#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 5.90 0.43 6.12 -1.08 -1.26 -5.00 116.67 121.78 2k9s s ASP 2 Ca 0.00 0.15 0.15 0.00 -0.52 0.00 0.00 52.55 52.33 2k9s s ASP 2 Cb 0.00 -1.72 0.97 0.00 -1.46 0.00 0.00 42.92 40.72 2k9s s ASP 2 CO 0.00 0.21 1.95 0.78 0.52 0.00 0.00 175.17 178.63 2k9s h ASN 3 N 3.50 0.00 -0.01 -0.34 2.35 -2.04 0.72 115.58 119.76 2k9s h ASN 3 Ca -0.47 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.27 2k9s h ASN 3 Cb 1.17 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.54 2k9s h ASN 3 CO 0.68 0.23 -0.02 0.03 -1.65 0.00 0.00 177.43 176.71 2k9s h ARG 4 N 0.00 0.03 -0.32 0.81 2.47 -1.94 -2.91 114.38 112.52 2k9s h ARG 4 Ca -0.00 -0.02 -0.14 0.00 -1.26 0.00 0.00 59.98 58.56 2k9s h ARG 4 Cb 0.43 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.74 2k9s h ARG 4 CO 0.03 0.56 -0.38 -0.39 0.56 0.00 0.00 179.97 180.35 2k9s h VAL 5 N -0.50 1.28 -0.58 2.04 -1.51 -1.91 -2.85 116.25 112.22 2k9s h VAL 5 Ca 0.00 -1.55 0.08 0.00 -1.23 0.00 0.00 66.70 64.00 2k9s h VAL 5 Cb 0.56 1.44 -0.06 0.00 -2.13 0.00 0.00 31.29 31.09 2k9s h VAL 5 CO 0.00 0.50 0.24 -0.09 -1.23 0.00 0.00 177.57 177.00 2k9s h ARG 6 N 0.62 0.43 -0.53 5.19 2.43 -0.91 -1.11 114.38 120.51 2k9s h ARG 6 Ca 0.06 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 59.12 2k9s h ARG 6 Cb 0.93 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 30.36 2k9s h ARG 6 CO 0.08 0.29 0.02 1.49 -1.51 0.00 0.00 179.97 180.34 2k9s h GLU 7 N 0.45 0.92 -0.70 0.20 4.57 -1.46 -2.84 114.58 115.73 2k9s h GLU 7 Ca 0.28 -0.28 0.04 0.00 -1.18 0.00 0.00 59.36 58.22 2k9s h GLU 7 Cb 0.30 -0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 28.76 2k9s h GLU 7 CO -0.26 0.93 0.46 0.00 -1.18 0.00 0.00 179.01 178.96 2k9s h ALA 8 N 0.96 1.61 -0.55 2.92 0.00 -1.11 -1.50 119.26 121.59 2k9s h ALA 8 Ca 0.15 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2k9s h ALA 8 Cb 0.50 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2k9s h ALA 8 CO 0.02 0.31 0.35 0.00 0.00 0.00 0.00 179.25 179.93 2k9s h GLN 10 N 0.76 0.81 -0.07 0.00 5.75 -1.26 0.12 115.11 121.22 2k9s h GLN 10 Ca 0.20 -0.19 -0.03 0.00 -0.15 0.00 0.00 58.65 58.48 2k9s h GLN 10 Cb -0.05 -0.11 -0.00 0.00 1.07 0.00 0.00 27.48 28.39 2k9s h GLN 10 CO -0.04 0.78 -0.05 -0.92 -2.65 0.00 0.00 178.83 175.94 2k9s h TYR 11 N 0.70 0.19 -0.48 3.99 3.20 -1.32 -2.66 116.97 120.60 2k9s h TYR 11 Ca 0.16 -0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.97 2k9s h TYR 11 Cb 0.33 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.53 2k9s h TYR 11 CO 0.02 0.58 0.26 0.82 -1.64 0.00 0.00 178.16 178.20 2k9s h ILE 12 N -0.25 1.17 -0.75 1.81 2.04 -1.10 -2.43 117.51 118.00 2k9s h ILE 12 Ca 0.01 -0.43 0.06 0.00 1.00 0.00 0.00 64.86 65.51 2k9s h ILE 12 Cb 0.54 0.58 -0.05 0.00 -0.74 0.00 0.00 36.82 37.15 2k9s h ILE 12 CO 0.01 0.18 0.49 -1.28 0.00 0.00 0.00 178.15 177.55 2k9s h SER 13 N 0.63 0.70 0.58 1.72 0.87 -0.78 0.50 113.55 117.78 2k9s h SER 13 Ca 0.17 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.70 2k9s h SER 13 Cb 0.05 -0.15 -0.00 0.00 -0.44 0.00 0.00 62.40 61.86 2k9s h SER 13 CO -0.03 0.45 -0.15 -0.78 -0.53 0.00 0.00 176.83 175.79 2k9s h ASP 14 N 0.79 0.00 -0.42 6.23 3.58 -1.07 -1.99 116.42 123.55 2k9s h ASP 14 Ca 0.32 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.77 2k9s h ASP 14 Cb 0.25 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.30 2k9s h ASP 14 CO -0.11 0.15 0.00 1.41 -2.88 0.00 0.00 