#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 0.21 6.12 -1.08 -1.26 -4.89 116.67 122.72 2k9s s ASP 2 Ca 0.00 1.77 -0.09 0.00 -0.52 0.00 0.00 52.55 53.72 2k9s s ASP 2 Cb 0.00 -2.55 0.29 0.00 -1.46 0.00 0.00 42.92 39.20 2k9s s ASP 2 CO 0.00 -0.35 1.75 0.78 0.52 0.00 0.00 175.17 177.86 2k9s h ASN 3 N 2.19 0.25 -0.76 -0.34 2.35 -2.05 0.17 115.58 117.39 2k9s h ASN 3 Ca -0.49 0.08 0.02 0.00 -0.55 0.00 0.00 56.30 55.36 2k9s h ASN 3 Cb 1.19 0.05 -0.04 0.00 0.05 0.00 0.00 38.32 39.57 2k9s h ASN 3 CO 0.62 0.15 0.49 0.03 -1.65 0.00 0.00 177.43 177.06 2k9s h ARG 4 N 0.43 0.95 -0.39 0.81 3.08 -2.00 -1.70 114.38 115.56 2k9s h ARG 4 Ca 0.32 -0.06 -0.14 0.00 0.07 0.00 0.00 59.98 60.17 2k9s h ARG 4 Cb 0.39 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 2k9s h ARG 4 CO -0.31 0.63 -0.30 0.28 -1.07 0.00 0.00 179.97 179.20 2k9s h VAL 5 N 0.98 1.28 -0.41 2.04 2.07 -1.64 -2.97 116.25 117.59 2k9s h VAL 5 Ca 0.29 -1.46 -0.02 0.00 0.82 0.00 0.00 66.70 66.33 2k9s h VAL 5 Cb -0.05 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 2k9s h VAL 5 CO -0.09 0.49 0.16 0.03 0.02 0.00 0.00 177.57 178.18 2k9s h ARG 6 N 0.72 0.58 -0.41 1.57 3.08 -0.22 -2.05 114.38 117.65 2k9s h ARG 6 Ca 0.08 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 2k9s h ARG 6 Cb 0.86 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.78 2k9s h ARG 6 CO 0.08 0.49 0.15 1.49 -1.07 0.00 0.00 179.97 181.10 2k9s h GLU 7 N 0.58 0.58 -0.65 0.04 4.57 -1.16 -2.18 114.58 116.37 2k9s h GLU 7 Ca 0.14 -0.08 0.04 0.00 -1.18 0.00 0.00 59.36 58.28 2k9s h GLU 7 Cb 0.12 -0.11 -0.04 0.00 -0.16 0.00 0.00 28.75 28.57 2k9s h GLU 7 CO -0.01 0.50 0.43 0.00 -1.18 0.00 0.00 179.01 178.74 2k9s h ALA 8 N 1.59 1.67 -0.41 2.92 0.00 -1.37 -1.30 119.26 122.35 2k9s h ALA 8 Ca 0.14 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.03 2k9s h ALA 8 Cb 0.14 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2k9s h ALA 8 CO -0.01 0.26 0.27 0.00 0.00 0.00 0.00 179.25 179.77 2k9s h GLN 10 N 0.52 0.83 -0.06 0.00 1.08 -1.30 0.24 115.11 116.41 2k9s h GLN 10 Ca 0.16 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 57.26 2k9s h GLN 10 Cb -0.00 -0.17 -0.00 0.00 -0.05 0.00 0.00 27.48 27.25 2k9s h GLN 10 CO -0.04 0.59 -0.05 -0.92 -0.95 0.00 0.00 178.83 177.46 2k9s h TYR 11 N 0.83 0.17 -0.55 2.96 3.20 -1.42 -3.08 116.97 119.08 2k9s h TYR 11 Ca 0.22 -0.05 -0.01 0.00 3.14 0.00 0.00 58.73 62.03 2k9s h TYR 11 Cb -0.03 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.18 2k9s h TYR 11 CO -0.02 0.58 0.28 0.82 -1.64 0.00 0.00 178.16 178.18 2k9s h ILE 12 N -0.29 1.18 -0.65 1.81 2.04 -1.23 -2.45 117.51 117.91 2k9s h ILE 12 Ca 0.01 -0.47 0.05 0.00 1.00 0.00 0.00 64.86 65.45 2k9s h ILE 12 Cb 0.55 0.46 -0.05 0.00 -0.74 0.00 0.00 36.82 37.03 2k9s h ILE 12 CO 0.01 0.20 0.37 -1.28 0.00 0.00 0.00 178.15 177.45 2k9s h SER 13 N 0.76 0.57 -0.04 1.72 0.87 -0.49 0.25 113.55 117.18 2k9s h SER 13 Ca 0.19 0.02 -0.10 0.00 -1.23 0.00 0.00 61.79 60.68 2k9s h SER 13 Cb 0.05 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 61.91 2k9s h SER 13 CO -0.03 0.38 -0.27 -0.78 -0.53 0.00 0.00 176.83 175.60 2k9s h ASP 14 N 0.70 0.48 -0.48 6.23 1.82 -1.36 -2.50 116.42 121.30 2k9s h ASP 14 Ca 0.28 -0.17 0.00 0.00 -0.39 0.00 0.00 57.03 56.76 2k9s h ASP 14 Cb 0.14 -0.13 0.00 0.00 0.68 0.00 0.00 39.33 40.02 2k9s h ASP 14 CO -0.16 0.74 0.00 1.41 -1.61 0.00 0.00 179.24 179.62 2k9s n HIS 15 N -4.11 1.48 0.27 0.28 