#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xng n ASP 4 N 0.00 0.63 0.12 -5.58 8.00 -1.26 -3.56 116.55 114.90 1xng n ASP 4 Ca 0.00 0.27 -0.02 0.00 0.71 0.00 0.00 54.79 55.74 1xng n ASP 4 Cb 0.00 0.57 0.16 0.00 -0.02 0.00 0.00 41.12 41.83 1xng n ASP 4 CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 1xng h TYR 5 N 0.00 0.10 -0.03 1.24 -1.99 -2.00 -0.23 116.97 114.05 1xng h TYR 5 Ca -0.17 -0.04 -0.18 0.00 2.00 0.00 0.00 58.73 60.34 1xng h TYR 5 Cb 1.50 -0.02 -0.01 0.00 2.00 0.00 0.00 36.73 40.20 1xng h TYR 5 CO 0.00 0.67 -0.77 1.96 -0.00 0.00 0.00 178.16 180.01 1xng h GLN 6 N 0.06 0.26 -0.05 4.88 1.08 -2.00 -0.36 115.11 118.97 1xng h GLN 6 Ca -0.01 -0.24 -0.13 0.00 -1.45 0.00 0.00 58.65 56.83 1xng h GLN 6 Cb 1.09 0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 28.56 1xng h GLN 6 CO 0.08 0.91 -0.56 0.87 -0.95 0.00 0.00 178.83 179.19 1xng h LYS 7 N 0.17 0.16 -0.09 1.46 1.57 -1.55 -1.62 116.57 116.68 1xng h LYS 7 Ca -0.03 -0.10 -0.02 0.00 -1.87 0.00 0.00 60.65 58.62 1xng h LYS 7 Cb 1.36 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.68 1xng h LYS 7 CO 0.12 0.68 -0.04 1.25 -0.57 0.00 0.00 179.45 180.89 1xng h LEU 8 N 0.13 0.19 -0.57 2.94 5.85 -0.73 -0.10 115.31 123.02 1xng h LEU 8 Ca -0.00 -0.42 0.03 0.00 0.84 0.00 0.00 57.88 58.33 1xng h LEU 8 Cb 1.02 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.96 1xng h LEU 8 CO 0.08 0.56 0.34 0.40 -0.34 0.00 0.00 178.44 179.49 1xng h ILE 9 N -0.19 1.06 -0.79 4.05 2.04 -0.95 0.19 117.51 122.92 1xng h ILE 9 Ca 0.02 -0.23 -0.05 0.00 1.00 0.00 0.00 64.86 65.60 1xng h ILE 9 Cb 0.50 0.32 -0.04 0.00 -0.74 0.00 0.00 36.82 36.86 1xng h ILE 9 CO 0.01 0.12 0.32 0.58 0.00 0.00 0.00 178.15 179.18 1xng h VAL 10 N 0.67 1.26 -0.09 1.67 2.07 -1.25 -0.02 116.25 120.57 1xng h VAL 10 Ca 0.23 -0.82 -0.00 0.00 0.82 0.00 0.00 66.70 66.93 1xng h VAL 10 Cb 0.03 0.31 -0.00 0.00 -1.52 0.00 0.00 31.29 30.11 1xng h VAL 10 CO -0.10 0.34 0.05 0.22 0.02 0.00 0.00 177.57 178.09 1xng h TYR 11 N 1.16 0.12 -0.53 1.57 3.20 -0.02 -0.91 116.97 121.56 1xng h TYR 11 Ca 0.26 -0.00 -0.10 0.00 3.14 0.00 0.00 58.73 62.03 1xng h TYR 11 Cb 0.22 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.43 1xng h TYR 11 CO 0.02 0.16 -0.07 -0.07 -1.64 0.00 0.00 178.16 176.56 1xng h LEU 12 N 0.04 0.96 -0.47 2.82 3.38 -0.42 -1.82 115.31 119.79 1xng h LEU 12 Ca 0.03 -0.29 -0.04 0.00 0.09 0.00 0.00 57.88 57.67 1xng h LEU 12 Cb 0.08 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 1xng h LEU 12 CO -0.00 1.05 0.15 0.00 0.09 0.00 0.00 178.44 179.72 1xng h ASP 14 N 0.63 0.80 -0.04 0.00 3.32 -1.03 -1.67 116.42 118.44 1xng h ASP 14 Ca 0.15 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1xng h ASP 14 Cb 0.27 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.61 1xng h ASP 14 CO -0.00 0.80 0.02 0.15 -1.72 0.00 0.00 179.24 178.49 1xng h PHE 15 N 0.82 0.05 -0.02 4.55 3.57 -1.04 -0.63 116.94 124.24 1xng h PHE 15 Ca 0.18 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.68 1xng h PHE 15 Cb 0.32 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.04 1xng h PHE 15 CO 0.02 0.04 0.00 -0.07 -2.23 0.00 0.00 178.31 176.07 1xng h LEU 16 N 0.05 0.00 -0.44 0.59 3.38 -1.04 -0.03 115.31 117.82 1xng h LEU 16 Ca 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1xng h LEU 16 Cb -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1xng h LEU 16 CO -0.00 0.01 0.22 -0.08 0.09 0.00 0.00 178.44 178.67 1xng h GLU 17 N 0.02 0.63 -0.21 1.13 4.81 -1.23 -1.51 114.58 118.22 1xng h GLU 17 Ca 0.01 -0.09 -0.04 0.00 -0.13 0.00 0.00 59.36 59.12 1xng h GLU 17 Cb 0.01 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 1xng h GLU 17 CO -0.01 0.53 -0.01 -0.22 -0.73 0.00 0.00 179.01 178.57 1xng h LYS 18 N 0.57 0.38 -0.77 1.92 3.64 -1.01 -0.99 116.57 120.31 1xng h LYS 18 Ca 0.15 -0.13 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 1xng h LYS 18 Cb 0.10 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 1xng h LYS 18 CO -0.02 0.58 0.33 0.93 -2.27 0.00 0.00 179.45 179.00 1xng h GLU 19 N 0.14 1.13 -0.19 1.90 4.39 -0.95 -0.23 114.58 120.77 1xng h GLU 19 Ca 0.06 -0.19 -0.21 0.00 0.34 0.00 0.00 59.36 59.35 1xng h GLU 19 Cb 0.41 -0.19 0.01 0.00 -0.10 0.00 0.00 28.75 28.88 1xng h GLU 19 CO 0.01 0.91 -0.72 0.28 -1.16 0.00 0.00 179.01 178.33 1xng h VAL 20 N 1.10 1.27 -0.40 3.13 2.07 -1.26 -3.20 116.25 118.96 1xng h VAL 20 Ca 0.26 -1.91 -0.11 0.00 0.82 0.00 0.00 66.70 65.76 1xng h VAL 20 Cb 0.18 1.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 1xng h VAL 20 CO -0.03 0.61 -0.19 -0.61 0.02 0.00 0.00 177.57 177.38 1xng h GLN 21 N 0.58 0.83 0.00 1.57 -0.00 -1.02 -2.07 115.11 115.00 1xng h GLN 21 Ca -0.04 -0.36 -0.00 0.00 -0.00 0.00 0.00 58.65 58.25 1xng h GLN 21 Cb 1.35 -0.02 -0.00 0.00 0.00 0.00 0.00 27.48 28.80 1xng h GLN 21 CO 0.15 0.99 -0.01 1.57 0.00 0.00 0.00 178.83 181.53 1xng h LYS 22 N 0.64 0.00 -0.01 1.69 2.10 -1.11 -0.17 116.57 119.70 1xng h LYS 22 Ca 0.09 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.74 1xng h LYS 22 Cb 0.74 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.07 1xng h LYS 22 CO 0.06 0.01 -0.10 0.54 -2.00 0.00 0.00 179.45 177.96 1xng n ARG 23 N -3.17 1.50 -1.11 0.07 1.74 -1.09 -4.94 116.66 109.66 1xng n ARG 23 Ca -0.02 -0.96 0.00 0.00 -0.77 0.00 0.00 57.85 56.10 1xng n ARG 23 Cb 0.15 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.11 1xng n ARG 23 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xng n GLY 24 N 1.26 0.48 3.68 -0.13 0.00 -0.08 -5.06 105.19 105.34 1xng n GLY 24 Ca 0.16 -0.92 -0.24 0.00 0.00 0.00 0.00 46.02 45.02 1xng n GLY 24 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xng s PHE 25 N -2.00 2.59 0.00 1.61 0.40 -0.80 -5.03 117.98 114.75 1xng s PHE 25 Ca 0.00 -0.47 0.00 0.00 -0.60 0.00 0.00 56.93 55.86 1xng s PHE 25 Cb 0.00 -1.64 0.00 0.00 0.51 0.00 0.00 43.02 41.89 1xng s PHE 25 CO 0.00 0.38 0.11 1.63 0.70 0.00 0.00 175.22 178.05 1xng n LYS 26 N -1.06 0.00 -4.13 0.44 5.02 -1.26 -4.00 118.16 113.18 1xng n LYS 26 Ca -0.03 -0.11 -0.16 0.00 -2.02 0.00 0.00 58.31 55.99 1xng n LYS 26 Cb 0.63 -0.48 -0.12 0.00 -0.02 0.00 0.00 35.03 35.05 1xng n LYS 26 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1xng s LYS 27 N 0.00 0.70 0.06 1.97 1.02 -1.26 -4.83 119.74 117.40 1xng s LYS 27 Ca 0.00 -0.90 -0.01 0.00 0.02 0.00 0.00 55.97 55.08 1xng s LYS 27 Cb 0.00 -0.57 -0.04 0.00 -0.52 0.00 0.00 37.83 36.70 1xng s LYS 27 CO 0.00 0.11 -0.01 0.14 -0.92 0.00 0.00 175.35 174.67 1xng s VAL 28 N -1.47 0.21 0.03 3.17 -7.23 -0.48 -2.15 120.40 112.48 1xng s VAL 28 Ca -0.04 -1.79 -0.02 0.00 -1.81 0.00 0.00 61.98 58.32 1xng s VAL 28 Cb -0.09 -1.55 -0.02 0.00 0.56 0.00 0.00 36.38 35.28 1xng s VAL 28 CO 0.01 -0.95 0.01 0.54 -0.31 0.00 0.00 175.10 174.40 1xng s VAL 29 N -3.93 0.14 0.13 1.32 0.11 0.21 -1.10 120.40 117.28 1xng s VAL 29 Ca 0.08 -1.19 -0.24 0.00 -2.93 0.00 0.00 61.98 57.70 1xng s VAL 29 Cb 0.08 -0.78 0.07 0.00 -1.53 0.00 0.00 36.38 34.22 1xng s VAL 29 CO -0.09 -0.66 0.60 -0.72 -3.33 0.00 0.00 175.10 170.90 1xng s TYR 30 N -2.43 -0.54 -0.09 1.54 -0.85 -0.87 -1.11 117.35 112.99 1xng s TYR 30 Ca -0.07 0.42 -0.24 0.00 -0.52 0.00 0.00 57.07 56.66 1xng s TYR 30 Cb -0.03 0.52 -0.03 0.00 0.38 0.00 0.00 41.96 42.81 1xng s TYR 30 CO -0.04 -0.81 0.76 0.20 -1.52 0.00 0.00 175.55 174.14 1xng s GLY 31 N -2.52 2.48 -0.38 5.49 