ILE 47 Cb 0.00 -1.58 -0.09 0.00 1.25 0.00 0.00 42.46 42.04 2k9s s ILE 47 CO 0.00 -0.33 1.07 -0.55 0.24 0.00 0.00 174.94 175.37 2k9s s SER 48 N -2.90 6.66 0.46 4.36 0.15 -1.26 -3.42 113.70 117.74 2k9s s SER 48 Ca 0.11 2.08 0.19 0.00 0.70 0.00 0.00 55.95 59.03 2k9s s SER 48 Cb 0.02 -2.59 1.17 0.00 -1.71 0.00 0.00 66.02 62.92 2k9s s SER 48 CO -0.05 -0.56 1.94 1.62 1.20 0.00 0.00 173.24 177.39 2k9s h VAL 49 N 2.13 0.77 -0.33 4.45 3.04 -1.91 0.52 116.25 124.90 2k9s h VAL 49 Ca -0.48 -0.10 -0.02 0.00 -1.01 0.00 0.00 66.70 65.09 2k9s h VAL 49 Cb 1.22 0.46 -0.02 0.00 -2.01 0.00 0.00 31.29 30.95 2k9s h VAL 49 CO 0.62 0.05 0.15 0.25 -1.01 0.00 0.00 177.57 177.63 2k9s h LEU 50 N 0.28 0.45 -0.26 3.16 5.85 -2.00 -1.66 115.31 121.12 2k9s h LEU 50 Ca 0.34 -0.15 -0.21 0.00 0.84 0.00 0.00 57.88 58.71 2k9s h LEU 50 Cb 0.93 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.85 2k9s h LEU 50 CO -0.08 0.47 -0.72 0.28 -0.34 0.00 0.00 178.44 178.04 2k9s h SER 51 N 0.40 0.82 -0.96 1.25 0.02 -1.57 -3.07 113.55 110.44 2k9s h SER 51 Ca 0.11 -0.52 0.04 0.00 -0.84 0.00 0.00 61.79 60.59 2k9s h SER 51 Cb 0.15 -0.24 -0.06 0.00 0.14 0.00 0.00 62.40 62.39 2k9s h SER 51 CO -0.01 1.30 0.62 -0.25 -1.14 0.00 0.00 176.83 177.35 2k9s h TRP 52 N 0.49 1.17 -0.21 3.45 7.01 -0.83 0.17 115.95 127.21 2k9s h TRP 52 Ca -0.04 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 60.98 2k9s h TRP 52 Cb 1.33 -0.39 -0.01 0.00 -2.10 0.00 0.00 29.16 28.00 2k9s h TRP 52 CO 0.07 0.65 0.07 0.00 -2.79 0.00 0.00 178.44 176.44 2k9s h ARG 53 N 1.19 0.32 -0.31 2.65 3.08 -1.29 -0.70 114.38 119.31 2k9s h ARG 53 Ca 0.39 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.36 2k9s h ARG 53 Cb 0.05 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 2k9s h ARG 53 CO -0.14 0.40 0.14 1.49 -1.07 0.00 0.00 179.97 180.80 2k9s h GLU 54 N 0.16 0.45 -0.87 0.04 4.81 -1.36 0.44 114.58 118.26 2k9s h GLU 54 Ca 0.07 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2k9s h GLU 54 Cb 0.22 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.47 2k9s h GLU 54 CO -0.00 0.43 0.56 0.22 -0.73 0.00 0.00 179.01 179.49 2k9s h ASP 55 N 0.36 1.02 0.08 1.04 3.58 -0.90 -2.28 116.42 119.33 2k9s h ASP 55 Ca 0.11 -0.04 -0.14 0.00 0.42 0.00 0.00 57.03 57.37 2k9s h ASP 55 Cb 0.14 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 40.92 2k9s h ASP 55 CO -0.01 0.76 -0.48 1.56 -2.88 0.00 0.00 179.24 178.19 2k9s h GLN 56 N 1.19 0.46 -0.37 0.28 1.08 -0.87 -1.60 115.11 115.27 2k9s h GLN 56 Ca 0.32 -0.26 0.03 0.00 -1.45 0.00 0.00 58.65 57.29 2k9s h GLN 56 Cb -0.10 