8.25 -0.65 -4.34 115.22 116.40 2k9s n HIS 15 Ca -0.01 -0.54 0.12 0.00 -0.26 0.00 0.00 57.72 57.04 2k9s n HIS 15 Cb 0.42 -0.34 0.75 0.00 1.12 0.00 0.00 29.99 31.94 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 3.23 0.00 0.00 2.41 5.85 -0.07 -1.73 115.31 124.99 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 1.50 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.52 2k9s h LEU 16 CO 0.31 0.07 -1.41 0.00 -0.34 0.00 0.00 178.44 177.08 2k9s n ALA 17 N -2.36 2.51 -1.75 1.25 0.00 -1.26 -4.18 120.51 114.71 2k9s n ALA 17 Ca -0.03 -0.40 -0.38 0.00 0.00 0.00 0.00 53.44 52.64 2k9s n ALA 17 Cb 0.16 -0.95 0.04 0.00 0.00 0.00 0.00 19.45 18.70 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 -5.15 5.36 -0.20 0.00 2.15 -0.65 -4.63 116.67 113.54 2k9s s ASP 18 Ca -0.03 2.68 -0.22 0.00 0.43 0.00 0.00 52.55 55.41 2k9s s ASP 18 Cb 0.11 -2.63 -0.19 0.00 -0.30 0.00 0.00 42.92 39.91 2k9s s ASP 18 CO 0.83 -1.50 0.26 0.28 -0.17 0.00 0.00 175.17 174.87 2k9s h SER 19 N 1.48 0.00 -2.90 -0.34 0.02 -1.92 -3.44 113.55 106.45 2k9s h SER 19 Ca -0.51 -0.54 -0.56 0.00 -0.84 0.00 0.00 61.79 59.34 2k9s h SER 19 Cb 1.29 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 63.74 2k9s h SER 19 CO 0.57 1.41 0.90 0.20 -1.14 0.00 0.00 176.83 178.77 2k9s s ASN 20 N -6.75 6.32 -0.20 3.07 -0.87 -1.26 -5.00 114.94 110.25 2k9s s ASN 20 Ca -0.27 -0.23 -0.08 0.00 -1.57 0.00 0.00 52.86 50.71 2k9s s ASN 20 Cb 0.05 -2.52 -0.04 0.00 -0.02 0.00 0.00 41.25 38.71 2k9s s ASN 20 CO 0.59 -1.54 0.07 0.12 -2.57 0.00 0.00 177.10 173.77 2k9s s PHE 21 N 4.95 3.21 -0.28 2.20 5.36 -1.26 -5.08 117.98 127.08 2k9s s PHE 21 Ca 0.37 -0.02 -0.01 0.00 -0.96 0.00 0.00 56.93 56.31 2k9s s PHE 21 Cb -0.09 -2.13 0.05 0.00 -0.34 0.00 0.00 43.02 40.51 2k9s s PHE 21 CO 0.20 0.04 -0.03 0.34 -1.46 0.00 0.00 175.22 174.30 2k9s s ASP 22 N 0.70 4.71 0.61 6.13 2.15 -1.26 -4.97 116.67 124.74 2k9s s ASP 22 Ca 0.04 -1.25 0.31 0.00 0.43 0.00 0.00 52.55 52.08 2k9s s ASP 22 Cb -0.13 -1.67 1.78 0.00 -0.30 0.00 0.00 42.92 42.60 2k9s s ASP 22 CO 0.02 -0.23 2.14 -0.29 -0.17 0.00 0.00 175.17 176.64 2k9s h ILE 23 N 6.49 0.36 -0.55 4.11 2.10 -2.01 -1.68 117.51 126.34 2k9s h ILE 23 Ca -0.22 0.00 0.02 0.00 1.08 0.00 0.00 64.86 65.74 2k9s h ILE 23 Cb 1.06 0.86 -0.04 0.00 -1.09 0.00 0.00 36.82 37.62 2k9s h ILE 23 CO 0.52 0.00 0.33 0.00 -1.08 0.00 0.00 178.15 177.92 2k9s h ALA 24 N 1.78 0.70 0.00 0.18 0.00 -1.99 -1.62 119.26 118.30 2k9s h ALA 24 Ca 0.06 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2k9s h ALA 24 Cb 0.39 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2k9s h ALA 24 CO -0.00 0.05 -0.20 0.77 0.00 0.00 0.00 179.25 179.87 2k9s h SER 25 N 0.65 0.00 -0.14 0.00 0.02 -1.74 -1.91 113.55 110.44 2k9s h SER 25 Ca 0.22 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.15 2k9s h SER 25 Cb 0.02 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 2k9s h SER 25 CO -0.09 0.20 0.03 0.58 -1.14 0.00 0.00 176.83 176.40 2k9s h VAL 26 N 0.00 1.21 -0.52 2.27 2.07 -1.33 -1.25 116.25 118.69 2k9s h VAL 26 Ca -0.00 -0.66 -0.12 0.00 0.82 0.00 0.00 66.70 66.74 2k9s h VAL 26 Cb 0.36 1.