0.00 -1.26 -0.66 107.32 110.46 1xng s GLY 31 Ca -0.01 0.12 -0.07 0.00 0.00 0.00 0.00 44.72 44.77 1xng s GLY 31 CO -0.10 1.37 0.18 -2.27 0.00 0.00 0.00 173.10 172.28 1xng s LEU 32 N 1.24 4.80 0.15 0.66 2.96 -0.69 -4.79 118.68 123.01 1xng s LEU 32 Ca 0.39 -1.43 0.22 0.00 -0.22 0.00 0.00 54.13 53.10 1xng s LEU 32 Cb -0.18 -1.91 -0.06 0.00 0.50 0.00 0.00 46.19 44.55 1xng s LEU 32 CO 0.17 -0.45 0.94 -1.54 -1.32 0.00 0.00 176.35 174.16 1xng n SER 33 N 4.82 0.67 0.00 3.68 3.41 -1.26 -4.45 113.62 120.49 1xng n SER 33 Ca -0.10 0.24 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 1xng n SER 33 Cb 0.43 0.75 0.00 0.00 -0.26 0.00 0.00 64.21 65.14 1xng n SER 33 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xng n GLY 34 N 1.21 0.48 3.97 5.00 0.00 -1.26 -4.41 105.19 110.18 1xng n GLY 34 Ca -0.01 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.78 1xng n GLY 34 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xng s GLY 35 N -1.07 1.77 0.04 -0.02 0.00 -1.26 -4.72 107.32 102.06 1xng s GLY 35 Ca 0.00 -1.43 -0.24 0.00 0.00 0.00 0.00 44.72 43.05 1xng s GLY 35 CO 0.00 -0.97 1.51 -2.00 0.00 0.00 0.00 173.10 171.64 1xng h LEU 36 N -0.40 0.03 0.09 0.66 5.85 -1.91 -2.71 115.31 116.91 1xng h LEU 36 Ca -0.40 -0.24 0.02 0.00 0.84 0.00 0.00 57.88 58.10 1xng h LEU 36 Cb 1.28 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.27 1xng h LEU 36 CO 0.48 0.27 -0.28 0.44 -0.34 0.00 0.00 178.44 179.01 1xng h ASP 37 N -0.20 -0.79 0.22 1.25 3.32 -1.96 -1.01 116.42 117.24 1xng h ASP 37 Ca 0.01 0.10 -0.07 0.00 0.02 0.00 0.00 57.03 57.09 1xng h ASP 37 Cb 0.25 0.31 -0.01 0.00 0.22 0.00 0.00 39.33 40.09 1xng h ASP 37 CO 0.00 -0.36 -0.27 0.77 -1.72 0.00 0.00 179.24 177.66 1xng h SER 38 N -0.47 0.10 -0.66 6.45 4.64 -1.84 -2.03 113.55 119.73 1xng h SER 38 Ca 0.04 -0.03 -0.07 0.00 -0.47 0.00 0.00 61.79 61.26 1xng h SER 38 Cb 0.51 -0.03 -0.03 0.00 -0.31 0.00 0.00 62.40 62.55 1xng h SER 38 CO -0.18 0.38 0.13 0.00 -0.87 0.00 0.00 176.83 176.29 1xng h ALA 39 N 1.63 0.88 -0.32 5.18 0.00 -1.11 0.69 119.26 126.20 1xng h ALA 39 Ca 0.01 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 1xng h ALA 39 Cb 0.54 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1xng h ALA 39 CO 0.04 0.62 0.06 0.28 0.00 0.00 0.00 179.25 180.25 1xng h VAL 40 N 1.01 1.23 -0.65 0.00 2.07 -0.71 -1.86 116.25 117.34 1xng h VAL 40 Ca 0.20 -0.79 -0.06 0.00 0.82 0.00 0.00 66.70 66.87 1xng h VAL 40 Cb 0.41 1.13 -0.03 0.00 -1.52 0.00 0.00 31.29 31.28 1xng h VAL 40 CO 0.01 0.26 0.17 0.58 0.02 0.00 0.00 177.57 178.60 1xng h VAL 41 N 0.36 1.26 -0.59 2.57 2.07 -1.15 -2.39 116.25 118.37 1xng h VAL 41 Ca 0.10 -0.93 -0.00 0.00 0.82 0.00 0.00 66.70 66.69 1xng h VAL 41 Cb 0.33 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 1xng h VAL 41 CO 0.00 0.35 0.36 1.23 0.02 0.00 0.00 177.57 179.53 1xng h GLY 42 N 0.97 0.85 1.07 2.17 0.00 -0.73 -0.37 103.07 107.03 1xng h GLY 42 Ca 0.21 -0.36 -0.09 0.00 0.00 0.00 0.00 47.33 47.09 1xng h GLY 42 CO 0.00 0.34 0.00 -2.08 0.00 0.00 0.00 176.54 174.81 1xng h VAL 43 N 0.80 1.27 -0.41 4.60 2.07 -1.20 -1.30 116.25 122.06 1xng h VAL 43 Ca 0.21 -1.14 -0.05 0.00 0.82 0.00 0.00 66.70 66.55 1xng h VAL 43 Cb -0.02 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 1xng h VAL 43 CO -0.04 0.41 0.08 -0.07 0.02 0.00 0.00 177.57 177.97 1xng h LEU 44 N 0.92 0.65 -1.30 2.57 3.38 -1.21 -2.41 115.31 117.90 1xng h LEU 44 Ca 0.17 -0.25 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 1xng h LEU 44 Cb 0.55 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1xng h LEU 44 CO 0.03 0.73 -0.15 0.00 0.09 0.00 0.00 178.44 179.15 1xng h GLN 46 N 0.28 0.99 -0.12 0.00 -0.00 -0.95 0.19 115.11 115.49 1xng h GLN 46 Ca 0.05 -0.31 -0.05 0.00 -0.00 0.00 0.00 58.65 58.34 1xng h GLN 46 Cb 0.43 -0.09 -0.01 0.00 0.00 0.00 0.00 27.48 27.81 1xng h GLN 46 CO 0.03 0.99 -0.17 0.87 0.00 0.00 0.00 178.83 180.55 1xng h LYS 47 N 0.88 0.20 0.03 1.69 1.57 -1.07 0.25 116.57 120.11 1xng h LYS 47 Ca 0.16 -0.05 -0.24 0.00 -1.87 0.00 0.00 60.65 58.65 1xng h LYS 47 Cb 0.54 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.80 1xng h LYS 47 CO 0.03 0.37 -1.29 0.28 -0.57 0.00 0.00 179.45 178.27 1xng h VAL 48 N 0.19 0.95 -0.01 0.50 2.07 -1.20 -3.41 116.25 115.35 1xng h VAL 48 Ca 0.04 -2.24 0.00 0.00 0.82 0.00 0.00 66.70 65.31 1xng h VAL 48 Cb 0.42 2.42 0.00 0.00 -1.52 0.00 0.00 31.29 32.60 1xng h VAL 48 CO 0.03 0.47 -0.50 0.49 0.02 0.00 0.00 177.57 178.08 1xng n PHE 49 N -4.24 0.00 0.00 1.57 3.01 0.63 -5.04 117.46 113.39 1xng n PHE 49 Ca -0.29 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.17 1xng n PHE 49 Cb 0.75 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.22 1xng n PHE 49 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1xng n LYS 50 N -0.76 0.00 0.07 -1.08 4.76 0.87 -0.62 118.16 121.39 1xng n LYS 50 Ca 0.04 0.00 0.11 0.00 -2.87 0.00 0.00 58.31 55.60 1xng n LYS 50 Cb 0.27 0.00 0.45 0.00 -1.84 0.00 0.00 35.03 33.91 1xng n LYS 50 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 1xng n GLU 51 N 7.36 0.13 -0.02 1.97 2.13 -1.26 -2.81 120.64 128.14 1xng n GLU 51 Ca 0.00 0.25 0.12 0.00 0.66 0.00 0.00 57.16 58.19 1xng n GLU 51 Cb 0.00 -1.69 0.60 0.00 0.27 0.00 0.00 31.44 30.62 1xng n GLU 51 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1xng n ASN 52 N -1.93 0.76 -4.38 4.31 3.02 0.21 -4.67 115.26 112.58 1xng n ASN 52 Ca 0.04 -1.40 -0.37 0.00 -0.03 0.00 0.00 54.58 52.82 1xng n ASN 52 Cb 0.29 -0.03 -0.13 0.00 -0.61 0.00 0.00 39.78 39.31 1xng n ASN 52 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xng s ALA 53 N -1.95 3.09 -0.09 5.41 0.00 -1.12 -1.38 121.76 125.71 1xng s ALA 53 Ca 0.36 -1.32 0.00 0.00 0.00 0.00 0.00 51.96 51.00 1xng s ALA 53 Cb 0.18 -2.11 -0.03 0.00 0.00 0.00 0.00 23.12 21.17 1xng s ALA 53 CO 0.29 -0.74 -0.08 -1.58 0.00 0.00 0.00 175.76 173.65 1xng s HIS 54 N 1.54 2.90 -0.18 0.00 2.46 -0.26 -4.25 115.29 117.51 1xng s HIS 54 Ca 0.04 -0.19 -0.08 0.00 0.47 0.00 0.00 55.06 55.30 1xng s HIS 54 Cb -0.16 -1.77 -0.05 0.00 -0.13 0.00 0.00 32.58 30.47 1xng s HIS 54 CO 0.03 0.14 0.11 0.00 -2.47 0.00 0.00 174.74 172.55 1xng s ALA 55 N -0.35 3.65 -0.28 1.58 0.00 -0.53 -2.06 121.76 123.78 1xng s ALA 55 Ca 0.05 -0.70 -0.03 0.00 0.00 0.00 0.00 51.96 51.28 1xng s ALA 55 Cb -0.12 -2.04 0.03 0.00 0.00 0.00 0.00 23.12 20.98 1xng s ALA 55 CO 0.02 0.27 -0.00 -1.17 0.00 0.00 0.00 175.76 174.88 1xng s LEU 56 N 0.03 3.56 -0.24 0.00 0.20 0.17 -1.65 118.68 120.76 1xng s LEU 56 Ca 0.08 -0.93 -0.15 0.00 0.69 0.00 0.00 54.13 53.82 1xng s LEU 56 Cb -0.12 -1.74 -0.04 0.00 -0.43 0.00 0.00 46.19 43.87 1xng s LEU 56 CO -0.00 -0.18 0.39 -0.76 -0.29 0.00 0.00 176.35 175.50 1xng s LEU 57 N 1.36 4.09 -0.56 -0.68 1.02 -0.01 -1.70 118.68 122.20 1xng s LEU 57 Ca -0.00 0.40 0.05 0.00 0.02 0.00 0.00 54.13 54.60 1xng s LEU 57 Cb -0.18 -2.47 0.20 0.00 0.02 0.00 0.00 46.19 43.77 1xng s LEU 57 CO -0.02 -0.13 0.52 0.23 0.02 0.00 0.00 176.35 176.97 1xng n MET 58 N 4.92 1.39 -2.21 1.70 2.81 -1.26 -0.52 117.12 123.95 1xng n MET 58 Ca -0.08 -3.99 -0.37 0.00 -1.81 0.00 0.00 57.70 51.46 1xng n MET 58 Cb 0.51 -1.94 -0.00 0.00 -0.71 0.00 0.00 33.22 31.08 1xng n MET 58 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1xng s PRO 59 N -1.27 3.56 0.02 0.03 0.04 -1.26 -4.62 135.00 131.49 1xng s PRO 59 Ca 0.32 1.77 0.00 0.00 0.04 0.00 0.00 61.00 63.13 1xng s PRO 59 Cb 0.06 -2.26 0.00 0.00 0.04 0.00 0.00 34.50 32.34 1xng s PRO 59 CO -0.13 -0.72 0.02 -1.13 0.04 0.00 0.00 177.00 175.08 1xng n SER 60 N -0.81 0.46 0.26 6.66 3.41 -1.26 -1.46 113.62 120.88 1xng n SER 60 Ca 0.09 -1.05 0.15 0.00 -0.26 0.00 0.00 58.87 57.80 1xng n SER 60 Cb 0.49 -0.01 0.53 0.00 -0.26 0.00 0.00 64.21 64.96 1xng n SER 60 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1xng h SER 61 N 0.01 0.00 0.00 4.04 0.02 -1.87 -3.19 113.55 112.55 1xng h SER 61 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1xng h SER 61 Cb 0.