0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.31 2k9s h GLN 56 CO -0.06 0.84 0.17 0.00 -0.95 0.00 0.00 178.83 178.83 2k9s h ARG 57 N 0.37 0.35 -0.08 1.46 3.08 -0.35 0.16 114.38 119.37 2k9s h ARG 57 Ca 0.02 -0.02 -0.11 0.00 0.07 0.00 0.00 59.98 59.94 2k9s h ARG 57 Cb 0.98 -0.08 0.01 0.00 0.08 0.00 0.00 29.97 30.96 2k9s h ARG 57 CO 0.09 0.23 -0.39 0.82 -1.07 0.00 0.00 179.97 179.65 2k9s h ILE 58 N 0.36 1.41 -0.46 2.04 1.08 -1.44 -2.86 117.51 117.63 2k9s h ILE 58 Ca 0.16 -1.77 0.04 0.00 -0.39 0.00 0.00 64.86 62.90 2k9s h ILE 58 Cb 0.09 2.29 -0.03 0.00 -3.07 0.00 0.00 36.82 36.10 2k9s h ILE 58 CO -0.13 0.52 0.31 0.28 -0.69 0.00 0.00 178.15 178.44 2k9s h SER 59 N -0.06 0.40 -0.20 1.72 0.02 -1.12 0.25 113.55 114.56 2k9s h SER 59 Ca -0.03 -0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.83 2k9s h SER 59 Cb 1.04 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 63.49 2k9s h SER 59 CO 0.08 0.27 -0.23 -0.61 -1.14 0.00 0.00 176.83 175.21 2k9s h GLN 60 N 0.46 0.51 -0.22 3.45 5.75 -0.67 0.87 115.11 125.25 2k9s h GLN 60 Ca 0.19 -0.28 -0.16 0.00 -0.15 0.00 0.00 58.65 58.26 2k9s h GLN 60 Cb 0.18 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.74 2k9s h GLN 60 CO -0.05 0.86 -0.51 0.00 -2.65 0.00 0.00 178.83 176.49 2k9s h ALA 61 N 0.64 0.69 -0.15 3.38 0.00 -1.15 -2.60 119.26 120.06 2k9s h ALA 61 Ca 0.03 -0.49 -0.13 0.00 0.00 0.00 0.00 54.91 54.31 2k9s h ALA 61 Cb 0.78 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2k9s h ALA 61 CO 0.05 0.68 -0.42 -0.22 0.00 0.00 0.00 179.25 179.34 2k9s h LYS 62 N 0.49 0.55 -0.06 0.00 3.64 -0.53 -0.57 116.57 120.09 2k9s h LYS 62 Ca 0.02 -0.39 0.02 0.00 -1.27 0.00 0.00 60.65 59.03 2k9s h LYS 62 Cb 1.05 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.92 2k9s h LYS 62 CO 0.10 1.01 -0.05 1.25 -2.27 0.00 0.00 179.45 179.49 2k9s h LEU 63 N 0.18 -0.16 -0.65 5.20 5.85 -0.83 -1.55 115.31 123.34 2k9s h LEU 63 Ca -0.01 0.03 -0.13 0.00 0.84 0.00 0.00 57.88 58.61 2k9s h LEU 63 Cb 1.04 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.14 2k9s h LEU 63 CO 0.09 -0.07 -0.35 0.17 -0.34 0.00 0.00 178.44 177.94 2k9s h LEU 64 N -0.07 0.70 -2.10 2.25 8.10 -1.53 -2.81 115.31 119.85 2k9s h LEU 64 Ca 0.04 -0.29 0.00 0.00 0.11 0.00 0.00 57.88 57.75 2k9s h LEU 64 Cb 0.13 -0.19 -0.00 0.00 -0.44 0.00 0.00 40.66 40.15 2k9s h LEU 64 CO -0.10 0.98 0.01 -0.07 -4.11 0.00 0.00 178.44 175.16 2k9s h LEU 65 N 0.56 0.00 -1.00 0.17 3.38 -0.71 0.34 115.31 118.05 2k9s h LEU 65 Ca 0.06 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 2k9s h LEU 65 Cb 0.86 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 2k9s h LEU 65 CO 0.07 0.00 -0.35 0.28 0.09 0.00 0.00 178.44 178.53 2k9s h SER 66 N 0.00 0.00 -0.21 -0.43 0.02 -1.02 -2.98 113.55 108.93 2k9s h SER 66 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2k9s h SER 66 Cb 0.