#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k27 s PRO 2 N 0.00 3.14 -1.52 3.17 0.04 -1.26 -4.71 135.00 133.85 2k27 s PRO 2 Ca 0.00 1.88 -0.12 0.00 0.04 0.00 0.00 61.00 62.80 2k27 s PRO 2 Cb 0.00 -4.34 -0.01 0.00 0.04 0.00 0.00 34.50 30.18 2k27 s PRO 2 CO 0.00 -2.10 2.52 0.72 0.04 0.00 0.00 177.00 178.18 2k27 n HIS 3 N 11.54 3.09 -4.00 0.56 8.25 -1.26 -4.86 115.22 128.55 2k27 n HIS 3 Ca 0.29 -3.02 -0.12 0.00 -0.26 0.00 0.00 57.72 54.61 2k27 n HIS 3 Cb 0.46 -2.53 -0.12 0.00 1.12 0.00 0.00 29.99 28.91 2k27 n HIS 3 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 2k27 s ASN 4 N 2.80 0.40 0.17 0.41 0.01 -1.26 -5.05 114.94 112.43 2k27 s ASN 4 Ca 0.56 -0.36 0.00 0.00 -0.71 0.00 0.00 52.86 52.35 2k27 s ASN 4 Cb 0.16 0.04 0.00 0.00 0.41 0.00 0.00 41.25 41.86 2k27 s ASN 4 CO -0.08 -0.17 0.00 -1.54 -1.51 0.00 0.00 177.10 173.81 2k27 n SER 5 N 2.04 -1.32 -3.45 -1.22 3.41 -1.26 -5.09 113.62 106.73 2k27 n SER 5 Ca -0.20 0.33 -0.14 0.00 -0.26 0.00 0.00 58.87 58.60 2k27 n SER 5 Cb 0.56 1.47 0.01 0.00 -0.26 0.00 0.00 64.21 65.99 2k27 n SER 5 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2k27 n ILE 6 N -2.88 -6.72 -2.74 -1.33 -0.00 -1.26 -5.03 119.36 99.40 2k27 n ILE 6 Ca 0.00 -0.23 -0.22 0.00 -0.00 0.00 0.00 62.75 62.30 2k27 n ILE 6 Cb 0.00 -4.91 0.09 0.00 -0.00 0.00 0.00 39.64 34.82 2k27 n ILE 6 CO 0.00 0.00 0.00 -0.13 -0.00 0.00 0.00 176.55 176.42 2k27 s ARG 7 N -4.19 1.91 0.19 0.38 1.81 -1.26 -5.15 118.95 112.64 2k27 s ARG 7 Ca 0.06 -1.28 -0.11 0.00 -1.72 0.00 0.00 55.73 52.68 2k27 s ARG 7 Cb -0.02 -2.44 -0.00 0.00 -0.45 0.00 0.00 34.95 32.04 2k27 s ARG 7 CO 0.83 -1.23 0.36 -1.54 -0.68 0.00 0.00 175.30 173.04 2k27 s SER 8 N -4.70 -0.04 0.00 0.23 1.04 -1.26 -5.14 113.70 103.83 2k27 s SER 8 Ca 0.65 -0.83 0.00 0.00 0.48 0.00 0.00 55.95 56.25 2k27 s SER 8 Cb -0.06 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.55 2k27 s SER 8 CO 0.42 -0.97 0.00 0.61 0.98 0.00 0.00 173.24 174.28 2k27 n GLY 9 N -0.27 -2.39 3.77 7.32 0.00 -1.26 -5.13 105.19 107.22 2k27 n GLY 9 Ca -0.06 -1.35 -0.04 0.00 0.00 0.00 0.00 46.02 44.57 2k27 n GLY 9 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2k27 s HIS 10 N -3.78 -0.14 -1.14 1.61 -3.43 -1.26 -5.20 115.29 101.95 2k27 s HIS 10 Ca 0.00 -0.19 0.00 0.00 -0.80 0.00 0.00 55.06 54.07 2k27 s HIS 10 Cb 0.00 0.65 0.00 0.00 -1.43 0.00 0.00 32.58 31.80 2k27 s HIS 10 CO 0.00 -0.87 0.00 0.41 -2.00 0.00 0.00 174.74 172.28 2k27 n GLY 11 N -0.47 -1.47 0.00 -1.38 0.00 -1.26 -5.20 105.19 95.42 2k27 n GLY 11 Ca -0.06 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.91 2k27 n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k27 n GLY 12 N -0.19 0.65 3.31 -0.02 0.00 -1.26 -5.17 105.19 102.52 2k27 n GLY 12 Ca 0.00 -0.69 -0.08 0.00 0.00 0.00 0.00 46.02 45.24 2k27 n GLY 12 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2k27 s LEU 13 N 0.00 -0.57 -0.03 0.99 1.98 -1.26 -5.16 118.68 114.63 2k27 s LEU 13 Ca 0.00 1.04 -0.15 0.00 -2.89 0.00 0.00 54.13 52.12 2k27 s LEU 13 Cb 0.00 1.47 0.03 0.00 0.66 0.00 0.00 46.19 48.35 2k27 s LEU 13 CO 0.00 -0.22 0.34 0.54 -1.89 0.00 0.00 176.35 175.11 2k27 s ASN 14 N 2.31 -0.24 0.16 3.68 4.22 -1.26 -5.10 114.94 118.71 2k27 s ASN 14 Ca -0.04 0.20 0.00 0.00 -2.14 0.00 0.00 52.86 50.88 2k27 s ASN 14 Cb -0.11 0.38 0.00 0.00 1.28 0.00 0.00 41.25 42.80 2k27 s ASN 14 CO -0.14 -0.41 0.00 0.00 -2.04 0.00 0.00 177.10 174.51 2k27 n GLN 15 N 1.46 0.00 -1.77 3.55 6.02 -1.26 -4.91 117.38 120.47 2k27 n GLN 15 Ca -0.20 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.37 2k27 n GLN 15 Cb 0.56 -0.16 0.00 0.00 1.02 0.00 0.00 30.24 31.66 2k27 n GLN 15 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2k27 n LEU 16 N -3.23 6.82 0.00 1.08 4.77 -1.26 -4.87 117.00 120.31 2k27 n LEU 16 Ca 0.00 -4.15 0.00 0.00 -0.03 0.00 0.00 56.01 51.83 2k27 n LEU 16 Cb 0.00 -1.66 0.00 0.00 -2.33 0.00 0.00 43.42 39.43 2k27 n LEU 16 CO 0.00 1.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.76 2k27 n GLY 17 N 4.09 -1.76 2.69 -0.72 0.00 -1.26 -4.90 105.19 103.33 2k27 n GLY 17 Ca 0.52 -1.32 -0.05 0.00 0.00 0.00 0.00 46.02 45.16 2k27 n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k27 n GLY 18 N 0.00 -0.72 3.72 -0.02 0.00 -1.26 -4.85 105.19 102.06 2k27 n GLY 18 Ca 0.00 0.53 -0.42 0.00 0.00 0.00 0.00 46.02 46.13 2k27 n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k27 s ALA 19 N 0.12 3.20 -0.06 4.61 0.00 -1.26 -5.05 121.76 123.32 2k27 s ALA 19 Ca 0.20 0.57 -0.05 0.00 0.00 0.00 0.00 51.96 52.68 2k27 s ALA 19 Cb 0.29 -3.32 0.02 0.00 0.00 0.00 0.00 23.12 20.10 2k27 s ALA 19 CO -0.14 -0.16 0.15 -0.06 0.00 0.00 0.00 175.76 175.55 2k27 s PHE 20 N 0.63 -0.17 -1.58 0.00 0.08 -1.26 -4.82 117.98 110.86 2k27 s PHE 20 Ca 0.50 0.42 -0.06 0.00 0.12 0.00 0.00 56.93 57.92 2k27 s PHE 20 Cb -0.22 0.05 0.05 0.00 -0.57 0.00 0.00 43.02 42.33 2k27 s PHE 20 CO 0.29 -0.09 0.29 1.55 -0.10 0.00 0.00 175.22 177.17 2k27 n VAL 21 N 3.05 -1.44 -3.12 -0.44 3.14 -1.26 -4.92 118.33 113.33 2k27 n VAL 21 Ca -0.13 -0.37 0.03 0.00 -2.96 0.00 0.00 64.34 60.91 2k27 n VAL 21 Cb 0.59 -1.48 -0.00 0.00 -1.06 0.00 0.00 33.84 31.89 2k27 n VAL 21 CO 0.00 0.00 0.00 0.21 -6.46 0.00 0.00 176.83 170.58 2k27 s ASN 22 N -4.10 -1.23 0.00 6.55 3.04 -1.26 -4.91 114.94 113.04 2k27 s ASN 22 Ca 0.21 -0.14 0.00 0.00 0.04 0.00 0.00 52.86 52.97 2k27 s ASN 22 Cb -0.12 1.69 0.00 0.00 -1.54 0.00 0.00 41.25 41.28 2k27 s ASN 22 CO 0.96 -0.19 0.00 0.61 -3.04 0.00 0.00 177.10 175.44 2k27 n GLY 23 N 4.90 1.39 3.71 1.21 0.00 -1.26 -4.86 105.19 110.28 2k27 n GLY 23 Ca 0.08 -0.02 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 2k27 n GLY 23 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k27 n ARG 24 N 0.00 2.30 -1.55 1.61 5.12 -1.26 -5.01 116.66 117.88 2k27 n ARG 24 Ca 0.00 0.82 -0.29 0.00 -1.93 0.00 0.00 57.85 56.45 2k27 n ARG 24 Cb 0.00 -2.51 0.14 0.00 -1.16 0.00 0.00 32.46 28.93 2k27 n ARG 24 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 2k27 s PRO 25 N -0.78 1.09 -0.57 5.56 0.04 -1.26 -4.68 135.00 134.41 2k27 s PRO 25 Ca 0.64 0.25 0.07 0.00 0.04 0.00 0.00 61.00 62.00 2k27 s PRO 25 Cb -0.58 -1.84 0.25 0.00 0.04 0.00 0.00 34.50 32.37 2k27 s PRO 25 CO 0.52 -2.22 0.67 1.28 0.04 0.00 0.00 177.00 177.29 2k27 n LEU 26 N -3.78 2.64 0.00 -3.56 4.32 -1.26 -4.95 117.00 110.42 2k27 n LEU 26 Ca 0.07 -5.21 0.00 0.00 -0.02 0.00 0.00 56.01 50.85 2k27 n LEU 26 Cb 0.59 -0.27 0.00 0.00 -1.62 0.00 0.00 43.42 42.12 2k27 n LEU 26 CO 0.57 2.05 0.00 -0.81 -1.22 0.00 0.00 177.39 177.98 2k27 n PRO 27 N 1.06 0.60 0.15 3.23 -0.04 -1.26 -4.77 135.00 133.97 2k27 n PRO 27 Ca 0.27 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.81 2k27 n PRO 27 Cb 0.44 0.00 0.44 0.00 -0.04 0.00 0.00 33.50 34.34 2k27 n PRO 27 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2k27 n GLU 28 N -0.35 0.11 -0.20 0.54 1.02 -1.26 -1.03 120.64 119.47 2k27 n GLU 28 Ca 0.00 0.59 0.18 0.00 -0.02 0.00 0.00 57.16 57.91 2k27 n GLU 28 Cb 0.00 -2.00 0.53 0.00 -0.02 0.00 0.00 31.44 29.95 2k27 n GLU 28 CO 0.00 0.00 0.00 -0.24 1.18 0.00 0.00 177.13 178.07 2k27 h VAL 29 N 0.00 0.72 -0.16 2.62 3.04 -1.97 -1.15 116.25 119.34 2k27 h VAL 29 Ca 0.00 -0.13 0.05 0.00 -1.01 0.00 0.00 66.70 65.61 2k27 h VAL 29 Cb 0.30 0.31 -0.01 0.00 -2.01 0.00 0.00 31.29 29.88 2k27 h VAL 29 CO 0.00 0.07 0.19 1.62 -1.01 0.00 0.00 177.57 178.44 2k27 h VAL 30 N 0.37 0.44 -0.59 1.51 3.04 -1.38 -2.36 116.25 117.28 2k27 h VAL 30 Ca 0.42 0.00 0.10 0.00 -1.01 0.00 0.00 66.70 66.21 2k27 h VAL 30 Cb 1.08 0.85 -0.08 0.00 -2.01 0.00 0.00 31.29 31.13 2k27 h VAL 30 CO -0.14 0.00 0.18 -0.09 -1.01 0.00 0.00 177.57 176.51 2k27 h ARG 31 N 0.00 0.33 -0.16 4.17 9.65 -1.42 -0.41 114.38 126.54 2k27 h ARG 31 Ca 0.08 -0.02 -0.04 0.00 -1.10 0.00 0.00 59.98 58.89 2k27 h ARG 31 Cb 0.45 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 28.94 2k27 h ARG 31 CO -0.00 0.22 -0.10 -0.56 2.80 0.00 0.00 179.97 182.32 2k27 h GLN 32 N 0.34 0.24 -0.39 0.20 -0.00 -1.61 -1.18 115.11 112.71 2k27 h GLN 32 Ca 0.30 -0.05 -0.10 0.00 -0.00 0.00 0.00 58.65 58.80 2k27 h GLN 32 Cb 0.41 -0.04 -0.01 0.00 -0.00 0.00 0.00 27.48 27.84 2k27 h GLN 32 CO -0.34 0.36 -0.16 0.00 -0.00 0.00 0.00 178.83 178.68 2k27 h ARG 33 N 0.23 0.79 -0.20 0.06 3.08 -1.24 0.26 114.38 117.37 2k27 h ARG 33 Ca 0.05 -0.34 0.04 0.00 0.07 0.00 0.00 59.98 59.80 2k27 h ARG 33 Cb 0.33 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.32 2k27 h ARG 33 CO 0.02 0.96 -0.04 0.82 -1.07 0.00 0.00 179.97 180.66 2k27 h ILE 34 N 0.60 0.81 -0.19 2.04 2.04 -0.60 -0.90 117.51 121.31 2k27 h ILE 34 Ca 0.09 -0.01 0.04 0.00 1.00 0.00 0.00 64.86 65.99 2k27 h ILE 34 Cb 0.71 0.79 -0.04 0.00 -0.74 0.00 0.00 36.82 37.54 2k27 h ILE 34 CO 0.05 0.00 -0.07 0.58 0.00 0.00 0.00 178.15 178.71 2k27 h VAL 35 N 0.02 0.75 0.21 1.67 2.07 -1.08 -0.11 116.25 119.77 2k27 h VAL 35 Ca 0.10 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.61 2k27 h VAL 35 Cb 0.14 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 30.66 2k27 h VAL 35 CO -0.20 0.00 -0.12 -0.78 0.02 0.00 0.00 177.57 176.50 2k27 h ASP 36 N -0.04 -0.29 -0.26 0.57 3.58 -0.62 -0.10 116.42 119.27 2k27 h ASP 36 Ca 0.10 0.01 -0.05 0.00 0.42 0.00 0.00 57.03 57.52 2k27 h ASP 36 Cb 0.19 0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.31 2k27 h ASP 36 CO -0.22 -0.19 -0.01 -0.07 -2.88 0.00 0.00 179.24 175.86 2k27 h LEU 37 N -0.31 0.47 -0.45 2.28 4.07 -1.10 -1.21 115.31 119.06 2k27 h LEU 37 Ca -0.02 -0.32 0.06 0.00 0.08 0.00 0.00 57.88 57.67 2k27 h LEU 37 Cb 0.25 -0.13 -0.05 0.00 1.08 0.00 0.00 40.66 41.81 2k27 h LEU 37 CO 0.03 0.68 0.15 0.00 -1.08 0.00 0.00 178.44 178.22 2k27 h ALA 38 N 0.81 0.53 0.08 1.53 0.00 -0.96 -1.23 119.26 120.03 2k27 h ALA 38 Ca 0.07 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2k27 h ALA 38 Cb 0.44 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2k27 h ALA 38 CO 0.02 -0.24 -0.04 1.25 0.00 0.00 0.00 179.25 180.23 2k27 h HIS 39 N 0.31 -0.10 0.00 0.00 -0.00 -0.84 -2.96 115.15 111.56 2k27 h HIS 39 Ca 0.21 -0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 60.58 2k27 h HIS 39 Cb 0.22 0.03 -0.00 0.00 -0.00 0.00 0.00 27.41 27.66 2k27 h HIS 39 CO -0.16 0.13 -0.00 -0.56 -0.00 0.00 0.00 177.93 177.33 2k27 h GLN 40 N -0.33 0.00 0.00 5.26 3.07 -1.15 -3.46 115.11 118.50 2k27 h GLN 40 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.73 2k27 h GLN 40 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.84 2k27 h GLN 40 CO 0.02 0.00 0.00 0.41 0.09 0.00 0.00 178.83 179.35 