#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 2.54 0.01 0.03 0.04 -1.26 -4.99 135.00 131.37 2k27 s PRO 2 Ca 0.00 1.10 -0.21 0.00 0.04 0.00 0.00 61.00 61.93 2k27 s PRO 2 Cb 0.00 -1.93 -0.19 0.00 0.04 0.00 0.00 34.50 32.42 2k27 s PRO 2 CO 0.00 -1.42 1.21 1.25 0.04 0.00 0.00 177.00 178.08 2k27 h HIS 3 N -0.92 0.48 -1.37 0.56 -0.00 -2.14 -3.50 115.15 108.26 2k27 h HIS 3 Ca -0.44 -0.20 0.16 0.00 -0.00 0.00 0.00 60.37 59.89 2k27 h HIS 3 Cb 1.22 -0.08 -0.04 0.00 -0.00 0.00 0.00 27.41 28.51 2k27 h HIS 3 CO 0.59 0.93 -0.22 0.09 -0.00 0.00 0.00 177.93 179.33 2k27 n ASN 4 N -4.42 -3.66 0.00 3.26 3.02 -1.26 -5.01 115.26 107.19 2k27 n ASN 4 Ca -0.08 0.65 0.00 0.00 -0.03 0.00 0.00 54.58 55.12 2k27 n ASN 4 Cb 0.50 -1.83 0.00 0.00 -0.61 0.00 0.00 39.78 37.84 2k27 n ASN 4 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2k27 n SER 5 N -2.35 0.00 -3.15 6.41 2.88 -1.26 -5.11 113.62 111.04 2k27 n SER 5 Ca 0.00 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 57.47 2k27 n SER 5 Cb 0.28 0.10 0.00 0.00 -0.75 0.00 0.00 64.21 63.84 2k27 n SER 5 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 2k27 n ILE 6 N -1.82 -9.05 -3.16 2.46 2.08 -1.26 -4.98 119.36 103.63 2k27 n ILE 6 Ca 0.00 0.05 -0.38 0.00 0.56 0.00 0.00 62.75 62.98 2k27 n ILE 6 Cb 0.00 -6.25 -0.06 0.00 -0.75 0.00 0.00 39.64 32.58 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 -3.18 4.30 0.27 0.38 1.81 -1.26 -5.08 118.95 116.19 2k27 s ARG 7 Ca 0.07 0.87 0.02 0.00 -1.72 0.00 0.00 55.73 54.97 2k27 s ARG 7 Cb -0.02 -3.15 -0.05 0.00 -0.45 0.00 0.00 34.95 31.28 2k27 s ARG 7 CO 0.78 0.56 0.06 -1.12 -0.68 0.00 0.00 175.30 174.90 2k27 s SER 8 N -1.28 1.63 1.07 0.23 0.01 -1.26 -5.17 113.70 108.93 2k27 s SER 8 Ca 0.34 -1.34 -0.07 0.00 1.31 0.00 0.00 55.95 56.19 2k27 s SER 8 Cb -0.20 0.06 0.11 0.00 0.21 0.00 0.00 66.02 66.20 2k27 s SER 8 CO 0.22 -0.65 0.44 0.61 0.41 0.00 0.00 173.24 174.27 2k27 n GLY 9 N -0.50 -2.19 1.74 3.44 0.00 -1.26 -5.07 105.19 101.35 2k27 n GLY 9 Ca -0.02 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.47 2k27 n GLY 9 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2k27 n HIS 10 N -3.19 -1.71 0.00 1.61 8.25 -1.26 -5.18 115.22 113.75 2k27 n HIS 10 Ca 0.06 0.30 0.00 0.00 -0.26 0.00 0.00 57.72 57.82 2k27 n HIS 10 Cb 0.22 0.43 0.00 0.00 1.12 0.00 0.00 29.99 31.76 2k27 n HIS 10 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2k27 n GLY 11 N 2.03 -0.29 3.64 -1.41 0.00 -1.26 -5.18 105.19 102.73 2k27 n GLY 11 Ca 0.00 -1.12 -0.07 0.00 0.00 0.00 0.00 46.02 44.83 2k27 n GLY 11 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2k27 s GLY 12 N 0.00 0.01 0.19 -0.02 0.00 -1.26 -5.19 107.32 101.05 2k27 s GLY 12 Ca 0.00 2.93 0.03 0.00 0.00 0.00 0.00 44.72 47.68 2k27 s GLY 12 CO 0.00 1.82 -0.04 1.08 0.00 0.00 0.00 173.10 175.96 2k27 s LEU 13 N 0.08 2.29 0.01 0.66 1.02 -1.26 -5.17 118.68 116.30 2k27 s LEU 13 Ca 0.04 -1.14 -0.17 0.00 0.02 0.00 0.00 54.13 52.89 2k27 s LEU 13 Cb -0.05 -0.25 0.03 0.00 0.02 0.00 0.00 46.19 45.95 2k27 s LEU 13 CO -0.09 -0.46 0.38 0.21 0.02 0.00 0.00 176.35 176.40 2k27 s ASN 14 N -3.23 -0.25 0.19 2.29 3.84 -1.26 -5.18 114.94 111.34 2k27 s ASN 14 Ca 0.23 0.07 -0.17 0.00 0.21 0.00 0.00 52.86 53.21 2k27 s ASN 14 Cb 0.05 0.38 0.03 0.00 -0.55 0.00 0.00 41.25 41.15 2k27 s ASN 14 CO 0.05 -0.56 0.50 0.00 -2.79 0.00 0.00 177.10 174.30 2k27 s GLN 15 N -1.87 1.36 -0.41 0.43 -2.07 -1.26 -5.13 119.66 110.71 2k27 s GLN 15 Ca -0.09 -0.88 0.01 0.00 -1.82 0.00 0.00 55.36 52.58 2k27 s GLN 15 Cb -0.03 0.51 0.14 0.00 -1.09 0.00 0.00 33.01 32.54 2k27 s GLN 15 CO 0.02 -0.57 0.24 -1.17 -1.32 0.00 0.00 175.29 172.48 2k27 s LEU 16 N -2.88 2.00 0.74 2.60 1.98 -1.26 -5.13 118.68 116.73 2k27 s LEU 16 Ca 0.10 -2.49 -0.11 0.00 -2.89 0.00 0.00 54.13 48.74 2k27 s LEU 16 Cb -0.01 -0.77 0.04 0.00 0.66 0.00 0.00 46.19 46.12 2k27 s LEU 16 CO -0.03 -0.28 1.08 -0.83 -1.89 0.00 0.00 176.35 174.40 2k27 s GLY 17 N 0.60 1.67 0.00 7.98 0.00 -1.26 -3.99 107.32 112.32 2k27 s GLY 17 Ca 0.19 0.19 0.00 0.00 0.00 0.00 0.00 44.72 45.09 2k27 s GLY 17 CO -0.01 0.52 0.00 0.61 0.00 0.00 0.00 173.10 174.23 2k27 n GLY 18 N -1.52 1.77 0.70 0.20 0.00 -1.26 -4.96 105.19 100.12 2k27 n GLY 18 Ca 0.08 -0.15 0.09 0.00 0.00 0.00 0.00 46.02 46.05 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 0.00 -1.81 -3.30 4.61 0.00 -1.26 -4.84 120.51 113.92 2k27 n ALA 19 Ca 0.00 0.24 -0.25 0.00 0.00 0.00 0.00 53.44 53.43 2k27 n ALA 19 Cb 0.00 -0.64 -0.08 0.00 0.00 0.00 0.00 19.45 18.74 2k27 n ALA 19 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2k27 n PHE 20 N -2.70 0.50 -4.14 0.00 3.72 -1.26 -5.03 117.46 108.56 2k27 n PHE 20 Ca 0.00 -3.67 -0.31 0.00 -0.05 0.00 0.00 57.45 53.41 2k27 n PHE 20 Cb 0.32 -0.31 -0.07 0.00 -0.94 0.00 0.00 39.48 38.47 2k27 n PHE 20 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2k27 s VAL 21 N -1.26 4.35 -0.50 -4.37 1.01 -1.26 -5.05 120.40 113.32 2k27 s VAL 21 Ca 0.35 -0.71 -0.27 0.00 0.00 0.00 0.00 61.98 61.35 2k27 s VAL 21 Cb 0.14 -3.03 -0.04 0.00 0.00 0.00 0.00 36.38 33.44 2k27 s VAL 21 CO -0.11 0.23 2.08 0.20 0.00 0.00 0.00 175.10 177.50 2k27 s ASN 22 N -2.04 5.08 0.00 3.32 0.01 -1.26 -2.51 114.94 117.54 2k27 s ASN 22 Ca 0.25 0.87 0.00 0.00 -0.71 0.00 0.00 52.86 53.27 2k27 s ASN 22 Cb -0.12 -2.52 0.00 0.00 0.41 0.00 0.00 41.25 39.02 2k27 s ASN 22 CO 0.17 -2.43 0.00 0.61 -1.51 0.00 0.00 177.10 173.94 2k27 n GLY 23 N 5.77 4.24 3.77 0.66 0.00 -1.26 -4.91 105.19 113.46 2k27 n GLY 23 Ca 0.27 -0.69 -0.40 0.00 0.00 0.00 0.00 46.02 45.21 2k27 n GLY 23 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2k27 s ARG 24 N 0.00 3.84 -0.95 1.61 3.52 -1.04 -4.93 118.95 121.00 2k27 s ARG 24 Ca 0.00 2.38 -0.24 0.00 -0.13 0.00 0.00 55.73 57.74 2k27 s ARG 24 Cb 0.00 -2.75 0.02 0.00 -1.56 0.00 0.00 34.95 30.66 2k27 s ARG 24 CO 0.00 -0.68 1.61 -1.25 -0.81 0.00 0.00 175.30 174.17 2k27 s PRO 25 N -2.32 3.20 0.30 5.12 0.04 -1.26 -4.85 135.00 135.23 2k27 s PRO 25 Ca 0.58 -0.74 -0.29 0.00 0.04 0.00 0.00 61.00 60.59 2k27 s PRO 25 Cb -0.43 -5.15 -0.10 0.00 0.04 0.00 0.00 34.50 28.86 2k27 s PRO 25 CO 0.56 -2.59 1.19 -0.51 0.04 0.00 0.00 177.00 175.69 2k27 s LEU 26 N 6.78 4.50 0.00 -3.56 1.02 -1.26 -5.06 118.68 121.10 2k27 s LEU 26 Ca 0.54 2.46 0.00 0.00 0.02 0.00 0.00 54.13 57.14 2k27 s LEU 26 Cb -0.03 -3.64 0.00 0.00 0.02 0.00 0.00 46.19 42.54 2k27 s LEU 26 CO -0.04 -0.32 0.00 -0.81 0.02 0.00 0.00 176.35 175.20 2k27 n PRO 27 N 1.05 2.19 -0.16 1.29 -0.04 -1.26 -4.72 135.00 133.35 2k27 n PRO 27 Ca -0.01 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.45 2k27 n PRO 27 Cb 0.43 0.00 0.02 0.00 -0.04 0.00 0.00 33.50 33.92 2k27 n PRO 27 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2k27 n GLU 28 N 0.00 -0.09 -0.51 0.54 0.00 -1.26 -1.69 120.64 117.63 2k27 n GLU 28 Ca 0.00 0.64 0.42 0.00 0.00 0.00 0.00 57.16 58.22 2k27 n GLU 28 Cb 0.00 -0.95 0.70 0.00 0.00 0.00 0.00 31.44 31.20 2k27 n GLU 28 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.13 176.89 2k27 h VAL 29 N 0.00 0.01 -0.92 6.31 3.04 -2.00 -1.56 116.25 121.14 2k27 h VAL 29 Ca 0.15 -0.00 0.18 0.00 -1.01 0.00 0.00 66.70 66.02 2k27 h VAL 29 Cb 0.25 0.00 -0.07 0.00 -2.01 0.00 0.00 31.29 29.46 2k27 h VAL 29 CO -0.41 0.00 0.59 1.62 -1.01 0.00 0.00 177.57 178.36 2k27 h VAL 30 N 0.01 0.74 -0.03 1.51 3.04 -1.61 -0.84 116.25 119.07 2k27 h VAL 30 Ca 0.89 -0.20 0.01 0.00 -1.01 0.00 0.00 66.70 66.39 2k27 h VAL 30 Cb 2.98 0.12 -0.00 0.00 -2.01 0.00 0.00 31.29 32.38 2k27 h VAL 30 CO -0.40 0.10 0.03 0.08 -1.01 0.00 0.00 177.57 176.38 2k27 h ARG 31 N 0.57 0.00 0.00 4.17 -0.00 -1.53 -1.94 114.38 115.65 2k27 h ARG 31 Ca 0.48 0.00 -0.25 0.00 -0.00 0.00 0.00 59.98 60.21 2k27 h ARG 31 Cb 0.97 0.00 -0.05 0.00 -0.00 0.00 0.00 29.97 30.89 2k27 h ARG 31 CO -0.22 0.00 -1.95 0.00 -0.00 0.00 0.00 179.97 177.80 2k27 n GLN 32 N -3.78 1.47 -0.07 0.08 -0.00 -0.67 -4.55 117.38 109.88 2k27 n GLN 32 Ca -0.02 0.02 -0.10 0.00 -0.00 0.00 0.00 57.00 56.90 2k27 n GLN 32 Cb 0.12 -1.35 -0.03 0.00 -0.00 0.00 0.00 30.24 28.98 2k27 n GLN 32 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.06 176.97 2k27 h ARG 33 N 0.00 0.33 -0.60 2.61 2.43 -0.80 -2.24 114.38 116.12 2k27 h ARG 33 Ca -0.38 -0.03 0.08 0.00 -0.81 0.00 0.00 59.98 58.85 2k27 h ARG 33 Cb 1.79 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 31.23 2k27 h ARG 33 CO 0.00 0.25 0.40 0.82 -1.51 0.00 0.00 179.97 179.93 2k27 h ILE 34 N 0.32 0.94 0.60 1.20 1.08 -1.63 0.09 117.51 120.10 2k27 h ILE 34 Ca 0.09 -0.17 -0.03 0.00 -0.39 0.00 0.00 64.86 64.37 2k27 h ILE 34 Cb -0.01 0.41 0.01 0.00 -3.07 0.00 0.00 36.82 34.16 2k27 h ILE 34 CO -0.02 0.09 -0.29 0.58 -0.69 0.00 0.00 178.15 177.82 2k27 h VAL 35 N 0.48 0.40 -0.38 1.67 2.07 -1.65 -0.53 116.25 118.31 2k27 h VAL 35 Ca 0.27 -0.08 0.03 0.00 0.82 0.00 0.00 66.70 67.74 2k27 h VAL 35 Cb 0.43 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 2k27 h VAL 35 CO -0.08 0.01 0.18 -0.78 0.02 0.00 0.00 177.57 176.92 2k27 h ASP 36 N -0.86 0.26 0.25 0.57 3.58 -1.17 -1.52 116.42 117.53 2k27 h ASP 36 Ca -0.08 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.39 2k27 h ASP 36 Cb 0.64 -0.03 -0.02 0.00 1.72 0.00 0.00 39.33 41.64 2k27 h ASP 36 CO 0.14 0.19 -0.27 0.25 -2.88 0.00 0.00 179.24 176.66 2k27 h LEU 37 N 0.37 -0.73 -0.66 2.28 5.85 -0.92 -2.40 115.31 119.09 2k27 h LEU 37 Ca 0.16 0.07 0.09 0.00 0.84 0.00 0.00 57.88 59.04 2k27 h LEU 37 Cb 0.08 0.25 -0.07 0.00 0.37 0.00 0.00 40.66 41.29 2k27 h LEU 37 CO -0.12 -0.39 0.30 0.00 -0.34 0.00 0.00 178.44 177.90 2k27 h ALA 38 N 0.07 0.88 0.00 1.25 0.00 -0.99 -2.15 119.26 118.33 2k27 h ALA 38 Ca -0.00 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2k27 h ALA 38 Cb 0.53 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2k27 h ALA 38 CO -0.07 -0.10 0.00 1.58 0.00 0.00 0.00 179.25 180.66 2k27 n HIS 39 N -4.91 0.79 0.27 0.00 -0.00 -0.58 -1.20 115.22 109.58 2k27 n HIS 39 Ca 0.10 0.38 0.11 0.00 -0.00 0.00 0.00 57.72 58.31 2k27 n HIS 39 Cb 0.26 -1.12 0.75 0.00 -0.00 0.00 0.00 29.99 29.88 2k27 n HIS 39 CO 0.00 0.00 0.00 -0.56 -0.00 0.00 0.00 176.34 175.78 2k27 h GLN 40 N 0.00 0.00 0.00 1.57 3.07 -1.01 -3.46 115.11 115.28 2k27 h GLN 40 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2k27 h GLN 40 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.65 2k27 h GLN 40 CO 0.00 0.02 0.00 0.41 