#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k27 n PRO 2 N 0.00 2.78 -2.01 3.17 -0.04 -1.26 -4.96 135.00 132.67 2k27 n PRO 2 Ca 0.00 -2.72 -0.39 0.00 -0.04 0.00 0.00 63.50 60.35 2k27 n PRO 2 Cb 0.00 -3.34 0.00 0.00 -0.04 0.00 0.00 33.50 30.13 2k27 n PRO 2 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2k27 s HIS 3 N 3.99 2.69 0.21 0.54 2.46 -1.26 -5.05 115.29 118.87 2k27 s HIS 3 Ca 0.51 1.41 0.05 0.00 0.47 0.00 0.00 55.06 57.50 2k27 s HIS 3 Cb 0.11 -3.67 -0.05 0.00 -0.13 0.00 0.00 32.58 28.84 2k27 s HIS 3 CO -0.01 -2.22 -0.07 -0.80 -2.47 0.00 0.00 174.74 169.16 2k27 s ASN 4 N -0.86 2.09 0.04 9.88 -0.87 -1.26 -5.07 114.94 118.89 2k27 s ASN 4 Ca 0.61 -1.11 -0.21 0.00 -1.57 0.00 0.00 52.86 50.58 2k27 s ASN 4 Cb -0.37 -0.05 -0.14 0.00 -0.02 0.00 0.00 41.25 40.66 2k27 s ASN 4 CO 0.47 -0.36 1.37 -1.28 -2.57 0.00 0.00 177.10 174.73 2k27 h SER 5 N 2.56 0.33 -5.20 -1.22 0.87 -2.06 -3.49 113.55 105.35 2k27 h SER 5 Ca -0.38 -0.44 0.00 0.00 -1.23 0.00 0.00 61.79 59.74 2k27 h SER 5 Cb 1.21 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 63.08 2k27 h SER 5 CO 0.64 0.71 -0.13 -0.38 -0.53 0.00 0.00 176.83 177.13 2k27 n ILE 6 N -4.62 -9.88 -3.96 2.23 5.41 -1.26 -5.07 119.36 102.21 2k27 n ILE 6 Ca -0.06 0.08 -0.09 0.00 1.00 0.00 0.00 62.75 63.68 2k27 n ILE 6 Cb 0.32 -6.83 -0.08 0.00 -0.71 0.00 0.00 39.64 32.34 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 -2.86 0.86 0.06 0.38 0.52 -1.26 -5.18 118.95 111.47 2k27 s ARG 7 Ca 0.07 -1.11 -0.03 0.00 -0.52 0.00 0.00 55.73 54.14 2k27 s ARG 7 Cb -0.02 0.31 0.01 0.00 0.52 0.00 0.00 34.95 35.77 2k27 s ARG 7 CO 0.71 -0.26 0.14 0.45 0.02 0.00 0.00 175.30 176.36 2k27 n SER 8 N -0.06 -0.39 -3.24 0.23 2.88 -1.26 -5.19 113.62 106.59 2k27 n SER 8 Ca -0.12 -1.26 -0.19 0.00 -1.33 0.00 0.00 58.87 55.96 2k27 n SER 8 Cb 0.62 0.65 0.14 0.00 -0.75 0.00 0.00 64.21 64.87 2k27 n SER 8 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2k27 n GLY 9 N -0.09 -1.46 3.36 0.46 0.00 -1.26 -5.13 105.19 101.07 2k27 n GLY 9 Ca -0.01 -1.68 -0.12 0.00 0.00 0.00 0.00 46.02 44.21 2k27 n GLY 9 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2k27 s HIS 10 N -2.87 -0.34 0.07 1.61 5.04 -1.26 -5.18 115.29 112.36 2k27 s HIS 10 Ca 0.49 0.14 -0.18 0.00 -1.54 0.00 0.00 55.06 53.97 2k27 s HIS 10 Cb -0.01 0.35 0.04 0.00 0.04 0.00 0.00 32.58 32.99 2k27 s HIS 10 CO 0.35 -0.71 0.43 0.20 -2.34 0.00 0.00 174.74 172.67 2k27 s GLY 11 N -2.55 -0.31 -0.47 1.59 0.00 -1.26 -5.12 107.32 99.20 2k27 s GLY 11 Ca 0.00 0.27 0.06 0.00 0.00 0.00 0.00 44.72 45.06 2k27 s GLY 11 CO -0.09 0.01 0.90 0.61 0.00 0.00 0.00 173.10 174.52 2k27 n GLY 12 N 0.28 0.49 3.67 0.20 0.00 -1.26 -5.13 105.19 103.44 2k27 n GLY 12 Ca -0.18 -0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.11 4.32 0.20 0.99 1.98 -1.26 -4.98 118.68 118.81 2k27 s LEU 13 Ca 0.30 2.23 -0.13 0.00 -2.89 0.00 0.00 54.13 53.64 2k27 s LEU 13 Cb 0.24 -3.54 0.01 0.00 0.66 0.00 0.00 46.19 43.56 2k27 s LEU 13 CO -0.19 -0.89 0.43 0.54 -1.89 0.00 0.00 176.35 174.35 2k27 s ASN 14 N 2.95 -0.11 0.16 3.68 2.20 -1.26 -5.19 114.94 117.37 2k27 s ASN 14 Ca 0.71 -0.73 -0.20 0.00 -0.94 0.00 0.00 52.86 51.71 2k27 s ASN 14 Cb -0.33 0.53 0.05 0.00 -2.00 0.00 0.00 41.25 39.50 2k27 s ASN 14 CO 0.29 -1.02 0.53 0.00 -2.94 0.00 0.00 177.10 173.95 2k27 s GLN 15 N -3.94 1.25 -0.28 3.55 -2.07 -1.26 -5.17 119.66 111.74 2k27 s GLN 15 Ca 0.15 -0.64 -0.00 0.00 -1.82 0.00 0.00 55.36 53.05 2k27 s GLN 15 Cb 0.01 0.54 0.17 0.00 -1.09 0.00 0.00 33.01 32.63 2k27 s GLN 15 CO 0.01 -0.53 0.49 -1.17 -1.32 0.00 0.00 175.29 172.77 2k27 s LEU 16 N -2.80 -1.04 -0.29 2.60 0.20 -1.26 -5.15 118.68 110.95 2k27 s LEU 16 Ca 0.03 0.37 -0.23 0.00 0.69 0.00 0.00 54.13 55.00 2k27 s LEU 16 Cb -0.00 1.60 0.15 0.00 -0.43 0.00 0.00 46.19 47.51 2k27 s LEU 16 CO -0.10 -0.29 1.17 -0.83 -0.29 0.00 0.00 176.35 176.01 2k27 s GLY 17 N 2.69 0.10 0.00 7.98 0.00 -1.26 -5.01 107.32 111.82 2k27 s GLY 17 Ca 0.15 3.12 0.00 0.00 0.00 0.00 0.00 44.72 47.99 2k27 s GLY 17 CO -0.21 2.07 0.00 0.61 0.00 0.00 0.00 173.10 175.57 2k27 n GLY 18 N 2.34 1.41 3.74 0.20 0.00 -1.26 -5.06 105.19 106.56 2k27 n GLY 18 Ca -0.13 -0.71 -0.35 0.00 0.00 0.00 0.00 46.02 44.82 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 -2.00 2.36 0.00 4.61 0.00 -1.26 -3.32 121.76 122.15 2k27 s ALA 19 Ca 0.00 0.95 0.00 0.00 0.00 0.00 0.00 51.96 52.91 2k27 s ALA 19 Cb 0.00 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.66 2k27 s ALA 19 CO 0.00 -1.50 0.00 0.34 0.00 0.00 0.00 175.76 174.60 2k27 n PHE 20 N -2.13 0.00 -3.80 0.00 -0.00 -1.26 -4.89 117.46 105.38 2k27 n PHE 20 Ca 0.14 0.00 -0.20 0.00 -0.00 0.00 0.00 57.45 57.38 2k27 n PHE 20 Cb 0.50 -0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.98 2k27 n PHE 20 CO 0.00 0.00 0.00 1.55 -0.00 0.00 0.00 176.76 178.31 2k27 n VAL 21 N -0.00 0.00 -2.89 -2.13 3.14 -1.21 -4.29 118.33 110.96 2k27 n VAL 21 Ca 0.00 -1.71 -0.05 0.00 -2.96 0.00 0.00 64.34 59.62 2k27 n VAL 21 Cb 0.00 -0.13 0.01 0.00 -1.06 0.00 0.00 33.84 32.66 2k27 n VAL 21 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 2k27 n ASN 22 N -1.87 -7.81 0.00 6.55 2.85 -1.26 -3.35 115.26 