#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 3.91 0.10 0.03 0.04 -1.26 -5.04 135.00 132.78 2k27 s PRO 2 Ca 0.00 1.52 -0.26 0.00 0.04 0.00 0.00 61.00 62.30 2k27 s PRO 2 Cb 0.00 -2.33 0.08 0.00 0.04 0.00 0.00 34.50 32.29 2k27 s PRO 2 CO 0.00 -0.37 0.95 -3.38 0.04 0.00 0.00 177.00 174.24 2k27 s HIS 3 N -1.75 -0.19 -0.09 0.56 -3.43 -1.26 -5.19 115.29 103.94 2k27 s HIS 3 Ca 0.63 -0.07 -0.28 0.00 -0.80 0.00 0.00 55.06 54.55 2k27 s HIS 3 Cb -0.21 0.61 0.06 0.00 -1.43 0.00 0.00 32.58 31.61 2k27 s HIS 3 CO 0.26 -0.73 0.64 0.54 -2.00 0.00 0.00 174.74 173.45 2k27 s ASN 4 N -2.82 -0.62 -0.43 7.38 2.20 -1.26 -5.09 114.94 114.30 2k27 s ASN 4 Ca 0.10 0.78 0.10 0.00 -0.94 0.00 0.00 52.86 52.90 2k27 s ASN 4 Cb -0.01 0.68 0.38 0.00 -2.00 0.00 0.00 41.25 40.30 2k27 s ASN 4 CO -0.01 -0.52 0.90 -1.54 -2.94 0.00 0.00 177.10 173.00 2k27 n SER 5 N 1.32 2.64 -3.45 3.54 3.41 -1.26 -4.97 113.62 114.85 2k27 n SER 5 Ca -0.18 -3.26 -0.40 0.00 -0.26 0.00 0.00 58.87 54.77 2k27 n SER 5 Cb 0.57 -0.56 -0.02 0.00 -0.26 0.00 0.00 64.21 63.94 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 -0.07 4.49 -3.93 -1.33 2.08 -1.26 -4.80 119.36 114.54 2k27 n ILE 6 Ca 0.26 -3.26 -0.29 0.00 0.56 0.00 0.00 62.75 60.02 2k27 n ILE 6 Cb 0.62 -2.44 -0.16 0.00 -0.75 0.00 0.00 39.64 36.90 2k27 n ILE 6 CO 0.00 0.00 0.00 -0.13 0.56 0.00 0.00 176.55 176.98 2k27 s ARG 7 N 1.20 1.68 -0.13 0.38 3.00 -1.26 -5.13 118.95 118.70 2k27 s ARG 7 Ca 0.61 -0.52 -0.07 0.00 0.00 0.00 0.00 55.73 55.75 2k27 s ARG 7 Cb 0.17 -1.99 0.05 0.00 0.00 0.00 0.00 34.95 33.18 2k27 s ARG 7 CO -0.07 -0.36 0.32 -1.54 0.00 0.00 0.00 175.30 173.64 2k27 s SER 8 N 1.59 -0.37 0.85 0.23 1.04 -1.26 -5.16 113.70 110.62 2k27 s SER 8 Ca 0.02 0.68 -0.11 0.00 0.48 0.00 0.00 55.95 57.02 2k27 s SER 8 Cb -0.14 0.57 0.10 0.00 0.10 0.00 0.00 66.02 66.65 2k27 s SER 8 CO -0.08 -0.18 1.09 -0.83 0.98 0.00 0.00 173.24 174.22 2k27 s GLY 9 N 1.30 1.62 -0.04 7.32 0.00 -1.26 -5.08 107.32 111.18 2k27 s GLY 9 Ca -0.09 -0.10 -0.29 0.00 0.00 0.00 0.00 44.72 44.23 2k27 s GLY 9 CO -0.10 0.36 0.92 -2.38 0.00 0.00 0.00 173.10 171.90 2k27 s HIS 10 N -3.01 -0.34 0.00 1.90 -3.43 -1.26 -5.19 115.29 103.96 2k27 s HIS 10 Ca 0.62 0.26 0.00 0.00 -0.80 0.00 0.00 55.06 55.15 2k27 s HIS 10 Cb -0.17 0.52 0.00 0.00 -1.43 0.00 0.00 32.58 31.51 2k27 s HIS 10 CO 0.56 -0.50 0.00 0.41 -2.00 0.00 0.00 174.74 173.21 2k27 n GLY 11 N -0.10 0.73 2.74 -1.38 0.00 -1.26 -5.11 105.19 100.80 2k27 n GLY 11 Ca -0.08 -0.75 -0.08 0.00 0.00 0.00 0.00 46.02 45.10 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 0.00 0.12 3.18 -0.02 0.00 -1.26 -5.07 105.19 102.14 2k27 n GLY 12 Ca 0.00 0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 2k27 n GLY 12 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2k27 n LEU 13 N 1.49 5.51 -4.89 0.99 7.99 -1.26 -4.95 117.00 121.88 2k27 n LEU 13 Ca 0.09 -3.85 -0.30 0.00 -0.01 0.00 0.00 56.01 51.94 2k27 n LEU 13 Cb 0.64 -1.65 0.05 0.00 -0.11 0.00 0.00 43.42 42.35 2k27 n LEU 13 CO 0.04 0.34 0.74 0.54 -1.51 0.00 0.00 177.39 177.53 2k27 s ASN 14 N 4.06 5.39 0.05 -1.43 2.20 -1.26 -5.12 114.94 118.83 2k27 s ASN 14 Ca 0.53 1.07 -0.01 0.00 -0.94 0.00 0.00 52.86 53.50 2k27 s ASN 14 Cb 0.09 -1.86 -0.04 0.00 -2.00 0.00 0.00 41.25 37.44 2k27 s ASN 14 CO 0.02 -1.36 -0.02 -1.10 -2.94 0.00 0.00 177.10 171.69 2k27 s GLN 15 N -5.35 0.61 0.05 3.55 -0.21 -1.26 -5.14 119.66 111.92 2k27 s GLN 15 Ca 0.58 -1.20 -0.31 0.00 0.02 0.00 0.00 55.36 54.45 2k27 s GLN 15 Cb -0.11 0.21 -0.06 0.00 1.00 0.00 0.00 33.01 34.05 2k27 s GLN 15 CO 0.51 -0.12 1.37 -1.17 -2.12 0.00 0.00 175.29 173.77 2k27 s LEU 16 N -2.90 4.34 -0.30 2.90 2.96 -1.26 -5.01 118.68 119.42 2k27 s LEU 16 Ca 0.07 2.18 -0.25 0.00 -0.22 0.00 0.00 54.13 55.91 2k27 s LEU 16 Cb 0.08 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.20 2k27 s LEU 16 CO -0.10 -0.66 0.87 -0.83 -1.32 0.00 0.00 176.35 174.31 2k27 s GLY 17 N 1.48 1.67 -1.42 7.98 0.00 -1.26 -4.97 107.32 110.80 2k27 s GLY 17 Ca 0.63 -0.30 -0.12 0.00 0.00 0.00 0.00 44.72 44.94 2k27 s GLY 17 CO 0.28 1.89 2.51 0.61 0.00 0.00 0.00 173.10 178.39 2k27 n GLY 18 N 4.06 4.06 0.00 0.20 0.00 -1.26 -4.91 105.19 107.34 2k27 n GLY 18 Ca 0.06 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.63 2k27 n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k27 n ALA 19 N 4.94 0.00 -2.22 4.61 0.00 -1.26 -4.73 120.51 121.85 2k27 n ALA 19 Ca 0.63 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 54.03 2k27 n ALA 19 Cb 0.30 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.72 2k27 n ALA 19 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2k27 n PHE 20 N -1.30 -2.92 -3.49 0.00 7.35 -1.26 -4.54 117.46 111.30 2k27 n PHE 20 Ca 0.00 1.65 -0.20 0.00 -0.76 0.00 0.00 57.45 58.14 2k27 n PHE 20 Cb 0.00 -3.11 0.06 0.00 0.35 0.00 0.00 39.48 36.78 2k27 n PHE 20 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 2k27 n VAL 21 N 1.02 -6.43 -3.29 -2.13 0.31 -1.26 -5.00 118.33 101.55 2k27 n VAL 21 Ca -0.24 -0.80 -0.09 0.00 -0.01 0.00 0.00 64.34 63.20 2k27 n VAL 21 Cb 0.38 -4.99 -0.05 0.00 -0.91 0.00 0.00 33.84 28.27 2k27 n VAL 21 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 2k27 s ASN 22 N -3.98 -0.03 0.00 4.52 0.01 -1.26 -4.94 114.94 109.26 2k27 s ASN 22 Ca 0.19 -1.19 0.00 0.00 -0.71 0.00 0.00 52.86 51.15 2k27 s ASN 22 Cb -0.04 1.18 0.00 0.00 0.41 0.00 0.00 41.25 42.81 2k27 s ASN 22 CO 0.77 -0.22 0.00 0.61 -1.51 0.00 0.00 177.10 176.75 2k27 n GLY 23 N 4.36 1.61 0.28 0.66 0.00 -1.26 -4.80 105.19 106.04 2k27 n GLY 23 Ca 0.11 -0.09 -0.00 0.00 0.00 0.00 0.00 46.02 46.03 2k27 n GLY 23 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2k27 h ARG 24 N 0.00 -0.03 -5.44 1.61 2.43 -1.97 -3.25 114.38 107.73 2k27 h ARG 24 Ca 0.00 0.00 -0.64 0.00 -0.81 0.00 0.00 59.98 58.53 2k27 h ARG 24 Cb 0.00 0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 29.49 2k27 h ARG 24 CO 0.00 -0.02 2.24 -0.35 -1.51 0.00 0.00 179.97 180.33 2k27 n PRO 25 N -5.46 2.90 0.12 0.20 -0.04 -1.26 -4.15 135.00 127.30 2k27 n PRO 25 Ca 0.08 -3.02 0.00 0.00 -0.04 0.00 0.00 63.50 60.52 2k27 n PRO 25 Cb 0.36 -3.47 0.00 0.00 -0.04 0.00 0.00 33.50 30.35 2k27 n PRO 25 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2k27 n LEU 26 N 8.67 -1.09 0.00 1.53 7.94 -1.23 -4.86 117.00 127.96 2k27 n LEU 26 Ca 0.49 0.43 -0.12 0.00 -1.11 0.00 0.00 56.01 55.70 2k27 n LEU 26 Cb 0.45 1.17 0.10 0.00 0.53 0.00 0.00 43.42 45.67 2k27 n LEU 26 CO 0.79 -0.44 0.25 -0.81 -1.11 0.00 0.00 177.39 176.07 2k27 n PRO 27 N -3.15 -1.91 -0.25 1.96 -0.04 -1.26 -4.18 135.00 126.17 2k27 n PRO 27 Ca 0.00 -0.72 0.12 0.00 -0.04 0.00 0.00 63.50 62.86 2k27 n PRO 27 Cb 0.00 -0.68 0.24 0.00 -0.04 0.00 0.00 33.50 33.02 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 -2.89 -0.06 0.28 0.54 4.71 -1.26 -0.91 120.64 121.05 2k27 n GLU 28 Ca 0.06 1.08 0.15 0.00 -0.01 0.00 0.00 57.16 58.44 2k27 n GLU 28 Cb 0.24 -1.73 0.78 0.00 -1.01 0.00 0.00 31.44 29.72 2k27 n GLU 28 CO 0.00 0.00 0.00 -0.24 0.09 0.00 0.00 177.13 176.98 2k27 h VAL 29 N 0.00 0.00 -0.98 2.62 3.04 -1.90 -2.17 116.25 116.86 2k27 h VAL 29 Ca 0.46 0.00 0.27 0.00 -1.01 0.00 0.00 66.70 66.42 2k27 h VAL 29 Cb 0.99 0.64 -0.13 0.00 -2.01 0.00 0.00 31.29 30.77 2k27 h VAL 29 CO -0.67 0.00 0.54 1.62 -1.01 0.00 0.00 177.57 178.05 2k27 h VAL 30 N 0.00 0.43 -0.28 1.51 3.04 -1.23 0.43 116.25 120.14 2k27 h VAL 30 Ca 0.00 -0.15 0.06 0.00 -1.01 0.00 0.00 66.70 65.60 2k27 h VAL 30 Cb 0.44 -0.05 -0.08 0.00 -2.01 0.00 0.00 31.29 29.59 2k27 h VAL 30 CO 0.00 0.08 -0.32 -0.09 -1.01 0.00 0.00 177.57 176.23 2k27 h ARG 31 N 0.45 -0.30 0.00 4.17 2.43 -1.64 -1.66 114.38 117.83 2k27 h ARG 31 Ca 0.66 0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.77 2k27 h ARG 31 Cb 1.36 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.96 2k27 h ARG 31 CO -0.54 -0.20 -0.40 1.96 -1.51 0.00 0.00 179.97 179.28 2k27 h GLN 32 N -0.31 0.00 -0.49 0.20 1.08 -1.36 -3.13 115.11 111.10 2k27 h GLN 32 Ca 0.14 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.28 2k27 h GLN 32 Cb 0.54 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.95 2k27 h GLN 32 CO -0.45 0.40 0.06 0.00 -0.95 0.00 0.00 178.83 177.89 2k27 h ARG 33 N 0.00 0.82 -0.19 1.46 2.47 -0.57 0.35 114.38 118.72 2k27 h ARG 33 Ca -0.00 -0.23 0.05 0.00 -1.26 0.00 0.00 59.98 58.54 2k27 h ARG 33 Cb 1.24 -0.09 -0.05 0.00 -1.65 0.00 0.00 29.97 29.42 2k27 h ARG 33 CO 0.05 0.83 -0.12 0.82 0.56 0.00 0.00 179.97 182.11 2k27 h ILE 34 N 0.69 0.64 0.82 2.04 2.04 -1.30 -0.69 117.51 121.75 2k27 h ILE 34 Ca 0.15 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.97 2k27 h ILE 34 Cb 0.41 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 37.14 2k27 h ILE 34 CO 0.01 0.00 -0.42 0.58 0.00 0.00 0.00 178.15 178.32 2k27 h VAL 35 N -0.12 0.14 -0.43 1.67 2.07 -1.46 -0.76 116.25 117.37 2k27 h VAL 35 Ca 0.11 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.69 2k27 h VAL 35 Cb 0.28 0.14 -0.05 0.00 -1.52 0.00 0.00 31.29 30.14 2k27 h VAL 35 CO -0.26 0.00 0.12 -0.78 0.02 0.00 0.00 177.57 176.67 2k27 h ASP 36 N -1.14 0.09 0.73 0.57 3.58 -0.89 0.04 116.42 119.40 2k27 h ASP 36 Ca -0.11 0.06 -0.04 0.00 0.42 0.00 0.00 57.03 57.36 2k27 h ASP 36 Cb 0.89 0.06 0.01 0.00 1.72 0.00 0.00 39.33 42.01 2k27 h ASP 36 CO 0.16 0.08 -0.35 0.25 -2.88 0.00 0.00 179.24 176.51 2k27 h LEU 37 N 0.27 -0.83 -1.43 2.28 5.85 -1.12 -3.18 115.31 117.15 2k27 h LEU 37 Ca 0.20 0.00 0.14 0.00 0.84 0.00 0.00 57.88 59.07 2k27 h LEU 37 Cb 0.22 0.21 -0.06 0.00 0.37 0.00 0.00 40.66 41.41 2k27 h LEU 37 CO -0.23 -0.51 0.54 0.00 -0.34 0.00 0.00 178.44 177.89 2k27 h ALA 38 N -0.95 1.96 -0.95 1.25 0.00 -0.92 -2.61 119.26 117.04 2k27 h ALA 38 Ca -0.10 0.01 0.17 0.00 0.00 0.00 0.00 54.91 54.99 2k27 h ALA 38 Cb 0.77 -0.10 -0.10 0.00 0.00 0.00 0.00 17.79 18.36 2k27 h ALA 38 CO 0.16 -0.18 0.55 1.25 0.00 0.00 0.00 179.25 181.04 2k27 h HIS 39 N 0.56 0.97 0.00 0.00 -0.00 -0.96 -0.21 115.15 115.51 2k27 h HIS 39 Ca 0.40 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.81 2k27 h HIS 39 Cb 0.76 -0.29 0.00 0.00 -0.00 0.00 0.00 27.41 27.88 2k27 h HIS 39 CO -0.00 0.24 0.00 -0.56 -0.00 0.00 0.00 177.93 177.60 2k27 h GLN 40 N 0.74 0.00 0.00 5.26 3.07 -1.57 -3.46 115.11 119.15 2k27 h GLN 40 Ca 0.53 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.27 2k27 h GLN 40 Cb 0.78 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.34 2k27 h GLN 40 CO -0.37 0.00 0.00 0.41 0.09 0.00 0.00 178.83 