0.09 0.00 0.00 178.83 179.35 2k27 n GLY 41 N -1.37 0.70 2.86 0.06 0.00 -0.34 -5.16 105.19 101.93 2k27 n GLY 41 Ca -0.03 -0.39 -0.16 0.00 0.00 0.00 0.00 46.02 45.44 2k27 n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k27 s VAL 42 N -0.38 0.20 0.60 1.61 0.11 -0.87 -5.11 120.40 116.55 2k27 s VAL 42 Ca 0.00 0.01 -0.18 0.00 -2.93 0.00 0.00 61.98 58.88 2k27 s VAL 42 Cb 0.00 -0.24 -0.03 0.00 -1.53 0.00 0.00 36.38 34.58 2k27 s VAL 42 CO 0.00 0.11 1.18 -0.13 -3.33 0.00 0.00 175.10 172.93 2k27 s ARG 43 N 0.60 2.95 0.41 1.54 0.52 -1.26 -4.61 118.95 119.11 2k27 s ARG 43 Ca -0.06 1.71 0.09 0.00 -0.52 0.00 0.00 55.73 56.95 2k27 s ARG 43 Cb -0.09 -1.94 0.85 0.00 0.52 0.00 0.00 34.95 34.29 2k27 s ARG 43 CO -0.01 -1.19 2.00 -1.00 0.02 0.00 0.00 175.30 175.12 2k27 h PRO 44 N 0.73 0.38 -0.12 3.54 0.13 -2.00 -0.80 132.00 133.85 2k27 h PRO 44 Ca -0.50 -0.05 -0.00 0.00 -0.87 0.00 0.00 66.00 64.59 2k27 h PRO 44 Cb 1.28 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 2k27 h PRO 44 CO 0.55 0.35 0.08 0.00 -0.23 0.00 0.00 178.00 178.74 2k27 h ASP 46 N 0.14 0.03 -0.95 0.00 5.19 -1.55 -2.43 116.42 116.85 2k27 h ASP 46 Ca 0.04 -0.01 0.23 0.00 -0.62 0.00 0.00 57.03 56.68 2k27 h ASP 46 Cb 0.02 -0.01 -0.07 0.00 0.18 0.00 0.00 39.33 39.45 2k27 h ASP 46 CO -0.01 0.26 0.63 0.40 -3.12 0.00 0.00 179.24 177.40 2k27 h ILE 47 N 0.03 0.61 -1.02 0.35 2.04 -1.24 -0.52 117.51 117.75 2k27 h ILE 47 Ca 0.00 -0.11 0.26 0.00 1.00 0.00 0.00 64.86 66.01 2k27 h ILE 47 Cb 0.42 0.25 -0.12 0.00 -0.74 0.00 0.00 36.82 36.63 2k27 h ILE 47 CO 0.03 0.06 0.62 0.28 0.00 0.00 0.00 178.15 179.14 2k27 h SER 48 N 0.33 0.60 0.31 1.72 0.02 -1.58 -1.90 113.55 113.05 2k27 h SER 48 Ca 0.50 0.13 -0.12 0.00 -0.84 0.00 0.00 61.79 61.46 2k27 h SER 48 Cb 1.37 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.94 2k27 h SER 48 CO -0.18 0.08 -0.48 0.08 -1.14 0.00 0.00 176.83 175.19 2k27 h ARG 49 N 0.50 0.20 -0.64 3.45 -0.00 -1.29 0.45 114.38 117.06 2k27 h ARG 49 Ca 0.64 -0.11 -0.04 0.00 -0.00 0.00 0.00 59.98 60.47 2k27 h ARG 49 Cb 1.37 0.01 -0.03 0.00 -0.00 0.00 0.00 29.97 31.31 2k27 h ARG 49 CO -0.44 0.64 0.24 1.96 -0.00 0.00 0.00 179.97 182.38 2k27 h GLN 50 N 0.16 0.97 0.00 0.08 4.20 -1.46 -2.57 115.11 116.49 2k27 h GLN 50 Ca 0.01 -0.19 -0.09 0.00 0.06 0.00 0.00 58.65 58.45 2k27 h GLN 50 Cb 0.91 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.53 2k27 h GLN 50 CO 0.07 0.83 -0.49 -0.07 -0.67 0.00 0.00 178.83 178.50 2k27 h LEU 51 N 0.91 0.00 -2.34 1.46 -0.00 -1.55 -3.49 115.31 110.30 2k27 h LEU 51 Ca 0.21 0.00 -0.16 0.00 -0.00 0.00 0.00 57.88 57.93 2k27 h LEU 51 Cb 0.23 0.00 0.11 0.00 -0.00 0.00 0.00 40.66 41.00 2k27 h LEU 51 CO -0.01 0.39 -0.48 0.54 -0.00 0.00 0.00 178.44 178.88 2k27 n ARG 52 N -3.16 -2.29 -4.30 1.13 1.74 0.11 -4.98 116.66 104.93 2k27 n ARG 52 Ca 0.01 0.50 -0.16 0.00 -0.77 0.00 0.00 57.85 57.44 2k27 n ARG 52 Cb 0.70 -4.19 -0.10 0.00 -1.02 0.00 0.00 32.46 27.85 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 -3.22 0.89 0.00 1.55 -7.23 -0.98 -5.03 120.40 106.38 2k27 s VAL 53 Ca 0.16 -2.02 0.00 0.00 -1.81 0.00 0.00 61.98 58.32 2k27 s VAL 53 Cb -0.02 -2.28 0.00 0.00 0.56 0.00 0.00 36.38 34.64 2k27 s VAL 53 CO 0.43 -0.36 0.00 -1.54 -0.31 0.00 0.00 175.10 173.32 2k27 n SER 54 N -0.36 0.00 0.00 4.85 3.41 -1.26 -4.72 113.62 115.54 2k27 n SER 54 Ca -0.05 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.56 2k27 n SER 54 Cb 0.64 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.59 2k27 n SER 54 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2k27 n HIS 55 N -0.44 -1.13 -0.08 7.33 8.25 -1.26 -4.78 115.22 123.11 2k27 n HIS 55 Ca 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.38 2k27 n HIS 55 Cb 0.00 0.44 -0.01 0.00 1.12 0.00 0.00 29.99 31.54 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 0.41 0.97 -1.41 0.00 -2.02 -2.79 103.07 98.22 2k27 h GLY 56 Ca 0.00 -0.12 -0.08 0.00 0.00 0.00 0.00 47.33 47.12 2k27 h GLY 56 CO 0.00 0.11 -0.08 0.00 0.00 0.00 0.00 176.54 176.57 2k27 h VAL 58 N 0.55 0.21 -0.53 0.00 2.07 -1.80 -0.18 116.25 116.56 2k27 h VAL 58 Ca 0.10 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.69 2k27 h VAL 58 Cb 0.60 0.21 -0.10 0.00 -1.52 0.00 0.00 31.29 30.48 2k27 h VAL 58 CO 0.04 0.00 -0.50 -1.28 0.02 0.00 0.00 177.57 175.85 2k27 h SER 59 N -0.04 -1.71 -0.21 0.57 0.87 -1.61 -1.93 113.55 109.49 2k27 h SER 59 Ca 0.33 0.25 -0.19 0.00 -1.23 0.00 0.00 61.79 60.96 2k27 h SER 59 Cb 0.56 0.74 0.00 0.00 -0.44 0.00 0.00 62.40 63.26 2k27 h SER 59 CO -0.77 -0.36 -0.58 0.11 -0.53 0.00 0.00 176.83 174.70 2k27 h LYS 60 N -0.29 0.81 -0.66 2.24 1.79 -1.20 -2.05 116.57 117.21 2k27 h LYS 60 Ca 0.13 -0.53 -0.08 0.00 -2.18 0.00 0.00 60.65 57.99 2k27 h LYS 60 Cb 0.57 0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 31.26 2k27 h LYS 60 CO -0.66 1.16 0.11 -0.84 -1.08 0.00 0.00 179.45 178.14 2k27 h ILE 61 N 0.61 1.26 -0.69 1.86 3.07 -1.08 -2.18 117.51 120.37 2k27 h ILE 61 Ca 0.00 -1.03 -0.03 0.00 1.55 0.00 0.00 64.86 65.35 2k27 h ILE 61 Cb 1.18 0.64 -0.03 0.00 -0.27 0.00 0.00 36.82 38.34 2k27 h ILE 61 CO 0.12 0.39 0.31 -0.07 -1.05 0.00 0.00 178.15 177.85 2k27 h LEU 62 N 1.02 