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.57 2k9s h SER 66 CO -0.00 0.35 0.00 1.07 -1.14 0.00 0.00 176.83 177.11 2k9s n THR 67 N -3.55 0.59 -4.22 -2.27 5.66 -0.14 -5.00 114.28 105.35 2k9s n THR 67 Ca -0.00 -0.80 -0.13 0.00 -3.05 0.00 0.00 64.05 60.07 2k9s n THR 67 Cb 0.49 0.80 -0.10 0.00 -1.55 0.00 0.00 70.33 69.97 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 -0.98 0.97 -0.10 1.09 -4.23 0.10 -5.05 115.64 107.45 2k9s s THR 68 Ca 0.19 -2.01 0.14 0.00 -1.18 0.00 0.00 61.69 58.83 2k9s s THR 68 Cb 0.11 -1.82 0.21 0.00 1.34 0.00 0.00 72.50 72.34 2k9s s THR 68 CO 0.15 -0.76 1.10 -2.11 -0.54 0.00 0.00 174.62 172.46 2k9s n ARG 69 N -0.15 1.40 -1.86 3.99 0.00 -1.26 -4.68 116.66 114.10 2k9s n ARG 69 Ca -0.10 -2.23 -0.34 0.00 -0.00 0.00 0.00 57.85 55.18 2k9s n ARG 69 Cb 0.61 -1.31 0.04 0.00 -0.00 0.00 0.00 32.46 31.80 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 2.87 0.73 2.89 -1.94 -1.26 -5.01 119.30 115.30 2k9s s MET 70 Ca 0.24 1.52 -0.12 0.00 -1.71 0.00 0.00 55.69 55.61 2k9s s MET 70 Cb 0.21 -1.95 0.03 0.00 2.01 0.00 0.00 34.83 35.13 2k9s s MET 70 CO 0.02 -1.22 1.10 -1.25 -0.01 0.00 0.00 175.02 173.66 2k9s s PRO 71 N -3.82 2.47 0.41 2.03 0.04 -1.26 -4.77 135.00 130.10 2k9s s PRO 71 Ca 0.70 1.25 0.17 0.00 0.04 0.00 0.00 61.00 63.16 2k9s s PRO 71 Cb -0.23 -1.92 1.06 0.00 0.04 0.00 0.00 34.50 33.45 2k9s s PRO 71 CO 0.38 -1.49 1.84 0.82 0.04 0.00 0.00 177.00 178.59 2k9s h ILE 72 N -0.68 0.67 -0.30 0.56 2.04 -1.98 -0.35 117.51 117.48 2k9s h ILE 72 Ca -0.45 -0.15 0.01 0.00 1.00 0.00 0.00 64.86 65.27 2k9s h ILE 72 Cb 1.24 0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 2k9s h ILE 72 CO 0.52 0.08 0.18 0.00 0.00 0.00 0.00 178.15 178.93 2k9s h ALA 73 N 1.61 0.37 -0.05 1.87 0.00 -1.92 0.10 119.26 121.24 2k9s h ALA 73 Ca 0.49 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.38 2k9s h ALA 73 Cb 1.17 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 2k9s h ALA 73 CO -0.20 -0.18 -0.00 1.15 0.00 0.00 0.00 179.25 180.01 2k9s h THR 74 N 0.37 1.26 -1.01 0.00 2.02 -1.45 -3.09 112.91 111.01 2k9s h THR 74 Ca 0.11 -0.82 0.05 0.00 0.77 0.00 0.00 66.41 66.53 2k9s h THR 74 Cb -0.02 1.71 -0.06 0.00 -1.74 0.00 0.00 68.15 68.04 2k9s h THR 74 CO -0.04 0.22 0.66 0.58 0.37 0.00 0.00 175.52 177.31 2k9s h VAL 75 N -0.21 