179.24 177.81 2k9s n HIS 15 N -3.51 1.29 -0.28 0.28 8.25 0.16 -4.37 115.22 117.04 2k9s n HIS 15 Ca -0.01 -0.47 0.04 0.00 -0.26 0.00 0.00 57.72 57.02 2k9s n HIS 15 Cb 0.31 -0.31 0.25 0.00 1.12 0.00 0.00 29.99 31.36 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 2.80 0.88 0.00 2.41 6.46 -1.25 -1.61 115.31 125.01 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 1.36 -0.19 -0.00 0.00 -0.73 0.00 0.00 40.66 41.09 2k9s h LEU 16 CO 0.27 0.58 -0.86 0.00 -0.62 0.00 0.00 178.44 177.81 2k9s h ALA 17 N 1.52 0.62 -2.20 1.25 0.00 -1.84 -3.45 119.26 115.16 2k9s h ALA 17 Ca 0.37 -0.14 -0.47 0.00 0.00 0.00 0.00 54.91 54.66 2k9s h ALA 17 Cb 0.16 0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.00 2k9s h ALA 17 CO -0.13 0.16 0.38 0.34 0.00 0.00 0.00 179.25 180.00 2k9s s ASP 18 N -5.63 6.58 -0.26 0.00 2.15 -0.61 -4.86 116.67 114.05 2k9s s ASP 18 Ca 0.01 1.58 -0.00 0.00 0.43 0.00 0.00 52.55 54.56 2k9s s ASP 18 Cb 0.08 -2.51 -0.17 0.00 -0.30 0.00 0.00 42.92 40.03 2k9s s ASP 18 CO 0.77 -0.62 -0.22 -0.24 -0.17 0.00 0.00 175.17 174.69 2k9s n SER 19 N -1.62 1.98 -4.56 -0.34 2.88 -1.26 -4.87 113.62 105.83 2k9s n SER 19 Ca 0.07 -0.06 -0.38 0.00 -1.33 0.00 0.00 58.87 57.16 2k9s n SER 19 Cb 0.54 -0.48 -0.03 0.00 -0.75 0.00 0.00 64.21 63.49 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 -6.66 4.77 -0.27 -3.46 -0.87 -1.26 -4.92 114.94 102.26 2k9s s ASN 20 Ca -0.35 1.27 0.01 0.00 -1.57 0.00 0.00 52.86 52.22 2k9s s ASN 20 Cb 0.10 -2.51 0.05 0.00 -0.02 0.00 0.00 41.25 38.88 2k9s s ASN 20 CO 0.59 -2.59 -0.08 0.12 -2.57 0.00 0.00 177.10 172.57 2k9s s PHE 21 N 10.92 3.25 -0.33 2.20 5.36 -1.26 -5.08 117.98 133.04 2k9s s PHE 21 Ca 0.97 -2.15 -0.00 0.00 -0.96 0.00 0.00 56.93 54.79 2k9s s PHE 21 Cb -0.21 -1.99 0.08 0.00 -0.34 0.00 0.00 43.02 40.56 2k9s s PHE 21 CO 0.28 -0.85 0.05 0.34 -1.46 0.00 0.00 175.22 173.58 2k9s s ASP 22 N 1.16 4.91 0.57 6.13 2.15 -1.26 -4.96 116.67 125.36 2k9s s ASP 22 Ca -0.07 -1.67 0.27 0.00 0.43 0.00 0.00 52.55 51.51 2k9s s ASP 22 Cb -0.20 -1.71 1.51 0.00 -0.30 0.00 0.00 42.92 42.23 2k9s s ASP 22 CO -0.04 -0.35 2.01 -0.29 -0.17 0.00 0.00 175.17 176.33 2k9s h ILE 23 N 6.51 0.55 -0.54 4.11 2.10 -2.00 -0.51 117.51 127.73 2k9s h ILE 23 Ca -0.15 0.00 -0.06 0.00 1.08 0.00 0.00 64.86 65.73 2k9s h ILE 23 Cb 1.05 0.75 -0.02 0.00 -1.09 0.00 0.00 36.82 37.50 2k9s h ILE 23 CO 0.56 0.00 0.12 0.00 -1.08 0.00 0.00 178.15 177.76 2k9s h ALA 24 N 1.68 0.71 -0.26 0.18 0.00 -2.00 -2.35 119.26 117.23 2k9s h ALA 24 Ca 0.18 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 2k9s h ALA 24 Cb 0.84 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2k9s h ALA 24 CO -0.00 0.42 -0.00 0.77 0.00 0.00 0.00 179.25 180.44 2k9s h SER 25 N 0.77 0.36 -0.19 0.00 0.02 -1.51 -1.98 113.55 111.01 2k9s h SER 25 Ca 0.17 -0.06 -0.15 0.00 -0.84 0.00 0.00 61.79 60.91 2k9s h SER 25 Cb 0.36 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 2k9s h SER 25 CO 0.00 0.43 -0.43 0.58 -1.14 0.00 0.00 176.83 176.27 2k9s h VAL 26 N 0.38 1.29 -0.07 2.27 2.07 -1.37 -2.07 116.25 118.75 2k9s h VAL 26 Ca 0.09 -1.62 -0.01 0.00 0.82 0.00 0.00 66.70 65.98 2k9s h VAL 26 Cb 0.26 1.52 -0.00 0.00 -1.52 0.00 0.00 31.29 31.55 2k9s h VAL 26 CO 0.01 0.52 -0.01 0.00 0.02 0.00 0.00 177.57 178.11 2k9s h ALA 27 N 0.92 0.10 -0.67 1.67 0.00 -0.96 -2.99 119.26 117.32 2k9s h ALA 27 Ca 0.04 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2k9s h ALA 27 Cb 0.99 