0.90 0.00 0.16 -0.00 -1.33 -3.46 115.31 112.60 2k27 h LEU 62 Ca 0.20 -0.11 0.00 0.00 -0.00 0.00 0.00 57.88 57.97 2k27 h LEU 62 Cb 0.44 -0.23 0.00 0.00 -0.00 0.00 0.00 40.66 40.87 2k27 h LEU 62 CO 0.01 0.78 0.00 0.61 -0.00 0.00 0.00 178.44 179.84 2k27 n GLY 63 N -1.05 1.62 0.24 0.83 0.00 -0.78 -4.90 105.19 101.16 2k27 n GLY 63 Ca 0.06 -0.16 -0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 0.38 0.00 1.61 -0.00 -1.78 -3.33 114.38 111.26 2k27 h ARG 64 Ca 0.00 -0.11 0.00 0.00 -0.50 0.00 0.00 59.98 59.37 2k27 h ARG 64 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 29.97 29.93 2k27 h ARG 64 CO 0.00 0.54 0.00 0.66 0.00 0.00 0.00 179.97 181.17 2k27 n TYR 65 N -4.20 0.00 -3.17 3.04 4.01 -1.26 -4.40 117.16 111.17 2k27 n TYR 65 Ca -0.00 0.00 -0.45 0.00 -0.16 0.00 0.00 57.90 57.29 2k27 n TYR 65 Cb 0.32 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.34 2k27 n TYR 65 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 2k27 s TYR 66 N 0.00 3.78 0.00 -0.72 5.04 -1.26 -5.00 117.35 119.19 2k27 s TYR 66 Ca 0.00 -2.19 0.00 0.00 -2.44 0.00 0.00 57.07 52.44 2k27 s TYR 66 Cb 0.00 -4.02 0.00 0.00 0.35 0.00 0.00 41.96 38.29 2k27 s TYR 66 CO 0.00 -1.16 0.00 0.39 -1.34 0.00 0.00 175.55 173.44 2k27 n GLU 67 N 4.34 0.00 -3.57 4.97 1.02 -1.26 -4.86 120.64 121.28 2k27 n GLU 67 Ca 0.25 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 57.17 2k27 n GLU 67 Cb 0.43 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.86 2k27 n GLU 67 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2k27 n THR 68 N 0.00 -2.75 0.00 2.62 -2.24 -1.26 -1.93 114.28 108.72 2k27 n THR 68 Ca 0.00 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2k27 n THR 68 Cb 0.00 -2.46 0.00 0.00 -2.10 0.00 0.00 70.33 65.77 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 -1.37 1.87 0.00 3.38 0.00 -1.26 -4.91 105.19 102.90 2k27 n GLY 69 Ca -0.26 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.55 2k27 n GLY 69 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2k27 n SER 70 N 3.49 0.00 -4.20 1.61 2.88 -0.81 -4.65 113.62 111.94 2k27 n SER 70 Ca 0.00 -0.86 -0.39 0.00 -1.33 0.00 0.00 58.87 56.29 2k27 n SER 70 Cb 0.00 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.42 2k27 n SER 70 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 2k27 n ILE 71 N -1.60 -1.90 -3.15 2.46 5.41 -1.26 -4.45 119.36 114.86 2k27 n ILE 71 Ca 0.00 -0.55 -0.22 0.00 1.00 0.00 0.00 62.75 62.98 2k27 n ILE 71 Cb 0.00 -1.68 -0.06 0.00 -0.71 0.00 0.00 39.64 37.19 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 -4.84 0.67 -1.60 0.38 5.12 -1.26 -4.51 116.66 110.62 2k27 n ARG 72 Ca -0.22 -3.04 -0.42 0.00 -1.93 0.00 0.00 57.85 52.24 2k27 n ARG 72 Cb 0.63 -1.28 -0.01 0.00 -1.16 0.00 0.00 32.46 30.64 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 1.58 2.60 0.00 5.56 -0.04 -1.26 -4.30 135.00 139.14 2k27 n PRO 73 Ca 0.20 -2.43 0.00 0.00 -0.04 0.00 0.00 63.50 61.23 2k27 n PRO 73 Cb 0.54 -3.20 0.00 0.00 -0.04 0.00 0.00 33.50 30.80 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 4.17 1.17 1.60 0.55 0.00 -1.26 -5.11 105.19 106.30 2k27 n GLY 74 Ca 0.52 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.62 2k27 n GLY 74 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2k27 n VAL 75 N 0.00 0.00 -2.04 1.61 3.14 -1.26 -5.10 118.33 114.68 2k27 n VAL 75 Ca 0.00 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 60.96 2k27 n VAL 75 Cb 0.00 -0.16 -0.03 0.00 -1.06 0.00 0.00 33.84 32.59 2k27 n VAL 75 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 2k27 s ILE 76 N -1.80 3.01 -0.45 1.55 1.01 -1.26 -4.95 121.20 118.32 2k27 s ILE 76 Ca 0.00 0.68 0.09 0.00 0.00 0.00 0.00 60.65 61.42 2k27 s ILE 76 Cb 0.00 -3.43 0.32 0.00 0.01 0.00 0.00 42.46 39.36 2k27 s ILE 76 CO 0.00 0.04 0.74 0.61 0.00 0.00 0.00 174.94 176.33 2k27 n GLY 77 N 3.69 4.02 3.78 6.18 0.00 -1.26 -5.12 105.19 116.48 2k27 n GLY 77 Ca 0.13 -2.01 -0.32 0.00 0.00 0.00 0.00 46.02 43.82 2k27 n GLY 77 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2k27 s GLY 78 N -2.43 1.98 0.46 -0.02 0.00 -1.26 -5.00 107.32 101.06 2k27 s GLY 78 Ca 0.41 0.41 -0.24 0.00 0.00 0.00 0.00 44.72 45.30 2k27 s GLY 78 CO -0.09 0.75 1.34 -0.56 0.00 0.00 0.00 173.10 174.53 2k27 s SER 79 N -2.94 5.87 -0.72 1.64 0.01 -1.26 -5.00 113.70 111.31 2k27 s SER 79 Ca 0.64 2.72 0.05 0.00 1.31 0.00 0.00 55.95 60.67 2k27 s SER 79 Cb -0.18 -2.64 0.18 0.00 0.21 0.00 0.00 66.02 63.59 2k27 s SER 79 CO 0.46 -1.16 0.55 1.17 0.41 0.00 0.00 173.24 174.67 2k27 n LYS 80 N -0.37 1.97 -1.64 12.44 4.81 -1.26 -5.10 118.16 129.01 2k27 n LYS 80 Ca 0.06 -4.52 -0.30 0.00 -0.87 0.00 0.00 58.31 52.69 2k27 n LYS 80 Cb 0.44 -2.30 0.19 0.00 0.02 0.00 0.00 35.03 33.38 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 -1.58 0.24 0.00 1.64 0.04 -1.26 -5.11 135.00 128.97 2k27 s PRO 81 Ca 0.27 -0.20 0.00 0.00 0.04 0.00 0.00 61.00 61.10 2k27 s PRO 81 Cb -0.02 -1.78 0.00 0.00 0.04 0.00 0.00 34.50 32.74 2k27 s PRO 81 CO -0.15 -2.72 0.00 1.63 0.04 0.00 0.00 177.00 175.80 2k27 n LYS 82 N -4.03 3.98 -4.01 4.56 4.76 -1.26 -5.16 118.16 117.00 2k27 n LYS 82 Ca 0.13 0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.48 