1.13 -0.57 3.16 2.07 -1.18 -1.56 116.25 119.09 2k9s h VAL 75 Ca 0.01 -0.42 0.12 0.00 0.82 0.00 0.00 66.70 67.23 2k9s h VAL 75 Cb 0.36 -0.21 -0.03 0.00 -1.52 0.00 0.00 31.29 29.89 2k9s h VAL 75 CO 0.00 0.22 0.39 1.23 0.02 0.00 0.00 177.57 179.43 2k9s h GLY 76 N 1.23 0.40 1.69 2.17 0.00 -0.72 -0.17 103.07 107.67 2k9s h GLY 76 Ca 0.42 -0.11 -0.07 0.00 0.00 0.00 0.00 47.33 47.57 2k9s h GLY 76 CO -0.15 0.06 -0.16 -0.09 0.00 0.00 0.00 176.54 176.20 2k9s h ARG 77 N 0.27 0.37 -0.09 4.80 2.43 -0.95 0.40 114.38 121.60 2k9s h ARG 77 Ca 0.27 -0.11 -0.07 0.00 -0.81 0.00 0.00 59.98 59.26 2k9s h ARG 77 Cb 0.69 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.19 2k9s h ARG 77 CO -0.06 0.53 -0.26 -0.91 -1.51 0.00 0.00 179.97 177.77 2k9s h ASN 78 N 0.35 0.15 -0.45 -3.80 2.35 -1.05 -1.89 115.58 111.24 2k9s h ASN 78 Ca 0.06 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 2k9s h ASN 78 Cb 0.49 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.81 2k9s h ASN 78 CO 0.03 0.42 0.00 1.33 -1.65 0.00 0.00 177.43 177.56 2k9s n VAL 79 N -4.18 0.78 -0.94 2.81 0.24 -0.93 -4.83 118.33 111.28 2k9s n VAL 79 Ca -0.01 -0.65 0.00 0.00 -2.04 0.00 0.00 64.34 61.63 2k9s n VAL 79 Cb 0.35 0.21 0.00 0.00 -1.47 0.00 0.00 33.84 32.93 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 1.11 0.68 3.57 7.63 0.00 -0.71 -4.85 105.19 112.62 2k9s n GLY 80 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.90 3.21 -0.09 1.61 0.08 0.13 -4.93 117.98 115.10 2k9s s PHE 81 Ca 0.00 0.22 0.14 0.00 0.12 0.00 0.00 56.93 57.41 2k9s s PHE 81 Cb 0.00 -2.76 -0.10 0.00 -0.57 0.00 0.00 43.02 39.59 2k9s s PHE 81 CO 0.00 -0.42 1.06 0.38 -0.10 0.00 0.00 175.22 176.14 2k9s h ASP 82 N 8.36 0.00 -3.40 1.36 2.03 -1.93 -2.74 116.42 120.10 2k9s h ASP 82 Ca -0.29 0.00 -0.60 0.00 -0.73 0.00 0.00 57.03 55.40 2k9s h ASP 82 Cb 1.14 0.00 -0.10 0.00 -0.83 0.00 0.00 39.33 39.54 2k9s h ASP 82 CO 0.72 0.67 0.35 -0.62 -1.03 0.00 0.00 179.24 179.32 2k9s s ASP 83 N -6.16 6.69 0.27 4.15 2.15 -1.26 -4.94 116.67 117.56 2k9s s ASP 83 Ca -0.00 0.79 -0.03 0.00 0.43 0.00 0.00 52.55 53.73 2k9s s ASP 83 Cb 0.08 -2.39 0.35 0.00 -0.30 0.00 0.00 42.92 40.66 2k9s s ASP 83 CO 0.79 -0.51 1.85 -0.61 -0.17 0.00 0.00 175.17 176.53 2k9s h GLN 84 N 7.92 0.99 -0.15 4.34 4.15 -1.90 -2.27 115.11 128.18 2k9s h GLN 84 Ca -0.25 -0.16 -0.09 0.00 0.77 0.00 0.00 58.65 58.92 2k9s h GLN 84 Cb 1.10 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 28.61 2k9s h GLN 84 CO 0.85 0.80 -0.32 -0.07 -1.93 0.00 0.00 178.83 178.15 2k9s h LEU 85 N 0.98 0.31 -0.13 -2.39 -0.00 -1.97 -2.02 