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 2k9s h ALA 27 CO 0.09 -0.19 0.35 -0.56 0.00 0.00 0.00 179.25 178.94 2k9s h GLN 28 N -0.19 0.94 -0.58 0.00 3.07 -1.35 0.71 115.11 117.71 2k9s h GLN 28 Ca 0.02 -0.11 0.05 0.00 0.09 0.00 0.00 58.65 58.70 2k9s h GLN 28 Cb 0.40 -0.18 -0.03 0.00 0.08 0.00 0.00 27.48 27.74 2k9s h GLN 28 CO 0.01 0.70 0.38 1.25 0.09 0.00 0.00 178.83 181.26 2k9s h HIS 29 N 0.94 0.59 -0.56 0.06 2.76 -1.29 0.21 115.15 117.86 2k9s h HIS 29 Ca 0.24 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.42 2k9s h HIS 29 Cb 0.05 -0.20 0.00 0.00 1.55 0.00 0.00 27.41 28.82 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 1.96 -3.75 5.26 0.24 -0.79 -4.92 118.33 111.87 2k9s n VAL 30 Ca 0.08 -1.13 -0.29 0.00 -2.04 0.00 0.00 64.34 60.96 2k9s n VAL 30 Cb 0.20 -0.07 0.01 0.00 -1.47 0.00 0.00 33.84 32.51 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 -7.02 2.00 0.59 0.00 0.20 0.18 -5.00 118.68 109.62 2k9s s LEU 32 Ca 0.58 -1.08 -0.10 0.00 0.69 0.00 0.00 54.13 54.23 2k9s s LEU 32 Cb -0.30 0.34 -0.03 0.00 -0.43 0.00 0.00 46.19 45.77 2k9s s LEU 32 CO 0.72 -0.69 0.98 -0.44 -0.29 0.00 0.00 176.35 176.63 2k9s s SER 33 N -2.98 6.17 0.17 3.68 0.01 -1.26 -3.25 113.70 116.24 2k9s s SER 33 Ca 0.16 1.27 -0.08 0.00 1.31 0.00 0.00 55.95 58.62 2k9s s SER 33 Cb 0.07 -2.36 0.04 0.00 0.21 0.00 0.00 66.02 63.98 2k9s s SER 33 CO -0.04 -0.84 1.51 1.55 0.41 0.00 0.00 173.24 175.84 2k9s h PRO 34 N -0.22 0.81 -0.24 12.44 0.13 -1.90 0.40 132.00 143.43 2k9s h PRO 34 Ca -0.45 -0.43 -0.02 0.00 -0.87 0.00 0.00 66.00 64.23 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 1.06 0.06 0.77 -0.23 0.00 0.00 178.00 180.28 2k9s h SER 35 N 0.66 0.36 -0.11 1.44 0.02 -1.98 0.19 113.55 114.12 2k9s h SER 35 Ca 0.05 -0.22 -0.11 0.00 -0.84 0.00 0.00 61.79 60.68 2k9s h SER 35 Cb 0.96 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.41 2k9s h SER 35 CO 0.09 0.48 -0.34 -0.09 -1.14 0.00 0.00 176.83 175.83 2k9s h ARG 36 N 0.21 0.43 -0.51 3.45 9.65 -1.96 -2.76 114.38 122.89 2k9s h ARG 36 Ca 0.07 -0.31 -0.01 0.00 -1.10 0.00 0.00 59.98 58.63 2k9s h ARG 36 Cb 0.26 0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 28.87 2k9s h ARG 36 CO -0.00 0.93 0.28 1.25 2.80 0.00 0.00 179.97 185.23 2k9s h LEU 37 N 0.01 0.64 -1.10 3.80 5.85 -0.90 -2.53 115.31 121.08 2k9s h LEU 37 Ca -0.01 -0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.63 2k9s h LEU 37 Cb 0.96 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.79 2k9s h LEU 37 CO 0.07 0.54 0.60 0.77 -0.34 0.00 0.00 178.44 180.09 2k9s h SER 38 N 0.68 1.05 -0.15 1.25 4.64 -0.67 0.14 113.55 120.50 2k9s h SER 38 Ca 0.18 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2k9s h SER 38 Cb 0.05 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 61.87 2k9s h SER 38 CO -0.03 0.76 0.09 -0.74 -0.87 0.00 0.00 176.83 176.04 2k9s h HIS 39 N 1.24 0.16 -0.06 4.77 -0.00 -1.15 0.95 115.15 121.07 2k9s h HIS 39 Ca 0.33 0.01 -0.13 0.00 -0.00 0.00 0.00 60.37 60.58 2k9s h HIS 39 Cb -0.13 -0.05 -0.01 0.00 -0.00 0.00 0.00 27.41 27.21 2k9s h HIS 39 CO 0.00 0.10 -0.56 -0.07 -0.00 0.00 0.00 177.93 177.40 2k9s h LEU 40 N 0.18 0.19 0.15 0.26 3.38 -1.11 -0.85 115.31 117.51 2k9s h LEU 40 Ca 0.06 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 2k9s h LEU 40 Cb -0.01 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2k9s h LEU 40 CO -0.02 0.71 -0.07 0.15 0.09 0.00 0.00 178.44 179.29 2k9s h PHE 41 N 0.13 -0.18 0.00 1.13 3.04 -0.32 