178.96 2k27 n GLY 41 N -0.34 0.76 2.82 0.06 0.00 -0.10 -5.14 105.19 103.25 2k27 n GLY 41 Ca -0.00 -0.66 -0.29 0.00 0.00 0.00 0.00 46.02 45.08 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 -0.45 0.93 0.78 1.61 1.01 -1.18 -5.07 120.40 118.03 2k27 s VAL 42 Ca 0.00 -0.81 -0.11 0.00 0.00 0.00 0.00 61.98 61.06 2k27 s VAL 42 Cb 0.00 -1.33 0.07 0.00 0.00 0.00 0.00 36.38 35.12 2k27 s VAL 42 CO 0.00 -0.15 1.11 -0.13 0.00 0.00 0.00 175.10 175.93 2k27 s ARG 43 N 1.67 2.08 0.21 2.72 0.52 -1.26 -4.78 118.95 120.11 2k27 s ARG 43 Ca -0.03 1.31 -0.09 0.00 -0.52 0.00 0.00 55.73 56.40 2k27 s ARG 43 Cb -0.18 -1.87 0.30 0.00 0.52 0.00 0.00 34.95 33.73 2k27 s ARG 43 CO -0.07 -1.79 1.73 -1.00 0.02 0.00 0.00 175.30 174.18 2k27 h PRO 44 N -1.07 0.35 -0.59 3.54 0.13 -2.00 0.11 132.00 132.47 2k27 h PRO 44 Ca -0.44 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2k27 h PRO 44 Cb 1.24 -0.08 -0.03 0.00 0.13 0.00 0.00 31.00 32.27 2k27 h PRO 44 CO 0.50 0.23 0.38 0.00 -0.23 0.00 0.00 178.00 178.88 2k27 h ASP 46 N 0.81 0.00 0.63 0.00 3.58 -1.31 -2.57 116.42 117.56 2k27 h ASP 46 Ca 0.22 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.64 2k27 h ASP 46 Cb -0.08 0.00 0.01 0.00 1.72 0.00 0.00 39.33 40.98 2k27 h ASP 46 CO -0.05 0.67 -0.30 0.40 -2.88 0.00 0.00 179.24 177.08 2k27 h ILE 47 N 0.00 0.24 -0.91 2.25 2.04 -0.51 -3.31 117.51 117.30 2k27 h ILE 47 Ca -0.01 -0.29 0.06 0.00 1.00 0.00 0.00 64.86 65.63 2k27 h ILE 47 Cb 1.23 0.31 -0.06 0.00 -0.74 0.00 0.00 36.82 37.56 2k27 h ILE 47 CO 0.09 0.03 0.59 0.77 0.00 0.00 0.00 178.15 179.63 2k27 h SER 48 N -1.08 0.91 -0.72 1.72 4.64 -1.24 -2.09 113.55 115.69 2k27 h SER 48 Ca -0.09 0.01 -0.05 0.00 -0.47 0.00 0.00 61.79 61.19 2k27 h SER 48 Cb 0.69 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 62.56 2k27 h SER 48 CO 0.14 0.59 0.25 0.08 -0.87 0.00 0.00 176.83 177.02 2k27 h ARG 49 N 1.04 1.11 -0.37 4.77 0.11 -1.59 0.16 114.38 119.61 2k27 h ARG 49 Ca 0.39 -0.23 -0.01 0.00 0.10 0.00 0.00 59.98 60.23 2k27 h ARG 49 Cb 0.19 -0.17 -0.02 0.00 1.11 0.00 0.00 29.97 31.09 2k27 h ARG 49 CO -0.15 0.94 0.17 1.96 0.10 0.00 0.00 179.97 183.00 2k27 h GLN 50 N 1.06 0.53 0.00 0.08 4.20 -1.47 -2.75 115.11 116.76 2k27 h GLN 50 Ca 0.24 -0.08 -0.13 0.00 0.06 0.00 0.00 58.65 58.74 2k27 h GLN 50 Cb 0.28 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.94 2k27 h GLN 50 CO -0.01 0.48 -0.60 -0.07 -0.67 0.00 0.00 178.83 177.96 2k27 h LEU 51 N 0.46 0.00 -2.90 1.46 -0.00 -1.50 -3.48 115.31 109.33 2k27 h LEU 51 Ca 0.13 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.99 2k27 h LEU 51 Cb 0.13 0.00 0.02 0.00 -0.00 0.00 0.00 40.66 40.81 2k27 h LEU 51 CO -0.01 0.60 -0.07 0.54 -0.00 0.00 0.00 178.44 179.50 2k27 n ARG 52 N -3.28 -0.29 0.00 1.13 1.74 0.40 -5.04 116.66 111.32 2k27 n ARG 52 Ca 0.01 0.41 0.00 0.00 -0.77 0.00 0.00 57.85 57.50 2k27 n ARG 52 Cb 0.76 -2.21 0.00 0.00 -1.02 0.00 0.00 32.46 29.99 2k27 n ARG 52 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2k27 n VAL 53 N -1.45 0.00 0.00 1.55 0.31 -0.22 -5.02 118.33 113.49 2k27 n VAL 53 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 2k27 n VAL 53 Cb 0.51 0.28 0.00 0.00 -0.91 0.00 0.00 33.84 33.72 2k27 n VAL 53 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2k27 n SER 54 N -1.03 0.00 0.00 4.52 2.88 -1.25 -2.95 113.62 115.79 2k27 n SER 54 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2k27 n SER 54 Cb 0.02 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.48 2k27 n SER 54 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 2k27 n HIS 55 N 0.00 0.00 -0.30 0.66 -0.00 -1.26 -4.75 115.22 109.56 2k27 n HIS 55 Ca 0.00 0.00 -0.11 0.00 0.46 0.00 0.00 57.72 58.07 2k27 n HIS 55 Cb 0.00 0.01 -0.08 0.00 -0.12 0.00 0.00 29.99 29.79 2k27 n HIS 55 CO 0.00 0.00 0.00 0.78 0.46 0.00 0.00 176.34 177.58 2k27 h GLY 56 N 0.00 -0.77 1.18 1.57 0.00 -1.97 -0.25 103.07 102.83 2k27 h GLY 56 Ca 0.00 0.72 -0.23 0.00 0.00 0.00 0.00 47.33 47.82 2k27 h GLY 56 CO 0.00 -0.05 -0.83 0.00 0.00 0.00 0.00 176.54 175.67 2k27 h VAL 58 N 0.51 0.87 -0.39 0.00 2.07 -1.63 -0.84 116.25 116.84 2k27 h VAL 58 Ca -0.07 -0.31 0.08 0.00 0.82 0.00 0.00 66.70 67.22 2k27 h VAL 58 Cb 1.46 -0.12 -0.09 0.00 -1.52 0.00 0.00 31.29 31.02 2k27 h VAL 58 CO 0.17 0.17 -0.32 0.28 0.02 0.00 0.00 177.57 177.88 2k27 h SER 59 N 0.91 -1.07 0.02 0.57 0.02 -1.17 -0.12 113.55 112.71 2k27 h SER 59 Ca 0.51 0.19 -0.00 0.00 -0.84 0.00 0.00 61.79 61.64 2k27 h SER 59 Cb 0.60 0.50 0.00 0.00 0.14 0.00 0.00 62.40 63.64 2k27 h SER 59 CO -0.28 -0.32 -0.01 0.11 -1.14 0.00 0.00 176.83 175.19 2k27 h LYS 60 N -0.26 -0.03 0.06 3.45 1.79 -1.36 -1.35 116.57 118.87 2k27 h LYS 60 Ca 0.17 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.64 2k27 h LYS 60 Cb 0.54 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.19 2k27 h LYS 60 CO -0.53 0.36 -0.03 0.82 -1.08 0.00 0.00 179.45 178.99 2k27 h ILE 61 N -0.42 0.99 0.00 1.86 1.08 -1.08 -2.20 117.51 117.73 2k27 h ILE 61 Ca -0.00 -0.16 -0.08 0.00 -0.39 0.00 0.00 64.86 64.23 2k27 h ILE 61 Cb 0.40 1.09 -0.01 0.00 -3.07 0.00 0.00 36.82 35.23 2k27 h ILE 61 CO 0.01 0.04 -0.37 -0.07 -0.69 0.00 0.00 178.15 177.07 2k27 h LEU 62 N -0.15 0.00 -4.29 1.44 -0.00 -1.12 -3.18 