115.31 110.09 2k9s h LEU 85 Ca 0.23 -0.11 -0.00 0.00 -0.00 0.00 0.00 57.88 58.00 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 -0.02 0.62 0.07 0.22 -0.00 0.00 0.00 178.44 179.32 2k9s h TYR 86 N 0.27 0.18 -0.37 1.13 5.03 -1.82 0.27 116.97 121.65 2k9s h TYR 86 Ca 0.04 -0.01 -0.07 0.00 2.58 0.00 0.00 58.73 61.27 2k9s h TYR 86 Cb 0.70 -0.06 -0.01 0.00 1.55 0.00 0.00 36.73 38.91 2k9s h TYR 86 CO 0.01 0.22 -0.03 0.35 -1.32 0.00 0.00 178.16 177.40 2k9s h PHE 87 N 0.09 0.74 -0.52 -3.82 3.57 -1.42 -2.37 116.94 113.21 2k9s h PHE 87 Ca 0.04 -0.14 -0.07 0.00 3.53 0.00 0.00 57.97 61.34 2k9s h PHE 87 Cb 0.10 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.63 2k9s h PHE 87 CO -0.03 0.79 0.05 0.66 -2.23 0.00 0.00 178.31 177.55 2k9s h SER 88 N 0.49 0.81 0.04 0.41 4.64 -1.25 0.25 113.55 118.93 2k9s h SER 88 Ca 0.10 -0.18 -0.00 0.00 -0.47 0.00 0.00 61.79 61.24 2k9s h SER 88 Cb 0.51 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 2k9s h SER 88 CO 0.02 0.84 -0.02 0.03 -0.87 0.00 0.00 176.83 176.84 2k9s h ARG 89 N 0.80 -0.05 -0.14 4.77 3.08 -0.34 0.26 114.38 122.76 2k9s h ARG 89 Ca 0.16 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.15 2k9s h ARG 89 Cb 0.41 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.47 2k9s h ARG 89 CO 0.01 0.10 -0.17 0.28 -1.07 0.00 0.00 179.97 179.12 2k9s h VAL 90 N -0.19 1.35 -0.58 2.04 2.07 -1.32 -3.10 116.25 116.52 2k9s h VAL 90 Ca -0.01 -1.36 -0.01 0.00 0.82 0.00 0.00 66.70 66.14 2k9s h VAL 90 Cb 0.17 1.91 -0.03 0.00 -1.52 0.00 0.00 31.29 31.83 2k9s h VAL 90 CO 0.01 0.40 0.30 0.15 0.02 0.00 0.00 177.57 178.45 2k9s h PHE 91 N -0.01 0.79 -0.36 1.57 3.04 -0.50 -0.53 116.94 120.94 2k9s h PHE 91 Ca 0.02 -0.01 0.03 0.00 3.98 0.00 0.00 57.97 61.99 2k9s h PHE 91 Cb 0.72 -0.25 -0.03 0.00 2.56 0.00 0.00 35.95 38.94 2k9s h PHE 91 CO 0.09 0.56 0.16 -0.22 -2.02 0.00 0.00 178.31 176.88 2k9s h LYS 92 N 0.81 0.32 0.00 1.11 3.11 -0.45 -1.90 116.57 119.57 2k9s h LYS 92 Ca 0.21 -0.02 -0.08 0.00 -2.81 0.00 0.00 60.65 57.94 2k9s h LYS 92 Cb 0.04 -0.07 -0.01 0.00 -1.00 0.00 0.00 32.23 31.19 2k9s h LYS 92 CO -0.03 0.21 -0.39 0.87 -2.81 0.00 0.00 179.45 177.30 2k9s h LYS 93 N 0.33 0.00 -0.25 1.90 1.57 -1.40 0.79 116.57 119.51 2k9s h LYS 93 Ca 0.16 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.99 2k9s h LYS 93 Cb 0.10 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.36 2k9s h LYS 93 CO -0.13 0.39 -0.04 0.00 -0.57 0.00 0.00 179.45 179.10 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 -0.01 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 