0.32 116.94 121.05 2k9s h PHE 41 Ca -0.00 -0.00 -0.08 0.00 3.98 0.00 0.00 57.97 61.87 2k9s h PHE 41 Cb 1.02 0.06 -0.01 0.00 2.56 0.00 0.00 35.95 39.58 2k9s h PHE 41 CO 0.01 0.15 -0.38 -0.09 -2.02 0.00 0.00 178.31 175.99 2k9s h ARG 42 N -0.54 0.00 0.11 1.11 2.43 -0.85 0.42 114.38 117.07 2k9s h ARG 42 Ca -0.02 0.00 -0.26 0.00 -0.81 0.00 0.00 59.98 58.89 2k9s h ARG 42 Cb 0.42 0.00 0.03 0.00 -0.42 0.00 0.00 29.97 29.99 2k9s h ARG 42 CO 0.03 0.38 -1.08 0.37 -1.51 0.00 0.00 179.97 178.16 2k9s h GLN 43 N 0.00 0.53 0.23 0.20 5.75 -1.07 0.50 115.11 121.25 2k9s h GLN 43 Ca -0.00 -0.72 -0.33 0.00 -0.15 0.00 0.00 58.65 57.44 2k9s h GLN 43 Cb 0.81 0.24 0.03 0.00 1.07 0.00 0.00 27.48 29.63 2k9s h GLN 43 CO 0.05 1.32 -1.47 1.96 -2.65 0.00 0.00 178.83 178.04 2k9s h GLN 44 N 0.09 0.49 0.00 1.69 1.08 -0.30 -3.31 115.11 114.86 2k9s h GLN 44 Ca -0.17 -0.83 0.00 0.00 -1.45 0.00 0.00 58.65 56.20 2k9s h GLN 44 Cb 1.79 0.31 0.00 0.00 -0.05 0.00 0.00 27.48 29.53 2k9s h GLN 44 CO 0.21 1.40 -0.71 -0.07 -0.95 0.00 0.00 178.83 178.70 2k9s h LEU 45 N 0.13 0.00 0.06 1.46 3.38 -0.29 -3.48 115.31 116.57 2k9s h LEU 45 Ca -0.24 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.54 2k9s h LEU 45 Cb 2.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.88 2k9s h LEU 45 CO 0.26 0.08 -0.02 0.61 0.09 0.00 0.00 178.44 179.46 2k9s n GLY 46 N 1.29 0.26 3.44 0.83 0.00 0.17 -4.93 105.19 106.25 2k9s n GLY 46 Ca 0.02 -0.03 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.40 0.03 0.64 -0.61 -4.36 -1.13 -4.97 121.20 109.41 2k9s s ILE 47 Ca 0.00 -1.35 -0.12 0.00 -0.26 0.00 0.00 60.65 58.92 2k9s s ILE 47 Cb 0.00 -1.98 -0.02 0.00 1.25 0.00 0.00 42.46 41.71 2k9s s ILE 47 CO 0.00 -0.15 1.04 -0.55 0.24 0.00 0.00 174.94 175.52 2k9s s SER 48 N -2.99 5.88 0.27 4.36 0.15 -1.26 -3.87 113.70 116.25 2k9s s SER 48 Ca 0.19 1.55 -0.00 0.00 0.70 0.00 0.00 55.95 58.39 2k9s s SER 48 Cb 0.02 -2.49 0.52 0.00 -1.71 0.00 0.00 66.02 62.35 2k9s s SER 48 CO 0.04 -1.10 1.81 -0.37 1.20 0.00 0.00 173.24 174.81 2k9s h VAL 49 N -0.29 0.86 -0.32 4.45 -1.51 -1.96 0.51 116.25 118.00 2k9s h VAL 49 Ca -0.44 -0.29 -0.03 0.00 -1.23 0.00 0.00 66.70 64.71 2k9s h VAL 49 Cb 1.20 -0.05 -0.02 0.00 -2.13 0.00 0.00 31.29 30.29 2k9s h VAL 49 CO 0.59 0.15 0.08 0.25 -1.23 0.00 0.00 177.57 177.41 2k9s h LEU 50 N 0.84 0.42 -0.04 4.19 5.85 -1.98 0.20 115.31 124.79 2k9s h LEU 50 Ca 0.47 -0.05 -0.04 0.00 0.84 0.00 0.00 57.88 59.10 2k9s h LEU 50 Cb 0.52 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.44 2k9s h LEU 50 CO -0.29 0.43 -0.14 0.28 -0.34 0.00 0.00 178.44 178.38 2k9s h SER 51 N 0.45 0.18 -0.36 1.25 0.02 -1.32 -2.41 113.55 111.37 2k9s h SER 51 Ca 0.11 -0.64 -0.05 0.00 -0.84 0.00 0.00 61.79 60.37 2k9s h SER 51 Cb 0.18 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 2k9s h SER 51 CO -0.00 0.79 0.04 -0.25 -1.14 0.00 0.00 176.83 176.26 2k9s h TRP 52 N -0.41 0.66 -0.31 3.45 7.01 -1.00 -0.64 115.95 124.70 2k9s h TRP 52 Ca -0.01 -0.10 0.02 0.00 2.11 0.00 0.00 58.89 60.92 2k9s h TRP 52 Cb 0.78 -0.18 -0.03 0.00 -2.10 0.00 0.00 29.16 27.63 2k9s h TRP 52 CO 0.14 0.68 0.14 -0.09 -2.79 0.00 0.00 178.44 176.53 2k9s h ARG 53 N 0.44 0.29 -0.52 2.65 2.43 -0.69 -2.40 114.38 116.59 2k9s h ARG 53 Ca 0.11 -0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 59.17 2k9s h ARG 53 Cb 0.40 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 2k9s h ARG 53 CO 0.01 0.19 -0.04 1.49 -1.51 0.00 0.00 179.97 180.11 2k9s h