#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 6.91 0.23 6.12 -1.08 -1.26 -4.88 116.67 122.70 2k9s s ASP 2 Ca 0.00 1.79 -0.07 0.00 -0.52 0.00 0.00 52.55 53.75 2k9s s ASP 2 Cb 0.00 -2.55 0.35 0.00 -1.46 0.00 0.00 42.92 39.26 2k9s s ASP 2 CO 0.00 -0.38 1.76 0.78 0.52 0.00 0.00 175.17 177.85 2k9s h ASN 3 N 2.15 0.38 -0.29 -0.34 2.35 -2.04 0.28 115.58 118.07 2k9s h ASN 3 Ca -0.49 0.07 -0.16 0.00 -0.55 0.00 0.00 56.30 55.18 2k9s h ASN 3 Cb 1.19 0.02 -0.00 0.00 0.05 0.00 0.00 38.32 39.58 2k9s h ASN 3 CO 0.62 0.20 -0.44 0.03 -1.65 0.00 0.00 177.43 176.19 2k9s h ARG 4 N 0.53 0.81 -0.74 0.81 3.08 -1.98 -3.13 114.38 113.75 2k9s h ARG 4 Ca 0.36 -0.48 -0.04 0.00 0.07 0.00 0.00 59.98 59.88 2k9s h ARG 4 Cb 0.43 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.49 2k9s h ARG 4 CO -0.31 1.12 0.30 0.28 -1.07 0.00 0.00 179.97 180.29 2k9s h VAL 5 N 0.57 1.25 -0.87 2.04 2.07 -1.72 -2.55 116.25 117.04 2k9s h VAL 5 Ca 0.03 -0.78 0.04 0.00 0.82 0.00 0.00 66.70 66.81 2k9s h VAL 5 Cb 1.04 0.36 -0.05 0.00 -1.52 0.00 0.00 31.29 31.12 2k9s h VAL 5 CO 0.10 0.32 0.57 -0.09 0.02 0.00 0.00 177.57 178.49 2k9s h ARG 6 N 1.08 1.04 -0.71 1.57 9.65 -0.44 -1.73 114.38 124.83 2k9s h ARG 6 Ca 0.25 -0.06 -0.04 0.00 -1.10 0.00 0.00 59.98 59.03 2k9s h ARG 6 Cb 0.20 -0.23 -0.03 0.00 -1.39 0.00 0.00 29.97 28.51 2k9s h ARG 6 CO -0.02 0.69 0.30 0.93 2.80 0.00 0.00 179.97 184.66 2k9s h GLU 7 N 1.07 1.04 -0.62 0.20 3.07 -1.40 -2.38 114.58 115.56 2k9s h GLU 7 Ca 0.35 -0.17 0.04 0.00 -0.50 0.00 0.00 59.36 59.09 2k9s h GLU 7 Cb 0.07 -0.18 -0.04 0.00 -0.84 0.00 0.00 28.75 27.76 2k9s h GLU 7 CO -0.11 0.83 0.41 0.00 -1.40 0.00 0.00 179.01 178.74 2k9s h ALA 8 N 1.30 1.71 -0.46 3.43 0.00 -1.21 -1.27 119.26 122.76 2k9s h ALA 8 Ca 0.24 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.14 2k9s h ALA 8 Cb 0.17 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2k9s h ALA 8 CO -0.02 0.21 0.31 0.00 0.00 0.00 0.00 179.25 179.75 2k9s h GLN 10 N 0.57 0.74 -0.06 0.00 1.08 -1.27 0.15 115.11 116.32 2k9s h GLN 10 Ca 0.18 -0.21 -0.02 0.00 -1.45 0.00 0.00 58.65 57.15 2k9s h GLN 10 Cb 0.02 -0.08 -0.00 0.00 -0.05 0.00 0.00 27.48 27.37 2k9s h GLN 10 CO -0.04 0.78 -0.05 -0.92 -0.95 0.00 0.00 178.83 177.65 2k9s h TYR 11 N 0.60 0.16 -0.71 2.96 3.20 -1.35 -2.01 116.97 119.83 2k9s h TYR 11 Ca 0.13 -0.05 -0.02 0.00 3.14 0.00 0.00 58.73 61.93 2k9s h TYR 11 Cb 0.41 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.61 2k9s h TYR 11 CO 0.03 0.57 0.35 0.82 -1.64 0.00 0.00 178.16 178.29 2k9s h ILE 12 N -0.31 1.23 -0.70 1.81 2.04 -1.10 -1.74 117.51 118.74 2k9s h ILE 12 Ca 0.01 -0.64 -0.04 0.00 1.00 0.00 0.00 64.86 65.20 2k9s h ILE 12 Cb 0.54 0.35 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 2k9s h ILE 12 CO 0.01 0.27 0.30 -1.28 0.00 0.00 0.00 178.15 177.45 2k9s h SER 13 N 0.98 0.95 0.31 1.72 0.87 -0.71 -0.98 113.55 116.69 2k9s h SER 13 Ca 0.24 -0.16 -0.07 0.00 -1.23 0.00 0.00 61.79 60.57 2k9s h SER 13 Cb 0.11 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 61.81 2k9s h SER 13 CO -0.03 0.85 -0.32 0.44 -0.53 0.00 0.00 176.83 177.23 2k9s h ASP 14 N 0.99 0.02 -0.59 6.23 5.19 -1.05 -2.21 116.42 125.01 2k9s h ASP 14 Ca 0.24 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.64 2k9s h ASP 14 Cb 0.18 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 39.68 2k9s h ASP 14 CO -0.02 0.35 0.00 1.41 -3.12 0.00 0.00 179.24 177.86 2k9s n HIS 15 N -4.15 1.78 0.24 