110.38 2k27 n ASN 22 Ca -0.02 0.35 0.00 0.00 -0.11 0.00 0.00 54.58 54.80 2k27 n ASN 22 Cb 0.49 -5.30 0.00 0.00 1.24 0.00 0.00 39.78 36.21 2k27 n ASN 22 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2k27 n GLY 23 N -0.75 2.35 3.67 8.20 0.00 -1.26 -4.87 105.19 112.53 2k27 n GLY 23 Ca 0.08 -0.45 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 2k27 n GLY 23 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k27 s ARG 24 N 0.00 4.14 0.30 1.61 3.00 -1.21 -4.94 118.95 121.85 2k27 s ARG 24 Ca 0.00 2.59 -0.28 0.00 0.00 0.00 0.00 55.73 58.04 2k27 s ARG 24 Cb 0.00 -3.95 -0.09 0.00 0.00 0.00 0.00 34.95 30.90 2k27 s ARG 24 CO 0.00 -0.91 1.02 -1.25 0.00 0.00 0.00 175.30 174.16 2k27 s PRO 25 N 3.83 4.59 -0.14 3.54 0.04 -1.26 -4.00 135.00 141.60 2k27 s PRO 25 Ca 0.85 1.59 -0.18 0.00 0.04 0.00 0.00 61.00 63.30 2k27 s PRO 25 Cb -0.43 -3.02 -0.25 0.00 0.04 0.00 0.00 34.50 30.84 2k27 s PRO 25 CO 0.39 0.23 0.46 -0.07 0.04 0.00 0.00 177.00 178.05 2k27 h LEU 26 N 3.54 0.23-10.69 -3.56 -0.00 -1.92 -3.40 115.31 99.50 2k27 h LEU 26 Ca -0.47 -0.77 -0.46 0.00 -0.00 0.00 0.00 57.88 56.18 2k27 h LEU 26 Cb 1.21 -0.07 0.09 0.00 -0.00 0.00 0.00 40.66 41.88 2k27 h LEU 26 CO 0.66 1.53 0.16 -2.16 -0.00 0.00 0.00 178.44 178.63 2k27 s PRO 27 N -2.42 1.64 0.00 1.13 0.04 -1.26 -4.63 135.00 129.50 2k27 s PRO 27 Ca -0.23 -0.88 0.00 0.00 0.04 0.00 0.00 61.00 59.93 2k27 s PRO 27 Cb 0.04 -2.25 0.00 0.00 0.04 0.00 0.00 34.50 32.33 2k27 s PRO 27 CO 0.70 -1.52 0.00 -1.91 0.04 0.00 0.00 177.00 174.31 2k27 n GLU 28 N -2.95 0.00 0.34 4.56 0.00 -1.26 -0.89 120.64 120.43 2k27 n GLU 28 Ca 0.14 0.00 0.18 0.00 0.00 0.00 0.00 57.16 57.48 2k27 n GLU 28 Cb 0.60 0.00 0.98 0.00 0.00 0.00 0.00 31.44 33.03 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 0.00 -1.21 6.31 3.04 -1.94 -0.58 116.25 121.88 2k27 h VAL 29 Ca 0.00 0.00 0.37 0.00 -1.01 0.00 0.00 66.70 66.06 2k27 h VAL 29 Cb 0.00 0.80 -0.11 0.00 -2.01 0.00 0.00 31.29 29.97 2k27 h VAL 29 CO 0.00 0.00 0.78 1.62 -1.01 0.00 0.00 177.57 178.96 2k27 h VAL 30 N 0.00 0.29 -0.99 1.51 3.04 -1.23 0.40 116.25 119.27 2k27 h VAL 30 Ca 0.00 -0.07 0.19 0.00 -1.01 0.00 0.00 66.70 65.81 2k27 h VAL 30 Cb 0.39 0.07 -0.18 0.00 -2.01 0.00 0.00 31.29 29.56 2k27 h VAL 30 CO 0.00 0.04 -0.29 -1.14 -1.01 0.00 0.00 177.57 175.17 2k27 n ARG 31 N -4.65 -0.13 -0.30 4.17 0.63 -0.23 -0.95 116.66 115.21 2k27 n ARG 31 Ca 0.32 1.54 -0.00 0.00 -0.92 0.00 0.00 57.85 58.79 2k27 n ARG 31 Cb 1.21 -2.30 0.12 0.00 0.45 0.00 0.00 32.46 31.94 2k27 n ARG 31 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 2k27 h GLN 32 N 0.00 0.94 -0.25 -0.14 1.08 -1.14 -0.00 115.11 115.60 2k27 h GLN 32 Ca 0.44 -0.06 -0.04 0.00 -1.45 0.00 0.00 58.65 57.55 2k27 h GLN 32 Cb 0.69 -0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 27.89 2k27 h GLN 32 CO -1.01 0.62 0.01 0.00 -0.95 0.00 0.00 178.83 177.51 2k27 h ARG 33 N 0.97 0.43 -0.17 1.46 3.08 -1.14 -0.10 114.38 118.91 2k27 h ARG 33 Ca 0.35 -0.13 -0.00 0.00 0.07 0.00 0.00 59.98 60.27 2k27 h ARG 33 Cb 0.11 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 2k27 h ARG 33 CO -0.15 0.59 0.10 0.82 -1.07 0.00 0.00 179.97 180.26 2k27 h ILE 34 N 0.21 1.08 0.41 2.04 1.08 -0.99 -0.84 117.51 120.50 2k27 h ILE 34 Ca 0.07 -0.19 -0.01 0.00 -0.39 0.00 0.00 64.86 64.35 2k27 h ILE 34 Cb 0.39 0.89 -0.02 0.00 -3.07 0.00 0.00 36.82 35.02 2k27 h ILE 34 CO 0.01 0.07 -0.33 0.58 -0.69 0.00 0.00 178.15 177.79 2k27 h VAL 35 N 0.20 0.31 -0.15 1.67 2.07 -0.95 -1.30 116.25 118.10 2k27 h VAL 35 Ca 0.06 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.62 2k27 h VAL 35 Cb 0.03 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 30.07 2k27 h VAL 35 CO -0.01 0.00 -0.12 -0.78 0.02 0.00 0.00 177.57 176.68 2k27 h ASP 36 N -0.75 -0.38 0.16 0.57 3.58 -0.96 0.14 116.42 118.78 2k27 h ASP 36 Ca -0.04 0.08 0.01 0.00 0.42 0.00 0.00 57.03 57.50 2k27 h ASP 36 Cb 0.65 0.19 -0.03 0.00 1.72 0.00 0.00 39.33 41.86 2k27 h ASP 36 CO -0.01 -0.16 -0.24 0.25 -2.88 0.00 0.00 179.24 176.20 2k27 h LEU 37 N -0.13 -0.66 -1.01 2.28 5.85 -1.08 -2.35 115.31 118.21 2k27 h LEU 37 Ca 0.10 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.86 2k27 h LEU 37 Cb 0.27 0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.51 2k27 h LEU 37 CO -0.23 -0.33 0.38 0.00 -0.34 0.00 0.00 178.44 177.91 2k27 h ALA 38 N 0.27 1.24 0.00 1.25 0.00 -1.06 -3.06 119.26 117.90 2k27 h ALA 38 Ca 0.02 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2k27 h ALA 38 Cb 0.47 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 2k27 h ALA 38 CO -0.11 0.59 -0.07 1.25 0.00 0.00 0.00 179.25 180.92 2k27 h HIS 39 N 1.07 0.00 -0.00 0.00 -0.00 -0.20 -0.89 115.15 115.13 2k27 h HIS 39 Ca 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.63 2k27 h HIS 39 Cb 0.09 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.50 2k27 h HIS 39 CO 0.01 0.07 0.00 -0.56 -0.00 0.00 0.00 177.93 177.45 2k27 h GLN 40 N 0.00 0.00 -1.55 5.26 3.07 -1.36 -3.47 115.11 117.07 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 0.20 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.76 2k27 h GLN 40 CO 0.01 0.00 0.00 0.41 0.09 0.00 0.00 178.83 179.34 