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.58 1xng h SER 61 CO 0.01 0.03 -0.72 0.55 -1.14 0.00 0.00 176.83 175.57 1xng n VAL 62 N -3.13 0.00 -1.65 2.27 3.14 -1.26 -5.02 118.33 112.68 1xng n VAL 62 Ca 0.01 -0.23 -0.45 0.00 -2.96 0.00 0.00 64.34 60.71 1xng n VAL 62 Cb 0.38 0.88 -0.02 0.00 -1.06 0.00 0.00 33.84 34.01 1xng n VAL 62 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 1xng n SER 63 N -1.38 2.41 -4.72 6.55 7.64 -1.21 -4.54 113.62 118.37 1xng n SER 63 Ca 0.02 1.16 -0.42 0.00 1.01 0.00 0.00 58.87 60.63 1xng n SER 63 Cb 0.21 -1.39 -0.03 0.00 -1.01 0.00 0.00 64.21 61.98 1xng n SER 63 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1xng s MET 64 N -0.76 4.35 0.38 1.43 -1.94 -1.26 -4.83 119.30 116.66 1xng s MET 64 Ca 0.66 2.01 0.06 0.00 -1.71 0.00 0.00 55.69 56.70 1xng s MET 64 Cb -0.67 -3.26 0.76 0.00 2.01 0.00 0.00 34.83 33.67 1xng s MET 64 CO 0.53 -0.38 2.01 -1.00 -0.01 0.00 0.00 175.02 176.17 1xng h PRO 65 N 6.64 0.59 -0.15 2.03 0.13 -1.99 -2.07 132.00 137.19 1xng h PRO 65 Ca -0.42 -0.06 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 1xng h PRO 65 Cb 1.21 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 1xng h PRO 65 CO 0.84 0.44 0.07 0.93 -0.23 0.00 0.00 178.00 180.05 1xng h GLU 66 N 0.59 0.20 -0.47 0.86 3.07 -2.00 -2.17 114.58 114.67 1xng h GLU 66 Ca 0.15 -0.02 -0.11 0.00 -0.50 0.00 0.00 59.36 58.89 1xng h GLU 66 Cb 0.03 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 27.88 1xng h GLU 66 CO -0.02 0.17 -0.13 -0.91 -1.40 0.00 0.00 179.01 176.72 1xng h ASN 67 N 0.21 0.92 -0.51 1.42 -0.26 -1.68 -1.44 115.58 114.24 1xng h ASN 67 Ca 0.05 -0.37 -0.09 0.00 -0.56 0.00 0.00 56.30 55.33 1xng h ASN 67 Cb 0.04 -0.25 -0.02 0.00 -1.06 0.00 0.00 38.32 37.02 1xng h ASN 67 CO -0.01 1.08 -0.04 0.50 -1.06 0.00 0.00 177.43 177.90 1xng h LYS 68 N 0.75 0.96 -0.64 0.81 3.64 -1.43 -1.38 116.57 119.28 1xng h LYS 68 Ca 0.12 -0.31 -0.04 0.00 -1.27 0.00 0.00 60.65 59.16 1xng h LYS 68 Cb 0.68 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.38 1xng h LYS 68 CO 0.05 0.97 0.27 1.15 -2.27 0.00 0.00 179.45 179.61 1xng h THR 69 N 0.88 1.23 -0.26 1.00 2.02 -1.24 0.23 112.91 116.77 1xng h THR 69 Ca 0.15 -0.72 -0.10 0.00 0.77 0.00 0.00 66.41 66.51 1xng h THR 69 Cb 0.56 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.46 1xng h THR 69 CO 0.03 0.29 -0.25 0.44 0.37 0.00 0.00 175.52 176.40 1xng h ASP 70 N 0.90 0.50 -0.40 4.18 3.32 -1.02 -0.82 116.42 123.10 1xng h ASP 70 Ca 0.22 -0.17 -0.10 0.00 0.02 0.00 0.00 57.03 56.99 1xng h ASP 70 Cb 0.19 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 1xng h ASP 70 CO -0.02 0.75 -0.15 0.00 -1.72 0.00 0.00 179.24 178.10 1xng h ALA 71 N 1.29 0.56 -0.72 3.45 0.00 -0.80 -1.97 119.26 121.07 1xng h ALA 71 Ca 0.06 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 1xng h ALA 71 Cb 0.67 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1xng h ALA 71 CO 0.05 0.47 0.26 -0.07 0.00 0.00 0.00 179.25 179.96 1xng h LEU 72 N 0.62 1.02 -1.31 0.00 3.38 -0.66 -2.37 115.31 115.99 1xng h LEU 72 Ca 0.10 -0.19 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 1xng h LEU 72 Cb 0.69 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1xng h LEU 72 CO 0.05 0.94 -0.30 0.78 0.09 0.00 0.00 178.44 180.00 1xng h ASN 73 N 1.05 0.07 -0.24 -0.43 2.35 -1.01 -2.29 115.58 115.09 1xng h ASN 73 Ca 0.24 -0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.94 1xng h ASN 73 Cb 0.26 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 1xng h ASN 73 CO -0.01 0.38 0.05 0.25 -1.65 0.00 0.00 177.43 176.44 1xng h LEU 74 N 0.07 0.36 -1.09 1.61 5.85 -0.87 -1.09 115.31 120.16 1xng h LEU 74 Ca 0.01 -0.24 -0.02 0.00 0.84 0.00 0.00 57.88 58.47 1xng h LEU 74 Cb 0.57 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.47 1xng h LEU 74 CO 0.04 0.51 0.39 0.00 -0.34 0.00 0.00 178.44 179.04 1xng h GLU 76 N 1.04 0.78 -0.09 0.00 4.81 -1.23 0.35 114.58 120.24 1xng h GLU 76 Ca 0.26 -0.29 -0.11 0.00 -0.13 0.00 0.00 59.36 59.10 1xng h GLU 76 Cb 0.04 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 1xng h GLU 76 CO -0.04 0.89 -0.43 0.87 -0.73 0.00 0.00 179.01 179.58 1xng h LYS 77 N 0.60 0.19 -0.29 1.92 1.79 -0.86 -3.20 116.57 116.73 1xng h LYS 77 Ca 0.11 -0.09 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 1xng h LYS 77 Cb 0.59 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.24 1xng h LYS 77 CO 0.04 0.59 0.00 1.19 -1.08 0.00 0.00 179.45 180.19 1xng n PHE 78 N -4.02 0.67 -3.85 -1.35 3.72 -0.54 -4.99 117.46 107.10 1xng n PHE 78 Ca -0.02 -0.69 -0.24 0.00 -0.05 0.00 0.00 57.45 56.45 1xng n PHE 78 Cb 0.48 -0.17 0.00 0.00 -0.94 0.00 0.00 39.48 38.86 1xng n PHE 78 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1xng n SER 79 N -0.04 -1.03 -4.56 4.37 7.64 0.88 -4.95 113.62 115.94 1xng n SER 79 Ca 0.16 -0.91 -0.40 0.00 1.01 0.00 0.00 58.87 58.73 1xng n SER 79 Cb 0.65 -3.53 -0.10 0.00 -1.01 0.00 0.00 64.21 60.22 1xng n SER 79 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1xng s ILE 80 N -3.77 5.22 0.35 0.44 1.01 0.73 -4.85 121.20 120.33 1xng s ILE 80 Ca 0.07 0.11 -0.28 0.00 0.00 0.00 0.00 60.65 60.54 1xng s ILE 80 Cb -0.03 -3.71 -0.11 0.00 0.01 0.00 0.00 42.46 38.62 1xng s ILE 80 CO 0.85 0.04 1.40 -2.16 0.00 0.00 0.00 174.94 175.08 1xng s PRO 81 N 1.91 4.23 0.20 2.79 0.04 -1.26 -4.73 135.00 138.19 1xng s PRO 81 Ca 0.10 2.39 -0.04 0.00 0.04 0.00 0.00 61.00 63.49 1xng s PRO 81 Cb -0.16 -3.02 -0.03 0.00 0.04 0.00 0.00 34.50 31.32 1xng s PRO 81 CO 0.11 -0.36 0.20 1.52 0.04 0.00 0.00 177.00 178.51 1xng s TYR 82 N -1.08 0.95 -0.06 0.56 -0.85 -1.26 -1.45 117.35 114.17 1xng s TYR 82 Ca 0.51 -1.21 -0.06 0.00 -0.52 0.00 0.00 57.07 55.79 1xng s TYR 82 Cb -0.43 -0.38 0.01 0.00 0.38 0.00 0.00 41.96 41.54 1xng s TYR 82 CO 0.57 -0.71 0.16 0.99 -1.52 0.00 0.00 175.55 175.04 1xng s THR 83 N -4.12 0.00 -0.24 -3.49 2.01 -0.66 -4.94 115.64 104.20 1xng s THR 83 Ca 0.34 -0.02 -0.05 0.00 0.31 0.00 0.00 61.69 62.27 1xng s THR 83 Cb 0.05 -0.23 -0.00 0.00 0.01 0.00 0.00 72.50 72.33 1xng s THR 83 CO 0.10 -0.01 -0.01 -0.70 -0.69 0.00 0.00 174.62 173.31 1xng s GLU 84 N 0.04 3.26 -0.22 4.92 2.12 -1.26 -0.83 118.70 126.73 1xng s GLU 84 Ca -0.00 -0.71 -0.01 0.00 0.36 0.00 0.00 54.97 54.60 1xng s GLU 84 Cb -0.01 -3.12 0.06 0.00 0.26 0.00 0.00 34.13 31.32 1xng s GLU 84 CO 0.00 -0.28 0.01 -0.47 -0.54 0.00 0.00 175.26 173.98 1xng s TYR 85 N 1.47 1.62 0.14 5.30 5.04 0.33 -4.99 117.35 126.27 1xng s TYR 85 Ca 0.04 -1.28 -0.30 0.00 -2.44 0.00 0.00 57.07 53.09 1xng s TYR 85 Cb -0.15 -1.30 -0.07 0.00 0.35 0.00 0.00 41.96 40.79 1xng s TYR 85 CO -0.01 -0.69 1.07 0.45 -1.34 0.00 0.00 175.55 175.02 1xng s SER 86 N 1.66 7.31 0.00 4.32 0.15 -1.26 -4.06 113.70 121.82 1xng s SER 86 Ca -0.02 1.99 0.22 0.00 0.70 0.00 0.00 55.95 58.85 1xng s SER 86 Cb -0.18 -2.60 0.56 0.00 -1.71 0.00 0.00 66.02 62.10 1xng s SER 86 CO -0.08 -0.20 1.48 2.30 1.20 0.00 0.00 173.24 177.93 1xng n ILE 87 N 2.66 0.85 -0.30 6.45 -5.35 -0.54 -4.52 119.36 118.61 1xng n ILE 87 Ca 0.03 -0.92 0.03 0.00 -0.27 0.00 0.00 62.75 61.62 1xng n ILE 87 Cb 0.47 0.65 0.18 0.00 -1.74 0.00 0.00 39.64 39.20 1xng n ILE 87 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1xng h ALA 88 N 4.25 1.21 0.00 -1.28 0.00 -1.84 -1.20 119.26 120.40 1xng h ALA 88 Ca 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1xng h ALA 88 Cb 0.98 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1xng h ALA 88 CO 0.00 0.11 -0.03 -1.00 0.00 0.00 0.00 179.25 178.33 1xng h PRO 89 N 0.81 0.00 0.11 0.00 0.13 -1.95 -0.41 132.00 130.68 1xng h PRO 89 Ca 0.41 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 65.33 1xng h PRO 89 Cb 0.