4.55 8.25 -0.68 -4.44 115.22 120.77 2k9s n HIS 15 Ca -0.02 -0.65 0.17 0.00 -0.26 0.00 0.00 57.72 56.96 2k9s n HIS 15 Cb 0.37 -0.39 0.86 0.00 1.12 0.00 0.00 29.99 31.95 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 3.92 0.00 -0.14 2.41 5.85 -0.54 0.21 115.31 127.02 2k9s h LEU 16 Ca 0.00 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 2k9s h LEU 16 Cb 1.72 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.75 2k9s h LEU 16 CO 0.37 0.00 -0.10 0.00 -0.34 0.00 0.00 178.44 178.38 2k9s h ALA 17 N 1.82 0.94 -2.53 1.25 0.00 -1.82 -3.39 119.26 115.53 2k9s h ALA 17 Ca 0.06 -0.09 -0.51 0.00 0.00 0.00 0.00 54.91 54.38 2k9s h ALA 17 Cb 0.35 -0.02 0.09 0.00 0.00 0.00 0.00 17.79 18.22 2k9s h ALA 17 CO -0.00 0.12 0.40 0.34 0.00 0.00 0.00 179.25 180.11 2k9s s ASP 18 N -6.22 5.37 -0.24 0.00 -1.08 0.73 -4.61 116.67 110.63 2k9s s ASP 18 Ca 0.06 2.10 -0.17 0.00 -0.52 0.00 0.00 52.55 54.02 2k9s s ASP 18 Cb 0.06 -2.57 -0.14 0.00 -1.46 0.00 0.00 42.92 38.82 2k9s s ASP 18 CO 0.67 -1.45 -0.15 -0.24 0.52 0.00 0.00 175.17 174.52 2k9s n SER 19 N -1.89 1.92 -4.58 -0.34 2.88 -1.26 -4.84 113.62 105.50 2k9s n SER 19 Ca 0.11 0.38 -0.43 0.00 -1.33 0.00 0.00 58.87 57.60 2k9s n SER 19 Cb 0.51 -0.87 -0.03 0.00 -0.75 0.00 0.00 64.21 63.08 2k9s n SER 19 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 2k9s s ASN 20 N -7.10 6.52 0.07 -3.46 0.01 -1.26 -5.01 114.94 104.71 2k9s s ASN 20 Ca -0.34 0.20 -0.28 0.00 -0.71 0.00 0.00 52.86 51.73 2k9s s ASN 20 Cb 0.11 -2.51 -0.05 0.00 0.41 0.00 0.00 41.25 39.21 2k9s s ASN 20 CO 0.51 -1.23 0.88 0.12 -1.51 0.00 0.00 177.10 175.87 2k9s s PHE 21 N 4.26 3.76 -0.48 2.20 5.36 -1.26 -5.03 117.98 126.80 2k9s s PHE 21 Ca 0.42 1.65 0.00 0.00 -0.96 0.00 0.00 56.93 58.04 2k9s s PHE 21 Cb -0.09 -2.96 0.13 0.00 -0.34 0.00 0.00 43.02 39.76 2k9s s PHE 21 CO 0.28 0.21 0.25 0.34 -1.46 0.00 0.00 175.22 174.84 2k9s s ASP 22 N 0.09 4.93 0.55 6.13 -1.08 -1.26 -4.94 116.67 121.09 2k9s s ASP 22 Ca 0.44 -2.51 0.27 0.00 -0.52 0.00 0.00 52.55 50.22 2k9s s ASP 22 Cb -0.22 -1.75 1.60 0.00 -1.46 0.00 0.00 42.92 41.09 2k9s s ASP 22 CO 0.27 -0.39 2.17 -0.29 0.52 0.00 0.00 175.17 177.44 2k9s h ILE 23 N 5.91 0.62 -0.43 4.11 2.10 -2.00 -2.29 117.51 125.54 2k9s h ILE 23 Ca -0.07 -0.23 -0.07 0.00 1.08 0.00 0.00 64.86 65.57 2k9s h ILE 23 Cb 0.98 1.15 -0.02 0.00 -1.09 0.00 0.00 36.82 37.84 2k9s h ILE 23 CO 0.66 0.06 -0.01 0.00 -1.08 0.00 0.00 178.15 177.77 2k9s h ALA 24 N 1.94 0.58 0.00 0.18 0.00 -1.98 -2.41 119.26 117.57 2k9s h ALA 24 Ca -0.00 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.56 2k9s h ALA 24 Cb 0.14 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2k9s h ALA 24 CO 0.01 0.38 -0.34 0.77 0.00 0.00 0.00 179.25 180.06 2k9s h SER 25 N 0.60 0.00 -0.11 0.00 0.02 -1.84 -1.90 113.55 110.31 2k9s h SER 25 Ca 0.12 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.03 2k9s h SER 25 Cb 0.51 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.05 2k9s h SER 25 CO 0.02 0.34 -0.07 0.58 -1.14 0.00 0.00 176.83 176.57 2k9s h VAL 26 N 0.00 1.33 -0.62 2.27 2.07 -1.32 -2.21 116.25 117.76 2k9s h VAL 26 Ca -0.00 -1.13 -0.08 0.00 0.82 0.00 0.00 66.70 66.31 2k9s h VAL 26 Cb 0.61 1.84 -0.02 0.00 -1.52 0.00 0.00 31.29 32.20 2k9s h VAL 26 CO 0.04 0.32 0.08 0.00 0.02 0.00 0.00 177.57 178.04 2k9s h ALA 27 N 0.63 0.83 -0.63 1.67 0.00 -1.32 -2.84 119.26 117.61 2k9s h ALA 27 Ca 0.02 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 