2k27 n GLY 41 N -0.34 0.63 2.96 0.06 0.00 -0.84 -5.10 105.19 102.56 2k27 n GLY 41 Ca -0.01 -0.80 -0.31 0.00 0.00 0.00 0.00 46.02 44.91 2k27 n GLY 41 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k27 s VAL 42 N -0.91 1.62 0.88 1.61 1.01 -0.53 -5.02 120.40 119.07 2k27 s VAL 42 Ca 0.00 -1.27 -0.11 0.00 0.00 0.00 0.00 61.98 60.60 2k27 s VAL 42 Cb 0.00 -1.86 0.12 0.00 0.00 0.00 0.00 36.38 34.64 2k27 s VAL 42 CO 0.00 -0.08 1.11 -0.13 0.00 0.00 0.00 175.10 176.00 2k27 s ARG 43 N 1.35 1.31 0.33 2.72 0.52 -1.26 -4.34 118.95 119.58 2k27 s ARG 43 Ca -0.06 1.29 0.07 0.00 -0.52 0.00 0.00 55.73 56.50 2k27 s ARG 43 Cb -0.19 -1.78 0.74 0.00 0.52 0.00 0.00 34.95 34.24 2k27 s ARG 43 CO -0.06 -2.34 1.85 -1.00 0.02 0.00 0.00 175.30 173.77 2k27 h PRO 44 N -1.65 0.76 -0.55 3.54 0.13 -2.00 0.70 132.00 132.94 2k27 h PRO 44 Ca -0.45 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 64.62 2k27 h PRO 44 Cb 1.26 -0.17 -0.03 0.00 0.13 0.00 0.00 31.00 32.19 2k27 h PRO 44 CO 0.47 0.50 0.31 0.00 -0.23 0.00 0.00 178.00 179.06 2k27 h ASP 46 N 0.74 0.00 0.51 0.00 3.32 -1.35 -1.13 116.42 118.51 2k27 h ASP 46 Ca 0.20 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.22 2k27 h ASP 46 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.58 2k27 h ASP 46 CO -0.03 0.35 -0.24 0.40 -1.72 0.00 0.00 179.24 177.99 2k27 h ILE 47 N 0.00 0.47 -0.58 0.35 2.04 -0.67 -2.69 117.51 116.42 2k27 h ILE 47 Ca -0.00 -0.23 0.11 0.00 1.00 0.00 0.00 64.86 65.74 2k27 h ILE 47 Cb 0.62 0.56 -0.09 0.00 -0.74 0.00 0.00 36.82 37.18 2k27 h ILE 47 CO 0.04 0.04 0.11 0.28 0.00 0.00 0.00 178.15 178.62 2k27 h SER 48 N -0.83 -0.03 -0.27 1.72 0.02 -0.74 -0.92 113.55 112.51 2k27 h SER 48 Ca -0.07 0.11 -0.11 0.00 -0.84 0.00 0.00 61.79 60.89 2k27 h SER 48 Cb 0.58 0.16 -0.00 0.00 0.14 0.00 0.00 62.40 63.28 2k27 h SER 48 CO 0.11 -0.00 -0.25 0.08 -1.14 0.00 0.00 176.83 175.63 2k27 h ARG 49 N 0.24 0.64 -0.66 3.45 -0.00 -1.30 0.54 114.38 117.30 2k27 h ARG 49 Ca 0.31 -0.34 -0.05 0.00 -0.00 0.00 0.00 59.98 59.90 2k27 h ARG 49 Cb 0.45 0.01 -0.03 0.00 -0.00 0.00 0.00 29.97 30.40 2k27 h ARG 49 CO -0.40 0.94 0.23 1.96 -0.00 0.00 0.00 179.97 182.69 2k27 h GLN 50 N 0.37 0.99 0.00 0.08 4.20 -1.11 -1.71 115.11 117.94 2k27 h GLN 50 Ca 0.04 -0.18 0.00 0.00 0.06 0.00 0.00 58.65 58.57 2k27 h GLN 50 Cb 0.81 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.43 2k27 h GLN 50 CO 0.06 0.84 0.00 1.28 -0.67 0.00 0.00 178.83 180.34 2k27 n LEU 51 N -4.28 0.58 -3.05 1.46 7.99 -0.39 -4.96 117.00 114.35 2k27 n LEU 51 Ca 0.05 0.57 -0.13 0.00 -0.01 0.00 0.00 56.01 56.49 2k27 n LEU 51 Cb 0.20 -0.40 0.06 0.00 -0.11 0.00 0.00 43.42 43.18 2k27 n LEU 51 CO 0.40 -0.18 0.04 0.54 -1.51 0.00 0.00 177.39 176.68 2k27 n ARG 52 N -2.05 -2.70 -4.11 3.23 1.74 0.04 -5.04 116.66 107.76 2k27 n ARG 52 Ca 0.05 0.76 -0.12 0.00 -0.77 0.00 0.00 57.85 57.77 2k27 n ARG 52 Cb 0.38 -5.32 -0.07 0.00 -1.02 0.00 0.00 32.46 26.43 2k27 n ARG 52 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2k27 s VAL 53 N -3.34 0.00 -0.22 1.55 -7.23 -0.36 -5.03 120.40 105.78 2k27 s VAL 53 Ca 0.32 -1.70 -0.11 0.00 -1.81 0.00 0.00 61.98 58.69 2k27 s VAL 53 Cb -0.04 -2.44 -0.10 0.00 0.56 0.00 0.00 36.38 34.36 2k27 s VAL 53 CO 0.64 0.00 -0.28 -1.20 -0.31 0.00 0.00 175.10 173.95 2k27 n SER 54 N -0.72 1.55 0.00 4.85 7.64 -1.26 -4.39 113.62 121.29 2k27 n SER 54 Ca 0.01 0.26 0.00 0.00 1.01 0.00 0.00 58.87 60.15 2k27 n SER 54 Cb 0.63 -0.64 0.00 0.00 -1.01 0.00 0.00 64.21 63.19 2k27 n SER 54 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2k27 n HIS 55 N -3.98 0.00 0.00 1.43 8.25 -1.26 -4.87 115.22 114.80 2k27 n HIS 55 Ca -0.43 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 56.98 2k27 n HIS 55 Cb 0.81 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.89 2k27 n HIS 55 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 2k27 h GLY 56 N 0.00 -1.39 2.00 -1.41 0.00 -2.00 -1.25 103.07 99.02 2k27 h GLY 56 Ca 0.00 0.66 -0.16 0.00 0.00 0.00 0.00 47.33 47.82 2k27 h GLY 56 CO 0.00 -0.46 -0.77 0.00 0.00 0.00 0.00 176.54 175.31 2k27 h VAL 58 N 0.00 0.42 -0.61 0.00 2.07 -1.83 -0.30 116.25 116.01 2k27 h VAL 58 Ca -0.01 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.64 2k27 h VAL 58 Cb 1.53 0.42 -0.11 0.00 -1.52 0.00 0.00 31.29 31.61 2k27 h VAL 58 CO 0.10 0.00 -0.05 -1.28 0.02 0.00 0.00 177.57 176.36 2k27 h SER 59 N -0.12 -0.36 -0.37 0.57 0.87 -1.31 -0.13 113.55 112.69 2k27 h SER 59 Ca 0.20 0.16 -0.04 0.00 -1.23 0.00 0.00 61.79 60.87 2k27 h SER 59 Cb 0.42 0.30 -0.01 0.00 -0.44 0.00 0.00 62.40 62.67 2k27 h SER 59 CO -0.48 -0.14 0.06 0.11 -0.53 0.00 0.00 176.83 175.85 2k27 h LYS 60 N 0.08 0.61 0.66 2.24 1.57 -1.28 -0.46 116.57 119.98 2k27 h LYS 60 Ca 0.31 -0.16 -0.03 0.00 -1.87 0.00 0.00 60.65 58.89 2k27 h LYS 60 Cb 0.50 -0.07 0.01 0.00 0.08 0.00 0.00 32.23 32.74 2k27 h LYS 60 CO -0.55 0.68 -0.32 0.82 -0.57 0.00 0.00 179.45 179.51 2k27 h ILE 61 N 0.46 0.22 -0.37 1.86 1.08 -0.54 -3.15 117.51 117.07 2k27 h ILE 61 Ca 0.11 -0.25 0.02 0.00 -0.39 0.00 0.00 64.86 64.35 2k27 h ILE 61 Cb 0.36 0.28 -0.02 0.00 -3.07 0.00 0.00 36.82 34.38 2k27 h ILE 61 CO 0.01 0.02 0.24 -0.07 -0.69 0.00 0.00 178.15 177.66 2k27 h LEU 62 N -1.09 0.37 0.00 1.44 -0.00 -1.08 -3.43 115.31 111.52 2k27 