2k27 n LYS 82 Cb 0.59 0.00 -0.11 0.00 -1.84 0.00 0.00 35.03 33.68 2k27 n LYS 82 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2k27 s VAL 83 N 2.84 0.16 0.64 -0.18 0.11 -1.26 -5.16 120.40 117.56 2k27 s VAL 83 Ca 0.00 -1.10 -0.16 0.00 -2.93 0.00 0.00 61.98 57.80 2k27 s VAL 83 Cb 0.00 -0.53 -0.01 0.00 -1.53 0.00 0.00 36.38 34.32 2k27 s VAL 83 CO 0.00 -0.59 1.13 0.00 -3.33 0.00 0.00 175.10 172.31 2k27 s ALA 84 N -1.93 2.48 -0.20 1.54 0.00 -1.26 -5.06 121.76 117.34 2k27 s ALA 84 Ca -0.11 0.65 -0.03 0.00 0.00 0.00 0.00 51.96 52.46 2k27 s ALA 84 Cb -0.07 -3.34 0.06 0.00 0.00 0.00 0.00 23.12 19.77 2k27 s ALA 84 CO -0.03 -1.23 0.05 -0.08 0.00 0.00 0.00 175.76 174.48 2k27 s THR 85 N -2.17 0.39 0.05 0.00 -1.32 -1.26 -5.04 115.64 106.28 2k27 s THR 85 Ca 0.69 -0.53 0.13 0.00 -1.21 0.00 0.00 61.69 60.77 2k27 s THR 85 Cb -0.22 -0.97 0.00 0.00 -1.51 0.00 0.00 72.50 69.80 2k27 s THR 85 CO 0.39 -0.28 1.50 1.55 -2.21 0.00 0.00 174.62 175.57 2k27 h PRO 86 N 8.28 0.00 -0.01 7.08 0.13 -1.97 -3.27 132.00 142.24 2k27 h PRO 86 Ca -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 2k27 h PRO 86 Cb 1.12 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 2k27 h PRO 86 CO 0.34 0.61 0.04 -0.22 -0.23 0.00 0.00 178.00 178.54 2k27 h LYS 87 N 0.00 0.00 -0.77 0.86 3.64 -2.03 -1.53 116.57 116.74 2k27 h LYS 87 Ca -0.01 0.00 0.19 0.00 -1.27 0.00 0.00 60.65 59.56 2k27 h LYS 87 Cb 1.31 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 33.09 2k27 h LYS 87 CO 0.08 0.00 0.53 0.28 -2.27 0.00 0.00 179.45 178.07 2k27 h VAL 88 N 0.00 0.70 -0.79 2.00 2.07 -2.00 -0.82 116.25 117.42 2k27 h VAL 88 Ca 0.00 -0.08 0.12 0.00 0.82 0.00 0.00 66.70 67.56 2k27 h VAL 88 Cb 0.09 0.45 -0.08 0.00 -1.52 0.00 0.00 31.29 30.22 2k27 h VAL 88 CO -0.00 0.04 0.40 0.58 0.02 0.00 0.00 177.57 178.61 2k27 h VAL 89 N 0.23 0.78 0.00 2.57 2.07 -1.55 -1.65 116.25 118.71 2k27 h VAL 89 Ca 0.38 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.68 2k27 h VAL 89 Cb 1.15 0.11 -0.00 0.00 -1.52 0.00 0.00 31.29 31.03 2k27 h VAL 89 CO -0.09 0.11 -0.04 -0.33 0.02 0.00 0.00 177.57 177.25 2k27 h GLU 90 N 0.62 0.00 -0.62 1.57 5.08 -1.35 -2.69 114.58 117.20 2k27 h GLU 90 Ca 0.41 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.71 2k27 h GLU 90 Cb 0.51 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.74 2k27 h GLU 90 CO -0.32 0.04 0.14 0.87 -1.00 0.00 0.00 179.01 178.73 2k27 h LYS 91 N 0.00 0.97 -0.72 2.33 1.79 -1.38 0.18 116.57 119.74 2k27 h LYS 91 Ca -0.00 -0.22 -0.02 0.00 -2.18 0.00 0.00 60.65 58.23 2k27 h LYS 91 Cb 0.09 -0.13 -0.03 0.00 -1.58 0.00 0.00 32.23 30.57 2k27 h LYS 91 CO 0.00 0.87 0.38 0.82 -1.08 0.00 0.00 179.45 180.44 2k27 h ILE 92 N 0.92 1.23 -0.49 1.86 5.03 -1.58 -0.59 117.51 123.89 2k27 h ILE 92 Ca 0.20 -0.59 0.10 0.00 -0.12 0.00 0.00 64.86 64.45 2k27 h ILE 92 Cb 0.34 0.30 -0.10 0.00 -3.03 0.00 0.00 36.82 34.33 2k27 h ILE 92 CO 0.00 0.25 -0.16 1.23 -0.68 0.00 0.00 178.15 178.80 2k27 h GLY 93 N 1.00 0.28 0.99 5.37 0.00 -1.18 0.31 103.07 109.83 2k27 h GLY 93 Ca 0.25 0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.78 2k27 h GLY 93 CO -0.04 -0.20 -0.09 -0.55 0.00 0.00 0.00 176.54 175.67 2k27 h ASP 94 N -0.04 -0.21 -0.02 0.19 3.32 -0.54 -3.07 116.42 116.05 2k27 h ASP 94 Ca 0.24 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.27 2k27 h ASP 94 Cb 0.40 0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.00 2k27 h ASP 94 CO -0.53 -0.15 -0.04 1.88 -1.72 0.00 0.00 179.24 178.69 2k27 h TYR 95 N -0.24 0.15 -0.30 4.55 0.05 -0.54 0.43 116.97 121.07 2k27 h TYR 95 Ca -0.02 -0.01 -0.00 0.00 0.05 0.00 0.00 58.73 58.75 2k27 h TYR 95 Cb 0.19 -0.05 -0.02 0.00 1.01 0.00 0.00 36.73 37.87 2k27 h TYR 95 CO -0.07 0.20 0.18 0.87 -1.05 0.00 0.00 178.16 178.29 2k27 h LYS 96 N 0.15 0.40 0.06 4.88 1.79 -0.86 0.36 116.57 123.35 2k27 h LYS 96 Ca 0.04 -0.03 -0.13 0.00 -2.18 0.00 0.00 60.65 58.34 2k27 h LYS 96 Cb 0.17 -0.09 0.01 0.00 -1.58 0.00 0.00 32.23 30.74 2k27 h LYS 96 CO 0.01 0.28 -0.56 0.00 -1.08 0.00 0.00 179.45 178.10 2k27 h ARG 97 N 0.41 0.27 0.57 3.15 3.08 -0.94 -3.38 114.38 117.53 2k27 h ARG 97 Ca 0.11 -0.37 -0.03 0.00 0.07 0.00 0.00 59.98 59.76 2k27 h ARG 97 Cb -0.02 0.13 0.01 0.00 0.08 0.00 0.00 29.97 30.16 2k27 h ARG 97 CO -0.02 1.12 -0.27 1.96 -1.07 0.00 0.00 179.97 181.69 2k27 h GLN 98 N -0.41 -0.73 -7.42 0.04 4.20 -1.06 -3.44 115.11 106.29 2k27 h GLN 98 Ca -0.09 0.05 -0.49 0.00 0.06 0.00 0.00 58.65 58.18 2k27 h GLN 98 Cb 1.37 0.17 0.11 0.00 0.30 0.00 0.00 27.48 29.42 2k27 h GLN 98 CO 0.11 -0.43 0.35 -0.80 -0.67 0.00 0.00 178.83 177.39 2k27 s ASN 99 N -4.64 4.69 1.37 1.46 0.01 0.10 -5.09 114.94 112.85 2k27 s ASN 99 Ca -0.15 1.29 -0.21 0.00 -0.71 0.00 0.00 52.86 53.07 2k27 s ASN 99 Cb 0.02 -2.04 0.33 0.00 0.41 0.00 0.00 41.25 39.97 2k27 s ASN 99 CO 0.53 -1.84 0.87 -0.81 -1.51 0.00 0.00 177.10 174.35 2k27 n PRO 100 N -3.35 -4.07 -1.38 -0.60 -0.04 -1.26 -4.74 135.00 119.56 2k27 n PRO 100 Ca 0.07 -1.44 -0.40 0.00 -0.04 0.00 0.00 63.50 61.69 2k27 n PRO 100 Cb 0.56 -1.66 -0.02 0.00 -0.04 0.00 0.00 33.50 32.34 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 -5.28 2.88 -2.45 0.52 -2.24 -1.26 -4.87 114.28 101.57 2k27 n THR 101 Ca 0.13 -2.31 -0.23 0.00 -2.27 0.00 0.00 64.05 59.37 2k27 n THR 101 Cb 0.55 -2.46 0.06 0.00 -2.10 0.00 0.00 70.33 66.37 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 3.73 2.32 0.77 -0.78 -1.94 -1.26 -5.08 119.30 117.05 2k27 s MET 102 Ca 0.52 -0.60 -0.11 0.00 -1.71 0.00 0.00 55.69 53.80 2k27 s MET 102 Cb 0.14 -2.34 0.05 0.00 2.01 0.00 0.00 34.83 34.69 2k27 s MET 102 CO -0.01 -1.00 1.09 -0.06 -0.01 0.00 0.00 175.02 175.04 2k27 s PHE 103 N -2.99 2.56 0.20 -0.03 0.08 -1.26 -4.93 117.98 111.61 2k27 s PHE 103 Ca 0.59 1.56 -0.10 0.00 0.12 0.00 0.00 56.93 59.11 2k27 s PHE 103 Cb -0.10 -3.06 0.14 0.00 -0.57 0.00 0.00 43.02 39.43 2k27 s PHE 103 CO 0.41 -1.81 1.81 0.00 -0.10 0.00 0.00 175.22 175.54 2k27 h ALA 104 N -1.06 0.95 -0.17 5.36 0.00 -1.98 -2.82 119.26 119.55 2k27 h ALA 104 Ca -0.44 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.29 2k27 h ALA 104 Cb 1.23 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 2k27 h ALA 104 CO 0.51 0.48 -0.12 0.11 0.00 0.00 0.00 179.25 180.23 2k27 h TRP 105 N 1.03 0.45 -0.42 0.00 0.09 -1.93 -0.34 115.95 114.82 2k27 h TRP 105 Ca 0.26 -0.12 0.08 0.00 0.09 0.00 0.00 58.89 59.20 2k27 h TRP 105 Cb 0.06 -0.10 -0.08 0.00 0.08 0.00 0.00 29.16 29.12 2k27 h TRP 105 CO 0.00 0.72 -0.10 0.93 0.09 0.00 0.00 178.44 180.09 2k27 h GLU 106 N 0.05 0.01 0.00 0.12 4.39 -1.95 -1.88 114.58 115.31 2k27 h GLU 106 Ca 0.03 -0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.59 2k27 h GLU 106 Cb 0.63 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.25 2k27 h GLU 106 CO 0.03 0.00 -0.70 0.82 -1.16 0.00 0.00 179.01 178.01 2k27 h ILE 107 N 0.01 1.33 0.23 3.13 2.04 -1.37 -1.96 117.51 120.91 2k27 h ILE 107 Ca 0.20 -2.55 0.01 0.00 1.00 0.00 0.00 64.86 63.52 2k27 h ILE 107 Cb 0.31 2.45 -0.03 0.00 -0.74 0.00 0.00 36.82 38.81 2k27 h ILE 107 CO -0.43 0.69 -0.31 -0.09 0.00 0.00 0.00 178.15 178.01 2k27 h ARG 108 N 0.00 -0.58 0.00 2.37 1.12 -0.79 -2.49 114.38 114.02 2k27 h ARG 108 Ca -0.01 0.04 0.00 0.00 -1.11 0.00 0.00 59.98 58.90 2k27 h ARG 108 Cb 1.39 0.13 0.00 0.00 -0.01 0.00 0.00 29.97 31.48 2k27 h ARG 108 CO 0.09 -0.39 0.00 -0.25 -3.11 0.00 0.00 179.97 176.32 2k27 n ASP 109 N -5.42 0.08 -0.29 -3.80 9.92 -0.73 -2.21 116.55 114.10 2k27 n ASP 109 Ca -0.08 0.53 -0.02 0.00 -0.53 0.00 0.00 54.79 54.68 2k27 n ASP 109 Cb 0.32 -0.54 0.09 0.00 -0.64 0.00 0.00 41.12 40.36 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 0.96 -0.60 -1.24 9.65 -0.88 -0.40 114.38 121.88 2k27 h ARG 110 Ca 0.00 -0.06 0.07 0.00 -1.10 0.00 0.00 59.98 58.89 2k27 h ARG 110 Cb 0.14 -0.22 -0.06 0.00 -1.39 0.00 0.00 29.97 28.44 2k27 h ARG 110 CO 0.00 0.64 0.28 -0.07 2.80 0.00 0.00 179.97 183.62 2k27 h LEU 111 N 0.99 0.36 -0.23 3.80 3.38 -1.58 0.23 115.31 122.27 2k27 h LEU 111 Ca 0.31 0.05 -0.08 0.00 0.09 0.00 0.00 57.88 58.25 2k27 h LEU 111 Cb -0.00 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 2k27 h LEU 111 CO -0.11 0.23 -0.19 -0.07 0.09 0.00 0.00 178.44 178.40 2k27 h LEU 112 N 0.51 0.56 -0.71 1.67 3.38 -1.61 -0.01 115.31 119.10 2k27 h LEU 112 Ca 0.28 -0.46 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 2k27 h LEU 112 Cb 0.26 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 2k27 h LEU 112 CO -0.23 0.90 0.39 0.00 0.09 0.00 0.00 178.44 179.59 2k27 h ALA 113 N 0.68 0.91 -0.35 1.53 0.00 -0.81 -2.67 119.26 118.55 2k27 h ALA 113 Ca 0.04 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 2k27 h ALA 113 Cb 0.72 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2k27 h ALA 113 CO 0.05 0.42 -0.03 0.93 0.00 0.00 0.00 179.25 180.62 2k27 h GLU 114 N 0.97 0.64 -0.70 0.00 5.08 -0.95 -3.48 114.58 116.14 2k27 h GLU 114 Ca 0.25 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2k27 h GLU 114 Cb 0.03 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.23 2k27 h GLU 114 CO -0.04 0.77 0.00 0.41 -1.00 0.00 0.00 179.01 179.15 2k27 n GLY 115 N -0.29 0.66 0.13 -3.84 0.00 -0.17 -5.06 105.19 96.61 2k27 n GLY 115 Ca -0.02 -0.35 -0.22 0.00 0.00 0.00 0.00 46.02 45.43 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 -0.35 1.59 -4.06 1.61 0.31 -0.29 -5.04 118.33 112.10 2k27 n VAL 116 Ca 0.00 -0.46 -0.12 0.00 -0.01 0.00 0.00 64.34 63.75 2k27 n VAL 116 Cb 0.15 -1.71 -0.05 0.00 -0.91 0.00 0.00 33.84 31.31 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 -3.12 6.38 0.57 0.00 2.15 -1.26 -4.68 116.67 116.71 2k27 s ASP 118 Ca 0.28 1.44 0.27 0.00 0.43 0.00 0.00 52.55 54.98 2k27 s ASP 118 Cb 0.00 -2.47 1.50 0.00 -0.30 0.00 0.00 42.92 41.65 2k27 s ASP 118 CO 0.14 -0.74 1.99 0.78 -0.17 0.00 0.00 175.17 177.17 2k27 h ASN 119 N 0.19 0.00 0.00 -0.34 4.21 -2.00 -1.54 115.58 116.11 2k27 h ASN 119 Ca -0.45 0.00 -0.17 0.00 1.21 0.00 0.00 56.30 56.89 2k27 h ASN 119 Cb 1.19 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 38.36 2k27 h ASN 119 CO 0.62 0.00 -0.97 -0.78 -1.29 0.00 0.00 177.43 175.01 2k27 h ASP 120 N 0.00 0.00 0.16 5.81 3.58 -2.02 -3.40 116.42 120.54 2k27 h ASP 120 Ca 0.20 -0.53 -0.06 0.00 0.42 0.00 0.00 57.03 57.06 2k27 h ASP 120 Cb 0.93 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.97 2k27 h ASP 120 CO -0.00 1.33 -0.22 