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.52 1xng h PRO 89 CO -0.25 0.03 -1.03 1.88 -0.23 0.00 0.00 178.00 178.40 1xng h TYR 90 N 0.00 0.40 0.00 1.56 -1.99 -1.58 -3.28 116.97 112.09 1xng h TYR 90 Ca -0.00 -0.30 -0.01 0.00 2.00 0.00 0.00 58.73 60.42 1xng h TYR 90 Cb 0.07 -0.02 -0.00 0.00 2.00 0.00 0.00 36.73 38.78 1xng h TYR 90 CO 0.00 1.40 -0.07 0.38 -0.00 0.00 0.00 178.16 179.87 1xng h ASP 91 N -0.45 0.00 -0.46 3.88 -0.00 -1.19 -2.27 116.42 115.93 1xng h ASP 91 Ca -0.21 0.00 -0.09 0.00 -0.00 0.00 0.00 57.03 56.73 1xng h ASP 91 Cb 1.60 0.00 -0.02 0.00 -0.00 0.00 0.00 39.33 40.91 1xng h ASP 91 CO 0.07 0.07 -0.03 0.00 -0.00 0.00 0.00 179.24 179.34 1xng h ALA 92 N 1.93 0.97 -0.31 4.15 0.00 -1.16 -0.19 119.26 124.65 1xng h ALA 92 Ca -0.00 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.53 1xng h ALA 92 Cb 0.51 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1xng h ALA 92 CO 0.01 0.62 -0.14 0.82 0.00 0.00 0.00 179.25 180.56 1xng h ILE 93 N 0.82 1.29 -0.66 0.00 2.04 -1.47 -2.04 117.51 117.49 1xng h ILE 93 Ca 0.15 -1.23 0.03 0.00 1.00 0.00 0.00 64.86 64.81 1xng h ILE 93 Cb 0.54 1.43 -0.04 0.00 -0.74 0.00 0.00 36.82 38.00 1xng h ILE 93 CO 0.03 0.40 0.40 0.15 0.00 0.00 0.00 178.15 179.13 1xng h PHE 94 N 0.41 0.75 -0.41 1.37 3.04 -1.19 -0.14 116.94 120.78 1xng h PHE 94 Ca 0.07 0.02 -0.05 0.00 3.98 0.00 0.00 57.97 61.99 1xng h PHE 94 Cb 0.66 -0.24 -0.02 0.00 2.56 0.00 0.00 35.95 38.90 1xng h PHE 94 CO 0.06 0.42 0.05 0.77 -2.02 0.00 0.00 178.31 177.58 1xng h SER 95 N 0.78 0.59 -0.27 0.41 0.02 -0.93 0.23 113.55 114.38 1xng h SER 95 Ca 0.27 -0.11 -0.17 0.00 -0.84 0.00 0.00 61.79 60.94 1xng h SER 95 Cb 0.05 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.44 1xng h SER 95 CO -0.12 0.63 -0.49 -1.28 -1.14 0.00 0.00 176.83 174.43 1xng h SER 96 N 0.61 0.93 0.85 3.07 0.87 -0.59 -2.47 113.55 116.83 1xng h SER 96 Ca 0.13 -0.47 -0.21 0.00 -1.23 0.00 0.00 61.79 60.01 1xng h SER 96 Cb 0.31 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 61.99 1xng h SER 96 CO 0.01 1.26 -1.00 0.45 -0.53 0.00 0.00 176.83 177.01 1xng h HIS 97 N 0.67 0.13 -2.24 2.24 3.86 -0.69 -3.38 115.15 115.73 1xng h HIS 97 Ca 0.03 -0.09 -0.58 0.00 -1.16 0.00 0.00 60.37 58.57 1xng h HIS 97 Cb 1.08 -0.01 -0.40 0.00 1.06 0.00 0.00 27.41 29.14 1xng h HIS 97 CO 0.06 1.02 -0.88 1.19 0.86 0.00 0.00 177.93 180.19 1xng n PHE 98 N -3.45 1.05 -0.08 2.45 3.01 0.78 -4.95 117.46 116.25 1xng n PHE 98 Ca -0.02 -3.76 -0.01 0.00 1.01 0.00 0.00 57.45 54.67 1xng n PHE 98 Cb 0.92 -0.33 0.26 0.00 -0.01 0.00 0.00 39.48 40.32 1xng n PHE 98 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 1xng h LYS 99 N 4.50 0.72 -0.60 -1.08 1.57 -1.63 -2.63 116.57 117.42 1xng h LYS 99 Ca 0.15 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1xng h LYS 99 Cb 0.81 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.00 1xng h LYS 99 CO 0.58 0.63 0.00 -0.25 -0.57 0.00 0.00 179.45 179.84 1xng n ASP 100 N -4.31 3.34 -4.76 0.86 8.00 -1.26 -4.95 116.55 113.46 1xng n ASP 100 Ca 0.03 -2.28 -0.39 0.00 0.71 0.00 0.00 54.79 52.87 1xng n ASP 100 Cb 0.19 -0.46 0.02 0.00 -0.02 0.00 0.00 41.12 40.84 1xng n ASP 100 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xng s ALA 101 N -1.71 3.08 0.81 2.24 0.00 -0.99 -4.97 121.76 120.23 1xng s ALA 101 Ca 0.35 1.30 -0.12 0.00 0.00 0.00 0.00 51.96 53.49 1xng s ALA 101 Cb 0.22 -3.53 0.08 0.00 0.00 0.00 0.00 23.12 19.89 1xng s ALA 101 CO 0.17 -1.08 1.14 -1.54 0.00 0.00 0.00 175.76 174.45 1xng s SER 102 N -0.81 3.87 0.37 0.00 1.04 -1.26 -4.81 113.70 112.10 1xng s SER 102 Ca 0.63 2.09 0.04 0.00 0.48 0.00 0.00 55.95 59.19 1xng s SER 102 Cb -0.39 -2.56 0.70 0.00 0.10 0.00 0.00 66.02 63.87 1xng s SER 102 CO 0.49 -2.47 2.01 -0.07 0.98 0.00 0.00 173.24 174.18 1xng h LEU 103 N -1.16 0.62 -0.32 2.42 3.38 -1.99 -1.83 115.31 116.43 1xng h LEU 103 Ca -0.44 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.46 1xng h LEU 103 Cb 1.26 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 1xng h LEU 103 CO 0.47 0.48 0.04 0.74 0.09 0.00 0.00 178.44 180.27 1xng h THR 104 N 0.72 1.24 -0.38 0.22 2.02 -1.98 -0.67 112.91 114.08 1xng h THR 104 Ca 0.19 -0.83 -0.00 0.00 0.77 0.00 0.00 66.41 66.53 1xng h THR 104 Cb -0.03 1.17 -0.02 0.00 -1.74 0.00 0.00 68.15 67.54 1xng h THR 104 CO -0.04 0.27 0.23 0.03 0.37 0.00 0.00 175.52 176.39 1xng h ARG 105 N 0.35 0.51 -0.64 6.66 3.08 -1.79 0.34 114.38 122.89 1xng h ARG 105 Ca 0.09 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 1xng h ARG 105 Cb 0.36 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.27 1xng h ARG 105 CO 0.01 0.38 0.35 0.87 -1.07 0.00 0.00 179.97 180.51 1xng h LYS 106 N 0.49 0.90 -0.61 0.04 1.57 -1.25 -1.76 116.57 115.96 1xng h LYS 106 Ca 0.14 -0.11 -0.08 0.00 -1.87 0.00 0.00 60.65 58.72 1xng h LYS 106 Cb 0.00 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.11 1xng h LYS 106 CO -0.03 0.69 0.05 0.78 -0.57 0.00 0.00 179.45 180.37 1xng h GLY 107 N 0.88 1.11 1.23 3.86 0.00 -0.84 -2.43 103.07 106.87 1xng h GLY 107 Ca 0.23 -0.76 -0.04 0.00 0.00 0.00 0.00 47.33 46.75 1xng h GLY 107 CO -0.04 0.70 0.26 3.43 0.00 0.00 0.00 176.54 180.89 1xng h ASN 108 N 0.95 0.90 -0.44 0.19 2.35 -0.56 -1.06 115.58 117.90 1xng h ASN 108 Ca 0.18 -0.13 -0.03 0.00 -0.55 0.00 0.00 56.30 55.77 1xng h ASN 108 Cb 0.49 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.61 1xng h ASN 108 CO 0.02 0.81 0.17 0.15 -1.65 0.00 0.00 177.43 176.92 1xng h PHE 109 N 0.96 0.68 -0.63 1.19 3.57 -1.06 -1.67 116.94 119.98 1xng h PHE 109 Ca 0.22 -0.06 -0.04 0.00 3.53 0.00 0.00 57.97 61.63 1xng h PHE 109 Cb 0.20 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 1xng h PHE 109 CO 0.02 0.60 0.23 0.00 -2.23 0.00 0.00 178.31 176.93 1xng h ALA 111 N 1.09 1.53 0.00 0.00 0.00 -1.02 -1.15 119.26 119.71 1xng h ALA 111 Ca 0.21 -0.10 -0.15 0.00 0.00 0.00 0.00 54.91 54.86 1xng h ALA 111 Cb 0.23 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1xng h ALA 111 CO -0.01 0.37 -0.73 0.00 0.00 0.00 0.00 179.25 178.88 1xng h ARG 112 N 0.61 0.00 -0.51 0.00 3.08 -0.90 -2.35 114.38 114.31 1xng h ARG 112 Ca 0.15 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.08 1xng h ARG 112 Cb 0.08 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 1xng h ARG 112 CO -0.02 0.73 -0.16 -0.07 -1.07 0.00 0.00 179.97 179.38 1xng h LEU 113 N 0.00 1.02 -0.84 3.04 3.38 -0.43 -1.94 115.31 119.55 1xng h LEU 113 Ca -0.01 -0.37 -0.05 0.00 0.09 0.00 0.00 57.88 57.54 1xng h LEU 113 Cb 