h LEU 62 Ca -0.09 -0.01 0.00 0.00 -0.00 0.00 0.00 57.88 57.78 2k27 h LEU 62 Cb 0.72 -0.09 0.00 0.00 -0.00 0.00 0.00 40.66 41.29 2k27 h LEU 62 CO 0.15 0.26 0.00 0.61 -0.00 0.00 0.00 178.44 179.46 2k27 n GLY 63 N -1.49 3.97 0.27 0.83 0.00 -0.19 -5.00 105.19 103.57 2k27 n GLY 63 Ca 0.03 -0.89 0.02 0.00 0.00 0.00 0.00 46.02 45.18 2k27 n GLY 63 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2k27 h ARG 64 N 0.00 0.02 0.00 1.61 3.08 -1.71 -3.43 114.38 113.94 2k27 h ARG 64 Ca 0.00 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2k27 h ARG 64 Cb 0.00 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2k27 h ARG 64 CO 0.00 0.01 0.00 2.48 -1.07 0.00 0.00 179.97 181.39 2k27 n TYR 65 N -5.45 -3.23 -3.17 3.04 4.11 -1.26 -4.95 117.16 106.25 2k27 n TYR 65 Ca 0.10 0.55 0.03 0.00 -0.00 0.00 0.00 57.90 58.58 2k27 n TYR 65 Cb 0.39 1.69 -0.00 0.00 -0.00 0.00 0.00 39.34 41.42 2k27 n TYR 65 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.86 177.57 2k27 s TYR 66 N -1.32 -1.77 1.02 -3.48 2.02 -1.26 -5.00 117.35 107.55 2k27 s TYR 66 Ca 0.00 0.71 -0.13 0.00 -0.37 0.00 0.00 57.07 57.29 2k27 s TYR 66 Cb 0.00 0.31 0.20 0.00 -0.40 0.00 0.00 41.96 42.07 2k27 s TYR 66 CO 0.00 -1.10 1.10 -1.21 -1.57 0.00 0.00 175.55 172.76 2k27 s GLU 67 N 2.41 0.27 -0.87 -0.62 2.02 -1.14 -4.87 118.70 115.90 2k27 s GLU 67 Ca 0.13 0.44 -0.08 0.00 0.02 0.00 0.00 54.97 55.48 2k27 s GLU 67 Cb -0.07 -1.72 -0.15 0.00 0.10 0.00 0.00 34.13 32.28 2k27 s GLU 67 CO -0.18 -2.82 3.22 0.25 0.02 0.00 0.00 175.26 175.75 2k27 n THR 68 N -4.23 3.76 0.00 3.63 -2.24 -1.26 -4.19 114.28 109.76 2k27 n THR 68 Ca 0.05 -2.20 0.00 0.00 -2.27 0.00 0.00 64.05 59.63 2k27 n THR 68 Cb 0.58 -2.29 0.00 0.00 -2.10 0.00 0.00 70.33 66.51 2k27 n THR 68 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2k27 n GLY 69 N 2.94 0.75 3.79 3.38 0.00 -1.26 -5.12 105.19 109.66 2k27 n GLY 69 Ca 0.62 -0.02 -0.31 0.00 0.00 0.00 0.00 46.02 46.30 2k27 n GLY 69 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k27 s SER 70 N -0.03 4.87 -1.21 1.61 0.01 -1.26 -4.23 113.70 113.45 2k27 s SER 70 Ca 0.00 1.76 -0.05 0.00 1.31 0.00 0.00 55.95 58.97 2k27 s SER 70 Cb 0.00 -2.51 0.01 0.00 0.21 0.00 0.00 66.02 63.72 2k27 s SER 70 CO 0.00 -1.79 1.04 -0.38 0.41 0.00 0.00 173.24 172.52 2k27 n ILE 71 N -3.30 -4.15 -3.58 1.44 5.41 -1.26 -2.88 119.36 111.04 2k27 n ILE 71 Ca 0.09 -0.22 -0.13 0.00 1.00 0.00 0.00 62.75 63.48 2k27 n ILE 71 Cb 0.53 -4.32 -0.06 0.00 -0.71 0.00 0.00 39.64 35.08 2k27 n ILE 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2k27 s ARG 72 N -5.79 0.77 0.40 0.38 1.70 -1.26 -3.97 118.95 111.18 2k27 s ARG 72 Ca 0.30 0.37 -0.23 0.00 -0.47 0.00 0.00 55.73 55.69 2k27 s ARG 72 Cb -0.13 0.37 -0.09 0.00 -0.57 0.00 0.00 34.95 34.52 2k27 s ARG 72 CO 0.69 -0.20 1.02 -1.25 -1.08 0.00 0.00 175.30 174.48 2k27 s PRO 73 N -0.71 4.19 -1.35 3.89 0.04 -1.26 -4.95 135.00 134.84 2k27 s PRO 73 Ca -0.04 1.42 -0.16 0.00 0.04 0.00 0.00 61.00 62.26 2k27 s PRO 73 Cb -0.02 -2.48 0.02 0.00 0.04 0.00 0.00 34.50 32.07 2k27 s PRO 73 CO 0.03 -0.10 2.09 0.41 0.04 0.00 0.00 177.00 179.46 2k27 n GLY 74 N 0.17 3.75 0.36 0.56 0.00 -1.26 -4.78 105.19 103.99 2k27 n GLY 74 Ca 0.05 -1.51 -0.00 0.00 0.00 0.00 0.00 46.02 44.56 2k27 n GLY 74 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2k27 h VAL 75 N 4.45 1.16 -2.80 1.61 3.04 -2.01 -3.39 116.25 118.31 2k27 h VAL 75 Ca 0.52 -0.42 -0.56 0.00 -1.01 0.00 0.00 66.70 65.23 2k27 h VAL 75 Cb 0.70 -0.17 -0.03 0.00 -2.01 0.00 0.00 31.29 29.79 2k27 h VAL 75 CO 1.78 0.22 1.09 -0.63 -1.01 0.00 0.00 177.57 179.03 2k27 s ILE 76 N -6.08 3.77 -5.00 3.17 -1.09 -1.26 -4.77 121.20 109.94 2k27 s ILE 76 Ca -0.13 0.89 0.00 0.00 -2.23 0.00 0.00 60.65 59.18 2k27 s ILE 76 Cb 0.19 -3.75 0.00 0.00 -1.58 0.00 0.00 42.46 37.32 2k27 s ILE 76 CO 0.81 -0.28 0.00 0.61 -1.23 0.00 0.00 174.94 174.86 2k27 n GLY 77 N 4.49 0.76 2.66 6.18 0.00 -1.26 -5.06 105.19 112.96 2k27 n GLY 77 Ca 0.18 -1.85 -0.03 0.00 0.00 0.00 0.00 46.02 44.31 2k27 n GLY 77 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k27 n GLY 78 N -0.21 -1.09 3.78 -0.02 0.00 -1.26 -5.15 105.19 101.24 2k27 n GLY 78 Ca 0.00 0.32 -0.37 0.00 0.00 0.00 0.00 46.02 45.97 2k27 n GLY 78 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k27 s SER 79 N -0.15 6.59 -0.59 1.61 0.01 -1.26 -5.02 113.70 114.89 2k27 s SER 79 Ca 0.09 2.18 0.06 0.00 1.31 0.00 0.00 55.95 59.59 2k27 s SER 79 Cb 0.14 -2.60 0.21 0.00 0.21 0.00 0.00 66.02 63.99 2k27 s SER 79 CO -0.08 -0.62 0.58 1.17 0.41 0.00 0.00 173.24 174.70 2k27 n LYS 80 N -0.07 1.70 0.21 12.44 4.81 -1.26 -4.87 118.16 131.12 2k27 n LYS 80 Ca 0.05 -4.17 0.08 0.00 -0.87 0.00 0.00 58.31 53.40 2k27 n LYS 80 Cb 0.48 -2.01 0.40 0.00 0.02 0.00 0.00 35.03 33.92 2k27 n LYS 80 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 2k27 h PRO 81 N 4.71 0.00 -3.52 1.64 0.13 -1.95 -3.45 132.00 129.56 2k27 h PRO 81 Ca 0.17 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 65.12 2k27 h PRO 81 Cb 0.76 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 31.65 2k27 h PRO 81 CO 0.67 0.27 -0.56 0.15 -0.23 0.00 0.00 178.00 178.31 2k27 s LYS 82 N -3.59 0.27 0.26 0.86 -0.14 -1.26 -5.09 119.74 111.04 2k27 s LYS 82 Ca 0.01 -0.10 -0.30 0.00 -1.36 0.00 