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 1.16 0.61 3.01 3.38 0.00 0.25 -5.04 105.19 108.56 2k9s n GLY 96 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.28 0.37 0.90 4.61 0.00 0.40 -4.83 121.76 120.93 2k9s s ALA 97 Ca 0.00 -0.61 -0.11 0.00 0.00 0.00 0.00 51.96 51.24 2k9s s ALA 97 Cb 0.00 0.06 0.13 0.00 0.00 0.00 0.00 23.12 23.32 2k9s s ALA 97 CO 0.00 -0.06 1.11 -1.12 0.00 0.00 0.00 175.76 175.69 2k9s s SER 98 N -1.30 3.25 0.28 0.00 0.01 -1.26 -4.02 113.70 110.65 2k9s s SER 98 Ca -0.10 1.86 0.07 0.00 1.31 0.00 0.00 55.95 59.08 2k9s s SER 98 Cb -0.09 -2.44 0.42 0.00 0.21 0.00 0.00 66.02 64.12 2k9s s SER 98 CO -0.00 -2.84 1.67 1.55 0.41 0.00 0.00 173.24 174.03 2k9s h PRO 99 N -1.69 0.22 -0.23 12.44 0.13 -1.89 -2.61 132.00 138.37 2k9s h PRO 99 Ca -0.47 -0.11 -0.09 0.00 -0.87 0.00 0.00 66.00 64.46 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 0.64 -0.26 0.66 -0.23 0.00 0.00 178.00 179.29 2k9s h SER 100 N 0.18 0.44 -0.02 1.44 4.64 -1.97 0.10 113.55 118.35 2k9s h SER 100 Ca 0.01 -0.15 -0.06 0.00 -0.47 0.00 0.00 61.79 61.13 2k9s h SER 100 Cb 0.89 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 2k9s h SER 100 CO 0.07 0.69 -0.21 -0.08 -0.87 0.00 0.00 176.83 176.44 2k9s h GLU 101 N 0.38 0.18 -0.16 4.77 4.57 -1.90 -1.62 114.58 120.79 2k9s h GLU 101 Ca 0.06 -0.16 -0.02 0.00 -1.18 0.00 0.00 59.36 58.05 2k9s h GLU 101 Cb 0.66 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.29 2k9s h GLU 101 CO 0.05 0.86 0.01 0.35 -1.18 0.00 0.00 179.01 179.10 2k9s h PHE 102 N -0.45 0.30 -0.01 0.92 3.57 -1.43 -2.89 116.94 116.95 2k9s h PHE 102 Ca -0.02 -0.05 -0.06 0.00 3.53 0.00 0.00 57.97 61.38 2k9s h PHE 102 Cb 0.92 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.57 2k9s h PHE 102 CO 0.16 0.47 -0.26 -0.09 -2.23 0.00 0.00 178.31 176.36 2k9s h ARG 103 N 0.05 0.01 0.00 1.11 1.12 -0.90 -2.28 114.38 113.48 2k9s h ARG 103 Ca 0.05 -0.00 -0.00 0.00 -1.11 0.00 0.00 59.98 58.91 2k9s h ARG 103 Cb 0.34 -0.00 -0.00 0.00 -0.01 0.00 0.00 29.97 30.30 2k9s h ARG 103 CO 0.01 0.27 -0.02 0.00 -3.11 0.00 0.00 179.97 177.12 2k9s h ALA 104 N 1.73 1.80 0.00 2.80 0.00 -1.07 -3.46 119.26 121.06 2k9s h ALA 104 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2k9s h ALA 104 Cb 0.47 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2k9s h ALA 104 CO 0.03 0.03 0.00 0.41 0.00 0.00 0.00 179.25 179.72 2k9s n GLY 105 N -1.39 0.53 3.67 0.00 0.00 -0.86 -5.02 105.19 102.12 2k9s n GLY 105 Ca -0.03 -0.20 -0.40 0.00 0.00 0.00 0.00 46.02 45.39 2k9s n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32