2k9s h ALA 27 Cb 0.54 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2k9s h ALA 27 CO 0.02 0.61 0.29 0.37 0.00 0.00 0.00 179.25 180.54 2k9s h GLN 28 N 0.96 0.90 -0.59 0.00 5.75 -1.27 0.11 115.11 120.97 2k9s h GLN 28 Ca 0.19 -0.12 0.05 0.00 -0.15 0.00 0.00 58.65 58.62 2k9s h GLN 28 Cb 0.46 -0.17 -0.03 0.00 1.07 0.00 0.00 27.48 28.81 2k9s h GLN 28 CO 0.02 0.71 0.39 1.25 -2.65 0.00 0.00 178.83 178.55 2k9s h HIS 29 N 0.90 0.59 -0.52 3.99 2.76 -1.14 0.22 115.15 121.95 2k9s h HIS 29 Ca 0.22 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.40 2k9s h HIS 29 Cb 0.12 -0.20 0.00 0.00 1.55 0.00 0.00 27.41 28.88 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 2.26 -3.49 5.26 0.24 -0.82 -4.91 118.33 112.40 2k9s n VAL 30 Ca 0.08 -1.19 -0.25 0.00 -2.04 0.00 0.00 64.34 60.93 2k9s n VAL 30 Cb 0.21 -0.23 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 -6.74 2.08 0.59 0.00 2.96 0.32 -5.00 118.68 112.89 2k9s s LEU 32 Ca 0.47 -1.16 -0.10 0.00 -0.22 0.00 0.00 54.13 53.12 2k9s s LEU 32 Cb -0.24 0.04 -0.04 0.00 0.50 0.00 0.00 46.19 46.45 2k9s s LEU 32 CO 0.58 -0.60 0.98 -0.44 -1.32 0.00 0.00 176.35 175.54 2k9s s SER 33 N -3.12 6.25 0.22 3.68 0.01 -1.26 -3.08 113.70 116.39 2k9s s SER 33 Ca 0.22 1.32 -0.01 0.00 1.31 0.00 0.00 55.95 58.80 2k9s s SER 33 Cb 0.06 -2.43 0.21 0.00 0.21 0.00 0.00 66.02 64.08 2k9s s SER 33 CO 0.02 -0.81 1.58 1.55 0.41 0.00 0.00 173.24 176.00 2k9s h PRO 34 N -0.18 0.54 -0.20 12.44 0.13 -1.90 -0.38 132.00 142.44 2k9s h PRO 34 Ca -0.45 -0.28 -0.04 0.00 -0.87 0.00 0.00 66.00 64.36 2k9s h PRO 34 Cb 1.19 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 2k9s h PRO 34 CO 0.62 0.87 -0.04 0.66 -0.23 0.00 0.00 178.00 179.87 2k9s h SER 35 N 0.44 0.38 -0.13 1.44 4.64 -1.96 0.24 113.55 118.59 2k9s h SER 35 Ca 0.03 -0.36 -0.18 0.00 -0.47 0.00 0.00 61.79 60.81 2k9s h SER 35 Cb 0.94 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.92 2k9s h SER 35 CO 0.08 0.66 -0.60 -0.09 -0.87 0.00 0.00 176.83 176.01 2k9s h ARG 36 N 0.10 0.73 -0.20 4.77 9.65 -1.96 -2.40 114.38 125.07 2k9s h ARG 36 Ca 0.05 -0.49 -0.08 0.00 -1.10 0.00 0.00 59.98 58.36 2k9s h ARG 36 Cb 0.49 0.07 -0.00 0.00 -1.39 0.00 0.00 29.97 29.13 2k9s h ARG 36 CO 0.02 1.11 -0.17 1.25 2.80 0.00 0.00 179.97 184.98 2k9s h LEU 37 N 0.55 0.50 -0.83 3.80 5.85 -1.04 -2.75 115.31 121.38 2k9s h LEU 37 Ca -0.00 -0.46 -0.00 0.00 0.84 0.00 0.00 57.88 58.25 2k9s h LEU 37 Cb 1.19 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 42.04 2k9s h LEU 37 CO 0.12 0.86 0.52 0.77 -0.34 0.00 0.00 178.44 180.37 2k9s h SER 38 N 0.15 0.98 -0.20 1.25 4.64 -0.56 0.25 113.55 120.05 2k9s h SER 38 Ca 0.03 -0.05 0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2k9s h SER 38 Cb 0.71 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.54 2k9s h SER 38 CO 0.04 0.74 0.11 -0.74 -0.87 0.00 0.00 176.83 176.12 2k9s h HIS 39 N 1.13 0.22 -0.04 4.77 -0.00 -1.41 -1.90 115.15 117.93 2k9s h HIS 39 Ca 0.30 0.01 -0.13 0.00 -0.00 0.00 0.00 60.37 60.55 2k9s h HIS 39 Cb -0.07 -0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 27.26 2k9s h HIS 39 CO -0.01 0.13 -0.57 -0.07 -0.00 0.00 0.00 177.93 177.41 2k9s h LEU 40 N 0.24 0.13 -0.03 0.26 3.38 -1.18 -2.78 115.31 115.32 2k9s h LEU 40 Ca 0.08 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2k9s h LEU 40 Cb -0.00 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 2k9s h LEU 40 CO -0.04 0.67 0.01 0.15 0.09 0.00 