2k27 n GLY 41 N -1.36 0.18 3.07 0.06 0.00 -0.34 -5.13 105.19 101.68 2k27 n GLY 41 Ca -0.03 -0.44 -0.14 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.05 0.61 0.37 1.61 0.11 -1.25 -5.13 120.40 114.67 2k27 s VAL 42 Ca 0.00 -1.09 -0.24 0.00 -2.93 0.00 0.00 61.98 57.72 2k27 s VAL 42 Cb 0.00 -0.66 -0.10 0.00 -1.53 0.00 0.00 36.38 34.09 2k27 s VAL 42 CO 0.00 -0.35 0.99 -0.13 -3.33 0.00 0.00 175.10 172.28 2k27 s ARG 43 N -1.57 4.35 0.40 1.54 0.52 -1.26 -4.94 118.95 117.99 2k27 s ARG 43 Ca -0.09 1.36 0.08 0.00 -0.52 0.00 0.00 55.73 56.57 2k27 s ARG 43 Cb -0.10 -2.57 0.84 0.00 0.52 0.00 0.00 34.95 33.64 2k27 s ARG 43 CO 0.01 0.05 1.99 -1.00 0.02 0.00 0.00 175.30 176.37 2k27 h PRO 44 N 2.65 0.37 0.00 3.54 0.13 -2.01 -0.46 132.00 136.22 2k27 h PRO 44 Ca -0.48 -0.05 -0.02 0.00 -0.87 0.00 0.00 66.00 64.59 2k27 h PRO 44 Cb 1.20 -0.07 -0.00 0.00 0.13 0.00 0.00 31.00 32.26 2k27 h PRO 44 CO 0.63 0.35 -0.08 0.00 -0.23 0.00 0.00 178.00 178.67 2k27 h ASP 46 N 0.00 0.48 -0.85 0.00 1.82 -1.53 -3.27 116.42 113.06 2k27 h ASP 46 Ca -0.00 -0.71 0.11 0.00 -0.39 0.00 0.00 57.03 56.04 2k27 h ASP 46 Cb 0.16 -0.16 -0.06 0.00 0.68 0.00 0.00 39.33 39.96 2k27 h ASP 46 CO 0.01 1.59 0.55 0.40 -1.61 0.00 0.00 179.24 180.18 2k27 h ILE 47 N 0.08 0.92 -0.98 2.25 2.04 -0.83 0.36 117.51 121.36 2k27 h ILE 47 Ca -0.29 -0.26 0.13 0.00 1.00 0.00 0.00 64.86 65.43 2k27 h ILE 47 Cb 2.05 0.09 -0.08 0.00 -0.74 0.00 0.00 36.82 38.14 2k27 h ILE 47 CO 0.16 0.14 0.62 0.28 0.00 0.00 0.00 178.15 179.35 2k27 h SER 48 N 0.76 0.86 0.19 1.72 0.02 -1.24 -0.94 113.55 114.92 2k27 h SER 48 Ca 0.40 0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.39 2k27 h SER 48 Cb 0.51 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.93 2k27 h SER 48 CO -0.17 0.44 -0.09 0.03 -1.14 0.00 0.00 176.83 175.91 2k27 h ARG 49 N 0.91 -0.24 -0.44 3.45 3.08 -1.02 -0.10 114.38 120.02 2k27 h ARG 49 Ca 0.49 0.02 0.09 0.00 0.07 0.00 0.00 59.98 60.64 2k27 h ARG 49 Cb 0.56 0.05 -0.08 0.00 0.08 0.00 0.00 29.97 30.58 2k27 h ARG 49 CO -0.26 0.11 -0.09 1.96 -1.07 0.00 0.00 179.97 180.62 2k27 h GLN 50 N -0.63 0.02 -0.00 0.04 4.20 -0.84 -0.66 115.11 117.24 2k27 h GLN 50 Ca -0.03 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.68 2k27 h GLN 50 Cb 0.46 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.24 2k27 h GLN 50 CO 0.04 0.01 -0.16 1.28 -0.67 0.00 0.00 178.83 179.33 2k27 n LEU 51 N -5.31 0.25 -3.69 1.46 7.99 -0.40 -4.97 117.00 112.32 2k27 n LEU 51 Ca 0.03 0.23 -0.29 0.00 -0.01 0.00 0.00 56.01 55.98 2k27 n LEU 51 Cb 0.24 -0.34 0.03 0.00 -0.11 0.00 0.00 43.42 43.23 2k27 n LEU 51 CO 0.14 0.05 -0.07 -2.11 -1.51 0.00 0.00 177.39 173.89 2k27 n ARG 52 N -1.36 -1.13 -4.18 3.23 1.85 -0.25 -5.03 116.66 109.78 2k27 n ARG 52 Ca 0.09 0.57 -0.22 0.00 -1.00 0.00 0.00 57.85 57.29 2k27 n ARG 52 Cb 0.32 -3.73 -0.07 0.00 -1.05 0.00 0.00 32.46 27.93 2k27 n ARG 52 CO 0.00 0.00 0.00 1.33 -0.01 0.00 0.00 177.63 178.95 2k27 n VAL 53 N -3.77 0.00 0.00 8.89 0.24 -0.21 -5.03 118.33 118.46 2k27 n VAL 53 Ca -0.13 -2.23 0.00 0.00 -2.04 0.00 0.00 64.34 59.95 2k27 n VAL 53 Cb 0.59 0.90 0.00 0.00 -1.47 0.00 0.00 33.84 33.86 2k27 n VAL 53 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2k27 n SER 54 N -1.63 0.00 0.00 -1.34 3.41 -1.26 -4.63 113.62 108.17 2k27 n SER 54 Ca -0.02 0.14 0.00 0.00 -0.26 0.00 0.00 58.87 58.73 2k27 n SER 54 Cb 0.57 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 2k27 n SER 54 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 2k27 n HIS 55 N -0.27 0.00 -0.12 7.33 -0.00 -1.26 -4.82 115.22 116.07 2k27 n HIS 55 Ca 0.00 0.00 0.07 0.00 0.46 0.00 0.00 57.72 58.25 2k27 n HIS 55 Cb 0.00 0.00 0.40 0.00 -0.12 0.00 0.00 29.99 30.27 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 0.78 0.99 1.57 0.00 -1.99 -0.69 103.07 103.74 2k27 h GLY 56 Ca 0.00 -0.25 -0.04 0.00 0.00 0.00 0.00 47.33 47.04 2k27 h GLY 56 CO 0.00 0.20 0.19 0.00 0.00 0.00 0.00 176.54 176.92 2k27 h VAL 58 N 0.78 1.18 -0.91 0.00 2.07 -1.69 0.27 116.25 117.93 2k27 h VAL 58 Ca 0.18 -0.42 0.10 0.00 0.82 0.00 0.00 66.70 67.38 2k27 h VAL 58 Cb 0.26 0.46 -0.08 0.00 -1.52 0.00 0.00 31.29 30.41 2k27 h VAL 58 CO -0.01 0.18 0.55 -1.28 0.02 0.00 0.00 177.57 177.04 2k27 h SER 59 N 0.74 0.81 0.18 0.57 0.87 -0.85 0.00 113.55 115.88 2k27 h SER 59 Ca 0.20 0.04 -0.17 0.00 -1.23 0.00 0.00 61.79 60.63 2k27 h SER 59 Cb 0.02 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 2k27 h SER 59 CO -0.03 0.45 -0.64 0.11 -0.53 0.00 0.00 176.83 176.18 2k27 h LYS 60 N 0.91 0.44 -0.58 2.24 1.57 -0.90 0.37 116.57 120.61 2k27 h LYS 60 Ca 0.44 -0.32 -0.03 0.00 -1.87 0.00 0.00 60.65 58.88 2k27 h LYS 60 Cb 0.40 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.74 2k27 h LYS 60 CO -0.25 0.94 0.24 0.82 -0.57 0.00 0.00 179.45 180.63 2k27 h ILE 61 N 0.32 1.22 0.22 1.86 2.04 0.01 -2.59 117.51 120.58 2k27 h ILE 61 Ca -0.01 -0.68 -0.01 0.00 1.00 0.00 0.00 64.86 65.16 2k27 h ILE 61 Cb 1.20 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 37.87 2k27 h ILE 61 CO 0.11 0.26 -0.10 -0.07 0.00 0.00 0.00 178.15 178.35 2k27 h LEU 62 N 0.79 -0.25 -5.06 1.44 -0.00 -1.03 -3.29 115.31 107.93 2k27 h LEU 62 