0.71 -2.88 0.00 0.00 179.24 178.18 2k27 h THR 121 N -1.00 1.19 -2.22 2.25 1.35 -1.87 -3.44 112.91 109.17 2k27 h THR 121 Ca -0.26 -0.90 -0.62 0.00 -0.55 0.00 0.00 66.41 64.08 2k27 h THR 121 Cb 1.16 1.38 0.08 0.00 -1.73 0.00 0.00 68.15 69.04 2k27 h THR 121 CO -0.16 0.27 0.34 0.55 -0.25 0.00 0.00 175.52 176.27 2k27 n VAL 122 N -4.23 1.08 -1.75 6.82 3.14 -0.61 -4.88 118.33 117.89 2k27 n VAL 122 Ca -0.02 -0.27 -0.33 0.00 -2.96 0.00 0.00 64.34 60.76 2k27 n VAL 122 Cb 0.31 -1.04 0.05 0.00 -1.06 0.00 0.00 33.84 32.09 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 -0.57 2.79 0.50 1.45 0.04 -1.26 -4.99 135.00 132.95 2k27 s PRO 123 Ca 0.69 1.40 -0.21 0.00 0.04 0.00 0.00 61.00 62.93 2k27 s PRO 123 Cb -0.77 -1.95 -0.07 0.00 0.04 0.00 0.00 34.50 31.75 2k27 s PRO 123 CO 0.53 -1.26 1.12 -1.12 0.04 0.00 0.00 177.00 176.31 2k27 s SER 124 N -2.56 6.02 0.22 6.66 0.01 -1.26 -4.90 113.70 117.89 2k27 s SER 124 Ca 0.67 2.17 -0.09 0.00 1.31 0.00 0.00 55.95 60.02 2k27 s SER 124 Cb -0.21 -2.59 0.22 0.00 0.21 0.00 0.00 66.02 63.66 2k27 s SER 124 CO 0.41 -1.01 1.87 0.58 0.41 0.00 0.00 173.24 175.50 2k27 h VAL 125 N 1.53 1.13 -0.62 3.43 2.07 -1.94 -1.53 116.25 120.33 2k27 h VAL 125 Ca -0.50 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 66.68 2k27 h VAL 125 Cb 1.25 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.04 2k27 h VAL 125 CO 0.59 0.18 0.37 0.77 0.02 0.00 0.00 177.57 179.49 2k27 h SER 126 N 0.99 0.75 0.74 0.57 4.64 -1.98 -2.85 113.55 116.41 2k27 h SER 126 Ca 0.31 -0.07 -0.04 0.00 -0.47 0.00 0.00 61.79 61.53 2k27 h SER 126 Cb -0.01 -0.19 0.01 0.00 -0.31 0.00 0.00 62.40 61.90 2k27 h SER 126 CO -0.11 0.60 -0.35 -1.28 -0.87 0.00 0.00 176.83 174.82 2k27 h SER 127 N 0.84 -0.84 -0.81 4.97 0.87 -1.71 -0.95 113.55 115.91 2k27 h SER 127 Ca 0.22 0.02 0.17 0.00 -1.23 0.00 0.00 61.79 60.97 2k27 h SER 127 Cb -0.01 0.22 -0.10 0.00 -0.44 0.00 0.00 62.40 62.06 2k27 h SER 127 CO -0.04 -0.47 0.34 0.16 -0.53 0.00 0.00 176.83 176.29 2k27 h ILE 128 N -1.24 0.60 -0.10 2.23 3.07 -1.41 -1.73 117.51 118.94 2k27 h ILE 128 Ca -0.10 -0.15 -0.01 0.00 1.55 0.00 0.00 64.86 66.15 2k27 h ILE 128 Cb 0.77 0.12 -0.00 0.00 -0.27 0.00 0.00 36.82 37.43 2k27 h ILE 128 CO 0.17 0.08 0.03 -1.13 -1.05 0.00 0.00 178.15 176.25 2k27 h ASN 129 N 0.45 0.15 -0.82 2.16 -1.24 -1.44 -2.93 115.58 111.91 2k27 h ASN 129 Ca 0.46 -0.22 0.14 0.00 0.71 0.00 0.00 56.30 57.40 2k27 h ASN 129 Cb 0.76 -0.04 -0.06 0.00 0.73 0.00 0.00 38.32 39.71 2k27 h ASN 129 CO -0.44 0.32 0.54 0.03 -1.29 0.00 0.00 177.43 176.58 2k27 h ARG 130 N -0.04 0.53 0.22 6.67 2.47 -0.31 -1.91 114.38 122.01 2k27 h ARG 130 Ca 0.03 -0.03 -0.01 0.00 -1.26 0.00 0.00 59.98 58.71 2k27 h ARG 130 Cb 0.23 -0.12 0.00 0.00 -1.65 0.00 0.00 29.97 28.43 2k27 h ARG 130 CO -0.00 0.35 -0.11 0.82 0.56 0.00 0.00 179.97 181.59 2k27 h ILE 131 N 0.54 0.80 -0.06 2.04 1.08 -1.20 -3.07 117.51 117.65 2k27 h ILE 131 Ca 0.40 -0.11 -0.03 0.00 -0.39 0.00 0.00 64.86 64.74 2k27 h ILE 131 Cb 0.78 0.87 -0.01 0.00 -3.07 0.00 0.00 36.82 35.40 2k27 h ILE 131 CO -0.16 0.03 -0.08 0.40 -0.69 0.00 0.00 178.15 177.65 2k27 h ILE 132 N -0.35 1.10 -0.71 -0.67 1.08 -1.32 -2.10 117.51 114.53 2k27 h ILE 132 Ca -0.03 -0.43 0.16 0.00 -0.39 0.00 0.00 64.86 64.16 2k27 h ILE 132 Cb 0.27 1.15 -0.11 0.00 -3.07 0.00 0.00 36.82 35.06 2k27 h ILE 132 CO 0.05 0.13 0.10 0.03 -0.69 0.00 0.00 178.15 177.77 2k27 h ARG 133 N 0.08 0.19 0.00 2.37 3.08 -1.35 -0.04 114.38 118.71 2k27 h ARG 133 Ca 0.02 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.06 2k27 h ARG 133 Cb 0.20 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.21 2k27 h ARG 133 CO 0.01 0.13 0.00 1.79 -1.07 0.00 0.00 179.97 180.83 2k27 h THR 134 N 0.20 0.00 0.00 2.04 1.35 -1.46 -3.40 112.91 111.63 2k27 h THR 134 Ca 0.39 -0.58 0.00 0.00 -0.55 0.00 0.00 66.41 65.67 2k27 h THR 134 Cb 0.67 1.57 0.00 0.00 -1.73 0.00 0.00 68.15 68.67 2k27 h THR 134 CO -0.55 0.00 0.00 0.29 -0.25 0.00 0.00 175.52 175.01 2k27 n LYS 135 N -3.05 0.00 -3.35 4.72 4.01 -0.15 -5.05 118.16 115.30 2k27 n LYS 135 Ca 0.01 0.00 -0.14 0.00 -0.51 0.00 0.00 58.31 57.67 2k27 n LYS 135 Cb 0.34 0.00 -0.07 0.00 -0.51 0.00 0.00 35.03 34.79 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 0.55 -0.46 0.57 -0.18 1.01 -0.50 -5.08 120.40 116.31 2k27 s VAL 136 Ca 0.00 -0.64 -0.18 0.00 0.00 0.00 0.00 61.98 61.16 2k27 s VAL 136 Cb 0.00 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.54 2k27 s VAL 136 CO 0.00 -0.45 1.12 -1.10 0.00 0.00 0.00 175.10 174.66 2k27 s GLN 137 N 1.96 3.24 -0.53 2.72 -1.52 -1.19 -4.90 119.66 119.43 2k27 s GLN 137 Ca 0.13 1.52 0.05 0.00 -1.95 0.00 0.00 55.36 55.12 2k27 s GLN 137 Cb -0.14 -2.00 0.19 0.00 -0.22 0.00 0.00 33.01 30.85 2k27 s GLN 137 CO -0.18 -0.92 0.47 1.04 -0.25 0.00 0.00 175.29 175.45 2k27 n GLN 138 N -1.60 1.07 -2.05 2.91 1.13 -1.26 -5.09 117.38 112.50 2k27 n GLN 138 Ca 0.11 -3.78 -0.33 0.00 -1.94 0.00 0.00 57.00 51.07 2k27 n GLN 138 Cb 0.51 -1.86 0.01 0.00 0.11 0.00 0.00 30.24 29.01 2k27 n GLN 138 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 2k27 s PRO 139 N -0.92 3.32 -1.53 -1.09 0.04 -1.26 -4.93 135.00 128.63 2k27 s PRO 139 Ca 0.32 