0.00 178.44 179.32 2k9s h PHE 41 N 0.09 0.02 0.00 1.13 3.04 -0.07 0.38 116.94 121.53 2k9s h PHE 41 Ca -0.00 0.00 -0.06 0.00 3.98 0.00 0.00 57.97 61.89 2k9s h PHE 41 Cb 1.03 -0.01 -0.01 0.00 2.56 0.00 0.00 35.95 39.52 2k9s h PHE 41 CO 0.01 0.01 -0.27 -0.09 -2.02 0.00 0.00 178.31 175.96 2k9s h ARG 42 N 0.03 0.00 0.15 1.11 2.43 -1.35 0.43 114.38 117.17 2k9s h ARG 42 Ca 0.01 0.00 -0.31 0.00 -0.81 0.00 0.00 59.98 58.87 2k9s h ARG 42 Cb 0.00 0.00 0.03 0.00 -0.42 0.00 0.00 29.97 29.58 2k9s h ARG 42 CO -0.01 0.27 -1.30 0.37 -1.51 0.00 0.00 179.97 177.79 2k9s h GLN 43 N 0.00 0.61 0.23 0.20 -0.00 -1.11 0.50 115.11 115.54 2k9s h GLN 43 Ca -0.00 -0.86 -0.34 0.00 -0.00 0.00 0.00 58.65 57.45 2k9s h GLN 43 Cb 0.63 0.29 0.03 0.00 0.00 0.00 0.00 27.48 28.43 2k9s h GLN 43 CO 0.03 1.40 -1.54 1.96 0.00 0.00 0.00 178.83 180.68 2k9s h GLN 44 N 0.26 0.50 0.00 1.69 1.08 -0.11 -3.32 115.11 115.21 2k9s h GLN 44 Ca -0.20 -0.85 0.00 0.00 -1.45 0.00 0.00 58.65 56.15 2k9s h GLN 44 Cb 1.97 0.32 0.00 0.00 -0.05 0.00 0.00 27.48 29.72 2k9s h GLN 44 CO 0.25 1.40 -0.72 1.25 -0.95 0.00 0.00 178.83 180.06 2k9s h LEU 45 N 0.14 0.00 0.00 1.46 6.46 -0.28 -3.39 115.31 119.70 2k9s h LEU 45 Ca -0.27 -0.16 0.00 0.00 -0.12 0.00 0.00 57.88 57.33 2k9s h LEU 45 Cb 2.15 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 42.08 2k9s h LEU 45 CO 0.25 0.08 0.00 0.61 -0.62 0.00 0.00 178.44 178.76 2k9s n GLY 46 N 1.29 0.20 3.52 3.75 0.00 0.17 -4.93 105.19 109.19 2k9s n GLY 46 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.42 0.00 0.41 -0.61 -4.36 -1.13 -4.96 121.20 109.13 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 -2.30 -0.09 0.00 1.25 0.00 0.00 42.46 41.32 2k9s s ILE 47 CO 0.00 0.00 1.01 -0.44 0.24 0.00 0.00 174.94 175.75 2k9s s SER 48 N -3.06 6.79 0.27 4.36 0.01 -1.26 -3.86 113.70 116.95 2k9s s SER 48 Ca 0.26 1.90 -0.00 0.00 1.31 0.00 0.00 55.95 59.41 2k9s s SER 48 Cb 0.01 -2.57 0.53 0.00 0.21 0.00 0.00 66.02 64.20 2k9s s SER 48 CO 0.10 -0.46 1.80 -0.37 0.41 0.00 0.00 173.24 174.73 2k9s h VAL 49 N 2.04 0.85 -0.49 3.43 -1.51 -1.94 0.41 116.25 119.03 2k9s h VAL 49 Ca -0.48 -0.29 -0.03 0.00 -1.23 0.00 0.00 66.70 64.67 2k9s h VAL 49 Cb 1.20 -0.06 -0.02 0.00 -2.13 0.00 0.00 31.29 30.28 2k9s h VAL 49 CO 0.62 0.15 0.20 -0.07 -1.23 0.00 0.00 177.57 177.23 2k9s h LEU 50 N 0.83 0.64 -0.11 4.19 3.38 -2.00 -1.64 115.31 120.60 2k9s h LEU 50 Ca 0.47 -0.07 -0.13 0.00 0.09 0.00 0.00 57.88 58.24 2k9s h LEU 50 Cb 0.54 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 41.13 2k9s h LEU 50 CO -0.30 0.58 -0.43 -1.28 0.09 0.00 0.00 178.44 177.10 2k9s h SER 51 N 0.70 0.56 -0.67 -0.43 0.87 -1.37 -2.83 113.55 110.39 2k9s h SER 51 Ca 0.17 -0.63 0.02 0.00 -1.23 0.00 0.00 61.79 60.13 2k9s h SER 51 Cb 0.14 -0.17 -0.04 0.00 -0.44 0.00 0.00 62.40 61.90 2k9s h SER 51 CO -0.02 1.10 0.42 -0.25 -0.53 0.00 0.00 176.83 177.55 2k9s h TRP 52 N 0.07 0.79 -0.40 2.24 7.01 -0.82 0.14 115.95 124.97 2k9s h TRP 52 Ca -0.02 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 60.99 2k9s h TRP 52 Cb 1.07 -0.26 -0.02 0.00 -2.10 0.00 0.00 29.16 27.85 2k9s h TRP 52 CO 0.11 0.46 0.23 -0.09 -2.79 0.00 0.00 178.44 176.36 2k9s h ARG 53 N 0.83 0.55 -0.41 2.65 9.65 -1.34 -0.86 114.38 125.44 2k9s h ARG 53 Ca 0.26 -0.06 -0.07 0.00 -1.10 0.00 0.00 59.98 59.02 2k9s h ARG 53 Cb -0.01 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 28.45 2k9s h ARG 53 CO -0.10 0.43 0.00 1.49 2.80 0.00 