Ca 0.19 -0.10 -0.64 0.00 -0.00 0.00 0.00 57.88 57.33 2k27 h LEU 62 Cb 0.18 0.06 -0.02 0.00 -0.00 0.00 0.00 40.66 40.88 2k27 h LEU 62 CO -0.02 -0.05 3.01 0.61 -0.00 0.00 0.00 178.44 182.00 2k27 n GLY 63 N -0.80 4.39 0.06 0.83 0.00 0.11 -4.65 105.19 105.13 2k27 n GLY 63 Ca -0.09 -1.63 -0.04 0.00 0.00 0.00 0.00 46.02 44.26 2k27 n GLY 63 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2k27 h ARG 64 N 4.66 0.00 -1.75 1.61 9.65 -1.55 -3.44 114.38 123.57 2k27 h ARG 64 Ca 0.76 0.00 0.06 0.00 -1.10 0.00 0.00 59.98 59.70 2k27 h ARG 64 Cb 0.41 0.00 -0.24 0.00 -1.39 0.00 0.00 29.97 28.75 2k27 h ARG 64 CO 1.54 0.27 0.25 1.52 2.80 0.00 0.00 179.97 186.35 2k27 s TYR 65 N -1.76 -0.74 0.00 2.20 1.13 -1.26 -4.96 117.35 111.96 2k27 s TYR 65 Ca -0.06 1.55 0.00 0.00 -1.41 0.00 0.00 57.07 57.15 2k27 s TYR 65 Cb -0.01 0.43 0.00 0.00 -1.10 0.00 0.00 41.96 41.29 2k27 s TYR 65 CO 0.19 -0.36 0.00 0.98 -2.51 0.00 0.00 175.55 173.85 2k27 n TYR 66 N 3.52 0.00 -1.05 -3.49 9.36 -1.26 -4.71 117.16 119.53 2k27 n TYR 66 Ca -0.17 0.00 -0.02 0.00 3.32 0.00 0.00 57.90 61.03 2k27 n TYR 66 Cb 0.57 0.00 -0.01 0.00 -0.63 0.00 0.00 39.34 39.28 2k27 n TYR 66 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 2k27 n GLU 67 N 0.00 -0.97 -3.64 2.98 1.02 -1.26 -4.89 120.64 113.87 2k27 n GLU 67 Ca 0.00 0.36 -0.13 0.00 -0.02 0.00 0.00 57.16 57.37 2k27 n GLU 67 Cb 0.00 -4.16 -0.04 0.00 -0.02 0.00 0.00 31.44 27.22 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 -2.52 0.00 0.00 2.62 -2.24 -1.26 -4.92 114.28 105.95 2k27 n THR 68 Ca -0.02 -1.64 0.00 0.00 -2.27 0.00 0.00 64.05 60.12 2k27 n THR 68 Cb 0.27 0.93 0.00 0.00 -2.10 0.00 0.00 70.33 69.43 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 -0.49 1.59 2.63 3.38 0.00 -1.26 -3.29 105.19 107.75 2k27 n GLY 69 Ca 0.03 0.23 -0.10 0.00 0.00 0.00 0.00 46.02 46.18 2k27 n GLY 69 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2k27 n SER 70 N 4.65 1.16 -1.04 1.61 7.64 -1.26 -4.73 113.62 121.65 2k27 n SER 70 Ca 0.00 -2.72 0.01 0.00 1.01 0.00 0.00 58.87 57.17 2k27 n SER 70 Cb 0.00 -0.42 0.15 0.00 -1.01 0.00 0.00 64.21 62.92 2k27 n SER 70 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2k27 n ILE 71 N -0.07 1.89 -3.60 0.44 5.41 -1.21 -4.88 119.36 117.35 2k27 n ILE 71 Ca 0.09 -3.05 -0.13 0.00 1.00 0.00 0.00 62.75 60.67 2k27 n ILE 71 Cb 0.81 -0.14 -0.05 0.00 -0.71 0.00 0.00 39.64 39.55 2k27 n ILE 71 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 2k27 s ARG 72 N -2.83 1.03 -1.29 0.38 0.52 -1.26 -4.73 118.95 110.77 2k27 s ARG 72 Ca 0.39 -0.37 -0.18 0.00 -0.52 0.00 0.00 55.73 55.05 2k27 s ARG 72 Cb 0.38 0.46 0.04 0.00 0.52 0.00 0.00 34.95 36.35 2k27 s ARG 72 CO -0.07 -0.38 1.80 -0.35 0.02 0.00 0.00 175.30 176.32 2k27 n PRO 73 N 0.27 2.94 0.00 3.54 -0.04 -1.26 -4.77 135.00 135.68 2k27 n PRO 73 Ca -0.18 -3.11 0.00 0.00 -0.04 0.00 0.00 63.50 60.17 2k27 n PRO 73 Cb 0.61 -3.51 0.00 0.00 -0.04 0.00 0.00 33.50 30.56 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 5.36 1.80 3.63 0.55 0.00 -1.26 -5.10 105.19 110.18 2k27 n GLY 74 Ca 0.49 -0.17 -0.04 0.00 0.00 0.00 0.00 46.02 46.30 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 -1.49 -0.05 0.21 1.61 0.11 -1.26 -4.71 120.40 114.82 2k27 s VAL 75 Ca 0.00 0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 58.75 2k27 s VAL 75 Cb 0.00 -1.00 -0.09 0.00 -1.53 0.00 0.00 36.38 33.76 2k27 s VAL 75 CO 0.00 0.00 1.26 -0.63 -3.33 0.00 0.00 175.10 172.40 2k27 s ILE 76 N 1.55 3.30 -0.45 7.04 1.01 -1.26 -4.99 121.20 127.40 2k27 s ILE 76 Ca -0.09 1.11 0.04 0.00 0.00 0.00 0.00 60.65 61.71 2k27 s ILE 76 Cb -0.05 -3.71 0.19 0.00 0.01 0.00 0.00 42.46 38.91 2k27 s ILE 76 CO -0.17 0.18 0.77 -0.83 0.00 0.00 0.00 174.94 174.89 2k27 s GLY 77 N 0.13 -1.37 -0.11 6.18 0.00 -1.26 -5.15 107.32 105.74 2k27 s GLY 77 Ca 0.54 0.06 -0.30 0.00 0.00 0.00 0.00 44.72 45.02 2k27 s GLY 77 CO 0.39 3.80 0.96 -0.32 0.00 0.00 0.00 173.10 177.93 2k27 s GLY 78 N 1.30 -0.34 0.18 0.20 0.00 -1.26 -5.19 107.32 102.21 2k27 s GLY 78 Ca 0.23 1.64 -0.24 0.00 0.00 0.00 0.00 44.72 46.36 2k27 s GLY 78 CO -0.07 0.76 0.79 -1.35 0.00 0.00 0.00 173.10 173.23 2k27 s SER 79 N -1.64 -0.31 -0.41 1.64 1.04 -1.26 -5.14 113.70 107.61 2k27 s SER 79 Ca 0.01 -0.35 0.05 0.00 0.48 0.00 0.00 55.95 56.14 2k27 s SER 79 Cb -0.01 0.59 0.17 0.00 0.10 0.00 0.00 66.02 66.87 2k27 s SER 79 CO -0.02 -1.05 0.47 -0.75 0.98 0.00 0.00 173.24 172.87 2k27 s LYS 80 N -3.59 0.80 0.78 4.02 2.47 -1.26 -5.16 119.74 117.80 2k27 s LYS 80 Ca 0.09 -1.08 -0.12 0.00 -1.56 0.00 0.00 55.97 53.30 2k27 s LYS 80 Cb -0.03 -0.63 0.06 0.00 -1.46 0.00 0.00 37.83 35.77 2k27 s LYS 80 CO -0.00 -1.26 1.12 -1.25 0.16 0.00 0.00 175.35 174.11 2k27 s PRO 81 N 1.09 2.21 -0.30 4.03 0.04 -1.26 -5.09 135.00 135.72 2k27 s PRO 81 Ca 0.23 0.44 -0.07 0.00 0.04 0.00 0.00 61.00 61.63 2k27 s PRO 81 Cb -0.07 -1.95 0.15 0.00 0.04 0.00 0.00 34.50 32.67 2k27 s PRO 81 CO -0.07 -1.49 0.65 0.21 0.04 0.00 0.00 177.00 176.34 2k27 s LYS 82 N -5.32 0.56 0.06 4.56 2.47 -1.26 -5.17 119.74 115.64 2k27 s LYS 82 Ca 0.60 1.27 0.04 0.00 -1.56 0.00 0.00 55.97 56.32 2k27 s LYS 82 Cb -0.13 0.75 -0.04 0.00 -1.46 0.00 0.00 37.83 