1.41 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.84 1xng h LEU 113 CO 0.09 1.17 0.26 0.03 0.09 0.00 0.00 178.44 180.08 1xng h ARG 114 N 0.87 1.12 -0.51 1.13 3.08 -1.12 -1.44 114.38 117.52 1xng h ARG 114 Ca 0.12 -0.22 -0.02 0.00 0.07 0.00 0.00 59.98 59.94 1xng h ARG 114 Cb 0.74 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.59 1xng h ARG 114 CO 0.06 0.93 0.24 1.98 -1.07 0.00 0.00 179.97 182.11 1xng h MET 115 N 1.09 0.73 -0.69 0.04 4.05 -1.21 -0.87 114.93 118.07 1xng h MET 115 Ca 0.24 -0.11 -0.02 0.00 -0.28 0.00 0.00 59.70 59.54 1xng h MET 115 Cb 0.25 -0.13 -0.03 0.00 -0.80 0.00 0.00 31.60 30.89 1xng h MET 115 CO -0.01 0.61 0.36 0.00 0.23 0.00 0.00 176.91 178.09 1xng h ALA 116 N 1.08 1.34 0.06 0.39 0.00 -0.82 -0.14 119.26 121.17 1xng h ALA 116 Ca 0.17 -0.12 -0.24 0.00 0.00 0.00 0.00 54.91 54.73 1xng h ALA 116 Cb 0.12 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1xng h ALA 116 CO -0.02 0.53 -1.07 0.74 0.00 0.00 0.00 179.25 179.43 1xng h PHE 117 N 0.96 0.38 -0.62 0.00 0.05 -1.11 -0.61 116.94 116.00 1xng h PHE 117 Ca 0.24 -0.25 -0.07 0.00 3.82 0.00 0.00 57.97 61.72 1xng h PHE 117 Cb 0.06 -0.03 -0.02 0.00 2.00 0.00 0.00 35.95 37.96 1xng h PHE 117 CO 0.01 1.14 0.12 -0.07 -0.18 0.00 0.00 178.31 179.33 1xng h LEU 118 N 0.09 0.96 -0.57 1.54 3.38 -0.79 0.10 115.31 120.02 1xng h LEU 118 Ca -0.08 -0.25 -0.16 0.00 0.09 0.00 0.00 57.88 57.48 1xng h LEU 118 Cb 1.77 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 42.25 1xng h LEU 118 CO 0.17 0.96 -0.65 1.88 0.09 0.00 0.00 178.44 180.89 1xng h TYR 119 N 0.92 0.34 -0.25 1.13 0.05 -1.01 -0.47 116.97 117.67 1xng h TYR 119 Ca 0.19 -0.14 -0.03 0.00 0.05 0.00 0.00 58.73 58.80 1xng h TYR 119 Cb 0.40 -0.06 -0.01 0.00 1.01 0.00 0.00 36.73 38.07 1xng h TYR 119 CO 0.03 0.83 0.04 0.22 -1.05 0.00 0.00 178.16 178.24 1xng h ASP 120 N 0.18 0.40 -0.70 3.88 3.58 -0.82 -1.81 116.42 121.13 1xng h ASP 120 Ca -0.01 -0.26 -0.00 0.00 0.42 0.00 0.00 57.03 57.18 1xng h ASP 120 Cb 1.18 -0.11 -0.03 0.00 1.72 0.00 0.00 39.33 42.09 1xng h ASP 120 CO 0.10 0.55 0.43 0.22 -2.88 0.00 0.00 179.24 177.66 1xng h TYR 121 N 0.22 0.91 -0.87 0.28 3.20 -0.69 -2.27 116.97 117.76 1xng h TYR 121 Ca 0.08 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.92 1xng h TYR 121 Cb 0.32 -0.30 -0.04 0.00 1.54 0.00 0.00 36.73 38.25 1xng h TYR 121 CO 0.02 0.61 0.46 0.66 -1.64 0.00 0.00 178.16 178.27 1xng h SER 122 N 0.95 1.11 -0.34 -2.11 4.64 -0.85 -2.07 113.55 114.87 1xng h SER 122 Ca 0.25 -0.11 -0.16 0.00 -0.47 0.00 0.00 61.79 61.30 1xng h SER 122 Cb -0.04 -0.28 -0.00 0.00 -0.31 0.00 0.00 62.40 61.76 1xng h SER 122 CO -0.05 0.91 -0.40 0.25 -0.87 0.00 0.00 176.83 176.67 1xng h LEU 123 N 1.23 0.94 -0.80 5.97 5.85 -1.03 0.23 115.31 127.70 1xng h LEU 123 Ca 0.30 -0.48 0.00 0.00 0.84 0.00 0.00 57.88 58.54 1xng h LEU 123 Cb 0.06 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.83 1xng h LEU 123 CO -0.04 1.24 0.00 0.07 -0.34 0.00 0.00 178.44 179.36 1xng h LYS 124 N 0.67 0.00 -0.11 1.25 2.10 -1.27 -3.18 116.57 116.03 1xng h LYS 124 Ca 0.05 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.70 1xng h LYS 124 Cb 0.99 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.32 1xng h LYS 124 CO 0.10 0.00 0.00 -1.13 -2.00 0.00 0.00 179.45 176.42 1xng n SER 125 N -2.76 2.06 -3.44 7.07 3.41 -0.79 -5.01 113.62 114.17 1xng n SER 125 Ca 0.02 -1.64 -0.19 0.00 -0.26 0.00 0.00 58.87 56.80 1xng n SER 125 Cb 0.34 -0.07 0.06 0.00 -0.26 0.00 0.00 64.21 64.29 1xng n SER 125 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1xng n ASP 126 N 0.26 -4.36 -4.41 4.04 8.00 -0.29 -4.98 116.55 114.81 1xng n ASP 126 Ca 0.06 -0.76 -0.20 0.00 0.71 0.00 0.00 54.79 54.60 1xng n ASP 126 Cb 0.26 -4.70 -0.10 0.00 -0.02 0.00 0.00 41.12 36.56 1xng n ASP 126 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1xng s SER 127 N -3.81 2.00 0.04 -2.24 0.01 0.65 -4.39 113.70 105.95 1xng s SER 127 Ca 0.27 -1.38 0.06 0.00 1.31 0.00 0.00 55.95 56.22 1xng s SER 127 Cb -0.05 -0.01 -0.03 0.00 0.21 0.00 0.00 66.02 66.14 1xng s SER 127 CO 0.77 -0.64 -0.16 -0.76 0.41 0.00 0.00 173.24 172.85 1xng s LEU 128 N -3.43 2.70 -0.17 2.44 1.43 -0.91 -4.51 118.68 116.22 1xng s LEU 128 Ca 0.37 -0.38 -0.23 0.00 -1.03 0.00 0.00 54.13 52.86 1xng s LEU 128 Cb 0.08 -1.57 -0.02 0.00 0.03 0.00 0.00 46.19 44.71 1xng s LEU 128 CO 0.15 0.26 0.72 -0.69 0.23 0.00 0.00 176.35 177.02 1xng s VAL 129 N -0.94 4.96 -0.23 -1.59 1.01 -1.26 -0.62 120.40 121.74 1xng s VAL 129 Ca 0.15 1.41 -0.10 0.00 0.00 0.00 0.00 61.98 63.43 1xng s VAL 129 Cb -0.11 -4.04 -0.05 0.00 0.00 0.00 0.00 36.38 32.19 1xng s VAL 129 CO 0.06 0.09 0.14 -0.63 0.00 0.00 0.00 175.10 174.76 1xng s ILE 130 N 1.90 5.31 0.71 2.22 -1.09 -0.27 -0.91 121.20 129.08 1xng s ILE 130 Ca 0.34 0.16 -0.10 0.00 -2.23 0.00 0.00 60.65 58.82 1xng s ILE 130 Cb -0.16 -3.46 0.04 0.00 -1.58 0.00 0.00 42.46 37.29 1xng s ILE 130 CO 0.12 0.38 1.07 -0.83 -1.23 0.00 0.00 174.94 174.45 1xng s GLY 131 N 0.84 1.62 -0.01 6.18 0.00 0.45 -4.61 107.32 111.79 1xng s GLY 131 Ca 0.07 -0.56 0.01 0.00 0.00 0.00 0.00 44.72 44.24 1xng s GLY 131 CO 0.02 -0.18 0.76 -1.30 0.00 0.00 0.00 173.10 172.41 1xng n THR 132 N -2.99 0.24 -2.44 0.90 -2.24 -1.26 -4.40 114.28 102.09 1xng n THR 132 Ca 0.07 -0.26 -0.42 0.00 -2.27 0.00 0.00 64.05 61.16 1xng n THR 132 Cb 0.59 0.70 -0.03 0.00 -2.10 0.00 0.00 70.33 69.49 1xng n THR 132 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1xng s SER 133 N -0.63 7.02 0.75 3.42 0.01 -1.26 -4.70 113.70 118.31 1xng s SER 133 Ca 0.02 1.81 -0.07 0.00 1.31 0.00 0.00 55.95 59.02 1xng s SER 133 Cb 0.02 -2.55 0.10 0.00 0.21 0.00 0.00 66.02 63.79 1xng s SER 133 CO 0.00 -0.62 1.07 0.54 0.41 0.00 0.00 173.24 174.63 1xng s ASN 134 N 1.60 4.43 0.38 2.44 2.20 -1.26 -3.38 114.94 121.34 1xng s ASN 134 Ca 0.56 0.28 0.06 0.00 -0.94 0.00 0.00 52.86 52.83 1xng s ASN 134 Cb -0.25 -0.78 0.74 0.00 -2.00 0.00 0.00 41.25 38.97 1xng s ASN 134 CO 0.21 -1.85 1.95 0.50 -2.94 0.00 0.00 177.10 174.98 1xng h LYS 135 N -0.77 0.47 -0.08 3.55 3.64 -0.86 -0.81 116.57 121.71 1xng h LYS 135 Ca -0.43 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 58.87 1xng h LYS 135 Cb 1.29 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1xng h LYS 135 CO 0.53 0.44 0.02 0.77 -2.27 0.00 0.00 179.45 178.93 1xng h SER 136 N 0.47 0.12 -0.74 4.20 0.02 -1.89 -0.90 113.55 114.83 1xng h SER 136 Ca 0.11 -0.25 -0.02 0.00 -0.84 0.00 0.00 61.79 60.80 1xng h SER 136 Cb 0.19 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 62.66 1xng h SER 136 CO -0.00 0.33 0.40 -0.33 -1.14 0.00 0.00 176.83 176.09 1xng h GLU 137 N -0.10 1.03 -0.06 3.45 5.08 -1.81 -2.09 114.58 120.07 1xng h GLU 137 Ca 0.02 -0.13 -0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1xng h GLU 137 Cb 0.26 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 1xng h GLU 137 CO 0.00 0.77 0.03 0.00 -1.00 0.00 0.00 179.01 178.81 1xng h ARG 138 N 1.02 0.10 -0.48 2.33 3.08 -0.99 0.44 114.38 119.87 1xng h ARG 138 Ca 0.26 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.26 1xng h ARG 138 Cb 0.05 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 1xng h ARG 138 CO -0.04 0.22 0.17 0.52 -1.07 0.00 0.00 179.97 179.77 1xng h MET 139 N -0.05 0.69 0.00 0.04 2.86 -1.09 -2.59 114.93 114.79 1xng h MET 139 Ca 0.02 -0.11 0.00 0.00 -2.06 0.00 0.00 59.70 57.55 1xng h MET 