0.00 179.97 184.60 2k9s h GLU 54 N 0.51 0.73 -0.47 0.20 4.81 -1.20 -0.19 114.58 118.97 2k9s h GLU 54 Ca 0.14 -0.23 0.02 0.00 -0.13 0.00 0.00 59.36 59.16 2k9s h GLU 54 Cb 0.03 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.32 2k9s h GLU 54 CO -0.02 0.81 0.29 0.22 -0.73 0.00 0.00 179.01 179.57 2k9s h ASP 55 N 0.56 0.47 0.08 1.04 3.58 -0.53 -2.24 116.42 119.38 2k9s h ASP 55 Ca 0.12 0.00 -0.13 0.00 0.42 0.00 0.00 57.03 57.43 2k9s h ASP 55 Cb 0.48 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.42 2k9s h ASP 55 CO 0.02 0.34 -0.46 1.56 -2.88 0.00 0.00 179.24 177.82 2k9s h GLN 56 N 0.58 0.45 -0.75 0.28 1.08 -1.07 -2.45 115.11 113.22 2k9s h GLN 56 Ca 0.19 -0.25 0.05 0.00 -1.45 0.00 0.00 58.65 57.18 2k9s h GLN 56 Cb -0.00 0.01 -0.05 0.00 -0.05 0.00 0.00 27.48 27.39 2k9s h GLN 56 CO -0.08 0.82 0.46 0.00 -0.95 0.00 0.00 178.83 179.09 2k9s h ARG 57 N 0.37 0.85 -0.10 1.46 3.08 -0.51 0.19 114.38 119.71 2k9s h ARG 57 Ca 0.02 -0.05 -0.09 0.00 0.07 0.00 0.00 59.98 59.93 2k9s h ARG 57 Cb 0.95 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.81 2k9s h ARG 57 CO 0.08 0.56 -0.30 0.82 -1.07 0.00 0.00 179.97 180.06 2k9s h ILE 58 N 0.87 1.39 -0.91 2.04 1.08 -1.34 -1.45 117.51 119.19 2k9s h ILE 58 Ca 0.32 -1.62 0.00 0.00 -0.39 0.00 0.00 64.86 63.17 2k9s h ILE 58 Cb 0.10 2.16 -0.04 0.00 -3.07 0.00 0.00 36.82 35.96 2k9s h ILE 58 CO -0.14 0.47 0.59 -1.28 -0.69 0.00 0.00 178.15 177.10 2k9s h SER 59 N -0.05 1.06 -0.14 1.72 0.87 -1.14 0.86 113.55 116.73 2k9s h SER 59 Ca -0.01 -0.04 -0.11 0.00 -1.23 0.00 0.00 61.79 60.40 2k9s h SER 59 Cb 0.92 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 62.61 2k9s h SER 59 CO 0.06 0.79 -0.35 -0.61 -0.53 0.00 0.00 176.83 176.19 2k9s h GLN 60 N 1.25 0.50 -0.31 2.24 5.75 -0.65 -1.23 115.11 122.65 2k9s h GLN 60 Ca 0.33 -0.34 -0.01 0.00 -0.15 0.00 0.00 58.65 58.48 2k9s h GLN 60 Cb -0.12 0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.47 2k9s h GLN 60 CO -0.07 0.95 0.15 0.00 -2.65 0.00 0.00 178.83 177.22 2k9s h ALA 61 N 0.54 0.40 -0.16 3.38 0.00 -0.95 -2.19 119.26 120.28 2k9s h ALA 61 Ca -0.00 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.71 2k9s h ALA 61 Cb 0.96 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 2k9s h ALA 61 CO 0.08 -0.04 -0.33 1.57 0.00 0.00 0.00 179.25 180.52 2k9s h LYS 62 N 0.37 0.32 -0.02 0.00 2.10 -0.89 -1.15 116.57 117.30 2k9s h LYS 62 Ca 0.11 -0.13 -0.00 0.00 -2.00 0.00 0.00 60.65 58.62 2k9s h LYS 62 Cb 0.11 -0.01 -0.00 0.00 -0.90 0.00 0.00 32.23 31.43 2k9s h LYS 62 CO -0.01 0.62 0.01 1.25 -2.00 0.00 0.00 179.45 179.32 2k9s h LEU 63 N 0.28 0.03 -0.35 7.07 6.46 -0.89 -0.17 115.31 127.73 2k9s h LEU 63 Ca 0.04 -0.07 -0.16 0.00 -0.12 0.00 0.00 57.88 57.56 2k9s h LEU 63 Cb 0.72 -0.01 -0.00 0.00 -0.73 0.00 0.00 40.66 40.64 2k9s h LEU 63 CO 0.06 0.09 -0.40 -0.07 -0.62 0.00 0.00 178.44 177.49 2k9s h LEU 64 N -0.04 0.96 -2.06 2.25 3.38 -1.34 -0.98 115.31 117.48 2k9s h LEU 64 Ca 0.01 -0.48 -0.02 0.00 0.09 0.00 0.00 57.88 57.48 2k9s h LEU 64 Cb 0.07 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 2k9s h LEU 64 CO -0.00 1.25 -0.09 -0.07 0.09 0.00 0.00 178.44 179.62 2k9s h LEU 65 N 0.69 0.00 0.00 1.67 3.38 -1.09 0.61 115.31 120.57 2k9s h LEU 65 Ca 0.05 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.80 2k9s h LEU 65 Cb 1.00 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.71 2k9s h LEU 65 CO 0.10 0.09 -1.57 -0.24 0.09 0.00 0.00 178.44 