0.00 55.97 54.22 2k27 s LYS 82 Cb 0.10 0.12 -0.10 0.00 -1.68 0.00 0.00 37.83 36.26 2k27 s LYS 82 CO 0.66 -0.05 1.47 0.08 -0.76 0.00 0.00 175.35 176.74 2k27 s VAL 83 N -0.56 2.54 0.41 3.17 1.01 -1.26 -4.92 120.40 120.79 2k27 s VAL 83 Ca -0.06 0.46 0.05 0.00 0.00 0.00 0.00 61.98 62.43 2k27 s VAL 83 Cb -0.04 -3.29 0.00 0.00 0.00 0.00 0.00 36.38 33.05 2k27 s VAL 83 CO 0.00 0.07 0.57 0.00 0.00 0.00 0.00 175.10 175.75 2k27 s ALA 84 N -0.03 4.22 -0.07 5.51 0.00 -1.26 -4.91 121.76 125.22 2k27 s ALA 84 Ca 0.60 -1.45 -0.22 0.00 0.00 0.00 0.00 51.96 50.88 2k27 s ALA 84 Cb -0.43 -1.78 0.05 0.00 0.00 0.00 0.00 23.12 20.96 2k27 s ALA 84 CO 0.44 -0.26 0.51 -0.08 0.00 0.00 0.00 175.76 176.37 2k27 s THR 85 N -2.37 0.02 0.49 0.00 -1.32 -1.26 -5.03 115.64 106.17 2k27 s THR 85 Ca 0.50 -0.17 0.41 0.00 -1.21 0.00 0.00 61.69 61.22 2k27 s THR 85 Cb -0.10 -0.80 0.41 0.00 -1.51 0.00 0.00 72.50 70.50 2k27 s THR 85 CO 0.34 -0.10 2.24 1.55 -2.21 0.00 0.00 174.62 176.44 2k27 h PRO 86 N 3.83 0.00 -0.19 7.08 0.13 -2.03 -1.96 132.00 138.86 2k27 h PRO 86 Ca -0.28 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.90 2k27 h PRO 86 Cb 1.16 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 2k27 h PRO 86 CO 0.34 0.00 0.19 -0.22 -0.23 0.00 0.00 178.00 178.08 2k27 h LYS 87 N 0.00 0.00 -0.76 0.86 1.63 -2.00 -1.10 116.57 115.21 2k27 h LYS 87 Ca 0.00 0.00 0.17 0.00 -0.85 0.00 0.00 60.65 59.97 2k27 h LYS 87 Cb 0.05 0.00 -0.11 0.00 -0.60 0.00 0.00 32.23 31.57 2k27 h LYS 87 CO 0.00 0.00 0.19 0.28 -3.45 0.00 0.00 179.45 176.47 2k27 h VAL 88 N 0.00 0.49 -0.60 2.00 2.07 -1.78 -0.22 116.25 118.21 2k27 h VAL 88 Ca 0.09 -0.09 0.01 0.00 0.82 0.00 0.00 66.70 67.53 2k27 h VAL 88 Cb 0.46 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.41 2k27 h VAL 88 CO -0.00 0.05 0.39 0.58 0.02 0.00 0.00 177.57 178.61 2k27 h VAL 89 N 0.27 1.15 -0.50 2.57 2.07 -1.42 -2.26 116.25 118.12 2k27 h VAL 89 Ca 0.43 -0.28 -0.04 0.00 0.82 0.00 0.00 66.70 67.64 2k27 h VAL 89 Cb 0.75 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 2k27 h VAL 89 CO -0.53 0.15 0.15 -0.33 0.02 0.00 0.00 177.57 177.03 2k27 h GLU 90 N 0.81 0.74 -0.38 1.57 5.08 -1.22 -2.24 114.58 118.94 2k27 h GLU 90 Ca 0.22 -0.13 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2k27 h GLU 90 Cb -0.09 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.02 2k27 h GLU 90 CO -0.05 0.65 0.23 0.87 -1.00 0.00 0.00 179.01 179.72 2k27 h LYS 91 N 0.73 0.52 -0.91 2.33 1.79 -0.54 0.78 116.57 121.26 2k27 h LYS 91 Ca 0.17 -0.05 0.11 0.00 -2.18 0.00 0.00 60.65 58.71 2k27 h LYS 91 Cb 0.23 -0.11 -0.08 0.00 -1.58 0.00 0.00 32.23 30.69 2k27 h LYS 91 CO -0.01 0.39 0.54 0.82 -1.08 0.00 0.00 179.45 180.11 2k27 h ILE 92 N 0.50 0.89 0.15 1.86 1.08 -1.09 -0.80 117.51 120.10 2k27 h ILE 92 Ca 0.14 -0.30 0.01 0.00 -0.39 0.00 0.00 64.86 64.32 2k27 h ILE 92 Cb 0.00 -0.05 -0.03 0.00 -3.07 0.00 0.00 36.82 33.67 2k27 h ILE 92 CO -0.03 0.16 -0.25 1.23 -0.69 0.00 0.00 178.15 178.58 2k27 h GLY 93 N 0.86 -0.48 0.70 5.37 0.00 -0.74 -2.91 103.07 105.88 2k27 h GLY 93 Ca 0.45 0.29 0.03 0.00 0.00 0.00 0.00 47.33 48.10 2k27 h GLY 93 CO -0.27 -0.22 -0.00 -0.55 0.00 0.00 0.00 176.54 175.50 2k27 h ASP 94 N -0.47 -0.08 -0.02 0.19 3.32 -0.09 -1.73 116.42 117.54 2k27 h ASP 94 Ca 0.02 0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.11 2k27 h ASP 94 Cb 0.48 0.08 -0.00 0.00 0.22 0.00 0.00 39.33 40.10 2k27 h ASP 94 CO -0.12 -0.02 0.00 -1.22 -1.72 0.00 0.00 179.24 176.17 2k27 n TYR 95 N -5.14 0.08 0.12 4.55 4.01 -0.38 -0.78 117.16 119.61 2k27 n TYR 95 Ca -0.03 -0.12 0.07 0.00 -0.16 0.00 0.00 57.90 57.67 2k27 n TYR 95 Cb 0.10 -0.14 -0.10 0.00 -0.31 0.00 0.00 39.34 38.89 2k27 n TYR 95 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2k27 n LYS 96 N 0.10 0.81 -0.08 -0.72 4.01 -0.66 -3.68 118.16 117.94 2k27 n LYS 96 Ca 0.01 -0.11 -0.14 0.00 -0.51 0.00 0.00 58.31 57.57 2k27 n LYS 96 Cb 0.33 -1.30 -0.09 0.00 -0.51 0.00 0.00 35.03 33.46 2k27 n LYS 96 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2k27 h ARG 97 N 0.00 0.00 0.00 1.97 3.08 -0.89 -3.42 114.38 115.12 2k27 h ARG 97 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2k27 h ARG 97 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.64 2k27 h ARG 97 CO 0.00 0.72 0.00 1.04 -1.07 0.00 0.00 179.97 180.66 2k27 n GLN 98 N -4.56 0.00 -1.55 0.04 1.13 0.04 -4.80 117.38 107.67 2k27 n GLN 98 Ca -0.17 0.47 -0.31 0.00 -1.94 0.00 0.00 57.00 55.05 2k27 n GLN 98 Cb 0.47 -1.15 0.06 0.00 0.11 0.00 0.00 30.24 29.72 2k27 n GLN 98 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 2k27 s ASN 99 N -2.55 5.27 0.90 1.08 -0.87 -1.24 -5.04 114.94 112.49 2k27 s ASN 99 Ca 0.00 1.61 0.00 0.00 -1.57 0.00 0.00 52.86 52.90 2k27 s ASN 99 Cb 0.00 -2.47 0.00 0.00 -0.02 0.00 0.00 41.25 38.76 2k27 s ASN 99 CO 0.00 -1.51 0.00 -0.81 -2.57 0.00 0.00 177.10 172.21 2k27 n PRO 100 N -3.17 -0.32 -1.42 -0.60 -0.04 -1.26 -3.54 135.00 124.64 2k27 n PRO 100 Ca 0.08 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.15 2k27 n PRO 100 Cb 0.54 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.98 2k27 n PRO 100 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2k27 n THR 101 N -2.04 3.60 -2.32 0.52 -2.24 -1.26 -4.47 114.28 106.06 2k27 n THR 101 Ca 