139 Cb 0.16 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.70 1xng h MET 139 CO -0.00 0.59 -0.22 1.28 1.06 0.00 0.00 176.91 179.62 1xng n LEU 140 N -4.34 0.71 -0.52 1.22 4.77 -0.79 -4.04 117.00 114.01 1xng n LEU 140 Ca 0.04 0.43 -0.07 0.00 -0.03 0.00 0.00 56.01 56.38 1xng n LEU 140 Cb 0.17 -0.28 -0.03 0.00 -2.33 0.00 0.00 43.42 40.95 1xng n LEU 140 CO 0.38 -0.12 -0.06 0.61 -1.33 0.00 0.00 177.39 176.87 1xng n GLY 141 N 1.34 0.90 3.52 -0.72 0.00 0.03 -4.46 105.19 105.79 1xng n GLY 141 Ca 0.05 -0.75 -0.43 0.00 0.00 0.00 0.00 46.02 44.89 1xng n GLY 141 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1xng s TYR 142 N -2.25 3.01 0.00 1.61 5.04 -0.51 -4.79 117.35 119.46 1xng s TYR 142 Ca 0.00 -1.59 0.00 0.00 -2.44 0.00 0.00 57.07 53.04 1xng s TYR 142 Cb 0.00 -4.53 0.00 0.00 0.35 0.00 0.00 41.96 37.78 1xng s TYR 142 CO 0.00 -1.66 0.00 0.41 -1.34 0.00 0.00 175.55 172.96 1xng n GLY 143 N 5.31 1.29 3.66 8.97 0.00 -1.26 -4.77 105.19 118.39 1xng n GLY 143 Ca 0.38 -0.77 -0.40 0.00 0.00 0.00 0.00 46.02 45.23 1xng n GLY 143 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xng s THR 144 N -2.00 5.08 0.19 2.61 2.01 -1.26 -4.98 115.64 117.29 1xng s THR 144 Ca 0.00 1.01 -0.31 0.00 0.31 0.00 0.00 61.69 62.69 1xng s THR 144 Cb 0.00 -3.87 -0.10 0.00 0.01 0.00 0.00 72.50 68.54 1xng s THR 144 CO 0.00 0.15 1.54 -0.22 -0.69 0.00 0.00 174.62 175.40 1xng s LEU 145 N 1.80 4.37 -0.66 4.42 2.96 -1.26 -0.73 118.68 129.59 1xng s LEU 145 Ca 0.25 2.64 0.00 0.00 -0.22 0.00 0.00 54.13 56.80 1xng s LEU 145 Cb -0.16 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 42.93 1xng s LEU 145 CO 0.10 -0.80 0.00 0.49 -1.32 0.00 0.00 176.35 174.81 1xng n PHE 146 N 3.58 0.00 0.00 5.38 0.99 -1.26 -4.90 117.46 121.25 1xng n PHE 146 Ca 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.57 1xng n PHE 146 Cb 0.39 -1.64 0.00 0.00 -1.00 0.00 0.00 39.48 37.23 1xng n PHE 146 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1xng n GLY 147 N -1.27 1.11 0.23 1.37 0.00 0.09 -4.67 105.19 102.05 1xng n GLY 147 Ca -0.06 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.11 1xng n GLY 147 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1xng h ASP 148 N 0.00 0.00 0.76 1.61 2.03 -1.69 -2.50 116.42 116.63 1xng h ASP 148 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1xng h ASP 148 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 1xng h ASP 148 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 179.24 178.39 1xng n LEU 149 N -2.89 0.00 -4.68 0.15 4.77 -1.18 -4.64 117.00 108.53 1xng n LEU 149 Ca 0.02 0.43 -0.41 0.00 -0.03 0.00 0.00 56.01 56.02 1xng n LEU 149 Cb 0.33 -0.43 -0.05 0.00 -2.33 0.00 0.00 43.42 40.94 1xng n LEU 149 CO 0.27 -0.04 0.49 0.00 -1.33 0.00 0.00 177.39 176.77 1xng s ALA 150 N -2.85 3.47 0.09 -1.18 0.00 -0.94 -4.85 121.76 115.50 1xng s ALA 150 Ca 0.17 -0.01 -0.26 0.00 0.00 0.00 0.00 51.96 51.86 1xng s ALA 150 Cb 0.17 -3.08 0.09 0.00 0.00 0.00 0.00 23.12 20.30 1xng s ALA 150 CO 0.45 -0.46 1.14 0.00 0.00 0.00 0.00 175.76 176.89 1xng n ALA 152 N -0.67 0.91 -2.97 0.00 0.00 -0.08 -4.97 120.51 112.73 1xng n ALA 152 Ca -0.03 -0.64 -0.11 0.00 0.00 0.00 0.00 53.44 52.66 1xng n ALA 152 Cb 0.60 -0.45 -0.12 0.00 0.00 0.00 0.00 19.45 19.48 1xng n ALA 152 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1xng s ILE 153 N -2.44 0.05 -0.20 0.00 -4.36 -1.21 -5.03 121.20 108.02 1xng s ILE 153 Ca -0.30 -0.42 -0.03 0.00 -0.26 0.00 0.00 60.65 59.65 1xng s ILE 153 Cb 0.08 -0.19 0.06 0.00 1.25 0.00 0.00 42.46 43.66 1xng s ILE 153 CO 0.61 -0.23 0.03 0.21 0.24 0.00 0.00 174.94 175.81 1xng s ASN 154 N -0.70 2.96 0.44 4.36 3.84 -1.26 -0.41 114.94 124.17 1xng s ASN 154 Ca -0.08 -0.85 0.29 0.00 0.21 0.00 0.00 52.86 52.43 1xng s ASN 154 Cb -0.05 -0.61 0.99 0.00 -0.55 0.00 0.00 41.25 41.03 1xng s ASN 154 CO -0.00 -0.31 1.82 1.55 -2.79 0.00 0.00 177.10 177.38 1xng h PRO 155 N 8.23 0.00 -0.22 0.43 0.13 -1.95 -3.29 132.00 135.33 1xng h PRO 155 Ca -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 1xng h PRO 155 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1xng h PRO 155 CO 0.34 0.00 0.00 0.44 -0.23 0.00 0.00 178.00 178.55 1xng n ILE 156 N -2.87 1.39 0.29 -3.56 -5.35 -1.26 -4.68 119.36 103.32 1xng n ILE 156 Ca 0.02 -1.33 0.18 0.00 -0.27 0.00 0.00 62.75 61.35 1xng n ILE 156 Cb 0.36 0.25 0.93 0.00 -1.74 0.00 0.00 39.64 39.44 1xng n ILE 156 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 1xng h GLY 157 N 1.33 0.00 -1.66 3.28 0.00 -1.63 -2.06 103.07 102.32 1xng h GLY 157 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1xng h GLY 157 CO 0.05 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.77 1xng n GLU 158 N -2.79 3.03 -4.57 4.80 -0.58 -1.26 -2.99 120.64 116.27 1xng n GLU 158 Ca -0.02 -2.70 -0.33 0.00 -0.42 0.00 0.00 57.16 53.69 1xng n GLU 158 Cb 0.10 -1.75 -0.15 0.00 -0.57 0.00 0.00 31.44 29.07 1xng n GLU 158 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1xng s LEU 159 N -2.43 2.54 0.72 -4.62 1.43 -0.78 -4.85 118.68 110.68 1xng s LEU 159 Ca 0.39 -0.44 -0.14 0.00 -1.03 0.00 0.00 54.13 52.92 1xng s LEU 159 Cb 0.30 -1.58 0.03 0.00 0.03 0.00 0.00 46.19 44.97 1xng s LEU 159 CO 0.11 0.10 1.13 -0.36 0.23 0.00 0.00 176.35 177.56 1xng s PHE 160 N 0.73 2.40 0.25 0.29 0.40 -1.26 -0.79 117.98 119.99 1xng s PHE 160 Ca -0.06 1.58 -0.04 0.00 -0.60 0.00 0.00 56.93 57.81 1xng s PHE 160 Cb -0.15 -3.23 0.47 0.00 0.51 0.00 0.00 43.02 40.61 1xng s PHE 160 CO 0.01 -2.01 1.72 -0.22 0.70 0.00 0.00 175.22 175.42 1xng h LYS 161 N -0.40 0.41 -0.58 0.44 1.63 -1.94 0.20 116.57 116.33 1xng h LYS 161 Ca -0.46 -0.02 0.02 0.00 -0.85 0.00 0.00 60.65 59.33 1xng h LYS 161 Cb 1.26 -0.09 -0.03 0.00 -0.60 0.00 0.00 32.23 32.76 1xng h LYS 161 CO 0.52 0.27 0.38 1.15 -3.45 0.00 0.00 179.45 178.32 1xng h THR 162 N 0.42 1.11 0.01 1.00 2.02 -1.91 -0.88 112.91 114.69 1xng h THR 162 Ca 0.42 -0.25 -0.19 0.00 0.77 0.00 0.00 66.41 67.16 1xng h THR 162 Cb 0.66 0.31 -0.02 0.00 -1.74 0.00 0.00 68.15 67.36 1xng h THR 162 CO -0.42 0.13 -0.86 -0.33 0.37 0.00 0.00 175.52 174.41 1xng h GLU 163 N 0.73 0.09 -0.48 6.66 5.08 -1.06 -2.78 114.58 122.82 1xng h GLU 163 Ca 0.22 -0.11 -0.08 0.00 -1.00 0.00 0.00 59.36 58.40 1xng h GLU 163 Cb -0.00 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 1xng h GLU 163 CO -0.05 0.90 -0.02 0.28 -1.00 0.00 0.00 179.01 179.11 1xng h VAL 164 N 0.05 1.25 -0.37 3.13 2.07 0.31 -1.29 116.25 121.40 1xng h VAL 164 Ca -0.03 -1.05 -0.03 0.00 0.82 0.00 0.00 66.70 66.41 1xng h VAL 164 Cb 1.50 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 32.16 1xng h VAL 164 CO 0.12 0.37 0.12 0.22 0.02 0.00 0.00 177.57 178.42 1xng h TYR 165 N 0.76 0.59 -0.69 1.57 3.20 -1.13 0.21 116.97 121.48 1xng h TYR 165 Ca 0.14 -0.06 -0.04 0.00 3.14 0.00 0.00 58.73 61.91 1xng h TYR 165 Cb 0.49 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.56 1xng h TYR 165 CO 0.03 0.57 0.26 0.93 -1.64 0.00 0.00 178.16 178.30 1xng h GLU 166 N 0.44 1.03 -0.54 1.82 4.39 -1.22 -2.01 114.58 118.50 1xng h GLU 166 Ca 0.12 -0.18 -0.10 0.00 0.34 0.00 0.00 59.36 59.54 1xng h GLU 166 Cb 0.25 -0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 28.72 1xng h GLU 166 CO -0.00 0.84 -0.06 1.25 -1.16 0.00 0.00 179.01 179.88 1xng h LEU 167 N 1.00 0.98 -1.60 1.33 5.85 -1.02 -2.82 115.31 119.04 1xng h LEU 167 Ca 0.23 -0.33 0.04 0.00 0.84 0.00 