176.90 2k9s n SER 66 N -3.72 0.82 -0.21 -0.43 2.88 -0.09 -3.97 113.62 108.91 2k9s n SER 66 Ca -0.02 0.38 0.12 0.00 -1.33 0.00 0.00 58.87 58.01 2k9s n SER 66 Cb 0.19 0.12 0.16 0.00 -0.75 0.00 0.00 64.21 63.94 2k9s n SER 66 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 2k9s n THR 67 N -2.94 0.00 -4.38 2.46 5.66 -0.39 -4.95 114.28 109.74 2k9s n THR 67 Ca -0.13 -0.11 -0.20 0.00 -3.05 0.00 0.00 64.05 60.55 2k9s n THR 67 Cb 0.93 0.70 -0.09 0.00 -1.55 0.00 0.00 70.33 70.31 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 -2.69 0.55 -0.13 1.09 -4.23 0.21 -5.04 115.64 105.40 2k9s s THR 68 Ca 0.17 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 58.84 2k9s s THR 68 Cb 0.18 -2.55 0.27 0.00 1.34 0.00 0.00 72.50 71.74 2k9s s THR 68 CO 0.64 0.00 1.15 0.54 -0.54 0.00 0.00 174.62 176.41 2k9s n ARG 69 N -0.64 1.71 -1.37 3.99 5.12 -1.26 -4.68 116.66 119.52 2k9s n ARG 69 Ca -0.01 -2.43 -0.32 0.00 -1.93 0.00 0.00 57.85 53.16 2k9s n ARG 69 Cb 0.65 -1.45 0.09 0.00 -1.16 0.00 0.00 32.46 30.59 2k9s n ARG 69 CO 0.00 0.00 0.00 -1.64 -1.93 0.00 0.00 177.63 174.06 2k9s s MET 70 N -2.56 2.21 0.82 5.56 -1.94 -1.26 -5.01 119.30 117.12 2k9s s MET 70 Ca 0.28 1.44 -0.11 0.00 -1.71 0.00 0.00 55.69 55.59 2k9s s MET 70 Cb 0.24 -1.87 0.08 0.00 2.01 0.00 0.00 34.83 35.29 2k9s s MET 70 CO 0.03 -1.72 1.09 -1.25 -0.01 0.00 0.00 175.02 173.17 2k9s s PRO 71 N -4.37 1.90 0.44 2.03 0.04 -1.26 -4.84 135.00 128.93 2k9s s PRO 71 Ca 0.67 1.04 0.13 0.00 0.04 0.00 0.00 61.00 62.88 2k9s s PRO 71 Cb -0.22 -1.87 0.96 0.00 0.04 0.00 0.00 34.50 33.42 2k9s s PRO 71 CO 0.49 -1.86 1.99 0.82 0.04 0.00 0.00 177.00 178.48 2k9s h ILE 72 N -1.28 1.13 -0.19 0.56 1.08 -1.99 -1.98 117.51 114.84 2k9s h ILE 72 Ca -0.46 -0.56 -0.02 0.00 -0.39 0.00 0.00 64.86 63.43 2k9s h ILE 72 Cb 1.25 1.20 -0.01 0.00 -3.07 0.00 0.00 36.82 36.19 2k9s h ILE 72 CO 0.52 0.17 0.03 0.00 -0.69 0.00 0.00 178.15 178.19 2k9s h ALA 73 N 1.78 0.25 0.02 1.87 0.00 -1.95 0.28 119.26 121.51 2k9s h ALA 73 Ca 0.02 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 2k9s h ALA 73 Cb 0.27 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2k9s h ALA 73 CO 0.02 -0.08 -0.01 1.15 0.00 0.00 0.00 179.25 180.33 2k9s h THR 74 N 0.11 1.19 -0.94 0.00 2.02 -1.86 -2.98 112.91 110.44 2k9s h THR 74 Ca 0.06 -0.63 0.01 0.00 0.77 0.00 0.00 66.41 66.62 2k9s h THR 74 Cb 0.31 1.61 -0.05 0.00 -1.74 0.00 0.00 68.15 68.29 2k9s h THR 74 CO 0.00 0.16 0.62 0.58 0.37 0.00 0.00 175.52 177.26 2k9s h VAL 75 N -0.29 1.23 -0.52 3.16 2.07 -1.39 -2.01 116.25 118.50 2k9s h VAL 75 Ca -0.00 -0.43 0.10 0.00 0.82 0.00 0.00 66.70 67.18 2k9s h VAL 75 Cb 0.28 -0.14 -0.03 0.00 -1.52 0.00 0.00 31.29 29.88 2k9s h VAL 75 CO 0.00 0.23 0.36 1.23 0.02 0.00 0.00 177.57 179.41 2k9s h GLY 76 N 1.26 0.41 1.78 2.17 0.00 -0.85 -0.53 103.07 107.32 2k9s h GLY 76 Ca 0.35 -0.12 -0.14 0.00 0.00 0.00 0.00 47.33 47.42 2k9s h GLY 76 CO -0.08 0.08 -0.57 3.21 0.00 0.00 0.00 176.54 179.17 2k9s h ARG 77 N 0.30 0.23 -0.19 4.80 3.08 -0.66 0.41 114.38 122.35 2k9s h ARG 77 Ca 0.24 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 60.15 2k9s h ARG 77 Cb 0.56 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.62 2k9s h ARG 77 CO -0.05 0.74 0.12 -0.91 -1.07 0.00 0.00 179.97 178.80 2k9s h ASN 78 N 0.17 0.21 -0.04 7.04 2.35 -0.98 0.30 115.58 124.63 2k9s h ASN 78 Ca -0.00 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 2k9s h ASN 78 Cb 1.06 