GLU 54 N 0.30 0.92 -0.84 0.20 4.81 -1.36 -2.75 114.58 115.87 2k9s h GLU 54 Ca 0.13 -0.29 0.14 0.00 -0.13 0.00 0.00 59.36 59.21 2k9s h GLU 54 Cb 0.06 -0.08 -0.06 0.00 0.63 0.00 0.00 28.75 29.30 2k9s h GLU 54 CO -0.10 0.94 0.55 0.22 -0.73 0.00 0.00 179.01 179.88 2k9s h ASP 55 N 0.84 0.58 0.18 1.04 1.82 -0.63 0.30 116.42 120.56 2k9s h ASP 55 Ca 0.15 0.03 -0.13 0.00 -0.39 0.00 0.00 57.03 56.69 2k9s h ASP 55 Cb 0.56 -0.08 -0.01 0.00 0.68 0.00 0.00 39.33 40.47 2k9s h ASP 55 CO 0.03 0.30 -0.49 1.56 -1.61 0.00 0.00 179.24 179.04 2k9s h GLN 56 N 0.62 0.36 -0.26 0.28 1.08 -1.16 -0.93 115.11 115.10 2k9s h GLN 56 Ca 0.41 -0.21 -0.00 0.00 -1.45 0.00 0.00 58.65 57.40 2k9s h GLN 56 Cb 0.71 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.14 2k9s h GLN 56 CO -0.17 0.77 0.15 0.00 -0.95 0.00 0.00 178.83 178.63 2k9s h ARG 57 N 0.29 0.36 -0.10 1.46 3.08 -0.87 0.24 114.38 118.84 2k9s h ARG 57 Ca 0.01 -0.04 -0.16 0.00 0.07 0.00 0.00 59.98 59.87 2k9s h ARG 57 Cb 0.97 -0.07 0.01 0.00 0.08 0.00 0.00 29.97 30.96 2k9s h ARG 57 CO 0.08 0.31 -0.56 0.82 -1.07 0.00 0.00 179.97 179.55 2k9s h ILE 58 N 0.32 1.36 -0.66 2.04 1.08 -1.44 -2.14 117.51 118.06 2k9s h ILE 58 Ca 0.09 -1.88 -0.02 0.00 -0.39 0.00 0.00 64.86 62.66 2k9s h ILE 58 Cb 0.04 2.22 -0.03 0.00 -3.07 0.00 0.00 36.82 35.98 2k9s h ILE 58 CO -0.02 0.57 0.32 -1.28 -0.69 0.00 0.00 178.15 177.05 2k9s h SER 59 N 0.15 0.85 -0.16 1.72 0.87 -1.09 0.23 113.55 116.13 2k9s h SER 59 Ca -0.04 -0.09 -0.10 0.00 -1.23 0.00 0.00 61.79 60.32 2k9s h SER 59 Cb 1.20 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 62.95 2k9s h SER 59 CO 0.11 0.72 -0.31 -0.61 -0.53 0.00 0.00 176.83 176.22 2k9s h GLN 60 N 0.94 0.48 -0.25 2.24 5.75 -0.54 -0.51 115.11 123.22 2k9s h GLN 60 Ca 0.23 -0.31 -0.05 0.00 -0.15 0.00 0.00 58.65 58.37 2k9s h GLN 60 Cb 0.10 0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.68 2k9s h GLN 60 CO -0.03 0.92 -0.02 0.00 -2.65 0.00 0.00 178.83 177.04 2k9s h ALA 61 N 0.56 0.34 -0.15 3.38 0.00 -1.13 -2.28 119.26 119.98 2k9s h ALA 61 Ca 0.01 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.58 2k9s h ALA 61 Cb 0.90 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 2k9s h ALA 61 CO 0.07 0.10 -0.32 1.57 0.00 0.00 0.00 179.25 180.67 2k9s h LYS 62 N 0.22 0.29 0.18 0.00 2.10 -0.60 0.15 116.57 118.92 2k9s h LYS 62 Ca 0.07 -0.12 -0.01 0.00 -2.00 0.00 0.00 60.65 58.59 2k9s h LYS 62 Cb 0.46 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.78 2k9s h LYS 62 CO 0.02 0.59 -0.09 1.25 -2.00 0.00 0.00 179.45 179.22 2k9s h LEU 63 N 0.26 -0.21 -0.38 7.07 6.46 -0.95 -1.65 115.31 125.91 2k9s h LEU 63 Ca 0.03 -0.16 -0.18 0.00 -0.12 0.00 0.00 57.88 57.46 2k9s h LEU 63 Cb 0.69 0.05 -0.00 0.00 -0.73 0.00 0.00 40.66 40.67 2k9s h LEU 63 CO 0.05 0.04 -0.62 0.17 -0.62 0.00 0.00 178.44 177.46 2k9s h LEU 64 N -0.46 0.75 -2.03 2.25 8.10 -1.37 -3.02 115.31 119.54 2k9s h LEU 64 Ca -0.02 -0.43 -0.01 0.00 0.11 0.00 0.00 57.88 57.53 2k9s h LEU 64 Cb 0.35 -0.22 -0.00 0.00 -0.44 0.00 0.00 40.66 40.35 2k9s h LEU 64 CO 0.04 1.19 -0.03 0.25 -4.11 0.00 0.00 178.44 175.78 2k9s h LEU 65 N 0.49 0.00 -0.59 0.17 6.46 -0.67 0.30 115.31 121.46 2k9s h LEU 65 Ca -0.01 0.00 -0.10 0.00 -0.12 0.00 0.00 57.88 57.65 2k9s h LEU 65 Cb 1.20 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.12 2k9s h LEU 65 CO 0.12 0.03 -0.48 -1.28 -0.62 0.00 0.00 178.44 176.21 2k9s h SER 66 N 0.00 0.00 -0.35 1.25 0.87 -1.16 -3.09 113.55 111.07 2k9s h SER 