115.31 108.01 2k27 h LEU 62 Ca -0.01 0.00 -0.33 0.00 -0.00 0.00 0.00 57.88 57.54 2k27 h LEU 62 Cb 0.13 0.00 -0.07 0.00 -0.00 0.00 0.00 40.66 40.72 2k27 h LEU 62 CO 0.01 0.37 0.53 0.61 -0.00 0.00 0.00 178.44 179.96 2k27 n GLY 63 N -0.34 3.45 0.00 0.83 0.00 -0.51 -4.60 105.19 104.02 2k27 n GLY 63 Ca -0.02 -1.37 0.08 0.00 0.00 0.00 0.00 46.02 44.71 2k27 n GLY 63 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2k27 n ARG 64 N 2.47 0.09 0.11 1.61 0.00 -1.20 -2.63 116.66 117.10 2k27 n ARG 64 Ca 0.51 0.19 -0.02 0.00 -0.00 0.00 0.00 57.85 58.52 2k27 n ARG 64 Cb 0.73 -1.50 0.22 0.00 -0.00 0.00 0.00 32.46 31.92 2k27 n ARG 64 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.63 179.51 2k27 h TYR 65 N 0.00 0.22 0.00 2.89 0.05 -1.91 -1.16 116.97 117.07 2k27 h TYR 65 Ca 0.00 -0.06 0.00 0.00 0.05 0.00 0.00 58.73 58.72 2k27 h TYR 65 Cb 0.23 -0.05 0.00 0.00 1.01 0.00 0.00 36.73 37.93 2k27 h TYR 65 CO 0.00 0.61 0.00 -0.92 -1.05 0.00 0.00 178.16 176.80 2k27 h TYR 66 N 0.15 0.00 -5.51 4.88 3.20 -1.88 -3.47 116.97 114.34 2k27 h TYR 66 Ca 0.01 0.00 -0.27 0.00 3.14 0.00 0.00 58.73 61.61 2k27 h TYR 66 Cb 0.86 0.00 0.19 0.00 1.54 0.00 0.00 36.73 39.32 2k27 h TYR 66 CO 0.01 0.00 -0.84 0.39 -1.64 0.00 0.00 178.16 176.08 2k27 n GLU 67 N -2.31 -3.37 -0.29 1.82 1.02 -0.44 -4.93 120.64 112.15 2k27 n GLU 67 Ca 0.03 0.86 -0.01 0.00 -0.02 0.00 0.00 57.16 58.02 2k27 n GLU 67 Cb 0.28 -5.84 0.12 0.00 -0.02 0.00 0.00 31.44 25.98 2k27 n GLU 67 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 2k27 h THR 68 N -1.29 1.06 0.00 2.62 1.35 -1.79 -3.37 112.91 111.49 2k27 h THR 68 Ca -0.61 -0.32 0.00 0.00 -0.55 0.00 0.00 66.41 64.93 2k27 h THR 68 Cb 1.32 0.04 0.00 0.00 -1.73 0.00 0.00 68.15 67.78 2k27 h THR 68 CO 0.46 0.17 0.00 0.61 -0.25 0.00 0.00 175.52 176.51 2k27 n GLY 69 N -1.32 1.79 2.70 5.82 0.00 -1.26 -4.99 105.19 107.93 2k27 n GLY 69 Ca 0.11 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.06 2k27 n GLY 69 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2k27 n SER 70 N 0.00 -1.82 -2.87 1.61 3.41 -1.26 -4.92 113.62 107.77 2k27 n SER 70 Ca 0.00 -2.55 -0.32 0.00 -0.26 0.00 0.00 58.87 55.74 2k27 n SER 70 Cb 0.00 1.23 -0.04 0.00 -0.26 0.00 0.00 64.21 65.14 2k27 n SER 70 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2k27 n ILE 71 N -0.30 4.07 -3.09 -1.33 5.41 -1.26 -4.41 119.36 118.44 2k27 n ILE 71 Ca -0.06 -3.56 -0.20 0.00 1.00 0.00 0.00 62.75 59.94 2k27 n ILE 71 Cb 0.78 -1.75 -0.04 0.00 -0.71 0.00 0.00 39.64 37.92 2k27 n ILE 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 2k27 n ARG 72 N 1.11 0.77 -2.37 0.38 5.12 -1.26 -4.96 116.66 115.46 2k27 n ARG 72 Ca 0.54 -2.93 -0.42 0.00 -1.93 0.00 0.00 57.85 53.10 2k27 n ARG 72 Cb 0.43 -1.32 -0.00 0.00 -1.16 0.00 0.00 32.46 30.41 2k27 n ARG 72 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 2k27 n PRO 73 N 1.25 3.07 0.00 5.56 -0.04 -1.26 -4.78 135.00 138.80 2k27 n PRO 73 Ca 0.19 -3.10 0.00 0.00 -0.04 0.00 0.00 63.50 60.55 2k27 n PRO 73 Cb 0.57 -3.45 0.00 0.00 -0.04 0.00 0.00 33.50 30.58 2k27 n PRO 73 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2k27 n GLY 74 N 5.11 3.68 3.53 0.55 0.00 -1.26 -5.15 105.19 111.65 2k27 n GLY 74 Ca 0.50 -0.75 -0.01 0.00 0.00 0.00 0.00 46.02 45.76 2k27 n GLY 74 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k27 s VAL 75 N -2.00 -0.98 0.09 1.61 0.11 -1.26 -5.16 120.40 112.81 2k27 s VAL 75 Ca 0.00 0.01 -0.26 0.00 -2.93 0.00 0.00 61.98 58.80 2k27 s VAL 75 Cb 0.00 -0.98 -0.06 0.00 -1.53 0.00 0.00 36.38 33.81 2k27 s VAL 75 CO 0.00 0.00 0.80 -0.63 -3.33 0.00 0.00 175.10 171.94 2k27 s ILE 76 N 2.87 4.60 -1.83 7.04 1.01 -1.26 -5.00 121.20 128.63 2k27 s ILE 76 Ca -0.01 1.73 0.00 0.00 0.00 0.00 0.00 60.65 62.37 2k27 s ILE 76 Cb -0.13 -4.16 0.00 0.00 0.01 0.00 0.00 42.46 38.19 2k27 s ILE 76 CO -0.19 0.40 0.00 0.61 0.00 0.00 0.00 174.94 175.76 2k27 n GLY 77 N 2.16 -1.01 1.25 6.18 0.00 -1.26 -5.11 105.19 107.40 2k27 n GLY 77 Ca -0.02 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.10 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 0.00 0.16 3.87 -0.02 0.00 -1.26 -5.09 105.19 102.85 2k27 n GLY 78 Ca 0.00 -0.31 -0.30 0.00 0.00 0.00 0.00 46.02 45.41 2k27 n GLY 78 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2k27 s SER 79 N -2.22 5.34 -0.47 1.61 1.04 -1.26 -5.07 113.70 112.67 2k27 s SER 79 Ca 0.00 1.17 0.06 0.00 0.48 0.00 0.00 55.95 57.66 2k27 s SER 79 Cb 0.00 -1.96 0.21 0.00 0.10 0.00 0.00 66.02 64.36 2k27 s SER 79 CO 0.00 -1.41 0.65 1.17 0.98 0.00 0.00 173.24 174.63 2k27 n LYS 80 N -3.06 0.54 -1.58 4.02 4.81 -1.26 -5.16 118.16 116.48 2k27 n LYS 80 Ca 0.07 -2.39 -0.30 0.00 -0.87 0.00 0.00 58.31 54.82 2k27 n LYS 80 Cb 0.57 -1.48 0.09 0.00 0.02 0.00 0.00 35.03 34.23 2k27 n LYS 80 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2k27 s PRO 81 N 0.36 2.10 -0.29 1.64 0.04 -1.26 -5.08 135.00 132.51 2k27 s PRO 81 Ca 0.32 0.61 0.06 0.00 0.04 0.00 0.00 61.00 62.03 2k27 s PRO 81 Cb 0.09 -1.92 0.20 0.00 0.04 0.00 0.00 34.50 32.90 2k27 s PRO 81 CO -0.14 -1.60 0.57 0.21 0.04 0.00 0.00 177.00 176.08 2k27 s LYS 82 N -5.18 0.55 0.00 4.56 2.47 -1.26 -5.16 119.74 115.73 2k27 s LYS 82 Ca 0.61 0.50 -0.16 0.00 -1.56 0.00 0.00 