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 2k9s h VAL 26 CO 0.03 0.20 -0.15 0.00 0.02 0.00 0.00 177.57 177.66 2k9s h ALA 27 N 0.82 0.74 -0.60 1.67 0.00 -1.22 -2.98 119.26 117.69 2k9s h ALA 27 Ca 0.04 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.55 2k9s h ALA 27 Cb 0.28 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 2k9s h ALA 27 CO 0.00 0.68 0.23 0.37 0.00 0.00 0.00 179.25 180.53 2k9s h GLN 28 N 0.90 0.88 -0.60 0.00 4.15 -1.28 0.22 115.11 119.37 2k9s h GLN 28 Ca 0.13 -0.14 0.06 0.00 0.77 0.00 0.00 58.65 59.46 2k9s h GLN 28 Cb 0.72 -0.15 -0.04 0.00 0.21 0.00 0.00 27.48 28.23 2k9s h GLN 28 CO 0.06 0.73 0.40 1.25 -1.93 0.00 0.00 178.83 179.33 2k9s h HIS 29 N 0.87 0.60 -0.53 3.99 2.76 -1.07 0.45 115.15 122.21 2k9s h HIS 29 Ca 0.20 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.39 2k9s h HIS 29 Cb 0.18 -0.20 0.00 0.00 1.55 0.00 0.00 27.41 28.95 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 1.79 -3.54 5.26 0.24 -0.86 -4.91 118.33 111.83 2k9s n VAL 30 Ca 0.08 -1.05 -0.26 0.00 -2.04 0.00 0.00 64.34 61.07 2k9s n VAL 30 Cb 0.22 -0.06 0.01 0.00 -1.47 0.00 0.00 33.84 32.54 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 -6.79 2.01 0.71 0.00 2.96 0.01 -5.01 118.68 112.57 2k9s s LEU 32 Ca 0.49 -1.16 -0.11 0.00 -0.22 0.00 0.00 54.13 53.13 2k9s s LEU 32 Cb -0.25 0.18 0.02 0.00 0.50 0.00 0.00 46.19 46.64 2k9s s LEU 32 CO 0.60 -0.66 1.07 -0.44 -1.32 0.00 0.00 176.35 175.60 2k9s s SER 33 N -3.05 5.22 0.15 3.68 0.01 -1.26 -3.36 113.70 115.09 2k9s s SER 33 Ca 0.21 1.66 -0.10 0.00 1.31 0.00 0.00 55.95 59.03 2k9s s SER 33 Cb 0.07 -2.50 -0.01 0.00 0.21 0.00 0.00 66.02 63.79 2k9s s SER 33 CO -0.00 -1.55 1.49 1.55 0.41 0.00 0.00 173.24 175.14 2k9s h PRO 34 N -0.77 0.90 -0.16 12.44 0.13 -1.90 -1.36 132.00 141.27 2k9s h PRO 34 Ca -0.44 -0.47 -0.04 0.00 -0.87 0.00 0.00 66.00 64.18 2k9s h PRO 34 Cb 1.21 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 2k9s h PRO 34 CO 0.56 1.12 -0.05 0.77 -0.23 0.00 0.00 178.00 180.17 2k9s h SER 35 N 0.73 0.33 -0.47 1.44 0.02 -1.98 0.23 113.55 113.85 2k9s h SER 35 Ca 0.06 -0.37 -0.06 0.00 -0.84 0.00 0.00 61.79 60.58 2k9s h SER 35 Cb 0.97 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 63.40 2k9s h SER 35 CO 0.09 0.63 0.07 -0.09 -1.14 0.00 0.00 176.83 176.39 2k9s h ARG 36 N 0.02 0.78 -0.26 3.45 9.65 -1.96 -1.40 114.38 124.66 2k9s h ARG 36 Ca 0.04 -0.21 -0.08 0.00 -1.10 0.00 0.00 59.98 58.63 2k9s h ARG 36 Cb 0.49 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 28.97 2k9s h ARG 36 CO 0.02 0.79 -0.16 1.25 2.80 0.00 0.00 179.97 184.67 2k9s h LEU 37 N 0.65 0.59 -1.02 3.80 5.85 -1.23 -2.90 115.31 121.05 2k9s h LEU 37 Ca 0.14 -0.43 0.01 0.00 0.84 0.00 0.00 57.88 58.44 2k9s h LEU 37 Cb 0.39 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.21 2k9s h LEU 37 CO 0.01 0.89 0.66 0.77 -0.34 0.00 0.00 178.44 180.43 2k9s h SER 38 N 0.28 1.15 -0.13 1.25 4.64 -0.47 0.26 113.55 120.54 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 -0.29 -0.01 0.00 -0.31 0.00 0.00 62.40 62.48 2k9s h SER 38 CO 0.05 0.83 0.06 -0.74 -0.87 0.00 0.00 176.83 176.16 2k9s h HIS 39 N 1.35 0.12 -0.04 4.77 -0.00 -1.19 -1.83 115.15 118.34 2k9s h HIS 39 Ca 0.37 0.01 -0.14 0.00 -0.00 0.00 0.00 60.37 60.61 2k9s h HIS 39 Cb -0.15 -0.04 -0.01 0.00 -0.00 0.00 0.00 27.41 27.21 2k9s h HIS 39 CO -0.00 0.07 -0.60 -0.07 -0.00 0.00 0.00 177.93 177.33 2k9s h LEU 40 N 0.14 0.14 -0.01 0.26 3.38 -1.27 -2.81 115.31 115.15 2k9s h LEU 40 Ca 0.05 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 57.94 2k9s h LEU 40 Cb 0.01 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2k9s h LEU 40 CO -0.03 0.71 -0.02 0.15 0.09 0.00 0.00 178.44 179.33 2k9s h PHE 41 N 0.09 -0.05 0.00 1.13 3.04 -0.09 0.37 116.94 121.44 2k9s h PHE 41 Ca -0.01 0.00 -0.05 0.00 3.98 0.00 0.00 57.97 61.89 2k9s h PHE 41 Cb 1.08 0.02 -0.01 0.00 2.56 0.00 0.00 35.95 39.60 2k9s h PHE 41 CO 0.01 -0.03 -0.25 -0.09 -2.02 0.00 0.00 178.31 175.93 2k9s h ARG 42 N -0.03 0.00 0.13 1.11 2.43 -1.35 0.43 114.38 117.10 2k9s h ARG 42 Ca 0.01 0.00 -0.29 0.00 -0.81 0.00 0.00 59.98 58.89 2k9s h ARG 42 Cb 0.05 0.00 0.03 0.00 -0.42 0.00 0.00 29.97 29.63 2k9s h ARG 42 CO -0.03 0.25 -1.23 0.37 -1.51 0.00 0.00 179.97 177.82 2k9s h GLN 43 N 0.00 0.60 0.23 0.20 5.75 -1.12 0.51 115.11 121.28 2k9s h GLN 43 Ca -0.00 -0.82 -0.34 0.00 -0.15 0.00 0.00 58.65 57.34 2k9s h GLN 43 Cb 0.62 0.27 0.03 0.00 1.07 0.00 0.00 27.48 29.47 2k9s h GLN 43 CO 0.03 1.37 -1.54 1.96 -2.65 0.00 0.00 178.83 178.01 2k9s h GLN 44 N 0.22 0.48 0.00 1.69 1.08 -0.13 -3.32 115.11 115.14 2k9s h GLN 44 Ca -0.19 -0.83 0.00 0.00 -1.45 0.00 0.00 58.65 56.18 2k9s h GLN 44 Cb 1.91 0.31 0.00 0.00 -0.05 0.00 0.00 27.48 29.65 2k9s h GLN 44 CO 0.23 1.39 -0.72 1.25 -0.95 0.00 0.00 178.83 180.04 2k9s h LEU 45 N 0.13 0.00 0.00 1.46 6.46 -0.27 -3.39 115.31 119.70 2k9s h LEU 45 Ca -0.27 -0.13 0.00 0.00 -0.12 0.00 0.00 57.88 57.35 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 0.25 0.07 0.00 0.61 -0.62 0.00 0.00 178.44 178.74 2k9s n GLY 46 N 1.27 0.23 3.51 3.75 0.00 0.18 -4.93 105.19 109.20 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 -1.51 0.00 0.39 -0.61 -4.36 -1.14 -4.96 121.20 109.01 2k9s s ILE 47 Ca 0.00 -1.53 -0.24 0.00 -0.26 0.00 0.00 60.65 58.62 2k9s s ILE 47 Cb 0.00 -2.38 -0.10 0.00 1.25 0.00 0.00 42.46 41.24 2k9s s ILE 47 CO 0.00 0.00 1.00 -0.44 0.24 0.00 0.00 174.94 175.74 2k9s s SER 48 N -3.09 6.91 0.28 4.36 0.01 -1.26 -3.83 113.70 117.08 2k9s s SER 48 Ca 0.27 1.91 0.02 0.00 1.31 0.00 0.00 55.95 59.46 2k9s s SER 48 Cb 0.00 -2.57 0.58 0.00 0.21 0.00 0.00 66.02 64.24 2k9s s SER 48 CO 0.12 -0.38 1.82 0.58 0.41 0.00 0.00 173.24 175.80 2k9s h VAL 49 N 2.20 0.88 -0.65 3.43 2.07 -1.94 0.17 116.25 122.42 2k9s h VAL 49 Ca -0.48 -0.33 -0.03 0.00 0.82 0.00 0.00 66.70 66.69 2k9s h VAL 49 Cb 1.20 -0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 2k9s h VAL 49 CO 0.62 0.17 0.30 -0.07 0.02 0.00 0.00 177.57 178.62 2k9s h LEU 50 N 0.95 0.84 -0.13 2.57 3.38 -2.00 -1.64 115.31 119.28 2k9s h LEU 50 Ca 0.51 -0.09 -0.15 0.00 0.09 0.00 0.00 57.88 58.24 2k9s h LEU 50 Cb 0.56 -0.21 0.01 0.00 0.09 0.00 0.00 40.66 41.10 2k9s h LEU 50 CO -0.29 0.72 -0.48 -1.28 0.09 0.00 0.00 178.44 177.20 2k9s h SER 51 N 0.92 0.66 -0.77 -0.43 0.87 -1.43 -2.99 113.55 110.38 2k9s h SER 51 Ca 0.23 -0.61 0.03 0.00 -1.23 0.00 0.00 61.79 60.20 2k9s h SER 51 Cb 0.11 -0.19 -0.05 0.00 -0.44 0.00 0.00 62.40 61.83 2k9s h SER 51 CO -0.03 1.16 0.49 -0.25 -0.53 0.00 0.00 176.83 177.67 2k9s h TRP 52 N 0.19 0.92 -0.29 2.24 7.01 -0.81 0.88 115.95 126.10 2k9s h TRP 52 Ca -0.02 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.00 2k9s h TRP 52 Cb 1.11 -0.31 -0.01 0.00 -2.10 0.00 0.00 29.16 27.86 2k9s h TRP 52 CO 0.10 0.53 0.19 -0.09 -2.79 0.00 0.00 178.44 176.38 2k9s h ARG 53 N 0.96 0.38 -0.41 2.65 2.43 -1.33 -1.51 114.38 117.55 2k9s h ARG 53 Ca 0.31 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.39 2k9s h ARG 53 Cb 0.01 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 2k9s h ARG 53 CO -0.11 0.26 0.02 1.49 -1.51 0.00 0.00 179.97 180.12 2k9s h GLU 54 N 0.38 0.71 -0.32 0.20 4.81 -1.30 -1.57 114.58 117.50 2k9s