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 39.38 2k9s h ASN 78 CO 0.09 0.15 0.00 1.33 -1.65 0.00 0.00 177.43 177.35 2k9s n VAL 79 N -4.51 0.03 -0.31 2.81 0.24 -1.13 -4.76 118.33 110.70 2k9s n VAL 79 Ca -0.00 -0.31 0.00 0.00 -2.04 0.00 0.00 64.34 61.99 2k9s n VAL 79 Cb 0.08 0.66 0.00 0.00 -1.47 0.00 0.00 33.84 33.11 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 1.21 0.67 3.59 7.63 0.00 0.10 -4.65 105.19 113.73 2k9s n GLY 80 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.58 3.21 0.01 1.61 0.08 0.14 -4.93 117.98 115.52 2k9s s PHE 81 Ca 0.00 0.47 0.07 0.00 0.12 0.00 0.00 56.93 57.59 2k9s s PHE 81 Cb 0.00 -2.92 -0.23 0.00 -0.57 0.00 0.00 43.02 39.30 2k9s s PHE 81 CO 0.00 -0.46 0.87 0.38 -0.10 0.00 0.00 175.22 175.91 2k9s h ASP 82 N 8.25 0.09 -3.53 1.36 3.04 -1.92 -2.14 116.42 121.56 2k9s h ASP 82 Ca -0.28 -0.14 -0.62 0.00 -3.24 0.00 0.00 57.03 52.76 2k9s h ASP 82 Cb 1.12 -0.03 -0.12 0.00 -1.04 0.00 0.00 39.33 39.26 2k9s h ASP 82 CO 0.77 1.12 0.10 -1.81 -2.04 0.00 0.00 179.24 177.39 2k9s s ASP 83 N -6.48 6.49 0.36 4.15 1.11 -1.26 -4.92 116.67 116.13 2k9s s ASP 83 Ca -0.05 0.50 0.05 0.00 0.18 0.00 0.00 52.55 53.24 2k9s s ASP 83 Cb 0.08 -2.32 0.69 0.00 1.07 0.00 0.00 42.92 42.45 2k9s s ASP 83 CO 0.83 -0.40 1.93 0.06 1.18 0.00 0.00 175.17 178.76 2k9s h GLN 84 N 8.08 0.51 -0.25 8.23 -0.00 -1.90 -2.26 115.11 127.52 2k9s h GLN 84 Ca -0.27 -0.08 -0.12 0.00 -0.00 0.00 0.00 58.65 58.17 2k9s h GLN 84 Cb 1.12 -0.09 -0.01 0.00 -0.00 0.00 0.00 27.48 28.51 2k9s h GLN 84 CO 0.77 0.48 -0.36 -0.07 -0.00 0.00 0.00 178.83 179.65 2k9s h LEU 85 N 0.50 0.58 -0.11 0.06 3.38 -1.98 -1.11 115.31 116.64 2k9s h LEU 85 Ca 0.12 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 2k9s h LEU 85 Cb 0.21 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 2k9s h LEU 85 CO -0.00 0.89 0.02 0.22 0.09 0.00 0.00 178.44 179.67 2k9s h TYR 86 N 0.47 0.18 -0.30 1.13 5.03 -1.83 0.26 116.97 121.91 2k9s h TYR 86 Ca 0.05 -0.02 -0.05 0.00 2.58 0.00 0.00 58.73 61.28 2k9s h TYR 86 Cb 0.85 -0.05 -0.01 0.00 1.55 0.00 0.00 36.73 39.07 2k9s h TYR 86 CO 0.03 0.35 -0.02 0.35 -1.32 0.00 0.00 178.16 177.55 2k9s h PHE 87 N -0.03 0.59 -0.50 -3.82 3.57 -1.45 -2.13 116.94 113.17 2k9s h PHE 87 Ca 0.03 -0.11 -0.08 0.00 3.53 0.00 0.00 57.97 61.35 2k9s h PHE 87 Cb 0.26 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.83 2k9s h PHE 87 CO 0.01 0.69 -0.00 0.77 -2.23 0.00 0.00 178.31 177.55 2k9s h SER 88 N 0.32 0.81 0.05 0.41 0.02 -1.17 0.26 113.55 114.24 2k9s h SER 88 Ca 0.08 -0.20 -0.00 0.00 -0.84 0.00 0.00 61.79 60.83 2k9s h SER 88 Cb 0.47 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.80 2k9s h SER 88 CO 0.02 0.87 -0.02 0.03 -1.14 0.00 0.00 176.83 176.59 2k9s h ARG 89 N 0.78 -0.06 -0.14 3.45 3.08 -0.38 0.25 114.38 121.36 2k9s h ARG 89 Ca 0.15 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.14 2k9s h ARG 89 Cb 0.47 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.53 2k9s h ARG 89 CO 0.02 0.10 -0.17 0.28 -1.07 0.00 0.00 179.97 179.13 2k9s h VAL 90 N -0.21 1.35 -0.56 2.04 2.07 -1.30 -3.14 116.25 116.50 2k9s h VAL 90 Ca -0.01 -1.37 -0.02 0.00 0.82 0.00 0.00 66.70 66.13 2k9s h VAL 90 Cb 0.19 1.