1.21 -0.09 0.00 0.04 0.00 0.00 61.00 62.48 2k27 s PRO 139 Cb 0.05 -2.03 -0.02 0.00 0.04 0.00 0.00 34.50 32.53 2k27 s PRO 139 CO -0.15 -0.81 2.78 1.19 0.04 0.00 0.00 177.00 180.05 2k27 n PHE 140 N -2.02 2.48 -3.56 0.56 3.01 -1.26 -4.92 117.46 111.74 2k27 n PHE 140 Ca 0.09 -3.01 -0.20 0.00 1.01 0.00 0.00 57.45 55.34 2k27 n PHE 140 Cb 0.53 -2.29 -0.01 0.00 -0.01 0.00 0.00 39.48 37.70 2k27 n PHE 140 CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 2k27 s ASN 141 N 1.60 5.78 -0.01 4.37 3.84 -1.26 -5.15 114.94 124.12 2k27 s ASN 141 Ca 0.65 -0.27 -0.11 0.00 0.21 0.00 0.00 52.86 53.34 2k27 s ASN 141 Cb 0.18 -1.16 0.01 0.00 -0.55 0.00 0.00 41.25 39.73 2k27 s ASN 141 CO -0.07 -0.41 0.22 -1.48 -2.79 0.00 0.00 177.10 172.57 2k27 s LEU 142 N -4.12 1.20 0.70 3.21 2.34 -1.26 -5.17 118.68 115.57 2k27 s LEU 142 Ca 0.44 -0.06 -0.11 0.00 0.06 0.00 0.00 54.13 54.46 2k27 s LEU 142 Cb -0.08 0.97 0.01 0.00 -0.56 0.00 0.00 46.19 46.52 2k27 s LEU 142 CO 0.30 -0.41 1.06 -2.16 -1.06 0.00 0.00 176.35 174.08 2k27 s PRO 143 N -1.36 2.93 0.07 1.48 0.04 -1.26 -5.10 135.00 131.80 2k27 s PRO 143 Ca -0.14 0.90 -0.03 0.00 0.04 0.00 0.00 61.00 61.77 2k27 s PRO 143 Cb -0.06 -1.99 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 2k27 s PRO 143 CO 0.03 -1.09 0.04 -1.64 0.04 0.00 0.00 177.00 174.38 2k27 s MET 144 N -5.07 0.71 0.11 4.56 -1.94 -1.26 -5.19 119.30 111.22 2k27 s MET 144 Ca 0.58 -1.19 -0.12 0.00 -1.71 0.00 0.00 55.69 53.25 2k27 s MET 144 Cb -0.14 0.25 0.02 0.00 2.01 0.00 0.00 34.83 36.97 2k27 s MET 144 CO 0.55 -0.17 0.30 0.34 -0.01 0.00 0.00 175.02 176.03 2k27 s ASP 145 N -2.92 -0.06 -0.33 3.03 2.15 -1.26 -5.07 116.67 112.20 2k27 s ASP 145 Ca 0.09 -0.50 0.16 0.00 0.43 0.00 0.00 52.55 52.73 2k27 s ASP 145 Cb 0.07 0.41 0.45 0.00 -0.30 0.00 0.00 42.92 43.55 2k27 s ASP 145 CO -0.09 -0.80 1.18 -1.20 -0.17 0.00 0.00 175.17 174.09 2k27 n SER 146 N -0.15 0.18 -4.41 -0.34 7.64 -1.26 -5.07 113.62 110.21 2k27 n SER 146 Ca -0.15 -2.41 -0.45 0.00 1.01 0.00 0.00 58.87 56.87 2k27 n SER 146 Cb 0.63 0.06 -0.02 0.00 -1.01 0.00 0.00 64.21 63.87 2k27 n SER 146 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2k27 s GLY 147 N -2.49 2.35 -0.58 0.23 0.00 -1.26 -4.92 107.32 100.65 2k27 s GLY 147 Ca 0.23 -3.15 0.06 0.00 0.00 0.00 0.00 44.72 41.87 2k27 s GLY 147 CO -0.04 1.78 0.68 0.00 0.00 0.00 0.00 173.10 175.52 2k27 n ALA 148 N 5.34 3.63 -1.62 3.20 0.00 -1.26 -5.11 120.51 124.70 2k27 n ALA 148 Ca 0.25 -4.41 -0.29 0.00 0.00 0.00 0.00 53.44 48.99 2k27 n ALA 148 Cb 0.46 -0.88 0.12 0.00 0.00 0.00 0.00 19.45 19.15 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 -2.09 1.49 -0.07 0.00 0.04 -1.26 -5.09 135.00 128.01 2k27 s PRO 149 Ca 0.38 0.31 -0.32 0.00 0.04 0.00 0.00 61.00 61.41 2k27 s PRO 149 Cb 0.15 -1.88 0.14 0.00 0.04 0.00 0.00 34.50 32.95 2k27 s PRO 149 CO -0.04 -1.96 1.40 0.20 0.04 0.00 0.00 177.00 176.63 2k27 s GLY 150 N -4.12 -0.48 0.00 0.56 0.00 -1.26 -5.20 107.32 96.82 2k27 s GLY 150 Ca 0.63 0.88 0.00 0.00 0.00 0.00 0.00 44.72 46.22 2k27 s GLY 150 CO 0.53 0.26 0.00 0.61 0.00 0.00 0.00 173.10 174.49 2k27 n GLY 151 N -0.50 -0.41 3.61 0.20 0.00 -1.26 -5.20 105.19 101.63 2k27 n GLY 151 Ca -0.09 -0.97 -0.00 0.00 0.00 0.00 0.00 46.02 44.95 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 -0.37 0.12 -0.02 0.00 -1.26 -5.20 107.32 100.60 2k27 s GLY 152 Ca 0.00 1.12 -0.24 0.00 0.00 0.00 0.00 44.72 45.60 2k27 s GLY 152 CO 0.00 0.30 0.66 -0.45 0.00 0.00 0.00 173.10 173.61 2k27 s SER 153 N -2.65 -0.53 0.02 1.64 0.15 -1.26 -5.19 113.70 105.88 2k27 s SER 153 Ca 0.13 0.02 -0.18 0.00 0.70 0.00 0.00 55.95 56.62 2k27 s SER 153 Cb 0.03 0.56 0.03 0.00 -1.71 0.00 0.00 66.02 64.93 2k27 s SER 153 CO -0.04 -0.90 0.39 -2.28 1.20 0.00 0.00 173.24 171.61 2k27 s HIS 154 N -3.57 -0.25 0.05 3.44 2.46 -1.26 -5.18 115.29 110.98 2k27 s HIS 154 Ca 0.02 0.25 -0.18 0.00 0.47 0.00 0.00 55.06 55.62 2k27 s HIS 154 Cb -0.01 0.19 0.03 0.00 -0.13 0.00 0.00 32.58 32.66 2k27 s HIS 154 CO -0.12 -0.52 0.40 -1.58 -2.47 0.00 0.00 174.74 170.45 2k27 s HIS 155 N -2.15 -0.25 0.27 3.88 5.04 -1.26 -5.19 115.29 115.63 2k27 s HIS 155 Ca -0.07 0.17 -0.21 0.00 -1.54 0.00 0.00 55.06 53.41 2k27 s HIS 155 Cb -0.02 0.21 0.02 0.00 0.04 0.00 0.00 32.58 32.84 2k27 s HIS 155 CO -0.00 -0.58 0.69 -3.38 -2.34 0.00 0.00 174.74 169.13 2k27 s HIS 156 N -2.65 -0.18 -0.04 3.88 -3.43 -1.26 -5.18 115.29 106.43 2k27 s HIS 156 Ca -0.04 -0.26 -0.11 0.00 -0.80 0.00 0.00 55.06 53.86 2k27 s HIS 156 Cb -0.00 0.66 0.02 0.00 -1.43 0.00 0.00 32.58 31.83 2k27 s HIS 156 CO -0.04 -1.19 0.25 -1.58 -2.00 0.00 0.00 174.74 170.18 2k27 s HIS 157 N -3.91 -0.16 0.00 0.38 2.46 -1.26 -5.18 115.29 107.62 2k27 s HIS 157 Ca 0.11 0.32 -0.07 0.00 0.47 0.00 0.00 55.06 55.89 2k27 s HIS 157 Cb -0.05 0.06 -0.00 0.00 -0.13 0.00 0.00 32.58 32.45 2k27 s HIS 157 CO 0.06 -0.27 0.12 -1.01 -2.47 0.00 0.00 174.74 171.17 2k27 s HIS 158 N -0.82 0.06 -2.22 3.88 3.76 -1.26 -5.39 115.29 113.29 2k27 s HIS 158 Ca -0.09 -0.16 0.30 0.00 -0.15 0.00 0.00 55.06 54.97 2k27 s HIS 158 Cb -0.05 -0.06 1.52 0.00 1.11 0.00 0.00 32.58 35.11 2k27 s HIS 158 CO 0.02 -0.27 2.01 1.58 -0.85 0.00 0.00 174.74 177.23