h GLU 54 Ca 0.10 -0.22 0.05 0.00 -0.13 0.00 0.00 59.36 59.17 2k9s h GLU 54 Cb -0.03 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.23 2k9s h GLU 54 CO -0.02 0.78 0.01 0.22 -0.73 0.00 0.00 179.01 179.27 2k9s h ASP 55 N 0.55 -0.11 -0.14 1.04 1.82 -0.61 -1.54 116.42 117.43 2k9s h ASP 55 Ca 0.12 0.07 -0.08 0.00 -0.39 0.00 0.00 57.03 56.75 2k9s h ASP 55 Cb 0.45 0.12 -0.02 0.00 0.68 0.00 0.00 39.33 40.56 2k9s h ASP 55 CO 0.02 -0.02 -0.16 1.56 -1.61 0.00 0.00 179.24 179.03 2k9s h GLN 56 N 0.10 0.53 -0.47 0.28 1.08 -1.21 -1.75 115.11 113.68 2k9s h GLN 56 Ca 0.15 -0.17 0.02 0.00 -1.45 0.00 0.00 58.65 57.20 2k9s h GLN 56 Cb 0.20 -0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 27.55 2k9s h GLN 56 CO -0.25 0.68 0.29 0.00 -0.95 0.00 0.00 178.83 178.60 2k9s h ARG 57 N 0.49 0.56 -0.15 1.46 3.08 -0.35 0.11 114.38 119.58 2k9s h ARG 57 Ca 0.08 -0.03 -0.09 0.00 0.07 0.00 0.00 59.98 60.01 2k9s h ARG 57 Cb 0.56 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.48 2k9s h ARG 57 CO 0.04 0.37 -0.24 0.82 -1.07 0.00 0.00 179.97 179.89 2k9s h ILE 58 N 0.58 1.36 -0.85 2.04 1.08 -1.15 -1.97 117.51 118.59 2k9s h ILE 58 Ca 0.18 -1.47 0.02 0.00 -0.39 0.00 0.00 64.86 63.20 2k9s h ILE 58 Cb -0.01 1.95 -0.05 0.00 -3.07 0.00 0.00 36.82 35.64 2k9s h ILE 58 CO -0.07 0.44 0.56 -1.28 -0.69 0.00 0.00 178.15 177.11 2k9s h SER 59 N 0.05 0.95 -0.15 1.72 0.87 -1.14 -1.00 113.55 114.84 2k9s h SER 59 Ca 0.01 -0.02 -0.18 0.00 -1.23 0.00 0.00 61.79 60.38 2k9s h SER 59 Cb 0.81 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 62.54 2k9s h SER 59 CO 0.05 0.67 -0.56 -0.61 -0.53 0.00 0.00 176.83 175.85 2k9s h GLN 60 N 1.11 0.75 -0.30 2.24 5.75 -0.76 -0.98 115.11 122.93 2k9s h GLN 60 Ca 0.33 -0.48 -0.02 0.00 -0.15 0.00 0.00 58.65 58.32 2k9s h GLN 60 Cb -0.05 0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.55 2k9s h GLN 60 CO -0.08 1.11 0.10 0.00 -2.65 0.00 0.00 178.83 177.30 2k9s h ALA 61 N 0.79 0.39 -0.10 3.38 0.00 -0.72 0.16 119.26 123.16 2k9s h ALA 61 Ca 0.01 -0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.64 2k9s h ALA 61 Cb 1.15 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 2k9s h ALA 61 CO 0.12 0.01 -0.55 1.57 0.00 0.00 0.00 179.25 180.39 2k9s h LYS 62 N 0.32 0.30 0.01 0.00 2.10 -1.22 -0.05 116.57 118.03 2k9s h LYS 62 Ca 0.10 -0.19 -0.00 0.00 -2.00 0.00 0.00 60.65 58.56 2k9s h LYS 62 Cb 0.22 0.02 0.00 0.00 -0.90 0.00 0.00 32.23 31.57 2k9s h LYS 62 CO -0.00 0.78 -0.00 1.25 -2.00 0.00 0.00 179.45 179.47 2k9s h LEU 63 N 0.23 -0.01 -0.54 7.07 6.46 -0.98 -2.88 115.31 124.67 2k9s h LEU 63 Ca 0.00 -0.39 -0.15 0.00 -0.12 0.00 0.00 57.88 57.22 2k9s h LEU 63 Cb 1.04 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.97 2k9s h LEU 63 CO 0.09 0.39 -0.40 0.17 -0.62 0.00 0.00 178.44 178.06 2k9s h LEU 64 N -0.41 0.79 -2.05 2.25 8.10 -0.99 -2.88 115.31 120.12 2k9s h LEU 64 Ca -0.00 -0.36 0.09 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 1.09 0.23 -0.07 -4.11 0.00 0.00 178.44 175.58 2k9s h LEU 65 N 0.60 0.00 -0.35 0.17 3.38 -1.01 0.32 115.31 118.42 2k9s h LEU 65 Ca 0.05 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.83 2k9s h LEU 65 Cb 0.95 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.70 2k9s h LEU 65 CO 0.09 0.00 -0.80 0.77 0.09 0.00 0.00 178.44 178.59 2k9s h SER 66 N 0.00 0.42 -0.60 -0.43 4.64 -1.28 -3.11 113.55 113.18 2k9s h SER 66 Ca 0.14 -0.30 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 