36.96 2k27 s LYS 82 CO 0.52 -0.34 -0.01 0.08 0.16 0.00 0.00 175.35 175.76 2k27 s VAL 83 N 2.87 4.02 -0.00 4.02 1.01 -1.26 -5.10 120.40 125.96 2k27 s VAL 83 Ca 0.03 -0.86 -0.30 0.00 0.00 0.00 0.00 61.98 60.85 2k27 s VAL 83 Cb -0.13 -2.86 -0.04 0.00 0.00 0.00 0.00 36.38 33.34 2k27 s VAL 83 CO -0.20 0.22 1.23 0.00 0.00 0.00 0.00 175.10 176.35 2k27 s ALA 84 N -1.22 3.46 0.26 5.51 0.00 -1.26 -5.02 121.76 123.49 2k27 s ALA 84 Ca 0.23 0.74 -0.24 0.00 0.00 0.00 0.00 51.96 52.70 2k27 s ALA 84 Cb -0.12 -3.50 -0.09 0.00 0.00 0.00 0.00 23.12 19.42 2k27 s ALA 84 CO 0.15 -0.65 0.84 0.95 0.00 0.00 0.00 175.76 177.05 2k27 s THR 85 N 1.78 4.35 0.21 0.00 -4.23 -1.26 -4.98 115.64 111.51 2k27 s THR 85 Ca 0.58 1.64 0.17 0.00 -1.18 0.00 0.00 61.69 62.89 2k27 s THR 85 Cb -0.27 -4.00 0.10 0.00 1.34 0.00 0.00 72.50 69.67 2k27 s THR 85 CO 0.25 0.25 1.73 1.55 -0.54 0.00 0.00 174.62 177.86 2k27 h PRO 86 N 3.50 0.00 -0.92 3.99 0.13 -2.02 -3.32 132.00 133.37 2k27 h PRO 86 Ca -0.47 0.00 0.21 0.00 -0.87 0.00 0.00 66.00 64.87 2k27 h PRO 86 Cb 1.19 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.21 2k27 h PRO 86 CO 0.65 0.41 0.46 1.57 -0.23 0.00 0.00 178.00 180.87 2k27 h LYS 87 N 0.00 0.49 -0.33 0.86 2.10 -2.00 -0.45 116.57 117.24 2k27 h LYS 87 Ca -0.00 -0.03 0.01 0.00 -2.00 0.00 0.00 60.65 58.62 2k27 h LYS 87 Cb 0.90 -0.11 -0.02 0.00 -0.90 0.00 0.00 32.23 32.10 2k27 h LYS 87 CO 0.05 0.32 0.21 0.28 -2.00 0.00 0.00 179.45 178.31 2k27 h VAL 88 N 0.50 1.06 -0.77 0.07 2.07 -1.99 -2.58 116.25 114.62 2k27 h VAL 88 Ca 0.56 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.91 2k27 h VAL 88 Cb 1.01 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 31.35 2k27 h VAL 88 CO -0.48 0.08 0.36 0.58 0.02 0.00 0.00 177.57 178.13 2k27 h VAL 89 N 0.42 1.24 -0.42 2.57 2.07 -1.32 -2.74 116.25 118.08 2k27 h VAL 89 Ca 0.13 -0.69 0.01 0.00 0.82 0.00 0.00 66.70 66.97 2k27 h VAL 89 Cb -0.02 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 29.99 2k27 h VAL 89 CO -0.04 0.29 0.28 -0.33 0.02 0.00 0.00 177.57 177.78 2k27 h GLU 90 N 1.09 0.54 -0.74 1.57 5.08 -1.00 -3.25 114.58 117.86 2k27 h GLU 90 Ca 0.26 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.54 2k27 h GLU 90 Cb 0.12 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 2k27 h GLU 90 CO -0.03 0.35 0.27 0.87 -1.00 0.00 0.00 179.01 179.47 2k27 h LYS 91 N 0.55 1.12 -0.93 2.33 1.79 -1.33 0.06 116.57 120.16 2k27 h LYS 91 Ca 0.15 -0.22 0.13 0.00 -2.18 0.00 0.00 60.65 58.54 2k27 h LYS 91 Cb -0.05 -0.18 -0.14 0.00 -1.58 0.00 0.00 32.23 30.28 2k27 h LYS 91 CO -0.03 0.93 -0.40 -0.89 -1.08 0.00 0.00 179.45 177.98 2k27 n ILE 92 N -4.27 -0.52 0.28 1.86 -0.00 -1.23 -1.36 119.36 114.12 2k27 n ILE 92 Ca 0.06 2.20 -0.11 0.00 -0.00 0.00 0.00 62.75 64.90 2k27 n ILE 92 Cb 0.20 -2.87 -0.05 0.00 -0.00 0.00 0.00 39.64 36.92 2k27 n ILE 92 CO 0.00 0.00 0.00 1.23 -0.00 0.00 0.00 176.55 177.78 2k27 h GLY 93 N 0.00 -0.76 0.19 7.39 0.00 -1.26 -3.24 103.07 105.39 2k27 h GLY 93 Ca 0.29 0.28 0.08 0.00 0.00 0.00 0.00 47.33 47.99 2k27 h GLY 93 CO -0.92 -0.28 -0.11 -0.55 0.00 0.00 0.00 176.54 174.68 2k27 h ASP 94 N -0.94 -0.41 0.08 0.19 3.32 -0.67 0.47 116.42 118.47 2k27 h ASP 94 Ca -0.07 0.12 -0.12 0.00 0.02 0.00 0.00 57.03 56.97 2k27 h ASP 94 Cb 0.56 0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.36 2k27 h ASP 94 CO 0.12 -0.15 -0.42 1.88 -1.72 0.00 0.00 179.24 178.96 2k27 h TYR 95 N -0.02 0.51 -0.53 4.55 0.05 -1.39 0.42 116.97 120.55 2k27 h TYR 95 Ca 0.19 -0.15 -0.11 0.00 0.05 0.00 0.00 58.73 58.71 2k27 h TYR 95 Cb 0.31 -0.11 -0.02 0.00 1.01 0.00 0.00 36.73 37.92 2k27 h TYR 95 CO -0.36 0.78 -0.10 -0.22 -1.05 0.00 0.00 178.16 177.20 2k27 h LYS 96 N 0.35 1.01 -0.39 4.88 1.63 -1.39 0.15 116.57 122.82 2k27 h LYS 96 Ca 0.03 -0.38 -0.02 0.00 -0.85 0.00 0.00 60.65 59.43 2k27 h LYS 96 Cb 0.89 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 32.43 2k27 h LYS 96 CO 0.07 1.06 0.17 0.00 -3.45 0.00 0.00 179.45 177.31 2k27 h ARG 97 N 0.89 0.57 0.30 1.90 3.08 -0.48 -1.95 114.38 118.69 2k27 h ARG 97 Ca 0.14 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 2k27 h ARG 97 Cb 0.67 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.63 2k27 h ARG 97 CO 0.05 0.52 -0.14 1.96 -1.07 0.00 0.00 179.97 181.29 2k27 h GLN 98 N 0.49 -0.39 -3.34 0.04 4.20 -0.89 -3.39 115.11 111.82 2k27 h GLN 98 Ca 0.13 0.03 -0.65 0.00 0.06 0.00 0.00 58.65 58.22 2k27 h GLN 98 Cb 0.15 0.09 -0.40 0.00 0.30 0.00 0.00 27.48 27.62 2k27 h GLN 98 CO -0.01 -0.07 -0.54 1.21 -0.67 0.00 0.00 178.83 178.74 2k27 s ASN 99 N -5.09 4.67 0.02 1.46 3.84 0.03 -4.95 114.94 114.93 2k27 s ASN 99 Ca -0.14 -3.22 -0.19 0.00 0.21 0.00 0.00 52.86 49.52 2k27 s ASN 99 Cb 0.02 -1.69 -0.20 0.00 -0.55 0.00 0.00 41.25 38.83 2k27 s ASN 99 CO 0.54 -0.22 1.18 1.55 -2.79 0.00 0.00 177.10 177.36 2k27 h PRO 100 N 6.31 0.44 -0.78 0.43 0.13 -1.56 -3.37 132.00 133.61 2k27 h PRO 100 Ca -0.01 -0.39 0.18 0.00 -0.87 0.00 0.00 66.00 64.91 2k27 h PRO 100 Cb 0.87 0.09 -0.13 0.00 0.13 0.00 0.00 31.00 31.95 2k27 h PRO 100 CO 0.71 1.04 0.06 1.79 -0.23 0.00 0.00 178.00 181.36 2k27 h THR 101 N -0.02 0.34 -4.08 1.56 1.35 -1.92 -3.43 112.91 106.70 