0.00 57.88 58.66 1xng h LEU 167 Cb 0.21 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 1xng h LEU 167 CO -0.02 1.08 0.34 0.00 -0.34 0.00 0.00 178.44 179.50 1xng h ALA 168 N 0.93 1.83 -0.47 1.25 0.00 -0.27 -1.61 119.26 120.92 1xng h ALA 168 Ca 0.14 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1xng h ALA 168 Cb 0.62 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1xng h ALA 168 CO 0.04 0.10 0.21 0.00 0.00 0.00 0.00 179.25 179.60 1xng h ARG 169 N 0.51 0.69 0.00 0.00 3.08 -1.13 -2.43 114.38 115.11 1xng h ARG 169 Ca 0.21 -0.11 -0.05 0.00 0.07 0.00 0.00 59.98 60.09 1xng h ARG 169 Cb 0.19 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 1xng h ARG 169 CO -0.06 0.61 -0.25 0.00 -1.07 0.00 0.00 179.97 179.20 1xng h ARG 170 N 0.62 0.00 -0.01 0.04 -0.00 -1.30 -2.45 114.38 111.28 1xng h ARG 170 Ca 0.16 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.64 1xng h ARG 170 Cb 0.16 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.13 1xng h ARG 170 CO -0.02 0.25 0.00 1.28 0.00 0.00 0.00 179.97 181.48 1xng n LEU 171 N -3.59 0.63 -3.46 3.04 4.77 -0.73 -4.93 117.00 112.73 1xng n LEU 171 Ca -0.01 -0.22 -0.22 0.00 -0.03 0.00 0.00 56.01 55.54 1xng n LEU 171 Cb 0.39 -0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.55 1xng n LEU 171 CO 0.34 0.11 0.22 0.59 -1.33 0.00 0.00 177.39 177.31 1xng n ASN 172 N -0.49 -5.51 -4.74 -1.43 3.02 -0.92 -4.96 115.26 100.23 1xng n ASN 172 Ca 0.21 -0.53 -0.41 0.00 -0.03 0.00 0.00 54.58 53.82 1xng n ASN 172 Cb 0.21 -4.89 -0.04 0.00 -0.61 0.00 0.00 39.78 34.45 1xng n ASN 172 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1xng s ILE 173 N -3.32 3.61 0.17 2.41 1.01 -0.98 -4.93 121.20 119.16 1xng s ILE 173 Ca 0.47 1.38 -0.31 0.00 0.00 0.00 0.00 60.65 62.19 1xng s ILE 173 Cb -0.21 -3.88 -0.17 0.00 0.01 0.00 0.00 42.46 38.21 1xng s ILE 173 CO 0.70 0.23 0.83 -2.65 0.00 0.00 0.00 174.94 174.06 1xng n PRO 174 N 2.36 0.43 -0.34 2.79 -0.02 -1.26 -4.62 135.00 134.35 1xng n PRO 174 Ca 0.04 0.15 0.11 0.00 -2.02 0.00 0.00 63.50 61.78 1xng n PRO 174 Cb 0.45 -1.40 0.32 0.00 -0.02 0.00 0.00 33.50 32.84 1xng n PRO 174 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1xng h LYS 175 N 2.02 0.78 -0.91 -0.52 1.57 -1.99 0.46 116.57 117.99 1xng h LYS 175 Ca -0.37 -0.05 0.18 0.00 -1.87 0.00 0.00 60.65 58.54 1xng h LYS 175 Cb 1.40 -0.18 -0.07 0.00 0.08 0.00 0.00 32.23 33.46 1xng h LYS 175 CO 0.62 0.52 0.59 -0.22 -0.57 0.00 0.00 179.45 180.38 1xng h LYS 176 N 0.81 0.52 0.14 3.15 1.63 -1.98 -1.13 116.57 119.71 1xng h LYS 176 Ca 0.52 -0.03 -0.31 0.00 -0.85 0.00 0.00 60.65 59.98 1xng h LYS 176 Cb 0.75 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 32.27 1xng h LYS 176 CO -0.30 0.34 -1.57 0.82 -3.45 0.00 0.00 179.45 175.30 1xng h ILE 177 N 0.54 0.98 -0.68 2.00 1.08 -1.27 -3.20 117.51 116.95 1xng h ILE 177 Ca 0.47 -2.44 0.05 0.00 -0.39 0.00 0.00 64.86 62.55 1xng h ILE 177 Cb 0.99 2.73 -0.05 0.00 -3.07 0.00 0.00 36.82 37.42 1xng h ILE 177 CO -0.21 0.77 0.39 -0.07 -0.69 0.00 0.00 178.15 178.35 1xng h LEU 178 N -0.13 0.60 -1.18 1.44 3.38 -0.71 -2.68 115.31 116.04 1xng h LEU 178 Ca -0.33 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1xng h LEU 178 Cb 1.91 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 42.55 1xng h LEU 178 CO 0.11 0.40 -0.03 0.59 0.09 0.00 0.00 178.44 179.59 1xng n ASN 179 N -4.75 1.87 -4.72 -0.43 3.02 -0.48 -4.92 115.26 104.85 1xng n ASN 179 Ca 0.08 -1.59 -0.42 0.00 -0.03 0.00 0.00 54.58 52.63 1xng n ASN 179 Cb 0.15 0.02 -0.03 0.00 -0.61 0.00 0.00 39.78 39.31 1xng n ASN 179 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1xng s LYS 180 N -2.05 4.30 0.23 3.52 2.20 -1.01 -4.96 119.74 121.97 1xng s LYS 180 Ca 0.34 2.12 -0.30 0.00 -0.36 0.00 0.00 55.97 57.77 1xng s LYS 180 Cb 0.21 -3.23 -0.10 0.00 -1.51 0.00 0.00 37.83 33.19 1xng s LYS 180 CO 0.35 -0.47 1.45 -1.25 -0.36 0.00 0.00 175.35 175.07 1xng s PRO 181 N 1.11 4.27 0.24 4.03 0.04 -1.26 -4.91 135.00 138.51 1xng s PRO 181 Ca 0.65 2.28 -0.31 0.00 0.04 0.00 0.00 61.00 63.66 1xng s PRO 181 Cb -0.38 -3.13 -0.13 0.00 0.04 0.00 0.00 34.50 30.90 1xng s PRO 181 CO 0.30 -0.44 1.40 -2.30 0.04 0.00 0.00 177.00 176.00 1xng n PRO 182 N 2.69 2.00 -3.64 0.56 -0.02 -1.26 -4.92 135.00 130.42 1xng n PRO 182 Ca 0.08 0.71 -0.08 0.00 -2.02 0.00 0.00 63.50 62.20 1xng n PRO 182 Cb 0.40 -2.36 -0.07 0.00 -0.02 0.00 0.00 33.50 31.45 1xng n PRO 182 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1xng s SER 183 N 0.28 -0.84 0.52 2.55 0.15 -1.26 -1.00 113.70 114.09 1xng s SER 183 Ca 0.68 1.39 0.24 0.00 0.70 0.00 0.00 55.95 58.97 1xng s SER 183 Cb -0.66 1.36 1.40 0.00 -1.71 0.00 0.00 66.02 66.42 1xng s SER 183 CO 0.50 -0.22 2.09 0.00 1.20 0.00 0.00 173.24 176.80 1xng h ALA 184 N 6.42 1.44 -6.08 5.45 0.00 -1.91 -3.46 119.26 121.11 1xng h ALA 184 Ca -0.30 -0.10 -0.43 0.00 0.00 0.00 0.00 54.91 54.08 1xng h ALA 184 Cb 1.21 -0.02 0.05 0.00 0.00 0.00 0.00 17.79 19.03 1xng h ALA 184 CO 0.14 0.14 -0.74 -3.47 0.00 0.00 0.00 179.25 175.32 1xng n ASP 185 N -3.87 -4.78 -0.29 0.00 2.03 -1.26 -4.87 116.55 103.51 1xng n ASP 185 Ca -0.02 -0.69 0.11 0.00 0.52 0.00 0.00 54.79 54.71 1xng n ASP 185 Cb 0.21 -4.38 0.07 0.00 -0.72 0.00 0.00 41.12 36.30 1xng n ASP 185 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1xng n LEU 186 N -4.72 1.46 -3.54 -2.67 4.77 -1.26 -4.54 117.00 106.50 1xng n LEU 186 Ca -0.03 -0.53 -0.15 0.00 -0.03 0.00 0.00 56.01 55.27 1xng n LEU 186 Cb 0.56 -0.05 -0.05 0.00 -2.33 0.00 0.00 43.42 41.55 1xng n LEU 186 CO 0.70 0.29 0.58 0.72 -1.33 0.00 0.00 177.39 178.35 1xng s PHE 187 N -2.65 -0.54 -0.15 -1.77 -0.12 -1.26 -4.57 117.98 106.92 1xng s PHE 187 Ca 0.17 0.90 -0.37 0.00 -0.05 0.00 0.00 56.93 57.58 1xng s PHE 187 Cb 0.18 0.43 -0.14 0.00 -0.63 0.00 0.00 43.02 42.86 1xng s PHE 187 CO 0.64 -0.51 1.79 0.28 -0.05 0.00 0.00 175.22 177.37 1xng n VAL 188 N 0.79 0.42 -0.44 -2.49 0.31 -1.26 -1.88 118.33 113.77 1xng n VAL 188 Ca -0.15 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 1xng n VAL 188 Cb 0.58 -1.55 0.00 0.00 -0.91 0.00 0.00 33.84 31.96 1xng n VAL 188 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1xng n GLY 189 N 4.20 0.86 3.76 2.92 0.00 -1.26 -5.05 105.19 110.62 1xng n GLY 189 Ca 0.24 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.89 1xng n GLY 189 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1xng s GLN 190 N -0.49 3.25 -0.09 1.61 0.74 -0.79 -5.04 119.66 118.86 1xng s GLN 190 Ca 0.00 1.94 -0.24 0.00 0.05 0.00 0.00 55.36 57.11 1xng s GLN 190 Cb 0.00 -2.17 0.06 0.00 1.10 0.00 0.00 33.01 32.00 1xng s GLN 190 CO 0.00 -1.01 0.57 -1.54 -0.55 0.00 0.00 175.29 172.76 1xng s SER 191 N -1.33 -0.54 0.24 6.67 1.04 -1.26 -4.69 113.70 113.83 1xng s SER 191 Ca 0.72 0.70 -0.07 0.00 0.48 0.00 0.00 55.95 57.78 1xng s SER 191 Cb -0.33 0.68 0.25 0.00 0.10 0.00 0.00 66.02 66.71 1xng s SER 191 CO 0.38 -0.46 1.91 0.44 0.98 0.00 0.00 173.24 176.50 1xng h ASP 192 N 3.82 1.08 -0.78 7.02 5.19 -1.42 -2.05 116.42 129.28 1xng h ASP 192 Ca -0.28 -0.02 -0.05 0.00 -0.62 0.00 0.00 57.03 56.06 1xng h ASP 192 Cb 1.16 -0.26 -0.03 0.00 0.18 0.00 0.00 39.33 40.37 1xng h ASP 192 CO 0.32 0.77 0.31 -0.08 -3.12 0.00 0.00 179.24 177.44 1xng h GLU 193 N 1.27 1.17 -0.15 3.56 4.81 -1.80 0.16 114.58 123.60 1xng h GLU 193 Ca 0.35 -0.21 -0.20 0.00 -0.13 0.00 0.00 59.36 59.18 1xng h GLU 193 