55.97 55.36 2k27 s LYS 82 Cb -0.14 0.20 -0.06 0.00 -1.46 0.00 0.00 37.83 36.37 2k27 s LYS 82 CO 0.54 -1.05 0.43 0.08 0.16 0.00 0.00 175.35 175.51 2k27 s VAL 83 N 2.79 5.00 0.18 4.02 1.01 -1.26 -5.08 120.40 127.06 2k27 s VAL 83 Ca 0.10 0.90 -0.23 0.00 0.00 0.00 0.00 61.98 62.74 2k27 s VAL 83 Cb -0.10 -3.74 0.06 0.00 0.00 0.00 0.00 36.38 32.60 2k27 s VAL 83 CO -0.26 0.56 0.67 0.00 0.00 0.00 0.00 175.10 176.07 2k27 s ALA 84 N -0.96 -1.53 -0.24 5.51 0.00 -1.26 -5.19 121.76 118.09 2k27 s ALA 84 Ca 0.24 0.32 -0.26 0.00 0.00 0.00 0.00 51.96 52.26 2k27 s ALA 84 Cb -0.17 0.82 0.08 0.00 0.00 0.00 0.00 23.12 23.86 2k27 s ALA 84 CO 0.14 -0.84 0.78 -0.08 0.00 0.00 0.00 175.76 175.75 2k27 s THR 85 N -3.71 0.00 -0.82 0.00 -1.32 -1.26 -5.04 115.64 103.49 2k27 s THR 85 Ca 0.04 0.00 0.21 0.00 -1.21 0.00 0.00 61.69 60.73 2k27 s THR 85 Cb -0.02 -1.00 0.19 0.00 -1.51 0.00 0.00 72.50 70.16 2k27 s THR 85 CO -0.07 0.00 1.65 -0.81 -2.21 0.00 0.00 174.62 173.18 2k27 n PRO 86 N 2.34 0.08 0.26 7.08 -0.04 -1.26 -3.12 135.00 140.34 2k27 n PRO 86 Ca -0.14 0.25 0.18 0.00 -0.04 0.00 0.00 63.50 63.75 2k27 n PRO 86 Cb 0.55 -1.64 0.91 0.00 -0.04 0.00 0.00 33.50 33.29 2k27 n PRO 86 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 2k27 h LYS 87 N 0.00 0.00 -0.45 0.54 1.57 -1.96 -0.56 116.57 115.70 2k27 h LYS 87 Ca 0.00 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.87 2k27 h LYS 87 Cb 0.38 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 32.60 2k27 h LYS 87 CO 0.00 0.00 -0.07 0.28 -0.57 0.00 0.00 179.45 179.09 2k27 h VAL 88 N 0.00 0.58 -0.49 0.50 2.07 -1.99 -1.33 116.25 115.59 2k27 h VAL 88 Ca 0.05 -0.01 0.02 0.00 0.82 0.00 0.00 66.70 67.58 2k27 h VAL 88 Cb 0.34 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 2k27 h VAL 88 CO -0.00 0.01 0.29 0.58 0.02 0.00 0.00 177.57 178.47 2k27 h VAL 89 N 0.04 1.05 0.00 2.57 2.07 -1.36 -2.24 116.25 118.38 2k27 h VAL 89 Ca 0.22 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.54 2k27 h VAL 89 Cb 0.34 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 2k27 h VAL 89 CO -0.44 0.11 0.00 -0.62 0.02 0.00 0.00 177.57 176.64 2k27 n GLU 90 N -4.81 0.92 0.21 1.57 1.02 -0.72 -2.44 120.64 116.40 2k27 n GLU 90 Ca 0.03 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.05 2k27 n GLU 90 Cb 0.07 -1.10 -0.07 0.00 -0.02 0.00 0.00 31.44 30.32 2k27 n GLU 90 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2k27 h LYS 91 N 0.02 -0.55 -1.00 3.49 1.57 -0.63 -0.37 116.57 119.09 2k27 h LYS 91 Ca 0.00 0.04 0.15 0.00 -1.87 0.00 0.00 60.65 58.97 2k27 h LYS 91 Cb 0.10 0.12 -0.09 0.00 0.08 0.00 0.00 32.23 32.45 2k27 h LYS 91 CO 0.00 -0.26 0.62 0.82 -0.57 0.00 0.00 179.45 180.07 2k27 h ILE 92 N -1.02 0.82 0.00 1.86 5.03 -1.64 -0.59 117.51 121.97 2k27 h ILE 92 Ca -0.06 -0.30 0.00 0.00 -0.12 0.00 0.00 64.86 64.38 2k27 h ILE 92 Cb 0.55 -0.13 0.00 0.00 -3.03 0.00 0.00 36.82 34.20 2k27 h ILE 92 CO 0.10 0.16 0.00 0.61 -0.68 0.00 0.00 178.15 178.34 2k27 n GLY 93 N -1.35 -3.09 0.39 5.37 0.00 -1.12 -2.81 105.19 102.58 2k27 n GLY 93 Ca 0.21 0.24 0.20 0.00 0.00 0.00 0.00 46.02 46.67 2k27 n GLY 93 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2k27 h ASP 94 N 0.00 0.54 -0.00 1.61 3.32 -0.86 0.30 116.42 121.32 2k27 h ASP 94 Ca 0.00 0.10 0.02 0.00 0.02 0.00 0.00 57.03 57.16 2k27 h ASP 94 Cb 0.00 0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 2k27 h ASP 94 CO 0.00 0.12 -0.43 1.88 -1.72 0.00 0.00 179.24 179.09 2k27 h TYR 95 N 0.48 -1.26 0.03 4.55 0.05 -1.16 -1.20 116.97 118.45 2k27 h TYR 95 Ca 0.60 0.04 -0.22 0.00 0.05 0.00 0.00 58.73 59.20 2k27 h TYR 95 Cb 1.35 0.55 -0.00 0.00 1.01 0.00 0.00 36.73 39.64 2k27 h TYR 95 CO -0.00 -0.46 -0.97 0.87 -1.05 0.00 0.00 178.16 176.55 2k27 h LYS 96 N -0.54 0.28 0.05 4.88 1.79 -1.11 -0.29 116.57 121.64 2k27 h LYS 96 Ca 0.01 -0.33 0.02 0.00 -2.18 0.00 0.00 60.65 58.16 2k27 h LYS 96 Cb 0.58 0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 31.30 2k27 h LYS 96 CO -0.29 1.06 -0.18 0.00 -1.08 0.00 0.00 179.45 178.96 2k27 h ARG 97 N 0.14 -0.32 0.04 3.15 3.08 -0.98 -2.16 114.38 117.33 2k27 h ARG 97 Ca -0.07 0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 2k27 h ARG 97 Cb 1.63 0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.75 2k27 h ARG 97 CO 0.16 -0.21 -0.02 1.96 -1.07 0.00 0.00 179.97 180.79 2k27 h GLN 98 N -0.33 -0.05 -3.20 0.04 4.20 -1.25 -3.41 115.11 111.11 2k27 h GLN 98 Ca 0.04 0.00 -0.65 0.00 0.06 0.00 0.00 58.65 58.11 2k27 h GLN 98 Cb 0.37 0.01 -0.40 0.00 0.30 0.00 0.00 27.48 27.76 2k27 h GLN 98 CO -0.14 0.60 -0.45 -0.80 -0.67 0.00 0.00 178.83 177.37 2k27 s ASN 99 N -5.87 5.07 0.23 1.46 -0.87 -0.12 -4.92 114.94 109.93 2k27 s ASN 99 Ca -0.15 -3.67 -0.01 0.00 -1.57 0.00 0.00 52.86 47.47 2k27 s ASN 99 Cb -0.01 -1.72 0.25 0.00 -0.02 0.00 0.00 41.25 39.75 2k27 s ASN 99 CO 0.55 -0.14 1.61 1.55 -2.57 0.00 0.00 177.10 178.10 2k27 h PRO 100 N 5.77 0.53 0.68 -0.60 0.13 -1.58 -3.35 132.00 133.58 2k27 h PRO 100 Ca 0.11 -0.26 -0.03 0.00 -0.87 0.00 0.00 66.00 64.94 2k27 h PRO 100 Cb 0.80 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.93 2k27 h PRO 100 CO 0.75 0.84 -0.32 1.79 -0.23 0.00 0.00 178.00 180.82 2k27 h THR 101 N 0.44 0.20 -3.65 1.56 1.35 -1.91 -3.46 112.91 107.44 2k27 h THR 101 Ca 0.04 -0.25 -0.43 0.00 -0.55 0.00 0.00 66.41 65.23 2k27 h THR 101 Cb 0.88 0.25 0.18 0.00 -1.73 0.00 0.00 68.15 67.73 2k27 h THR 101 CO 0.07 0.02 0.17 -0.04 -0.25 0.00 0.00 175.52 175.49 2k27 s MET 102 N -5.15 -0.66 0.26 4.72 -1.94 -1.26 -5.05 119.30 110.23 2k27 s MET 102 Ca -0.16 0.06 0.07 0.00 -1.71 0.00 0.00 55.69 53.95 2k27 s MET 102 Cb 0.02 -1.65 -0.03 0.00 2.01 0.00 0.00 34.83 35.18 2k27 s MET 102 CO 0.51 -3.36 0.24 -0.06 -0.01 0.00 0.00 175.02 172.34 2k27 s PHE 103 N -3.06 3.14 0.19 -0.03 0.08 -1.26 -4.95 117.98 112.08 2k27 s PHE 103 Ca 0.70 -0.13 -0.14 0.00 0.12 0.00 0.00 56.93 57.48 2k27 s PHE 103 Cb -0.12 -1.50 0.19 0.00 -0.57 0.00 0.00 43.02 41.03 2k27 s PHE 103 CO 0.56 0.45 1.69 0.00 -0.10 0.00 0.00 175.22 177.82 2k27 h ALA 104 N 1.39 0.48 -0.33 5.36 0.00 -1.96 -0.60 119.26 123.60 2k27 h ALA 104 Ca -0.48 0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.63 2k27 h ALA 104 Cb 1.24 0.24 -0.08 0.00 0.00 0.00 0.00 17.79 19.19 2k27 h ALA 104 CO 0.60 -0.38 -0.44 -1.49 0.00 0.00 0.00 179.25 177.54 2k27 h TRP 105 N 0.13 -1.30 0.04 0.00 4.06 -1.96 -1.08 115.95 115.83 2k27 h TRP 105 Ca 0.25 0.06 -0.00 0.00 2.06 0.00 0.00 58.89 61.26 2k27 h TRP 105 Cb 0.38 0.61 0.00 0.00 -1.00 0.00 0.00 29.16 29.15 2k27 h TRP 105 CO -0.31 -0.46 -0.02 0.93 -3.56 0.00 0.00 178.44 175.03 2k27 h GLU 106 N -0.39 -0.05 0.00 0.49 4.39 -1.81 -3.24 114.58 113.98 2k27 h GLU 106 Ca 0.11 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.81 2k27 h GLU 106 Cb 0.60 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.26 2k27 h GLU 106 CO -0.53 0.10 0.00 0.82 -1.16 0.00 0.00 179.01 178.24 2k27 h ILE 107 N -0.19 0.00 -0.69 3.13 2.04 -0.95 -2.00 117.51 118.85 2k27 h ILE 107 Ca -0.00 -0.73 0.13 0.00 1.00 0.00 0.00 64.86 65.25 2k27 h ILE 107 Cb 0.17 1.72 -0.04 0.00 -0.74 0.00 0.00 36.82 37.93 2k27 h ILE 107 CO 0.01 0.00 0.46 -0.09 0.00 0.00 0.00 178.15 178.53 2k27 h ARG 108 N 0.00 0.38 0.00 2.37 1.12 -1.22 -0.88 114.38 116.15 2k27 h ARG 108 Ca 0.00 -0.02 0.00 0.00 -1.11 0.00 0.00 59.98 58.85 2k27 h ARG 108 Cb 0.83 -0.09 0.00 0.00 -0.01 0.00 0.00 29.97 30.70 2k27 h ARG 108 CO 0.00 0.25 0.00 -0.25 -3.11 0.00 0.00 179.97 176.86 2k27 n ASP 109 N -4.47 0.00 -0.22 -3.80 8.00 -0.75 -2.82 116.55 112.49 2k27 n ASP 109 Ca 0.13 -0.54 0.02 0.00 0.71 0.00 0.00 54.79 55.11 2k27 n ASP 109 Cb 0.48 -0.06 0.12 0.00 -0.02 0.00 0.00 41.12 41.64 2k27 n ASP 109 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 2k27 h ARG 110 N 0.00 0.14 -0.39 -1.24 9.65 -1.30 -0.31 114.38 120.92 2k27 h ARG 110 Ca 0.00 -0.01 0.04 0.00 -1.10 0.00 0.00 59.98 58.91 2k27 h ARG 110 Cb 0.05 -0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 28.55 2k27 h ARG 110 CO 0.00 0.09 0.16 -0.07 2.80 0.00 0.00 179.97 182.95 2k27 h LEU 111 N 0.14 0.20 -0.27 3.80 3.38 -1.74 -0.65 115.31 120.18 2k27 h LEU 111 Ca 0.35 0.04 -0.08 0.00 0.09 0.00 0.00 57.88 58.27 2k27 h LEU 111 Cb 0.57 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 2k27 h LEU 111 CO -0.54 0.15 -0.16 -0.07 0.09 0.00 0.00 178.44 177.91 2k27 h LEU 112 N 0.33 0.60 -0.02 1.67 3.38 -1.64 0.57 115.31 120.21 2k27 h LEU 112 Ca 0.18 -0.43 0.01 0.00 0.09 0.00 0.00 57.88 57.73 2k27 h LEU 112 Cb 0.13 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2k27 h LEU 112 CO -0.16 0.90 -0.01 0.00 0.09 0.00 0.00 178.44 179.25 2k27 h ALA 113 N 0.72 0.00 0.00 1.53 0.00 -0.82 -2.64 119.26 118.06 2k27 h ALA 113 Ca 0.06 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 2k27 h ALA 113 Cb 0.69 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 2k27 h ALA 113 CO 0.05 -0.51 -0.51 0.93 0.00 0.00 0.00 179.25 179.21 2k27 h GLU 114 N -0.02 0.00 -1.70 0.00 4.39 -1.16 -3.48 114.58 112.62 2k27 h GLU 114 Ca 0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.71 2k27 h GLU 114 Cb 0.04 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.69 2k27 h GLU 114 CO -0.03 0.51 0.00 0.41 -1.16 0.00 0.00 179.01 178.74 2k27 n GLY 115 N -0.02 0.76 0.14 -3.84 0.00 -0.19 -5.04 105.19 97.00 2k27 n GLY 115 Ca -0.01 -0.42 -0.26 0.00 0.00 0.00 0.00 46.02 45.33 2k27 n GLY 115 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2k27 n VAL 116 N -0.85 1.53 -4.19 1.61 0.31 0.02 -5.03 118.33 111.72 2k27 n VAL 116 Ca 0.00 -0.43 -0.16 0.00 -0.01 0.00 0.00 64.34 63.74 2k27 n VAL 116 Cb 0.32 -1.75 -0.07 0.00 -0.91 0.00 0.00 33.84 31.43 2k27 n VAL 116 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2k27 s ASP 118 N -3.27 5.69 0.61 0.00 1.11 -1.26 -4.53 116.67 115.02 2k27 s ASP 118 Ca 0.36 0.82 0.33 0.00 0.18 0.00 0.00 52.55 54.24 2k27 s ASP 118 Cb 0.02 -1.83 1.89 0.00 1.07 0.00 0.00 42.92 44.07 2k27 s ASP 118 CO 0.22 -1.03 2.21 -0.55 1.18 0.00 0.00 175.17 177.19 2k27 h ASN 119 N -0.19 0.00 0.02 0.27 7.08 -1.99 -1.77 115.58 119.00 2k27 h ASN 119 Ca -0.45 0.00 -0.33 0.00 -3.08 0.00 0.00 56.30 52.44 2k27 h ASN 119 Cb 1.25 0.00 -0.04 0.00 -2.08 0.00 0.00 38.32 37.44 2k27 h ASN 119 CO 0.61 0.00 -1.83 0.47 -2.08 0.00 0.00 177.43 174.60 2k27 n ASP 120 N -3.59 1.95 0.20 6.14 8.00 -1.26 -4.48 116.55 123.50 2k27 n ASP 120 Ca -0.01 0.31 0.14 0.00 0.71 0.00 0.00 54.79 55.94 2k27 n ASP 120 Cb 0.18 -0.86 0.47 0.00 -0.02 0.00 0.00 