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.85 2k9s h VAL 90 CO 0.01 0.40 0.29 0.15 0.02 0.00 0.00 177.57 178.44 2k9s h PHE 91 N -0.01 0.77 -0.84 1.57 3.04 -0.49 -1.94 116.94 119.05 2k9s h PHE 91 Ca 0.02 -0.02 0.05 0.00 3.98 0.00 0.00 57.97 62.01 2k9s h PHE 91 Cb 0.72 -0.25 -0.06 0.00 2.56 0.00 0.00 35.95 38.93 2k9s h PHE 91 CO 0.09 0.56 0.52 -0.22 -2.02 0.00 0.00 178.31 177.24 2k9s h LYS 92 N 0.79 0.94 0.00 1.11 3.11 -0.46 -1.22 116.57 120.83 2k9s h LYS 92 Ca 0.20 -0.06 -0.09 0.00 -2.81 0.00 0.00 60.65 57.89 2k9s h LYS 92 Cb 0.06 -0.21 -0.01 0.00 -1.00 0.00 0.00 32.23 31.06 2k9s h LYS 92 CO -0.03 0.62 -0.44 0.87 -2.81 0.00 0.00 179.45 177.66 2k9s h LYS 93 N 0.97 0.00 -0.21 1.90 1.57 -1.39 0.76 116.57 120.17 2k9s h LYS 93 Ca 0.36 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 59.18 2k9s h LYS 93 Cb 0.13 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.40 2k9s h LYS 93 CO -0.16 0.44 -0.04 0.00 -0.57 0.00 0.00 179.45 179.11 2k9s n THR 95 N -5.19 0.00 -0.05 0.00 -2.24 -1.14 -4.98 114.28 100.67 2k9s n THR 95 Ca -0.02 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 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 1.24 0.60 3.00 3.38 0.00 0.24 -5.04 105.19 108.61 2k9s n GLY 96 Ca 0.03 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 -2.26 0.36 0.91 4.61 0.00 0.47 -4.82 121.76 121.03 2k9s s ALA 97 Ca 0.00 -0.56 -0.11 0.00 0.00 0.00 0.00 51.96 51.29 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 -0.04 1.10 -1.54 0.00 0.00 0.00 175.76 175.28 2k9s s SER 98 N -1.19 3.21 0.29 0.00 1.04 -1.26 -4.12 113.70 111.68 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 -2.43 0.45 0.00 0.10 0.00 0.00 66.02 64.06 2k9s s SER 98 CO -0.00 -2.86 1.68 1.55 0.98 0.00 0.00 173.24 174.59 2k9s h PRO 99 N -1.70 0.16 -0.23 4.02 0.13 -1.90 -2.61 132.00 129.86 2k9s h PRO 99 Ca -0.47 -0.08 -0.10 0.00 -0.87 0.00 0.00 66.00 64.48 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 0.60 -0.27 1.03 -0.23 0.00 0.00 178.00 179.61 2k9s h SER 100 N 0.13 0.45 -0.02 1.44 0.87 -1.99 -1.32 113.55 113.12 2k9s h SER 100 Ca 0.01 -0.16 -0.06 0.00 -1.23 0.00 0.00 61.79 60.35 2k9s h SER 100 Cb 0.88 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.72 2k9s h SER 100 CO 0.07 0.72 -0.22 -0.08 -0.53 0.00 0.00 176.83 176.79 2k9s h GLU 101 N 0.40 0.18 -0.38 2.24 4.57 -1.90 -2.78 114.58 116.91 2k9s h GLU 101 Ca 0.06 -0.17 0.00 0.00 -1.18 0.00 0.00 59.36 58.07 2k9s h GLU 101 Cb 0.68 0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.30 2k9s h GLU 101 CO 0.05 0.87 0.25 0.35 -1.18 0.00 0.00 179.01 179.35 2k9s h PHE 102 N -0.45 0.47 -0.96 0.92 3.57 -1.44 -1.66 116.94 117.39 2k9s h PHE 102 Ca -0.02 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.51 2k9s h PHE 102 Cb 0.93 -0.16 -0.05 0.00 2.79 0.00 0.00 35.95 39.46 2k9s h PHE 102 CO 0.16 0.29 0.63 -0.09 -2.23 0.00 0.00 178.31 177.08 2k9s h ARG 103 N 0.51 1.22 -0.05 1.11 9.65 -1.33 -1.58 114.38 123.89 2k9s h ARG 103 Ca 0.14 -0.07 -0.07 0.00 -1.10 0.00 0.00 59.98 58.88 2k9s h ARG 103 Cb -0.05 -0.27 -0.01 0.00 -1.39 0.00 0.00 29.97 28.24 2k9s h ARG 103 CO -0.03 0.80 -0.29 0.00 2.80 0.00 0.00 179.97 183.25 2k9s h ALA 104 N 1.38 1.42 0.00 2.80 0.00 -1.15 -3.46 119.26 120.24 2k9s h ALA 104 Ca 0.37 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2k9s h ALA 104 Cb -0.06 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2k9s h ALA 104 CO -0.10 0.42 0.00 0.41 0.00 0.00 0.00 179.25 179.98 2k9s n GLY 105 N -0.60 1.25 3.68 0.00 0.00 -0.60 -5.01 105.19 103.92 2k9s n GLY 105 Ca -0.02 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.53 2k9s n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32