66 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2k9s h SER 66 Cb 0.06 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.02 2k9s h SER 66 CO 0.00 0.48 0.00 1.07 -0.53 0.00 0.00 176.83 177.86 2k9s n THR 67 N -3.45 0.70 -4.13 2.23 5.66 -0.31 -4.97 114.28 110.01 2k9s n THR 67 Ca 0.00 -0.85 -0.15 0.00 -3.05 0.00 0.00 64.05 60.00 2k9s n THR 67 Cb 0.62 0.75 -0.11 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 -1.09 0.85 -0.32 1.09 -4.23 0.90 -5.04 115.64 107.81 2k9s s THR 68 Ca 0.28 -1.32 0.16 0.00 -1.18 0.00 0.00 61.69 59.63 2k9s s THR 68 Cb 0.16 -0.99 0.53 0.00 1.34 0.00 0.00 72.50 73.54 2k9s s THR 68 CO 0.21 -0.38 1.43 -1.14 -0.54 0.00 0.00 174.62 174.21 2k9s n ARG 69 N 1.14 3.11 -1.32 3.99 0.63 -1.26 -4.70 116.66 118.26 2k9s n ARG 69 Ca -0.20 -2.76 -0.32 0.00 -0.92 0.00 0.00 57.85 53.65 2k9s n ARG 69 Cb 0.55 -1.80 0.09 0.00 0.45 0.00 0.00 32.46 31.75 2k9s n ARG 69 CO 0.00 0.00 0.00 -1.64 -2.51 0.00 0.00 177.63 173.48 2k9s s MET 70 N -2.54 2.23 0.61 -0.14 -1.94 -1.26 -5.00 119.30 111.25 2k9s s MET 70 Ca 0.41 1.30 -0.17 0.00 -1.71 0.00 0.00 55.69 55.52 2k9s s MET 70 Cb 0.32 -1.89 -0.02 0.00 2.01 0.00 0.00 34.83 35.25 2k9s s MET 70 CO 0.11 -1.68 1.12 -1.25 -0.01 0.00 0.00 175.02 173.30 2k9s s PRO 71 N -4.63 3.03 0.51 2.03 0.04 -1.26 -4.78 135.00 129.94 2k9s s PRO 71 Ca 0.64 1.48 0.21 0.00 0.04 0.00 0.00 61.00 63.37 2k9s s PRO 71 Cb -0.19 -1.97 1.29 0.00 0.04 0.00 0.00 34.50 33.66 2k9s s PRO 71 CO 0.52 -1.08 2.01 0.82 0.04 0.00 0.00 177.00 179.32 2k9s h ILE 72 N 0.51 0.81 -0.16 0.56 1.08 -1.98 0.81 117.51 119.13 2k9s h ILE 72 Ca -0.48 -0.03 -0.03 0.00 -0.39 0.00 0.00 64.86 63.93 2k9s h ILE 72 Cb 1.25 0.71 -0.01 0.00 -3.07 0.00 0.00 36.82 35.70 2k9s h ILE 72 CO 0.55 0.02 -0.02 0.00 -0.69 0.00 0.00 178.15 178.01 2k9s h ALA 73 N 1.77 0.22 -0.23 1.87 0.00 -1.93 -2.23 119.26 118.71 2k9s h ALA 73 Ca 0.22 -0.22 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 2k9s h ALA 73 Cb 0.75 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 2k9s h ALA 73 CO -0.02 -0.05 -0.36 1.15 0.00 0.00 0.00 179.25 179.97 2k9s h THR 74 N 0.02 1.32 -0.99 0.00 2.02 -1.67 -3.17 112.91 110.44 2k9s h THR 74 Ca 0.04 -1.56 0.09 0.00 0.77 0.00 0.00 66.41 65.75 2k9s h THR 74 Cb 0.42 1.75 -0.07 0.00 -1.74 0.00 0.00 68.15 68.51 2k9s h THR 74 CO 0.01 0.49 0.63 0.58 0.37 0.00 0.00 175.52 177.60 2k9s h VAL 75 N 0.36 1.01 -0.98 3.16 2.07 -0.90 -1.70 116.25 119.27 2k9s h VAL 75 Ca 0.02 -0.37 0.06 0.00 0.82 0.00 0.00 66.70 67.23 2k9s h VAL 75 Cb 0.95 -0.16 -0.06 0.00 -1.52 0.00 0.00 31.29 30.50 2k9s h VAL 75 CO 0.08 0.20 0.64 1.23 0.02 0.00 0.00 177.57 179.74 2k9s h GLY 76 N 1.07 1.47 1.13 2.17 0.00 -1.37 -1.34 103.07 106.21 2k9s h GLY 76 Ca 0.45 -0.47 0.09 0.00 0.00 0.00 0.00 47.33 47.41 2k9s h GLY 76 CO -0.21 0.35 0.36 3.21 0.00 0.00 0.00 176.54 180.25 2k9s h ARG 77 N 1.17 0.31 0.00 4.80 3.08 -0.38 0.61 114.38 123.97 2k9s h ARG 77 Ca 0.41 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.43 2k9s h ARG 77 Cb 0.13 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.11 2k9s h ARG 77 CO -0.15 0.21 -0.06 -0.91 -1.07 0.00 0.00 179.97 177.98 2k9s h ASN 78 N 0.32 0.00 -0.26 7.04 2.35 -1.25 -2.08 115.58 121.71 2k9s h ASN 78 Ca 0.24 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.99 2k9s h ASN 78 Cb 0.54 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.91 2k9s h ASN 78 CO -0.06 0.06 0.00 1.33 -1.65 0.00 0.00 177.43 177.11 2k9s n VAL 79 N -3.29 1.51 -0.97 2.81 0.24 0.58 -4.94 118.33 114.26 2k9s n VAL 79 Ca -0.01 -1.39 0.00 0.00 -2.04 0.00 0.00 64.34 60.90 2k9s n VAL 79 Cb 0.24 0.19 0.00 0.00 -1.47 0.00 0.00 33.84 32.80 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 -0.06 0.98 3.61 7.63 0.00 -0.62 -4.70 105.19 112.03 2k9s n GLY 80 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 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 -3.89 3.19 -0.08 1.61 0.08 0.18 -4.89 117.98 114.18 2k9s s PHE 81 Ca 0.00 0.80 0.11 0.00 0.12 0.00 0.00 56.93 57.96 2k9s s PHE 81 Cb 0.00 -3.25 -0.24 0.00 -0.57 0.00 0.00 43.02 38.96 2k9s s PHE 81 CO 0.00 -0.59 0.51 -0.25 -0.10 0.00 0.00 175.22 174.79 2k9s n ASP 82 N 6.25 0.91 -4.61 1.36 9.92 -1.26 -1.68 116.55 127.44 2k9s n ASP 82 Ca 0.04 0.31 -0.41 0.00 -0.53 0.00 0.00 54.79 54.20 2k9s n ASP 82 Cb 0.48 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 40.90 2k9s n ASP 82 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 2k9s s ASP 83 N -6.12 6.55 0.30 -2.24 1.01 -1.26 -4.94 116.67 109.97 2k9s s ASP 83 Ca -0.08 0.58 -0.00 0.00 0.71 0.00 0.00 52.55 53.76 2k9s s ASP 83 Cb 0.08 -2.34 0.47 0.00 1.01 0.00 0.00 42.92 42.13 2k9s s ASP 83 CO 0.81 -0.45 1.87 0.06 0.21 0.00 0.00 175.17 177.68 2k9s h GLN 84 N 8.04 0.81 -0.16 8.23 3.07 -1.88 -2.26 115.11 130.97 2k9s h GLN 84 Ca -0.26 -0.14 -0.10 0.00 0.09 0.00 0.00 58.65 58.24 2k9s h GLN 84 Cb 1.12 -0.14 -0.01 0.00 0.08 0.00 0.00 27.48 28.53 2k9s h GLN 84 CO 0.80 0.69 -0.34 -0.07 0.09 0.00 0.00 178.83 180.00 2k9s h LEU 85 N 0.79 0.32 -0.11 0.06 3.38 -1.96 -1.71 115.31 116.09 2k9s h LEU 85 Ca 0.18 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2k9s h LEU 85 Cb 0.21 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 2k9s h LEU 85 CO -0.01 0.65 0.04 0.22 0.09 0.00 0.00 178.44 179.42 2k9s h TYR 86 N 0.28 0.18 -0.35 1.13 5.03 -1.82 0.26 116.97 121.67 2k9s h TYR 86 Ca 0.03 -0.02 -0.07 0.00 2.58 0.00 0.00 58.73 61.26 2k9s h TYR 86 Cb 0.73 -0.05 -0.01 0.00 1.55 0.00 0.00 36.73 38.95 2k9s h TYR 86 CO 0.02 0.30 -0.03 0.35 -1.32 0.00 0.00 178.16 177.48 2k9s h PHE 87 N -0.00 0.72 -0.57 -3.82 3.57 -1.43 -2.27 116.94 113.13 2k9s h PHE 87 Ca 0.04 -0.14 -0.08 0.00 3.53 0.00 0.00 57.97 61.32 2k9s h PHE 87 Cb 0.21 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.74 2k9s h PHE 87 CO -0.01 0.77 0.04 0.66 -2.23 0.00 0.00 178.31 177.55 2k9s h SER 88 N 0.45 0.93 0.06 0.41 4.64 -1.25 0.27 113.55 119.05 2k9s h SER 88 Ca 0.10 -0.23 -0.00 0.00 -0.47 0.00 0.00 61.79 61.18 2k9s h SER 88 Cb 0.51 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 2k9s h SER 88 CO 0.02 0.96 -0.03 0.03 -0.87 0.00 0.00 176.83 176.95 2k9s h ARG 89 N 0.90 -0.07 -0.17 4.77 3.08 -0.36 0.28 114.38 122.81 2k9s h ARG 89 Ca 0.17 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.14 2k9s h ARG 89 Cb 0.47 0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.54 2k9s h ARG 89 CO 0.02 0.04 -0.22 0.28 -1.07 0.00 0.00 179.97 179.02 2k9s h VAL 90 N -0.17 1.35 -0.60 2.04 2.07 -1.33 -3.11 116.25 116.50 2k9s h VAL 90 Ca -0.01 -1.42 -0.02 0.00 0.82 0.00 0.00 66.70 66.08 2k9s h VAL 90 Cb 0.15 1.88 -0.03 0.00 -1.52 0.00 0.00 31.29 31.76 2k9s h VAL 90 CO 0.01 0.42 0.31 0.15 0.02 0.00 0.00 177.57 178.48 2k9s h PHE 91 N 0.08 0.82 -0.26 1.57 3.04 -0.43 0.42 116.94 122.17 2k9s h PHE 91 Ca 0.02 -0.02 0.03 0.00 3.98 0.00 0.00 57.97 61.98 2k9s h PHE 91 Cb 0.78 -0.26 -0.03 0.00 2.56 0.00 0.00 35.95 39.00 2k9s h PHE 91 CO 0.09 0.59 