2k9s h SER 66 Cb 0.60 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 2k9s h SER 66 CO -0.00 1.06 0.00 1.07 -0.87 0.00 0.00 176.83 178.08 2k9s n THR 67 N -3.78 0.79 -4.21 2.95 5.66 -0.07 -4.94 114.28 110.69 2k9s n THR 67 Ca -0.04 -0.87 -0.13 0.00 -3.05 0.00 0.00 64.05 59.96 2k9s n THR 67 Cb 0.75 0.61 -0.10 0.00 -1.55 0.00 0.00 70.33 70.03 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 -1.21 0.97 -0.10 1.09 -4.23 0.94 -5.05 115.64 108.05 2k9s s THR 68 Ca 0.44 -1.96 0.14 0.00 -1.18 0.00 0.00 61.69 59.13 2k9s s THR 68 Cb 0.24 -1.73 0.22 0.00 1.34 0.00 0.00 72.50 72.57 2k9s s THR 68 CO 0.32 -0.77 1.10 -2.11 -0.54 0.00 0.00 174.62 172.62 2k9s n ARG 69 N -0.05 1.40 -1.95 3.99 -4.01 -1.26 -4.74 116.66 110.05 2k9s n ARG 69 Ca -0.12 -2.24 -0.33 0.00 -1.04 0.00 0.00 57.85 54.13 2k9s n ARG 69 Cb 0.60 -1.32 0.02 0.00 -3.04 0.00 0.00 32.46 28.72 2k9s n ARG 69 CO 0.00 0.00 0.00 -1.64 -3.04 0.00 0.00 177.63 172.95 2k9s s MET 70 N -2.29 3.19 0.83 2.89 -1.94 -1.26 -5.03 119.30 115.69 2k9s s MET 70 Ca 0.24 1.20 -0.11 0.00 -1.71 0.00 0.00 55.69 55.31 2k9s s MET 70 Cb 0.21 -2.02 0.09 0.00 2.01 0.00 0.00 34.83 35.12 2k9s s MET 70 CO 0.02 -0.91 1.09 -1.25 -0.01 0.00 0.00 175.02 173.96 2k9s s PRO 71 N -4.19 1.77 0.50 2.03 0.04 -1.26 -4.74 135.00 129.15 2k9s s PRO 71 Ca 0.63 1.00 0.19 0.00 0.04 0.00 0.00 61.00 62.86 2k9s s PRO 71 Cb -0.16 -1.85 1.26 0.00 0.04 0.00 0.00 34.50 33.78 2k9s s PRO 71 CO 0.40 -1.93 2.05 0.82 0.04 0.00 0.00 177.00 178.38 2k9s h ILE 72 N -1.33 0.88 -0.20 0.56 1.08 -1.97 -0.30 117.51 116.24 2k9s h ILE 72 Ca -0.46 -0.03 -0.02 0.00 -0.39 0.00 0.00 64.86 63.95 2k9s h ILE 72 Cb 1.26 0.77 -0.01 0.00 -3.07 0.00 0.00 36.82 35.77 2k9s h ILE 72 CO 0.53 0.02 0.04 0.00 -0.69 0.00 0.00 178.15 178.04 2k9s h ALA 73 N 1.83 0.26 -0.19 1.87 0.00 -1.91 -1.71 119.26 119.41 2k9s h ALA 73 Ca 0.16 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 2k9s h ALA 73 Cb 0.49 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 2k9s h ALA 73 CO -0.02 -0.08 -0.25 1.15 0.00 0.00 0.00 179.25 180.06 2k9s h THR 74 N 0.12 1.34 -0.96 0.00 2.02 -1.71 -3.17 112.91 110.56 2k9s h THR 74 Ca 0.06 -1.44 0.09 0.00 0.77 0.00 0.00 66.41 65.88 2k9s h THR 74 Cb 0.30 1.83 -0.07 0.00 -1.74 0.00 0.00 68.15 68.47 2k9s h THR 74 CO 0.00 0.44 0.60 0.58 0.37 0.00 0.00 175.52 177.51 2k9s h VAL 75 N 0.16 1.00 -0.94 3.16 2.07 -1.08 -1.80 116.25 118.81 2k9s h VAL 75 Ca 0.02 -0.36 0.07 0.00 0.82 0.00 0.00 66.70 67.26 2k9s h VAL 75 Cb 0.81 -0.13 -0.07 0.00 -1.52 0.00 0.00 31.29 30.39 2k9s h VAL 75 CO 0.06 0.19 0.59 1.23 0.02 0.00 0.00 177.57 179.66 2k9s h GLY 76 N 1.04 1.45 1.21 2.17 0.00 -1.28 -1.24 103.07 106.42 2k9s h GLY 76 Ca 0.44 -0.43 0.06 0.00 0.00 0.00 0.00 47.33 47.41 2k9s h GLY 76 CO -0.21 0.27 0.38 3.21 0.00 0.00 0.00 176.54 180.19 2k9s h ARG 77 N 1.05 0.52 -0.16 4.80 3.08 -0.92 0.48 114.38 123.22 2k9s h ARG 77 Ca 0.42 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.42 2k9s h ARG 77 Cb 0.23 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 2k9s h ARG 77 CO -0.19 0.34 -0.01 -0.91 -1.07 0.00 0.00 179.97 178.13 2k9s h ASN 78 N 0.53 0.20 -0.60 7.04 2.35 -1.19 -1.25 115.58 122.67 2k9s h ASN 78 Ca 0.25 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 2k9s h ASN 78 Cb 0.29 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.61 2k9s h ASN 78 CO -0.07 0.25 0.00 1.33 -1.65 0.00 0.00 177.43 177.29 2k9s n VAL 79 N -4.40 