2k27 h THR 101 Ca -0.04 -0.04 -0.45 0.00 -0.55 0.00 0.00 66.41 65.32 2k27 h THR 101 Cb 1.16 0.19 0.15 0.00 -1.73 0.00 0.00 68.15 67.92 2k27 h THR 101 CO 0.10 0.02 0.35 -0.04 -0.25 0.00 0.00 175.52 175.70 2k27 s MET 102 N -6.08 0.64 0.48 4.72 -1.94 -1.26 -4.18 119.30 111.69 2k27 s MET 102 Ca -0.13 -0.12 -0.03 0.00 -1.71 0.00 0.00 55.69 53.70 2k27 s MET 102 Cb 0.23 -1.82 0.10 0.00 2.01 0.00 0.00 34.83 35.35 2k27 s MET 102 CO 0.76 -2.46 0.65 1.19 -0.01 0.00 0.00 175.02 175.15 2k27 n PHE 103 N -3.86 -3.39 -0.01 -0.03 3.01 -1.26 -4.81 117.46 107.10 2k27 n PHE 103 Ca 0.12 -0.94 -0.04 0.00 1.01 0.00 0.00 57.45 57.60 2k27 n PHE 103 Cb 0.60 -0.49 0.18 0.00 -0.01 0.00 0.00 39.48 39.76 2k27 n PHE 103 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2k27 h ALA 104 N -0.96 1.08 -0.15 4.37 0.00 -1.97 -3.10 119.26 118.54 2k27 h ALA 104 Ca -0.21 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.32 2k27 h ALA 104 Cb 0.72 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2k27 h ALA 104 CO 0.20 0.56 -0.11 0.11 0.00 0.00 0.00 179.25 180.02 2k27 h TRP 105 N 0.50 0.23 -0.87 0.00 5.08 -1.95 -1.33 115.95 117.61 2k27 h TRP 105 Ca 0.08 -0.02 0.06 0.00 1.08 0.00 0.00 58.89 60.08 2k27 h TRP 105 Cb 0.64 -0.07 -0.05 0.00 -3.00 0.00 0.00 29.16 26.68 2k27 h TRP 105 CO 0.02 0.34 0.57 1.49 -1.28 0.00 0.00 178.44 179.58 2k27 h GLU 106 N 0.22 0.98 -0.24 0.12 4.22 -1.92 -0.43 114.58 117.52 2k27 h GLU 106 Ca 0.05 -0.06 -0.05 0.00 0.08 0.00 0.00 59.36 59.38 2k27 h GLU 106 Cb 0.33 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 2k27 h GLU 106 CO 0.02 0.65 -0.03 0.82 -2.18 0.00 0.00 179.01 178.28 2k27 h ILE 107 N 1.01 1.27 -0.02 2.32 1.08 -1.33 -0.01 117.51 121.83 2k27 h ILE 107 Ca 0.36 -1.00 -0.00 0.00 -0.39 0.00 0.00 64.86 63.83 2k27 h ILE 107 Cb 0.15 1.44 -0.00 0.00 -3.07 0.00 0.00 36.82 35.34 2k27 h ILE 107 CO -0.13 0.31 0.01 -0.09 -0.69 0.00 0.00 178.15 177.57 2k27 h ARG 108 N 0.21 0.02 -0.65 2.37 2.43 -1.13 -3.04 114.38 114.59 2k27 h ARG 108 Ca 0.06 -0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.19 2k27 h ARG 108 Cb 0.48 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.00 2k27 h ARG 108 CO 0.02 0.05 0.25 -0.44 -1.51 0.00 0.00 179.97 178.34 2k27 h ASP 109 N -0.01 0.91 -0.92 -3.80 3.32 -1.03 -2.97 116.42 111.91 2k27 h ASP 109 Ca 0.01 -0.18 0.05 0.00 0.02 0.00 0.00 57.03 56.93 2k27 h ASP 109 Cb 0.03 -0.24 -0.06 0.00 0.22 0.00 0.00 39.33 39.29 2k27 h ASP 109 CO -0.00 0.84 0.60 -0.09 -1.72 0.00 0.00 179.24 178.87 2k27 h ARG 110 N 0.92 1.06 -0.50 3.56 2.43 -0.94 -0.32 114.38 120.60 2k27 h ARG 110 Ca 0.22 -0.06 0.08 0.00 -0.81 0.00 0.00 59.98 59.40 2k27 h ARG 110 Cb 0.23 -0.24 -0.06 0.00 -0.42 0.00 0.00 29.97 29.47 2k27 h ARG 110 CO -0.02 0.70 0.15 -0.07 -1.51 0.00 0.00 179.97 179.22 2k27 h LEU 111 N 1.09 0.11 -0.25 3.80 3.38 -1.41 -0.87 115.31 121.16 2k27 h LEU 111 Ca 0.39 0.07 -0.21 0.00 0.09 0.00 0.00 57.88 58.22 2k27 h LEU 111 Cb 0.13 0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2k27 h LEU 111 CO -0.14 0.09 -0.81 -0.07 0.09 0.00 0.00 178.44 177.60 2k27 h LEU 112 N 0.30 0.67 -0.26 1.67 3.38 -1.42 0.47 115.31 120.13 2k27 h LEU 112 Ca 0.25 -0.46 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 2k27 h LEU 112 Cb 0.30 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2k27 h LEU 112 CO -0.28 1.24 0.16 0.00 0.09 0.00 0.00 178.44 179.65 2k27 h ALA 113 N 0.74 0.33 0.00 1.53 0.00 -0.79 -2.56 119.26 118.51 2k27 h ALA 113 Ca -0.06 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 2k27 h ALA 113 Cb 1.42 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 2k27 h ALA 113 CO 0.15 -0.18 -0.52 0.93 0.00 0.00 0.00 179.25 179.63 2k27 h GLU 114 N 0.33 0.00 -2.42 0.00 5.08 -1.19 -3.48 114.58 112.89 2k27 h GLU 114 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2k27 h GLU 114 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 2k27 h GLU 114 CO -0.02 0.52 0.00 0.41 -1.00 0.00 0.00 179.01 178.93 2k27 n GLY 115 N 0.52 0.84 0.13 -3.84 0.00 -0.01 -5.04 105.19 97.79 2k27 n GLY 115 Ca -0.00 -0.37 -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 -1.21 1.63 -3.74 1.61 0.31 -0.25 -5.02 118.33 111.65 2k27 n VAL 116 Ca 0.00 -0.39 -0.10 0.00 -0.01 0.00 0.00 64.34 63.84 2k27 n VAL 116 Cb 0.43 -1.82 -0.05 0.00 -0.91 0.00 0.00 33.84 31.48 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 -2.86 4.74 0.25 0.00 1.11 -1.26 -4.69 116.67 113.97 2k27 s ASP 118 Ca 0.07 2.13 -0.08 0.00 0.18 0.00 0.00 52.55 54.85 2k27 s ASP 118 Cb 0.02 -2.56 0.41 0.00 1.07 0.00 0.00 42.92 41.85 2k27 s ASP 118 CO -0.07 -1.88 1.44 -0.46 1.18 0.00 0.00 175.17 175.37 2k27 n ASN 119 N -2.56 -0.35 -0.08 0.27 0.23 -1.26 -2.06 115.26 109.45 2k27 n ASN 119 Ca 0.11 1.59 -0.16 0.00 -0.53 0.00 0.00 54.58 55.59 2k27 n ASN 119 Cb 0.51 -0.47 -0.11 0.00 -2.08 0.00 0.00 39.78 37.63 2k27 n ASN 119 CO 0.00 0.00 0.00 -0.78 -0.93 0.00 0.00 177.26 175.55 2k27 h ASP 120 N 0.00 0.00 -0.83 0.53 3.58 -2.03 -3.40 116.42 114.27 2k27 h ASP 120 Ca 0.43 -0.66 0.14 0.00 0.42 0.00 0.00 57.03 57.36 2k27 h ASP 120 Cb 0.66 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 41.65 2k27 h ASP 120 CO -0.95 1.16 0.54 