0.00 -2.57 -0.26 0.00 -2.27 0.00 0.00 64.05 58.95 2k27 n THR 101 Cb 0.00 -2.55 0.13 0.00 -2.10 0.00 0.00 70.33 65.81 2k27 n THR 101 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 2k27 s MET 102 N 2.93 1.38 0.30 -0.78 -1.94 -1.26 -5.12 119.30 114.81 2k27 s MET 102 Ca 0.57 -0.78 0.04 0.00 -1.71 0.00 0.00 55.69 53.80 2k27 s MET 102 Cb 0.15 -2.15 -0.02 0.00 2.01 0.00 0.00 34.83 34.82 2k27 s MET 102 CO -0.06 -1.75 0.45 -0.06 -0.01 0.00 0.00 175.02 173.59 2k27 s PHE 103 N -3.41 3.38 0.62 -0.03 0.40 -1.26 -4.96 117.98 112.73 2k27 s PHE 103 Ca 0.68 0.05 0.30 0.00 -0.60 0.00 0.00 56.93 57.36 2k27 s PHE 103 Cb -0.05 -1.78 1.60 0.00 0.51 0.00 0.00 43.02 43.30 2k27 s PHE 103 CO 0.47 0.22 1.96 0.00 0.70 0.00 0.00 175.22 178.58 2k27 h ALA 104 N 0.96 1.75 -0.36 5.36 0.00 -1.89 -1.27 119.26 123.82 2k27 h ALA 104 Ca -0.50 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.47 2k27 h ALA 104 Cb 1.23 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.98 2k27 h ALA 104 CO 0.59 -0.46 -0.02 -1.49 0.00 0.00 0.00 179.25 177.87 2k27 h TRP 105 N 0.00 -0.06 0.24 0.00 -0.00 -1.95 -0.59 115.95 113.60 2k27 h TRP 105 Ca 0.10 0.03 -0.01 0.00 -0.00 0.00 0.00 58.89 59.01 2k27 h TRP 105 Cb 0.81 0.08 0.00 0.00 -0.00 0.00 0.00 29.16 30.05 2k27 h TRP 105 CO 0.00 -0.09 -0.12 1.49 -0.00 0.00 0.00 178.44 179.73 2k27 h GLU 106 N 0.08 -0.31 -0.97 0.49 4.57 -1.64 -3.34 114.58 113.46 2k27 h GLU 106 Ca 0.18 0.02 0.07 0.00 -1.18 0.00 0.00 59.36 58.45 2k27 h GLU 106 Cb 0.25 0.07 -0.07 0.00 -0.16 0.00 0.00 28.75 28.85 2k27 h GLU 106 CO -0.31 0.05 0.62 0.82 -1.18 0.00 0.00 179.01 179.02 2k27 h ILE 107 N -0.80 1.06 -0.04 2.32 1.08 -1.20 0.15 117.51 120.08 2k27 h ILE 107 Ca -0.03 -0.38 0.02 0.00 -0.39 0.00 0.00 64.86 64.08 2k27 h ILE 107 Cb 0.51 -0.13 -0.04 0.00 -3.07 0.00 0.00 36.82 34.09 2k27 h ILE 107 CO 0.05 0.20 -0.35 -0.09 -0.69 0.00 0.00 178.15 177.27 2k27 h ARG 108 N 1.10 -0.40 0.00 2.37 2.43 -1.28 -2.72 114.38 115.89 2k27 h ARG 108 Ca 0.42 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.62 2k27 h ARG 108 Cb 0.21 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.85 2k27 h ARG 108 CO -0.17 -0.26 0.00 -0.25 -1.51 0.00 0.00 179.97 177.78 2k27 n ASP 109 N -4.43 0.22 0.24 -3.80 9.92 -0.44 -2.70 116.55 115.56 2k27 n ASP 109 Ca -0.04 0.54 -0.16 0.00 -0.53 0.00 0.00 54.79 54.60 2k27 n ASP 109 Cb 0.25 -0.59 -0.08 0.00 -0.64 0.00 0.00 41.12 40.06 2k27 n ASP 109 CO 0.00 0.00 0.00 -0.09 0.13 0.00 0.00 177.20 177.24 2k27 h ARG 110 N 0.00 -0.53 -0.56 -1.24 1.12 -0.44 0.01 114.38 112.74 2k27 h ARG 110 Ca 0.00 0.04 0.10 0.00 -1.11 0.00 0.00 59.98 59.01 2k27 h ARG 110 Cb 0.36 0.12 -0.08 0.00 -0.01 0.00 0.00 29.97 30.36 2k27 h ARG 110 CO 0.00 -0.35 0.10 -0.07 -3.11 0.00 0.00 179.97 176.54 2k27 h LEU 111 N -0.55 -0.03 0.16 3.80 3.38 -1.48 -0.47 115.31 120.11 2k27 h LEU 111 Ca -0.06 0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 2k27 h LEU 111 Cb 0.42 0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.33 2k27 h LEU 111 CO 0.09 -0.00 -0.08 -0.07 0.09 0.00 0.00 178.44 178.47 2k27 h LEU 112 N 0.23 -0.18 -1.03 1.67 3.38 -1.55 -0.94 115.31 116.88 2k27 h LEU 112 Ca 0.29 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 58.06 2k27 h LEU 112 Cb 0.43 0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.18 2k27 h LEU 112 CO -0.39 0.11 0.62 0.00 0.09 0.00 0.00 178.44 178.87 2k27 h ALA 113 N 0.29 1.29 0.00 1.53 0.00 -0.88 -1.69 119.26 119.81 2k27 h ALA 113 Ca -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2k27 h ALA 113 Cb 0.38 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2k27 h ALA 113 CO 0.04 0.64 0.00 -1.91 0.00 0.00 0.00 179.25 178.02 2k27 n GLU 114 N -4.38 0.20 -2.38 0.00 2.13 -0.20 -4.91 120.64 111.11 2k27 n GLU 114 Ca 0.11 0.38 -0.05 0.00 0.66 0.00 0.00 57.16 58.26 2k27 n GLU 114 Cb 0.03 -1.85 0.01 0.00 0.27 0.00 0.00 31.44 29.89 2k27 n GLU 114 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2k27 n GLY 115 N 0.25 0.37 0.12 8.31 0.00 -0.63 -4.96 105.19 108.64 2k27 n GLY 115 Ca 0.03 -0.59 -0.17 0.00 0.00 0.00 0.00 46.02 45.29 2k27 n GLY 115 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2k27 h VAL 116 N -0.28 0.80 -3.07 1.61 2.07 -1.42 -3.49 116.25 112.48 2k27 h VAL 116 Ca -0.12 -2.53 -0.44 0.00 0.82 0.00 0.00 66.70 64.43 2k27 h VAL 116 Cb 1.08 2.55 -0.15 0.00 -1.52 0.00 0.00 31.29 33.25 2k27 h VAL 116 CO 0.13 0.77 -0.74 0.00 0.02 0.00 0.00 177.57 177.75 2k27 s ASP 118 N -3.12 4.31 0.52 0.00 2.15 -1.26 -4.64 116.67 114.63 2k27 s ASP 118 Ca 0.19 2.00 0.37 0.00 0.43 0.00 0.00 52.55 55.54 2k27 s ASP 118 Cb -0.01 -2.54 1.53 0.00 -0.30 0.00 0.00 42.92 41.59 2k27 s ASP 118 CO 0.06 -2.17 1.74 0.78 -0.17 0.00 0.00 175.17 175.41 2k27 h ASN 119 N -0.90 0.07 -4.08 -0.34 -0.26 -1.96 -3.32 115.58 104.80 2k27 h ASN 119 Ca -0.45 0.02 -0.35 0.00 -0.56 0.00 0.00 56.30 54.97 2k27 h ASN 119 Cb 1.25 0.01 -0.27 0.00 -1.06 0.00 0.00 38.32 38.25 2k27 h ASN 119 CO 0.50 -0.01 -0.76 1.51 -1.06 0.00 0.00 177.43 177.61 2k27 s ASP 120 N -4.87 0.86 0.44 5.81 -4.77 -1.26 -3.36 116.67 109.52 2k27 s ASP 120 Ca -0.06 -0.20 0.00 0.00 -3.30 0.00 0.00 52.55 49.00 2k27 s ASP 120 Cb 0.25 -0.08 0.00 0.00 -1.09 0.00 0.00 42.92 42.00 2k27 s ASP 120 CO 0.82 0.05 0.00 0.35 0.70 0.00 