41.12 40.89 2k27 n ASP 120 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 2k27 h THR 121 N -0.71 0.00 -1.93 -3.53 1.35 -1.90 -3.44 112.91 102.75 2k27 h THR 121 Ca -0.47 -0.56 -0.65 0.00 -0.55 0.00 0.00 66.41 64.18 2k27 h THR 121 Cb 1.57 1.49 0.09 0.00 -1.73 0.00 0.00 68.15 69.58 2k27 h THR 121 CO -0.20 0.00 0.14 0.55 -0.25 0.00 0.00 175.52 175.76 2k27 n VAL 122 N -2.76 1.24 -1.39 6.82 3.14 -0.68 -4.89 118.33 119.81 2k27 n VAL 122 Ca 0.03 -0.31 -0.29 0.00 -2.96 0.00 0.00 64.34 60.81 2k27 n VAL 122 Cb 0.36 -0.75 0.16 0.00 -1.06 0.00 0.00 33.84 32.54 2k27 n VAL 122 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 2k27 s PRO 123 N -0.71 0.78 0.35 1.45 0.04 -1.26 -4.99 135.00 130.66 2k27 s PRO 123 Ca 0.69 0.35 -0.28 0.00 0.04 0.00 0.00 61.00 61.80 2k27 s PRO 123 Cb -0.84 -1.79 -0.11 0.00 0.04 0.00 0.00 34.50 31.80 2k27 s PRO 123 CO 0.55 -2.46 1.39 -1.12 0.04 0.00 0.00 177.00 175.40 2k27 s SER 124 N -3.82 6.56 0.13 6.66 0.01 -1.26 -4.94 113.70 117.04 2k27 s SER 124 Ca 0.65 2.87 -0.12 0.00 1.31 0.00 0.00 55.95 60.65 2k27 s SER 124 Cb -0.16 -2.66 -0.06 0.00 0.21 0.00 0.00 66.02 63.36 2k27 s SER 124 CO 0.55 -0.70 1.46 0.58 0.41 0.00 0.00 173.24 175.54 2k27 h VAL 125 N 3.00 1.28 -1.00 3.43 2.07 -1.94 -3.22 116.25 119.87 2k27 h VAL 125 Ca -0.50 -1.53 0.16 0.00 0.82 0.00 0.00 66.70 65.64 2k27 h VAL 125 Cb 1.23 1.43 -0.10 0.00 -1.52 0.00 0.00 31.29 32.34 2k27 h VAL 125 CO 0.65 0.51 0.62 0.28 0.02 0.00 0.00 177.57 179.65 2k27 h SER 126 N 0.68 0.86 0.31 0.57 0.02 -1.99 -0.60 113.55 113.40 2k27 h SER 126 Ca 0.06 0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 61.06 2k27 h SER 126 Cb 0.95 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.40 2k27 h SER 126 CO 0.09 0.38 -0.15 0.77 -1.14 0.00 0.00 176.83 176.79 2k27 h SER 127 N 0.88 -0.35 -1.00 3.07 4.64 -1.96 -2.11 113.55 116.73 2k27 h SER 127 Ca 0.54 0.01 0.21 0.00 -0.47 0.00 0.00 61.79 62.08 2k27 h SER 127 Cb 0.70 0.09 -0.11 0.00 -0.31 0.00 0.00 62.40 62.76 2k27 h SER 127 CO -0.32 -0.13 0.60 0.16 -0.87 0.00 0.00 176.83 176.27 2k27 h ILE 128 N -0.66 0.63 0.25 0.95 3.07 -1.57 -0.14 117.51 120.04 2k27 h ILE 128 Ca -0.04 -0.23 -0.00 0.00 1.55 0.00 0.00 64.86 66.13 2k27 h ILE 128 Cb 0.32 -0.11 -0.01 0.00 -0.27 0.00 0.00 36.82 36.75 2k27 h ILE 128 CO 0.07 0.12 -0.21 -1.13 -1.05 0.00 0.00 178.15 175.95 2k27 h ASN 129 N 0.68 -0.54 -0.85 2.16 -1.24 -1.15 -0.28 115.58 114.36 2k27 h ASN 129 Ca 0.61 0.05 0.08 0.00 0.71 0.00 0.00 56.30 57.74 2k27 h ASN 129 Cb 1.04 0.18 -0.06 0.00 0.73 0.00 0.00 38.32 40.21 2k27 h ASN 129 CO -0.43 -0.32 0.56 0.03 -1.29 0.00 0.00 177.43 175.98 2k27 h ARG 130 N -0.48 0.88 0.05 6.67 2.47 -0.37 -1.24 114.38 122.36 2k27 h ARG 130 Ca -0.01 -0.05 -0.00 0.00 -1.26 0.00 0.00 59.98 58.65 2k27 h ARG 130 Cb 0.43 -0.20 0.00 0.00 -1.65 0.00 0.00 29.97 28.55 2k27 h ARG 130 CO -0.02 0.58 -0.02 0.82 0.56 0.00 0.00 179.97 181.89 2k27 h ILE 131 N 0.91 1.02 -0.90 2.04 1.08 -0.62 -2.76 117.51 118.28 2k27 h ILE 131 Ca 0.38 -0.21 0.14 0.00 -0.39 0.00 0.00 64.86 64.78 2k27 h ILE 131 Cb 0.28 1.16 -0.09 0.00 -3.07 0.00 0.00 36.82 35.10 2k27 h ILE 131 CO -0.14 0.05 0.51 0.40 -0.69 0.00 0.00 178.15 178.28 2k27 h ILE 132 N -0.15 0.80 -0.21 -0.67 2.04 -0.44 -1.88 117.51 117.00 2k27 h ILE 132 Ca -0.01 -0.26 0.05 0.00 1.00 0.00 0.00 64.86 65.65 2k27 h ILE 132 Cb 0.13 -0.02 -0.05 0.00 -0.74 0.00 0.00 36.82 36.14 2k27 h ILE 132 CO 0.01 0.14 -0.13 0.03 0.00 0.00 0.00 178.15 178.20 2k27 h ARG 133 N 0.75 -0.12 0.00 2.37 3.08 -0.96 0.06 114.38 119.56 2k27 h ARG 133 Ca 0.48 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.53 2k27 h ARG 133 Cb 0.61 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.68 2k27 h ARG 133 CO -0.32 -0.08 -0.04 1.79 -1.07 0.00 0.00 179.97 180.25 2k27 h THR 134 N -0.12 0.88 0.25 2.04 1.35 -1.15 -2.77 112.91 113.39 2k27 h THR 134 Ca 0.12 -0.13 -0.01 0.00 -0.55 0.00 0.00 66.41 65.83 2k27 h THR 134 Cb 0.30 1.08 0.00 0.00 -1.73 0.00 0.00 68.15 67.80 2k27 h THR 134 CO -0.29 0.04 -0.12 0.11 -0.25 0.00 0.00 175.52 175.01 2k27 h LYS 135 N 0.00 -0.33 -0.75 4.72 6.56 -1.17 -3.47 116.57 122.14 2k27 h LYS 135 Ca -0.00 0.02 0.11 0.00 -1.06 0.00 0.00 60.65 59.72 2k27 h LYS 135 Cb 0.07 0.07 -0.21 0.00 -0.57 0.00 0.00 32.23 31.60 2k27 h LYS 135 CO 0.00 -0.22 -0.21 0.54 -2.06 0.00 0.00 179.45 177.51 2k27 s VAL 136 N -2.67 -0.75 -0.82 0.50 0.11 -0.05 -5.04 120.40 111.69 2k27 s VAL 136 Ca -0.05 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.02 2k27 s VAL 136 Cb 0.00 -0.83 0.28 0.00 -1.53 0.00 0.00 36.38 34.30 2k27 s VAL 136 CO 0.15 0.00 1.06 0.00 -3.33 0.00 0.00 175.10 172.98 2k27 n GLN 137 N 5.36 3.36 -3.33 1.54 10.64 -1.15 -4.56 117.38 129.24 2k27 n GLN 137 Ca 0.03 -4.64 -0.27 0.00 -1.83 0.00 0.00 57.00 50.30 2k27 n GLN 137 Cb 0.54 -2.36 -0.07 0.00 -0.86 0.00 0.00 30.24 27.49 2k27 n GLN 137 CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 2k27 n GLN 138 N 0.99 2.56 -2.12 2.61 6.02 -1.26 -5.09 117.38 121.08 2k27 n GLN 138 Ca 0.29 -4.63 -0.33 0.00 -0.01 0.00 0.00 57.00 52.32 2k27 n GLN 138 Cb 0.38 -2.20 0.01 0.00 1.02 0.00 0.00 30.24 29.44 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 -2.60 3.35 0.07 -1.09 0.04 -1.26 -5.06 135.00 