0.71 -2.88 0.00 0.00 179.24 177.83 2k27 h THR 121 N -1.00 0.83 -2.02 2.25 1.35 -1.78 -3.43 112.91 109.11 2k27 h THR 121 Ca -0.15 -0.21 -0.62 0.00 -0.55 0.00 0.00 66.41 64.89 2k27 h THR 121 Cb 1.03 0.18 0.13 0.00 -1.73 0.00 0.00 68.15 67.77 2k27 h THR 121 CO -0.09 0.11 -0.41 1.33 -0.25 0.00 0.00 175.52 176.21 2k27 n VAL 122 N -4.53 1.71 -1.94 6.82 0.24 -1.07 -4.90 118.33 114.67 2k27 n VAL 122 Ca 0.16 -0.50 -0.38 0.00 -2.04 0.00 0.00 64.34 61.58 2k27 n VAL 122 Cb 0.48 -0.45 0.02 0.00 -1.47 0.00 0.00 33.84 32.42 2k27 n VAL 122 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2k27 s PRO 123 N -1.39 3.39 0.77 7.34 0.04 -1.26 -4.95 135.00 138.93 2k27 s PRO 123 Ca 0.62 2.10 -0.14 0.00 0.04 0.00 0.00 61.00 63.62 2k27 s PRO 123 Cb -0.69 -2.34 0.06 0.00 0.04 0.00 0.00 34.50 31.57 2k27 s PRO 123 CO 0.59 -0.95 1.20 -1.54 0.04 0.00 0.00 177.00 176.34 2k27 s SER 124 N -1.05 3.94 0.27 6.66 1.04 -1.26 -4.74 113.70 118.55 2k27 s SER 124 Ca 0.68 2.33 -0.01 0.00 0.48 0.00 0.00 55.95 59.43 2k27 s SER 124 Cb -0.37 -2.58 0.45 0.00 0.10 0.00 0.00 66.02 63.62 2k27 s SER 124 CO 0.44 -2.43 1.87 1.62 0.98 0.00 0.00 173.24 175.72 2k27 h VAL 125 N -0.62 1.04 -0.21 5.02 3.04 -1.92 -0.85 116.25 121.74 2k27 h VAL 125 Ca -0.47 -0.39 0.00 0.00 -1.01 0.00 0.00 66.70 64.84 2k27 h VAL 125 Cb 1.29 -0.19 -0.01 0.00 -2.01 0.00 0.00 31.29 30.37 2k27 h VAL 125 CO 0.48 0.21 0.14 0.28 -1.01 0.00 0.00 177.57 177.67 2k27 h SER 126 N 1.13 0.24 0.19 3.17 0.02 -1.95 -2.43 113.55 113.91 2k27 h SER 126 Ca 0.45 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.39 2k27 h SER 126 Cb 0.27 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.75 2k27 h SER 126 CO -0.20 0.17 -0.09 -1.28 -1.14 0.00 0.00 176.83 174.29 2k27 h SER 127 N 0.28 -0.22 -0.98 3.07 0.87 -1.65 -0.67 113.55 114.26 2k27 h SER 127 Ca 0.08 0.01 0.18 0.00 -1.23 0.00 0.00 61.79 60.82 2k27 h SER 127 Cb -0.03 0.06 -0.10 0.00 -0.44 0.00 0.00 62.40 61.88 2k27 h SER 127 CO -0.02 -0.16 0.59 0.16 -0.53 0.00 0.00 176.83 176.87 2k27 h ILE 128 N -0.26 0.73 0.59 2.23 3.07 -1.28 0.94 117.51 123.54 2k27 h ILE 128 Ca -0.03 -0.26 -0.02 0.00 1.55 0.00 0.00 64.86 66.10 2k27 h ILE 128 Cb 0.20 -0.10 -0.01 0.00 -0.27 0.00 0.00 36.82 36.63 2k27 h ILE 128 CO 0.04 0.14 -0.43 -1.13 -1.05 0.00 0.00 178.15 175.72 2k27 h ASN 129 N 0.77 -1.13 -0.87 2.16 -1.24 -1.46 -3.22 115.58 110.58 2k27 h ASN 129 Ca 0.55 0.07 0.11 0.00 0.71 0.00 0.00 56.30 57.74 2k27 h ASN 129 Cb 0.82 0.35 -0.06 0.00 0.73 0.00 0.00 38.32 40.15 2k27 h ASN 129 CO -0.37 -0.63 0.56 0.03 -1.29 0.00 0.00 177.43 175.74 2k27 h ARG 130 N -0.98 0.79 -0.70 6.67 2.47 0.71 -0.41 114.38 122.93 2k27 h ARG 130 Ca -0.08 -0.05 0.04 0.00 -1.26 0.00 0.00 59.98 58.64 2k27 h ARG 130 Cb 0.81 -0.18 -0.05 0.00 -1.65 0.00 0.00 29.97 28.90 2k27 h ARG 130 CO 0.04 0.53 0.42 0.82 0.56 0.00 0.00 179.97 182.33 2k27 h ILE 131 N 0.82 1.04 0.00 2.04 1.08 -1.04 -2.17 117.51 119.28 2k27 h ILE 131 Ca 0.41 -0.28 -0.15 0.00 -0.39 0.00 0.00 64.86 64.46 2k27 h ILE 131 Cb 0.48 0.17 -0.02 0.00 -3.07 0.00 0.00 36.82 34.38 2k27 h ILE 131 CO -0.18 0.15 -0.74 0.40 -0.69 0.00 0.00 178.15 177.09 2k27 h ILE 132 N 0.80 1.16 -0.51 -0.67 2.04 -1.33 -3.26 117.51 115.76 2k27 h ILE 132 Ca 0.30 -2.66 0.05 0.00 1.00 0.00 0.00 64.86 63.55 2k27 h ILE 132 Cb 0.10 2.57 -0.03 0.00 -0.74 0.00 0.00 36.82 38.71 2k27 h ILE 132 CO -0.14 0.66 0.34 0.03 0.00 0.00 0.00 178.15 179.04 2k27 h ARG 133 N 0.00 0.47 0.00 2.37 2.47 -0.46 0.14 114.38 119.37 2k27 h ARG 133 Ca -0.02 -0.03 -0.02 0.00 -1.26 0.00 0.00 59.98 58.65 2k27 h ARG 133 Cb 1.54 -0.11 -0.00 0.00 -1.65 0.00 0.00 29.97 29.75 2k27 h ARG 133 CO 0.09 0.31 -0.11 1.79 0.56 0.00 0.00 179.97 182.61 2k27 h THR 134 N 0.48 1.06 0.00 2.04 1.35 -1.54 -3.38 112.91 112.93 2k27 h THR 134 Ca 0.21 -0.39 0.00 0.00 -0.55 0.00 0.00 66.41 65.69 2k27 h THR 134 Cb 0.24 1.21 0.00 0.00 -1.73 0.00 0.00 68.15 67.87 2k27 h THR 134 CO -0.06 0.11 0.00 0.29 -0.25 0.00 0.00 175.52 175.61 2k27 n LYS 135 N -4.38 0.00 -3.10 4.72 4.01 0.40 -5.03 118.16 114.78 2k27 n LYS 135 Ca -0.03 0.00 -0.20 0.00 -0.51 0.00 0.00 58.31 57.57 2k27 n LYS 135 Cb 0.19 0.00 -0.04 0.00 -0.51 0.00 0.00 35.03 34.66 2k27 n LYS 135 CO 0.00 0.00 0.00 0.28 -1.11 0.00 0.00 177.40 176.57 2k27 n VAL 136 N 0.00 -0.58 -2.66 -0.18 0.31 -0.54 -5.07 118.33 109.61 2k27 n VAL 136 Ca 0.00 -3.24 -0.43 0.00 -0.01 0.00 0.00 64.34 60.66 2k27 n VAL 136 Cb 0.00 -1.02 -0.02 0.00 -0.91 0.00 0.00 33.84 31.89 2k27 n VAL 136 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 2k27 s GLN 137 N -0.51 4.03 -0.15 5.55 -0.44 -0.94 -4.94 119.66 122.25 2k27 s GLN 137 Ca 0.34 1.00 0.00 0.00 -2.50 0.00 0.00 55.36 54.20 2k27 s GLN 137 Cb 0.16 -3.75 0.02 0.00 -1.64 0.00 0.00 33.01 27.80 2k27 s GLN 137 CO -0.15 -0.92 -0.13 -0.65 0.50 0.00 0.00 175.29 173.94 2k27 s GLN 138 N 3.66 2.20 0.03 1.67 -1.52 -1.26 -4.78 119.66 119.66 2k27 s GLN 138 Ca 0.45 -0.55 -0.30 0.00 -1.95 0.00 0.00 55.36 53.00 2k27 s GLN 138 Cb -0.12 -2.08 -0.05 0.00 -0.22 0.00 0.00 33.01 30.55 2k27 s GLN 138 CO 0.16 -0.25 1.15 -1.25 -0.25 0.00 0.00 175.29 174.85 2k27 s PRO 139 N 1.50 4.45 -0.72 2.91 0.04 -1.26 -4.93 135.00 136.99 2k27 