0.00 175.17 177.09 2k27 n THR 121 N 2.67 0.00 -1.75 2.11 -2.24 -1.25 -4.84 114.28 108.99 2k27 n THR 121 Ca -0.15 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.25 2k27 n THR 121 Cb 0.57 -0.14 0.04 0.00 -2.10 0.00 0.00 70.33 68.70 2k27 n THR 121 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 2k27 n VAL 122 N -3.49 3.74 -0.97 2.28 0.24 -1.26 -4.69 118.33 114.19 2k27 n VAL 122 Ca 0.00 -0.50 -0.18 0.00 -2.04 0.00 0.00 64.34 61.62 2k27 n VAL 122 Cb 0.00 -1.69 0.15 0.00 -1.47 0.00 0.00 33.84 30.83 2k27 n VAL 122 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 2k27 n PRO 123 N -0.94 -2.01 -0.03 7.34 -0.04 -1.26 -4.88 135.00 133.18 2k27 n PRO 123 Ca 0.10 -1.09 -0.01 0.00 -0.04 0.00 0.00 63.50 62.45 2k27 n PRO 123 Cb 0.44 -0.96 -0.00 0.00 -0.04 0.00 0.00 33.50 32.94 2k27 n PRO 123 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2k27 n SER 124 N -4.01 0.02 0.12 3.54 7.64 -1.26 -4.79 113.62 114.88 2k27 n SER 124 Ca 0.09 0.02 0.05 0.00 1.01 0.00 0.00 58.87 60.04 2k27 n SER 124 Cb 0.35 -0.02 0.48 0.00 -1.01 0.00 0.00 64.21 64.02 2k27 n SER 124 CO 0.00 0.00 0.00 1.62 -3.01 0.00 0.00 175.04 173.65 2k27 h VAL 125 N 0.12 1.10 0.00 0.44 3.04 -1.95 0.18 116.25 119.18 2k27 h VAL 125 Ca -0.01 -0.33 -0.03 0.00 -1.01 0.00 0.00 66.70 65.33 2k27 h VAL 125 Cb 0.03 0.90 -0.00 0.00 -2.01 0.00 0.00 31.29 30.21 2k27 h VAL 125 CO 0.02 0.12 -0.14 -1.28 -1.01 0.00 0.00 177.57 175.28 2k27 h SER 126 N 0.26 0.00 0.04 3.17 0.87 -1.97 -1.35 113.55 114.58 2k27 h SER 126 Ca 0.07 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.54 2k27 h SER 126 Cb 0.11 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.07 2k27 h SER 126 CO -0.00 0.14 -0.42 -1.28 -0.53 0.00 0.00 176.83 174.74 2k27 h SER 127 N 0.00 0.14 0.13 6.23 0.87 -1.31 -2.93 113.55 116.67 2k27 h SER 127 Ca -0.00 -0.93 -0.02 0.00 -1.23 0.00 0.00 61.79 59.61 2k27 h SER 127 Cb 0.42 -0.04 -0.00 0.00 -0.44 0.00 0.00 62.40 62.33 2k27 h SER 127 CO 0.02 1.19 -0.11 0.16 -0.53 0.00 0.00 176.83 177.56 2k27 h ILE 128 N -0.81 0.97 -0.31 2.23 3.07 -1.44 -0.19 117.51 121.04 2k27 h ILE 128 Ca -0.09 -0.38 0.00 0.00 1.55 0.00 0.00 64.86 65.94 2k27 h ILE 128 Cb 1.23 1.21 -0.02 0.00 -0.27 0.00 0.00 36.82 38.98 2k27 h ILE 128 CO 0.02 0.10 0.19 -1.13 -1.05 0.00 0.00 178.15 176.28 2k27 h ASN 129 N 0.00 0.36 -0.08 2.16 -0.00 -1.28 -2.94 115.58 113.79 2k27 h ASN 129 Ca -0.00 -0.01 0.02 0.00 -0.00 0.00 0.00 56.30 56.31 2k27 h ASN 129 Cb 0.20 -0.09 -0.00 0.00 -0.00 0.00 0.00 38.32 38.43 2k27 h ASN 129 CO 0.01 0.27 0.10 0.08 -0.00 0.00 0.00 177.43 177.89 2k27 h ARG 130 N 0.42 0.00 0.53 6.67 0.11 -0.83 -0.33 114.38 120.95 2k27 h ARG 130 Ca 0.11 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.17 2k27 h ARG 130 Cb -0.03 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.06 2k27 h ARG 130 CO -0.02 0.00 -0.26 0.82 0.10 0.00 0.00 179.97 180.61 2k27 h ILE 131 N 0.00 0.48 -0.82 0.08 5.03 -1.63 -0.25 117.51 120.38 2k27 h ILE 131 Ca 0.04 -0.01 0.13 0.00 -0.12 0.00 0.00 64.86 64.90 2k27 h ILE 131 Cb 0.23 0.48 -0.09 0.00 -3.03 0.00 0.00 36.82 34.41 2k27 h ILE 131 CO -0.00 0.00 0.43 0.40 -0.68 0.00 0.00 178.15 178.30 2k27 h ILE 132 N -0.72 0.79 0.05 -0.67 5.03 -1.25 -1.46 117.51 119.28 2k27 h ILE 132 Ca -0.07 -0.23 -0.00 0.00 -0.12 0.00 0.00 64.86 64.44 2k27 h ILE 132 Cb 0.55 0.07 0.00 0.00 -3.03 0.00 0.00 36.82 34.41 2k27 h ILE 132 CO 0.12 0.12 -0.03 0.03 -0.68 0.00 0.00 178.15 177.72 2k27 h ARG 133 N 0.66 -0.07 -0.14 2.37 3.08 -1.12 0.67 114.38 119.83 2k27 h ARG 133 Ca 0.43 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.47 2k27 h ARG 133 Cb 0.54 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.59 2k27 h ARG 133 CO -0.32 0.05 -0.00 1.79 -1.07 0.00 0.00 179.97 180.41 2k27 h THR 134 N -0.17 1.09 0.00 2.04 1.35 -0.57 -0.49 112.91 116.16 2k27 h THR 134 Ca -0.01 -0.36 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 2k27 h THR 134 Cb 0.15 1.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.56 2k27 h THR 134 CO 0.01 0.12 0.00 0.29 -0.25 0.00 0.00 175.52 175.69 2k27 n LYS 135 N -4.42 0.00 -3.41 4.72 4.01 -0.59 -4.82 118.16 113.65 2k27 n LYS 135 Ca -0.01 0.39 -0.26 0.00 -0.51 0.00 0.00 58.31 57.92 2k27 n LYS 135 Cb 0.16 -1.13 -0.11 0.00 -0.51 0.00 0.00 35.03 33.44 2k27 n LYS 135 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 2k27 s VAL 136 N -1.64 0.08 0.59 -0.18 1.01 0.21 -5.10 120.40 115.36 2k27 s VAL 136 Ca 0.00 -1.79 -0.14 0.00 0.00 0.00 0.00 61.98 60.05 2k27 s VAL 136 Cb 0.00 -1.05 -0.05 0.00 0.00 0.00 0.00 36.38 35.29 2k27 s VAL 136 CO 0.00 -0.96 1.02 0.00 0.00 0.00 0.00 175.10 175.16 2k27 s GLN 137 N 0.90 3.55 -0.44 2.72 -2.07 -0.20 -4.55 119.66 119.57 2k27 s GLN 137 Ca 0.21 0.97 0.08 0.00 -1.82 0.00 0.00 55.36 54.80 2k27 s GLN 137 Cb -0.15 -2.07 0.26 0.00 -1.09 0.00 0.00 33.01 29.95 2k27 s GLN 137 CO -0.04 -0.60 0.58 1.04 -1.32 0.00 0.00 175.29 174.95 2k27 n GLN 138 N -2.20 1.13 -1.85 9.60 6.02 -1.26 -5.07 117.38 123.75 2k27 n GLN 138 Ca 0.07 -3.55 -0.33 0.00 -0.01 0.00 0.00 57.00 53.18 2k27 n GLN 138 Cb 0.54 -1.47 0.03 0.00 1.02 0.00 0.00 30.24 30.37 2k27 n GLN 138 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2k27 s PRO 139 N -1.55 2.97 0.10 -1.09 0.04 -1.26 -5.05 135.00 129.16 