2.37 -0.92 2.81 0.24 -0.21 -4.82 118.33 113.40 2k9s n VAL 79 Ca -0.01 -1.29 0.00 0.00 -2.04 0.00 0.00 64.34 61.00 2k9s n VAL 79 Cb 0.17 -0.13 0.00 0.00 -1.47 0.00 0.00 33.84 32.41 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 0.82 0.49 3.63 7.63 0.00 -0.47 -4.83 105.19 112.46 2k9s n GLY 80 Ca 0.27 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.31 3.19 0.02 1.61 0.40 0.15 -4.91 117.98 116.13 2k9s s PHE 81 Ca 0.00 1.03 0.07 0.00 -0.60 0.00 0.00 56.93 57.43 2k9s s PHE 81 Cb 0.00 -3.44 -0.23 0.00 0.51 0.00 0.00 43.02 39.85 2k9s s PHE 81 CO 0.00 -0.66 0.92 -0.44 0.70 0.00 0.00 175.22 175.74 2k9s h ASP 82 N 8.07 0.09 -3.65 1.36 5.19 -1.94 -2.62 116.42 122.92 2k9s h ASP 82 Ca -0.22 -0.14 -0.63 0.00 -0.62 0.00 0.00 57.03 55.42 2k9s h ASP 82 Cb 1.08 -0.03 -0.14 0.00 0.18 0.00 0.00 39.33 40.42 2k9s h ASP 82 CO 0.96 1.12 -0.13 -1.81 -3.12 0.00 0.00 179.24 176.26 2k9s s ASP 83 N -6.52 6.33 0.21 6.45 1.11 -1.26 -4.96 116.67 118.03 2k9s s ASP 83 Ca -0.04 0.33 -0.08 0.00 0.18 0.00 0.00 52.55 52.93 2k9s s ASP 83 Cb 0.08 -2.25 0.16 0.00 1.07 0.00 0.00 42.92 41.99 2k9s s ASP 83 CO 0.83 -0.27 1.81 0.06 1.18 0.00 0.00 175.17 178.78 2k9s h GLN 84 N 8.16 1.15 -0.13 8.23 3.07 -1.87 -2.40 115.11 131.31 2k9s h GLN 84 Ca -0.30 -0.16 -0.11 0.00 0.09 0.00 0.00 58.65 58.17 2k9s h GLN 84 Cb 1.15 -0.21 -0.01 0.00 0.08 0.00 0.00 27.48 28.48 2k9s h GLN 84 CO 0.69 0.88 -0.40 -0.07 0.09 0.00 0.00 178.83 180.02 2k9s h LEU 85 N 1.13 0.31 -0.84 0.06 -0.00 -1.94 -2.91 115.31 111.12 2k9s h LEU 85 Ca 0.28 -0.13 0.01 0.00 -0.00 0.00 0.00 57.88 58.04 2k9s h LEU 85 Cb 0.10 -0.09 -0.04 0.00 -0.00 0.00 0.00 40.66 40.63 2k9s h LEU 85 CO -0.04 0.68 0.56 0.22 -0.00 0.00 0.00 178.44 179.86 2k9s h TYR 86 N 0.25 1.05 -0.25 1.13 3.20 -1.85 0.20 116.97 120.70 2k9s h TYR 86 Ca 0.02 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.87 2k9s h TYR 86 Cb 0.81 -0.36 -0.01 0.00 1.54 0.00 0.00 36.73 38.72 2k9s h TYR 86 CO 0.02 0.66 -0.03 0.35 -1.64 0.00 0.00 178.16 177.52 2k9s h PHE 87 N 1.14 0.51 -0.53 -3.82 3.57 -1.37 -1.97 116.94 114.46 2k9s h PHE 87 Ca 0.31 -0.10 -0.08 0.00 3.53 0.00 0.00 57.97 61.63 2k9s h PHE 87 Cb -0.13 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.46 2k9s h PHE 87 CO -0.01 0.65 0.01 0.66 -2.23 0.00 0.00 178.31 177.39 2k9s h SER 88 N 0.22 0.86 0.05 0.41 4.64 -1.30 0.26 113.55 118.69 2k9s h SER 88 Ca 0.07 -0.22 -0.00 0.00 -0.47 0.00 0.00 61.79 61.17 2k9s h SER 88 Cb 0.47 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 2k9s h SER 88 CO 0.02 0.92 -0.02 0.03 -0.87 0.00 0.00 176.83 176.90 2k9s h ARG 89 N 0.83 -0.06 -0.13 4.77 3.08 -0.52 0.25 114.38 122.59 2k9s h ARG 89 Ca 0.16 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.16 2k9s h ARG 89 Cb 0.48 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.54 2k9s h ARG 89 CO 0.02 0.10 -0.14 0.28 -1.07 0.00 0.00 179.97 179.16 2k9s h VAL 90 N -0.21 1.35 -0.45 2.04 2.07 -1.28 -3.13 116.25 116.64 2k9s h VAL 90 Ca -0.01 -1.31 -0.02 0.00 0.82 0.00 0.00 66.70 66.19 2k9s h VAL 90 Cb 0.19 1.92 -0.02 0.00 -1.52 0.00 0.00 31.29 31.86 2k9s h VAL 90 CO 0.01 0.38 0.22 0.15 0.02 0.00 0.00 177.57 178.35 2k9s h PHE 91 N -0.06 0.62 -0.28 1.57 3.04 -0.48 -0.75 116.94 120.60 2k9s h PHE 91 Ca 0.02 -0.01 0.04 0.00 3.98 0.00 0.00 57.97 62.00 2k9s h PHE 91 Cb 0.67 -0.20 -0.04 0.00 2.56 0.00 0.00 35.95 38.95 2k9s h PHE 91 CO 0.09 0.46 0.05 -0.22 -2.02 0.00 0.00 178.31 176.66 2k9s h