0.08 -0.22 -2.02 0.00 0.00 178.31 176.83 2k9s h LYS 92 N 0.84 0.19 0.00 1.11 3.64 -0.39 -2.08 116.57 119.87 2k9s h LYS 92 Ca 0.21 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.49 2k9s h LYS 92 Cb 0.05 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 2k9s h LYS 92 CO -0.03 0.13 -0.45 0.87 -2.27 0.00 0.00 179.45 177.70 2k9s h LYS 93 N 0.20 0.00 -0.13 1.90 1.57 -1.41 0.77 116.57 119.46 2k9s h LYS 93 Ca 0.12 0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.92 2k9s h LYS 93 Cb 0.09 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.37 2k9s h LYS 93 CO -0.12 0.45 -0.03 0.00 -0.57 0.00 0.00 179.45 179.17 2k9s n THR 95 N -5.16 0.00 -0.04 0.00 -2.24 -1.00 -4.98 114.28 100.86 2k9s n THR 95 Ca -0.04 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 2k9s n THR 95 Cb 0.09 1.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.33 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 1.30 0.61 3.01 3.38 0.00 0.24 -5.04 105.19 108.69 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 -2.25 0.35 0.91 4.61 0.00 0.40 -4.82 121.76 120.97 2k9s s ALA 97 Ca 0.00 -0.59 -0.11 0.00 0.00 0.00 0.00 51.96 51.26 2k9s s ALA 97 Cb 0.00 0.06 0.14 0.00 0.00 0.00 0.00 23.12 23.32 2k9s s ALA 97 CO 0.00 -0.06 1.10 -1.54 0.00 0.00 0.00 175.76 175.27 2k9s s SER 98 N -1.27 3.16 0.29 0.00 1.04 -1.26 -3.99 113.70 111.66 2k9s s SER 98 Ca -0.10 1.84 0.07 0.00 0.48 0.00 0.00 55.95 58.24 2k9s s SER 98 Cb -0.08 -2.43 0.42 0.00 0.10 0.00 0.00 66.02 64.03 2k9s s SER 98 CO -0.00 -2.89 1.67 1.55 0.98 0.00 0.00 173.24 174.55 2k9s h PRO 99 N -1.72 0.21 -0.22 4.02 0.13 -1.90 -2.59 132.00 129.93 2k9s h PRO 99 Ca -0.47 -0.11 -0.10 0.00 -0.87 0.00 0.00 66.00 64.45 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 0.63 -0.28 1.03 -0.23 0.00 0.00 178.00 179.63 2k9s h SER 100 N 0.17 0.43 -0.02 1.44 0.87 -1.98 -1.48 113.55 112.97 2k9s h SER 100 Ca 0.01 -0.15 -0.06 0.00 -1.23 0.00 0.00 61.79 60.36 2k9s h SER 100 Cb 0.89 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.74 2k9s h SER 100 CO 0.07 0.70 -0.21 -0.08 -0.53 0.00 0.00 176.83 176.79 2k9s h GLU 101 N 0.37 0.17 -0.36 2.24 4.81 -1.89 -1.88 114.58 118.04 2k9s h GLU 101 Ca 0.05 -0.16 0.01 0.00 -0.13 0.00 0.00 59.36 59.13 2k9s h GLU 101 Cb 0.69 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.09 2k9s h GLU 101 CO 0.05 0.86 0.22 0.35 -0.73 0.00 0.00 179.01 179.76 2k9s h PHE 102 N -0.45 0.42 -0.04 0.92 3.04 -1.43 -2.12 116.94 117.27 2k9s h PHE 102 Ca -0.02 0.01 -0.08 0.00 3.98 0.00 0.00 57.97 61.86 2k9s h PHE 102 Cb 0.92 -0.14 -0.01 0.00 2.56 0.00 0.00 35.95 39.28 2k9s h PHE 102 CO 0.16 0.25 -0.37 0.07 -2.02 0.00 0.00 178.31 176.40 2k9s h ARG 103 N 0.45 0.07 0.00 1.11 0.11 -1.36 -2.59 114.38 112.17 2k9s h ARG 103 Ca 0.14 -0.03 -0.04 0.00 0.10 0.00 0.00 59.98 60.15 2k9s h ARG 103 Cb -0.02 -0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.05 2k9s h ARG 103 CO -0.05 0.44 -0.17 0.00 0.10 0.00 0.00 179.97 180.28 2k9s h ALA 104 N 1.56 1.60 0.00 0.08 0.00 -0.68 -3.46 119.26 118.37 2k9s h ALA 104 Ca 0.01 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2k9s h ALA 104 Cb 0.69 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2k9s h ALA 104 CO 0.05 0.22 0.00 0.41 0.00 0.00 0.00 179.25 179.93 2k9s n GLY 105 N -0.94 1.06 3.76 0.00 0.00 -0.98 -5.04 105.19 103.05 2k9s n GLY 105 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 2k9s n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32