2k27 s PRO 139 Ca 0.37 1.33 0.05 0.00 0.04 0.00 0.00 61.00 62.79 2k27 s PRO 139 Cb 0.18 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.70 2k27 s PRO 139 CO -0.09 -1.10 -0.00 -0.06 0.04 0.00 0.00 177.00 175.79 2k27 s PHE 140 N -2.37 2.98 0.67 0.56 0.08 -1.26 -5.11 117.98 113.52 2k27 s PHE 140 Ca 0.66 -0.04 -0.15 0.00 0.12 0.00 0.00 56.93 57.52 2k27 s PHE 140 Cb -0.19 -1.52 0.00 0.00 -0.57 0.00 0.00 43.02 40.74 2k27 s PHE 140 CO 0.40 0.48 1.11 1.21 -0.10 0.00 0.00 175.22 178.32 2k27 s ASN 141 N -2.37 5.05 -0.66 1.36 2.47 -1.26 -5.03 114.94 114.50 2k27 s ASN 141 Ca 0.26 2.01 0.03 0.00 0.42 0.00 0.00 52.86 55.57 2k27 s ASN 141 Cb -0.11 -2.55 0.16 0.00 -1.45 0.00 0.00 41.25 37.30 2k27 s ASN 141 CO 0.18 -1.67 0.46 -0.22 -3.72 0.00 0.00 177.10 172.13 2k27 s LEU 142 N -4.91 4.83 0.35 3.21 2.96 -1.26 -5.11 118.68 118.75 2k27 s LEU 142 Ca 0.67 -3.45 -0.26 0.00 -0.22 0.00 0.00 54.13 50.87 2k27 s LEU 142 Cb -0.21 -1.71 -0.09 0.00 0.50 0.00 0.00 46.19 44.69 2k27 s LEU 142 CO 0.42 -0.18 1.08 -2.16 -1.32 0.00 0.00 176.35 174.19 2k27 s PRO 143 N -0.90 4.34 -0.28 0.98 0.04 -1.26 -5.02 135.00 132.90 2k27 s PRO 143 Ca 0.22 1.66 -0.20 0.00 0.04 0.00 0.00 61.00 62.72 2k27 s PRO 143 Cb -0.14 -2.82 -0.02 0.00 0.04 0.00 0.00 34.50 31.57 2k27 s PRO 143 CO -0.09 -0.02 0.60 1.41 0.04 0.00 0.00 177.00 178.94 2k27 s MET 144 N -2.05 4.00 0.39 4.56 1.75 -1.26 -5.07 119.30 121.62 2k27 s MET 144 Ca 0.52 0.38 -0.23 0.00 -1.25 0.00 0.00 55.69 55.11 2k27 s MET 144 Cb -0.27 -3.69 -0.10 0.00 2.84 0.00 0.00 34.83 33.61 2k27 s MET 144 CO 0.34 -0.47 0.96 0.34 -0.65 0.00 0.00 175.02 175.54 2k27 s ASP 145 N 1.56 7.03 0.06 1.11 2.15 -1.26 -5.08 116.67 122.24 2k27 s ASP 145 Ca 0.25 1.79 -0.11 0.00 0.43 0.00 0.00 52.55 54.90 2k27 s ASP 145 Cb -0.15 -2.56 0.01 0.00 -0.30 0.00 0.00 42.92 39.92 2k27 s ASP 145 CO 0.10 -0.29 0.25 -0.44 -0.17 0.00 0.00 175.17 174.61 2k27 s SER 146 N -1.90 -0.02 0.03 -0.34 0.01 -1.26 -5.18 113.70 105.03 2k27 s SER 146 Ca 0.58 -0.38 -0.29 0.00 1.31 0.00 0.00 55.95 57.17 2k27 s SER 146 Cb -0.14 0.34 0.10 0.00 0.21 0.00 0.00 66.02 66.53 2k27 s SER 146 CO 0.19 -0.65 1.07 -0.83 0.41 0.00 0.00 173.24 173.43 2k27 s GLY 147 N -2.35 -0.34 0.30 3.44 0.00 -1.26 -5.16 107.32 101.94 2k27 s GLY 147 Ca -0.02 0.67 -0.29 0.00 0.00 0.00 0.00 44.72 45.09 2k27 s GLY 147 CO -0.06 0.18 1.07 0.00 0.00 0.00 0.00 173.10 174.29 2k27 s ALA 148 N -2.89 3.35 0.72 3.20 0.00 -1.26 -5.04 121.76 119.83 2k27 s ALA 148 Ca 0.11 0.83 -0.11 0.00 0.00 0.00 0.00 51.96 52.79 2k27 s ALA 148 Cb 0.01 -3.30 0.02 0.00 0.00 0.00 0.00 23.12 19.84 2k27 s ALA 148 CO -0.03 -0.13 1.07 -1.25 0.00 0.00 0.00 175.76 175.43 2k27 s PRO 149 N -1.59 2.75 0.78 0.00 0.04 -1.26 -5.08 135.00 130.64 2k27 s PRO 149 Ca 0.46 0.81 -0.05 0.00 0.04 0.00 0.00 61.00 62.26 2k27 s PRO 149 Cb -0.30 -1.98 0.14 0.00 0.04 0.00 0.00 34.50 32.40 2k27 s PRO 149 CO 0.38 -1.19 1.08 0.20 0.04 0.00 0.00 177.00 177.51 2k27 s GLY 150 N -3.90 1.76 0.00 0.56 0.00 -1.26 -5.12 107.32 99.36 2k27 s GLY 150 Ca 0.59 -1.51 0.00 0.00 0.00 0.00 0.00 44.72 43.80 2k27 s GLY 150 CO 0.54 -0.90 0.00 0.61 0.00 0.00 0.00 173.10 173.35 2k27 n GLY 151 N -3.09 -1.23 3.61 0.20 0.00 -1.26 -5.20 105.19 98.22 2k27 n GLY 151 Ca 0.14 -0.93 -0.03 0.00 0.00 0.00 0.00 46.02 45.20 2k27 n GLY 151 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2k27 s GLY 152 N 0.00 -0.35 -0.30 -0.02 0.00 -1.26 -5.14 107.32 100.26 2k27 s GLY 152 Ca 0.00 1.13 0.06 0.00 0.00 0.00 0.00 44.72 45.91 2k27 s GLY 152 CO 0.00 0.34 0.58 -0.56 0.00 0.00 0.00 173.10 173.46 2k27 s SER 153 N -2.53 -1.52 -0.00 1.64 0.01 -1.26 -5.16 113.70 104.88 2k27 s SER 153 Ca 0.11 0.06 0.02 0.00 1.31 0.00 0.00 55.95 57.44 2k27 s SER 153 Cb 0.01 1.98 -0.01 0.00 0.21 0.00 0.00 66.02 68.21 2k27 s SER 153 CO -0.04 -0.29 -0.05 -1.00 0.41 0.00 0.00 173.24 172.26 2k27 s HIS 154 N 2.71 0.48 0.16 2.43 3.76 -1.26 -5.16 115.29 118.41 2k27 s HIS 154 Ca 0.11 -0.12 -0.09 0.00 -0.15 0.00 0.00 55.06 54.80 2k27 s HIS 154 Cb -0.10 -0.30 -0.01 0.00 1.11 0.00 0.00 32.58 33.29 2k27 s HIS 154 CO -0.24 -0.01 0.29 -1.01 -0.85 0.00 0.00 174.74 172.91 2k27 s HIS 155 N -0.21 0.33 0.02 1.40 3.76 -1.26 -5.18 115.29 114.15 2k27 s HIS 155 Ca 0.01 -0.70 -0.06 0.00 -0.15 0.00 0.00 55.06 54.16 2k27 s HIS 155 Cb -0.03 -0.03 -0.01 0.00 1.11 0.00 0.00 32.58 33.63 2k27 s HIS 155 CO -0.00 -0.71 0.11 -1.58 -0.85 0.00 0.00 174.74 171.71 2k27 s HIS 156 N -3.95 0.13 0.83 1.40 2.46 -1.26 -5.17 115.29 109.73 2k27 s HIS 156 Ca 0.15 -0.33 -0.11 0.00 0.47 0.00 0.00 55.06 55.24 2k27 s HIS 156 Cb 0.03 -0.10 0.09 0.00 -0.13 0.00 0.00 32.58 32.48 2k27 s HIS 156 CO -0.02 -0.32 1.09 -3.38 -2.47 0.00 0.00 174.74 169.64 2k27 s HIS 157 N -2.00 2.54 -0.87 3.88 -3.43 -1.26 -4.95 115.29 109.20 2k27 s HIS 157 Ca -0.10 1.32 -0.25 0.00 -0.80 0.00 0.00 55.06 55.24 2k27 s HIS 157 Cb -0.05 -3.10 0.02 0.00 -1.43 0.00 0.00 32.58 28.02 2k27 s HIS 157 CO -0.02 -2.04 1.54 -1.58 -2.00 0.00 0.00 174.74 170.64 2k27 s HIS 158 N -2.98 2.23 -2.00 0.38 2.46 -1.26 -5.37 115.29 108.75 2k27 s HIS 158 Ca 0.62 -0.16 0.22 0.00 0.47 0.00 0.00 55.06 56.21 2k27 s HIS 158 Cb -0.17 -4.49 1.34 0.00 -0.13 0.00 0.00 32.58 29.13 2k27 s HIS 158 CO 0.56 -1.99 1.71 1.58 -2.47 0.00 0.00 174.74 174.13