LYS 92 N 0.63 0.14 0.00 1.11 3.64 -0.44 -1.88 116.57 119.77 2k9s h LYS 92 Ca 0.16 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.44 2k9s h LYS 92 Cb 0.07 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 2k9s h LYS 92 CO -0.02 0.09 -0.44 0.87 -2.27 0.00 0.00 179.45 177.68 2k9s h LYS 93 N 0.15 0.00 -0.22 1.90 6.56 -1.44 0.76 116.57 124.28 2k9s h LYS 93 Ca 0.13 0.00 0.04 0.00 -1.06 0.00 0.00 60.65 59.76 2k9s h LYS 93 Cb 0.14 0.00 -0.04 0.00 -0.57 0.00 0.00 32.23 31.76 2k9s h LYS 93 CO -0.18 0.44 -0.05 0.00 -2.06 0.00 0.00 179.45 177.61 2k9s n THR 95 N -5.20 0.00 -0.08 0.00 -2.24 -1.03 -4.98 114.28 100.75 2k9s n THR 95 Ca -0.02 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 2k9s n THR 95 Cb 0.13 0.96 0.00 0.00 -2.10 0.00 0.00 70.33 69.32 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 1.31 0.62 3.02 3.38 0.00 0.24 -5.04 105.19 108.70 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 -2.29 0.38 0.90 4.61 0.00 0.27 -4.83 121.76 120.80 2k9s s ALA 97 Ca 0.00 -0.64 -0.11 0.00 0.00 0.00 0.00 51.96 51.21 2k9s s ALA 97 Cb 0.00 0.07 0.13 0.00 0.00 0.00 0.00 23.12 23.33 2k9s s ALA 97 CO 0.00 -0.06 1.10 -1.54 0.00 0.00 0.00 175.76 175.26 2k9s s SER 98 N -1.38 3.25 0.27 0.00 1.04 -1.26 -4.02 113.70 111.60 2k9s s SER 98 Ca -0.11 1.84 0.05 0.00 0.48 0.00 0.00 55.95 58.21 2k9s s SER 98 Cb -0.09 -2.43 0.37 0.00 0.10 0.00 0.00 66.02 63.97 2k9s s SER 98 CO -0.00 -2.84 1.65 1.55 0.98 0.00 0.00 173.24 174.58 2k9s h PRO 99 N -1.68 0.28 -0.21 4.02 0.13 -1.90 -2.58 132.00 130.05 2k9s h PRO 99 Ca -0.47 -0.15 -0.09 0.00 -0.87 0.00 0.00 66.00 64.42 2k9s h PRO 99 Cb 1.27 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 2k9s h PRO 99 CO 0.48 0.69 -0.28 1.03 -0.23 0.00 0.00 178.00 179.70 2k9s h SER 100 N 0.23 0.42 -0.03 1.44 0.87 -1.99 -1.23 113.55 113.27 2k9s h SER 100 Ca 0.02 -0.14 -0.06 0.00 -1.23 0.00 0.00 61.79 60.37 2k9s h SER 100 Cb 0.90 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.75 2k9s h SER 100 CO 0.07 0.69 -0.22 -0.08 -0.53 0.00 0.00 176.83 176.77 2k9s h GLU 101 N 0.37 0.19 -0.27 2.24 4.81 -1.90 -2.23 114.58 117.78 2k9s h GLU 101 Ca 0.05 -0.17 -0.00 0.00 -0.13 0.00 0.00 59.36 59.11 2k9s h GLU 101 Cb 0.68 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.09 2k9s h GLU 101 CO 0.05 0.86 0.17 0.35 -0.73 0.00 0.00 179.01 179.70 2k9s h PHE 102 N -0.41 0.36 -0.63 0.92 3.57 -1.43 -0.71 116.94 118.61 2k9s h PHE 102 Ca -0.02 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.44 2k9s h PHE 102 Cb 0.91 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 39.50 2k9s h PHE 102 CO 0.16 0.26 0.24 -0.09 -2.23 0.00 0.00 178.31 176.64 2k9s h ARG 103 N 0.35 0.93 0.00 1.11 2.43 -1.31 -2.06 114.38 115.83 2k9s h ARG 103 Ca 0.10 -0.16 -0.07 0.00 -0.81 0.00 0.00 59.98 59.04 2k9s h ARG 103 Cb 0.01 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.39 2k9s h ARG 103 CO -0.02 0.78 -0.33 0.00 -1.51 0.00 0.00 179.97 178.89 2k9s h ALA 104 N 1.34 1.10 0.00 2.80 0.00 -1.01 -3.47 119.26 120.03 2k9s h ALA 104 Ca 0.21 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2k9s h ALA 104 Cb 0.20 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2k9s h ALA 104 CO -0.02 0.41 0.00 0.41 0.00 0.00 0.00 179.25 180.05 2k9s n GLY 105 N -0.04 0.51 3.74 0.00 0.00 -0.31 -5.02 105.19 104.08 2k9s n GLY 105 Ca -0.01 -0.20 -0.41 0.00 0.00 0.00 0.00 46.02 45.40 2k9s n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32