s PRO 139 Ca 0.05 1.68 -0.26 0.00 0.04 0.00 0.00 61.00 62.50 2k27 s PRO 139 Cb -0.13 -3.40 0.00 0.00 0.04 0.00 0.00 34.50 31.01 2k27 s PRO 139 CO -0.10 -0.24 1.61 -0.06 0.04 0.00 0.00 177.00 178.24 2k27 s PHE 140 N 1.22 1.98 -0.02 0.56 0.40 -1.26 -4.93 117.98 115.93 2k27 s PHE 140 Ca 0.57 0.32 -0.02 0.00 -0.60 0.00 0.00 56.93 57.20 2k27 s PHE 140 Cb -0.27 -4.34 0.01 0.00 0.51 0.00 0.00 43.02 38.92 2k27 s PHE 140 CO 0.28 -2.15 0.05 -0.80 0.70 0.00 0.00 175.22 173.30 2k27 s ASN 141 N 6.14 -0.04 -0.47 1.36 0.01 -1.26 -5.03 114.94 115.64 2k27 s ASN 141 Ca 0.53 0.10 0.06 0.00 -0.71 0.00 0.00 52.86 52.84 2k27 s ASN 141 Cb -0.09 0.09 0.20 0.00 0.41 0.00 0.00 41.25 41.86 2k27 s ASN 141 CO 0.14 -0.03 0.65 -0.11 -1.51 0.00 0.00 177.10 176.25 2k27 n LEU 142 N 3.15 -2.22 -3.61 0.60 7.94 -1.26 -5.06 117.00 116.54 2k27 n LEU 142 Ca -0.13 -3.55 -0.41 0.00 -1.11 0.00 0.00 56.01 50.80 2k27 n LEU 142 Cb 0.59 0.72 -0.01 0.00 0.53 0.00 0.00 43.42 45.25 2k27 n LEU 142 CO 0.24 1.95 2.76 -0.81 -1.11 0.00 0.00 177.39 180.42 2k27 n PRO 143 N 2.44 3.36 -4.06 1.96 -0.04 -1.26 -4.85 135.00 132.54 2k27 n PRO 143 Ca 0.19 -2.71 -0.17 0.00 -0.04 0.00 0.00 63.50 60.77 2k27 n PRO 143 Cb 0.55 -3.04 -0.16 0.00 -0.04 0.00 0.00 33.50 30.82 2k27 n PRO 143 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2k27 s MET 144 N 2.09 0.47 0.10 0.54 -1.94 -1.26 -5.16 119.30 114.15 2k27 s MET 144 Ca 0.53 -0.06 -0.12 0.00 -1.71 0.00 0.00 55.69 54.33 2k27 s MET 144 Cb 0.15 -0.53 0.02 0.00 2.01 0.00 0.00 34.83 36.47 2k27 s MET 144 CO -0.07 -0.04 0.29 0.34 -0.01 0.00 0.00 175.02 175.54 2k27 s ASP 145 N 0.59 -0.06 -0.09 3.03 2.15 -1.26 -5.18 116.67 115.85 2k27 s ASP 145 Ca -0.07 -0.45 -0.28 0.00 0.43 0.00 0.00 52.55 52.18 2k27 s ASP 145 Cb -0.10 0.40 0.07 0.00 -0.30 0.00 0.00 42.92 42.99 2k27 s ASP 145 CO -0.01 -0.77 0.65 -0.55 -0.17 0.00 0.00 175.17 174.33 2k27 s SER 146 N -2.74 -0.64 0.00 -0.34 0.15 -1.26 -5.11 113.70 103.76 2k27 s SER 146 Ca 0.03 0.81 0.00 0.00 0.70 0.00 0.00 55.95 57.49 2k27 s SER 146 Cb 0.03 0.70 0.00 0.00 -1.71 0.00 0.00 66.02 65.04 2k27 s SER 146 CO -0.11 -0.52 0.00 0.61 1.20 0.00 0.00 173.24 174.42 2k27 n GLY 147 N 1.31 -1.99 2.37 9.45 0.00 -1.26 -5.09 105.19 109.98 2k27 n GLY 147 Ca -0.18 0.97 -0.26 0.00 0.00 0.00 0.00 46.02 46.54 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 0.00 3.34 -1.53 4.61 0.00 -1.26 -5.12 120.51 120.55 2k27 n ALA 148 Ca 0.00 -4.14 -0.29 0.00 0.00 0.00 0.00 53.44 49.01 2k27 n ALA 148 Cb 0.00 -0.87 0.15 0.00 0.00 0.00 0.00 19.45 18.74 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 -1.77 0.79 -0.14 0.00 0.04 -1.26 -5.10 135.00 127.57 2k27 s PRO 149 Ca 0.37 0.16 -0.33 0.00 0.04 0.00 0.00 61.00 61.23 2k27 s PRO 149 Cb 0.14 -1.81 0.13 0.00 0.04 0.00 0.00 34.50 33.00 2k27 s PRO 149 CO -0.07 -2.41 1.17 0.20 0.04 0.00 0.00 177.00 175.92 2k27 s GLY 150 N -4.12 -0.33 0.00 0.56 0.00 -1.26 -5.19 107.32 96.98 2k27 s GLY 150 Ca 0.66 1.38 0.00 0.00 0.00 0.00 0.00 44.72 46.75 2k27 s GLY 150 CO 0.54 0.44 0.00 0.61 0.00 0.00 0.00 173.10 174.69 2k27 n GLY 151 N -0.17 -0.87 0.00 0.20 0.00 -1.26 -5.20 105.19 97.90 2k27 n GLY 151 Ca -0.02 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.82 2k27 n GLY 151 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k27 n GLY 152 N -0.57 -0.55 3.20 -0.02 0.00 -1.26 -5.19 105.19 100.81 2k27 n GLY 152 Ca 0.00 -0.98 -0.10 0.00 0.00 0.00 0.00 46.02 44.95 2k27 n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k27 s SER 153 N 0.00 0.05 0.25 1.61 0.01 -1.26 -5.18 113.70 109.18 2k27 s SER 153 Ca 0.00 -0.49 -0.21 0.00 1.31 0.00 0.00 55.95 56.56 2k27 s SER 153 Cb 0.00 0.33 0.05 0.00 0.21 0.00 0.00 66.02 66.61 2k27 s SER 153 CO 0.00 -0.66 0.86 -1.38 0.41 0.00 0.00 173.24 172.47 2k27 s HIS 154 N -3.24 -0.06 0.37 2.43 -3.43 -1.26 -5.20 115.29 104.91 2k27 s HIS 154 Ca 0.00 -0.40 -0.14 0.00 -0.80 0.00 0.00 55.06 53.72 2k27 s HIS 154 Cb 0.02 0.72 0.04 0.00 -1.43 0.00 0.00 32.58 31.93 2k27 s HIS 154 CO -0.08 -1.15 0.74 -3.38 -2.00 0.00 0.00 174.74 168.87 2k27 s HIS 155 N -3.08 0.22 0.03 0.38 -3.43 -1.26 -5.19 115.29 102.96 2k27 s HIS 155 Ca 0.14 -0.82 -0.26 0.00 -0.80 0.00 0.00 55.06 53.32 2k27 s HIS 155 Cb -0.04 0.70 0.06 0.00 -1.43 0.00 0.00 32.58 31.87 2k27 s HIS 155 CO 0.06 -1.48 0.61 -1.58 -2.00 0.00 0.00 174.74 170.35 2k27 s HIS 156 N -2.56 -0.55 0.07 0.38 5.04 -1.26 -5.18 115.29 111.22 2k27 s HIS 156 Ca 0.17 0.72 -0.21 0.00 -1.54 0.00 0.00 55.06 54.21 2k27 s HIS 156 Cb -0.04 0.42 0.05 0.00 0.04 0.00 0.00 32.58 33.04 2k27 s HIS 156 CO 0.12 -0.67 0.49 -3.38 -2.34 0.00 0.00 174.74 168.95 2k27 s HIS 157 N -2.19 -0.37 0.00 3.88 -3.43 -1.26 -5.17 115.29 106.75 2k27 s HIS 157 Ca -0.06 0.32 0.00 0.00 -0.80 0.00 0.00 55.06 54.52 2k27 s HIS 157 Cb -0.01 0.32 0.00 0.00 -1.43 0.00 0.00 32.58 31.46 2k27 s HIS 157 CO 0.01 -0.65 0.00 -2.39 -2.00 0.00 0.00 174.74 169.71 2k27 n HIS 158 N 0.27 0.00 0.50 0.38 1.44 -1.26 -5.39 115.22 111.16 2k27 n HIS 158 Ca -0.18 0.00 0.04 0.00 -2.01 0.00 0.00 57.72 55.57 2k27 n HIS 158 Cb 0.61 0.00 0.24 0.00 0.12 0.00 0.00 29.99 30.96 2k27 n HIS 158 CO 0.00 0.00 0.00 -2.39 -2.81 0.00 0.00 176.34 171.14