128.46 2k27 s PRO 139 Ca 0.41 1.29 0.00 0.00 0.04 0.00 0.00 61.00 62.74 2k27 s PRO 139 Cb 0.18 -2.03 -0.04 0.00 0.04 0.00 0.00 34.50 32.64 2k27 s PRO 139 CO -0.04 -0.79 0.21 -0.06 0.04 0.00 0.00 177.00 176.36 2k27 s PHE 140 N -2.30 3.50 0.06 0.56 0.08 -1.26 -5.12 117.98 113.50 2k27 s PHE 140 Ca 0.65 0.23 -0.23 0.00 0.12 0.00 0.00 56.93 57.70 2k27 s PHE 140 Cb -0.17 -1.74 0.06 0.00 -0.57 0.00 0.00 43.02 40.59 2k27 s PHE 140 CO 0.33 0.58 0.54 1.21 -0.10 0.00 0.00 175.22 177.78 2k27 s ASN 141 N -2.58 -0.47 -0.38 1.36 2.47 -1.26 -5.13 114.94 108.95 2k27 s ASN 141 Ca 0.35 0.18 0.03 0.00 0.42 0.00 0.00 52.86 53.85 2k27 s ASN 141 Cb -0.13 0.51 0.16 0.00 -1.45 0.00 0.00 41.25 40.34 2k27 s ASN 141 CO 0.28 -0.75 0.39 -0.22 -3.72 0.00 0.00 177.10 173.08 2k27 s LEU 142 N -2.03 -0.07 0.43 3.21 2.96 -1.26 -5.15 118.68 116.77 2k27 s LEU 142 Ca -0.05 -1.65 -0.22 0.00 -0.22 0.00 0.00 54.13 51.99 2k27 s LEU 142 Cb -0.01 0.60 -0.09 0.00 0.50 0.00 0.00 46.19 47.19 2k27 s LEU 142 CO -0.02 -0.24 1.03 -2.16 -1.32 0.00 0.00 176.35 173.64 2k27 s PRO 143 N 1.34 4.05 0.20 0.98 0.04 -1.26 -5.05 135.00 135.30 2k27 s PRO 143 Ca 0.18 1.42 -0.23 0.00 0.04 0.00 0.00 61.00 62.41 2k27 s PRO 143 Cb -0.14 -2.36 0.05 0.00 0.04 0.00 0.00 34.50 32.09 2k27 s PRO 143 CO -0.03 -0.23 0.82 0.00 0.04 0.00 0.00 177.00 177.61 2k27 s MET 144 N -2.80 1.44 0.13 4.56 0.23 -1.26 -5.19 119.30 116.40 2k27 s MET 144 Ca 0.61 -0.77 -0.09 0.00 -1.03 0.00 0.00 55.69 54.42 2k27 s MET 144 Cb -0.19 0.51 -0.01 0.00 -1.53 0.00 0.00 34.83 33.61 2k27 s MET 144 CO 0.23 -0.65 0.24 0.34 -2.03 0.00 0.00 175.02 173.15 2k27 s ASP 145 N -2.89 0.08 -1.48 -1.18 2.15 -1.26 -5.07 116.67 107.02 2k27 s ASP 145 Ca 0.10 -0.77 -0.13 0.00 0.43 0.00 0.00 52.55 52.18 2k27 s ASP 145 Cb -0.03 0.39 0.02 0.00 -0.30 0.00 0.00 42.92 43.00 2k27 s ASP 145 CO 0.02 -0.82 2.37 -0.24 -0.17 0.00 0.00 175.17 176.34 2k27 n SER 146 N -0.14 5.16 -3.68 -0.34 2.88 -1.26 -4.85 113.62 111.38 2k27 n SER 146 Ca -0.11 -2.81 -0.42 0.00 -1.33 0.00 0.00 58.87 54.21 2k27 n SER 146 Cb 0.63 -1.62 -0.00 0.00 -0.75 0.00 0.00 64.21 62.47 2k27 n SER 146 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2k27 n GLY 147 N 3.83 4.37 2.75 0.46 0.00 -1.26 -4.80 105.19 110.54 2k27 n GLY 147 Ca 0.57 -1.57 -0.28 0.00 0.00 0.00 0.00 46.02 44.74 2k27 n GLY 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k27 n ALA 148 N 5.82 3.31 -1.53 4.61 0.00 -1.26 -5.11 120.51 126.35 2k27 n ALA 148 Ca 0.55 -4.20 -0.29 0.00 0.00 0.00 0.00 53.44 49.50 2k27 n ALA 148 Cb 0.37 -0.96 0.15 0.00 0.00 0.00 0.00 19.45 19.01 2k27 n ALA 148 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2k27 s PRO 149 N -1.17 0.89 -0.04 0.00 0.04 -1.26 -5.10 135.00 128.36 2k27 s PRO 149 Ca 0.28 0.20 -0.31 0.00 0.04 0.00 0.00 61.00 61.21 2k27 s PRO 149 Cb -0.01 -1.82 0.12 0.00 0.04 0.00 0.00 34.50 32.83 2k27 s PRO 149 CO -0.17 -2.35 1.25 0.20 0.04 0.00 0.00 177.00 175.97 2k27 s GLY 150 N -4.08 -0.38 0.00 0.56 0.00 -1.26 -5.20 107.32 96.96 2k27 s GLY 150 Ca 0.65 0.84 0.00 0.00 0.00 0.00 0.00 44.72 46.21 2k27 s GLY 150 CO 0.54 0.19 0.00 0.61 0.00 0.00 0.00 173.10 174.44 2k27 n GLY 151 N -0.41 -1.44 3.60 0.20 0.00 -1.26 -5.20 105.19 100.68 2k27 n GLY 151 Ca -0.07 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.90 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 -0.38 -0.27 -0.02 0.00 -1.26 -5.18 107.32 100.21 2k27 s GLY 152 Ca 0.00 1.16 -0.25 0.00 0.00 0.00 0.00 44.72 45.63 2k27 s GLY 152 CO 0.00 0.31 0.79 -1.35 0.00 0.00 0.00 173.10 172.85 2k27 s SER 153 N -2.66 -0.68 -0.30 1.64 1.04 -1.26 -5.14 113.70 106.33 2k27 s SER 153 Ca 0.13 1.31 -0.29 0.00 0.48 0.00 0.00 55.95 57.58 2k27 s SER 153 Cb 0.04 1.33 0.01 0.00 0.10 0.00 0.00 66.02 67.50 2k27 s SER 153 CO -0.05 -0.23 1.14 -2.28 0.98 0.00 0.00 173.24 172.81 2k27 s HIS 154 N 0.38 3.02 -0.16 5.02 2.46 -1.26 -5.03 115.29 119.72 2k27 s HIS 154 Ca 0.00 1.11 -0.07 0.00 0.47 0.00 0.00 55.06 56.57 2k27 s HIS 154 Cb -0.05 -3.72 -0.04 0.00 -0.13 0.00 0.00 32.58 28.64 2k27 s HIS 154 CO -0.01 -1.06 0.07 -1.01 -2.47 0.00 0.00 174.74 170.26 2k27 s HIS 155 N 3.81 3.31 0.07 3.88 3.76 -1.26 -5.07 115.29 123.79 2k27 s HIS 155 Ca 0.49 0.18 -0.27 0.00 -0.15 0.00 0.00 55.06 55.31 2k27 s HIS 155 Cb -0.14 -2.04 0.09 0.00 1.11 0.00 0.00 32.58 31.61 2k27 s HIS 155 CO 0.17 0.29 1.16 -3.38 -0.85 0.00 0.00 174.74 172.13 2k27 s HIS 156 N 0.03 -0.00 0.07 1.40 -3.43 -1.26 -5.19 115.29 106.90 2k27 s HIS 156 Ca 0.06 -0.22 -0.14 0.00 -0.80 0.00 0.00 55.06 53.96 2k27 s HIS 156 Cb -0.12 0.61 0.02 0.00 -1.43 0.00 0.00 32.58 31.66 2k27 s HIS 156 CO 0.01 -0.55 0.33 -1.58 -2.00 0.00 0.00 174.74 170.94 2k27 s HIS 157 N -2.37 -0.12 0.66 0.38 2.46 -1.26 -5.17 115.29 109.87 2k27 s HIS 157 Ca 0.20 -0.08 -0.14 0.00 0.47 0.00 0.00 55.06 55.51 2k27 s HIS 157 Cb 0.00 0.13 -0.00 0.00 -0.13 0.00 0.00 32.58 32.58 2k27 s HIS 157 CO 0.01 -0.56 1.08 -3.38 -2.47 0.00 0.00 174.74 169.42 2k27 s HIS 158 N -2.97 2.80 -2.00 3.88 -3.43 -1.26 -5.35 115.29 106.96 2k27 s HIS 158 Ca -0.02 1.52 0.20 0.00 -0.80 0.00 0.00 55.06 55.96 2k27 s HIS 158 Cb 0.00 -3.06 1.17 0.00 -1.43 0.00 0.00 32.58 29.27 2k27 s HIS 158 CO -0.06 -1.45 1.56 1.58 -2.00 0.00 0.00 174.74 174.37