Cb -0.12 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.07 1xng h GLU 193 CO -0.08 0.95 -0.70 0.87 -0.73 0.00 0.00 179.01 179.32 1xng h LYS 194 N 1.14 0.64 -0.10 1.92 1.57 -1.83 0.33 116.57 120.25 1xng h LYS 194 Ca 0.26 -0.49 -0.10 0.00 -1.87 0.00 0.00 60.65 58.46 1xng h LYS 194 Cb 0.22 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.62 1xng h LYS 194 CO -0.02 1.11 -0.32 -0.44 -0.57 0.00 0.00 179.45 179.21 1xng h ASP 195 N 0.46 0.46 1.08 0.86 3.45 -1.18 -3.32 116.42 118.23 1xng h ASP 195 Ca -0.03 -0.61 -0.18 0.00 0.43 0.00 0.00 57.03 56.65 1xng h ASP 195 Cb 1.29 -0.13 -0.03 0.00 -0.56 0.00 0.00 39.33 39.90 1xng h ASP 195 CO 0.14 0.98 -0.96 -0.07 -1.57 0.00 0.00 179.24 177.76 1xng h LEU 196 N -0.05 0.00 0.00 1.55 3.38 -0.75 -3.48 115.31 115.97 1xng h LEU 196 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1xng h LEU 196 Cb 0.94 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.69 1xng h LEU 196 CO 0.07 0.78 0.00 0.61 0.09 0.00 0.00 178.44 179.99 1xng n GLY 197 N 1.34 1.58 3.16 0.83 0.00 0.12 -5.01 105.19 107.21 1xng n GLY 197 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 1xng n GLY 197 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xng s TYR 198 N -2.39 0.11 0.66 1.61 1.51 -1.13 -4.93 117.35 112.79 1xng s TYR 198 Ca 0.00 -0.38 -0.09 0.00 -1.01 0.00 0.00 57.07 55.59 1xng s TYR 198 Cb 0.00 -0.07 0.02 0.00 -0.11 0.00 0.00 41.96 41.80 1xng s TYR 198 CO 0.00 -0.42 1.01 -1.25 -1.11 0.00 0.00 175.55 173.78 1xng s PRO 199 N -2.73 2.83 0.46 -1.71 0.04 -1.26 -4.33 135.00 128.30 1xng s PRO 199 Ca -0.04 0.22 0.31 0.00 0.04 0.00 0.00 61.00 61.53 1xng s PRO 199 Cb -0.00 -2.13 1.41 0.00 0.04 0.00 0.00 34.50 33.81 1xng s PRO 199 CO -0.05 -0.91 1.93 1.88 0.04 0.00 0.00 177.00 179.89 1xng h TYR 200 N -0.46 0.00 0.00 0.56 0.05 -1.98 -1.90 116.97 113.24 1xng h TYR 200 Ca -0.45 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.30 1xng h TYR 200 Cb 1.26 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.99 1xng h TYR 200 CO 0.48 0.00 -0.15 0.66 -1.05 0.00 0.00 178.16 178.09 1xng h SER 201 N 0.00 0.00 0.02 3.88 4.64 -2.01 -0.85 113.55 119.23 1xng h SER 201 Ca 0.00 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.94 1xng h SER 201 Cb 0.32 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.34 1xng h SER 201 CO 0.00 0.15 -2.40 0.52 -0.87 0.00 0.00 176.83 174.23 1xng n VAL 202 N -3.50 1.48 -0.03 0.95 0.31 -0.80 -4.52 118.33 112.21 1xng n VAL 202 Ca -0.01 -0.68 -0.13 0.00 -0.01 0.00 0.00 64.34 63.51 1xng n VAL 202 Cb 0.31 -1.10 -0.10 0.00 -0.91 0.00 0.00 33.84 32.04 1xng n VAL 202 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1xng h ILE 203 N 0.00 1.47 -0.73 2.52 2.04 -1.26 -3.35 117.51 118.21 1xng h ILE 203 Ca -0.55 -1.48 0.09 0.00 1.00 0.00 0.00 64.86 63.91 1xng h ILE 203 Cb 2.03 2.42 -0.07 0.00 -0.74 0.00 0.00 36.82 40.46 1xng h ILE 203 CO -0.03 0.39 0.38 0.44 0.00 0.00 0.00 178.15 179.33 1xng h ASP 204 N -0.51 0.52 -0.90 1.72 3.32 -1.41 -1.42 116.42 117.74 1xng h ASP 204 Ca -0.00 0.05 0.06 0.00 0.02 0.00 0.00 57.03 57.16 1xng h ASP 204 Cb 0.67 -0.04 -0.06 0.00 0.22 0.00 0.00 39.33 40.13 1xng h ASP 204 CO 0.01 0.30 0.59 1.55 -1.72 0.00 0.00 179.24 179.97 1xng h PRO 205 N 0.65 1.03 -0.43 3.56 0.13 -1.79 -0.63 132.00 134.52 1xng h PRO 205 Ca 0.35 -0.06 -0.15 0.00 -0.87 0.00 0.00 66.00 65.27 1xng h PRO 205 Cb 0.34 -0.23 -0.01 0.00 0.13 0.00 0.00 31.00 31.23 1xng h PRO 205 CO -0.25 0.68 -0.31 1.25 -0.23 0.00 0.00 178.00 179.14 1xng h LEU 206 N 1.06 1.02 -0.92 1.56 5.85 -1.43 -2.74 115.31 119.70 1xng h LEU 206 Ca 0.38 -0.43 -0.05 0.00 0.84 0.00 0.00 57.88 58.61 1xng h LEU 206 Cb 0.14 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.86 1xng h LEU 206 CO -0.13 1.23 0.18 -0.07 -0.34 0.00 0.00 178.44 179.31 1xng h LEU 207 N 0.81 0.90 -1.01 2.25 3.38 -0.56 -1.28 115.31 119.80 1xng h LEU 207 Ca 0.08 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.84 1xng h LEU 207 Cb 0.90 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.39 1xng h LEU 207 CO 0.08 0.86 0.14 0.11 0.09 0.00 0.00 178.44 179.72 1xng h LYS 208 N 0.93 0.85 -0.27 1.13 1.57 -1.02 -0.37 116.57 119.39 1xng h LYS 208 Ca 0.20 -0.17 -0.18 0.00 -1.87 0.00 0.00 60.65 58.63 1xng h LYS 208 Cb 0.30 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.48 1xng h LYS 208 CO -0.00 0.77 -0.53 -0.44 -0.57 0.00 0.00 179.45 178.67 1xng h ASP 209 N 0.82 0.88 -0.71 0.86 3.32 -1.15 -2.22 116.42 118.24 1xng h ASP 209 Ca 0.18 -0.46 -0.02 0.00 0.02 0.00 0.00 57.03 56.75 1xng h ASP 209 Cb 0.30 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 1xng h ASP 209 CO -0.00 1.24 0.38 0.40 -1.72 0.00 0.00 179.24 179.54 1xng h ILE 210 N 0.62 1.22 -0.40 0.35 2.04 -0.84 0.34 117.51 120.83 1xng h ILE 210 Ca 0.02 -0.56 -0.08 0.00 1.00 0.00 0.00 64.86 65.23 1xng h ILE 210 Cb 1.12 0.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.43 1xng h ILE 210 CO 0.11 0.25 -0.10 -0.33 0.00 0.00 0.00 178.15 178.08 1xng h GLU 211 N 1.01 0.69 0.14 2.37 4.39 -0.90 0.23 114.58 122.51 1xng h GLU 211 Ca 0.25 -0.21 -0.30 0.00 0.34 0.00 0.00 59.36 59.44 1xng h GLU 211 Cb 0.05 -0.07 0.01 0.00 -0.10 0.00 0.00 28.75 28.63 1xng h GLU 211 CO -0.04 0.78 -1.39 0.00 -1.16 0.00 0.00 179.01 177.20 1xng h ALA 212 N 1.26 0.12 0.15 3.43 0.00 -0.72 -3.39 119.26 120.11 1xng h ALA 212 Ca 0.11 -0.97 -0.34 0.00 0.00 0.00 0.00 54.91 53.72 1xng h ALA 212 Cb 0.54 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 1xng h ALA 212 CO 0.03 1.00 -1.72 -0.07 0.00 0.00 0.00 179.25 178.48 1xng h LEU 213 N 0.08 0.49 -7.98 0.00 3.38 -0.35 -3.46 115.31 107.48 1xng h LEU 213 Ca -0.19 -0.77 -0.62 0.00 0.09 0.00 0.00 57.88 56.38 1xng h LEU 213 Cb 2.02 -0.16 -0.35 0.00 0.09 0.00 0.00 40.66 42.26 1xng h LEU 213 CO 0.20 1.66 -0.84 -0.36 0.09 0.00 0.00 178.44 179.18 1xng s PHE 214 N -2.59 2.32 0.00 1.13 0.40 0.06 -4.84 117.98 114.47 1xng s PHE 214 Ca -0.14 -1.27 0.00 0.00 -0.60 0.00 0.00 56.93 54.91 1xng s PHE 214 Cb 0.06 -1.66 0.00 0.00 0.51 0.00 0.00 43.02 41.93 1xng s PHE 214 CO 0.84 -0.66 0.00 0.00 0.70 0.00 0.00 175.22 176.10 1xng n GLN 215 N 4.57 0.00 -0.00 0.44 10.64 -1.26 -4.40 117.38 127.36 1xng n GLN 215 Ca -0.18 0.00 0.02 0.00 -1.83 0.00 0.00 57.00 55.00 1xng n GLN 215 Cb 0.50 0.00 -0.02 0.00 -0.86 0.00 0.00 30.24 29.86 1xng n GLN 215 CO 0.00 0.00 0.00 2.41 -1.83 0.00 0.00 177.06 177.64 1xng n THR 216 N -0.02 0.00 -4.03 -0.39 -1.04 -1.26 -5.03 114.28 102.51 1xng n THR 216 Ca 0.00 -0.36 -0.08 0.00 -2.04 0.00 0.00 64.05 61.57 1xng n THR 216 Cb 0.00 0.92 -0.10 0.00 -1.82 0.00 0.00 70.33 69.33 1xng n THR 216 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 1xng s LYS 217 N -1.49 0.59 0.79 -2.82 -2.85 -1.26 -5.16 119.74 107.54 1xng s LYS 217 Ca 0.01 -1.05 -0.12 0.00 -1.00 0.00 0.00 55.97 53.80 1xng s LYS 217 Cb 0.03 0.21 0.07 0.00 -2.06 0.00 0.00 37.83 36.08 1xng s LYS 217 CO 0.16 -0.12 1.14 -1.25 0.10 0.00 0.00 175.35 175.38 1xng s PRO 218 N -3.43 1.93 0.30 1.78 0.04 -1.26 -4.70 135.00 129.66 1xng s PRO 218 Ca 0.02 1.47 -0.30 0.00 0.04 0.00 0.00 61.00 62.23 1xng s PRO 218 Cb 0.04 -1.84 -0.11 0.00 0.04 0.00 0.00 34.50 32.63 1xng s PRO 218 CO -0.08 -1.93 1.60 0.42 0.04 0.00 0.00 177.00 177.04 1xng s ILE 219 N -2.51 2.01 -0.34 0.56 1.01 -1.26 -4.94 121.20 115.73 1xng s ILE 219 Ca 0.67 0.01 -0.03 0.00 0.00 0.00 0.00 60.65 61.30 1xng s ILE 219 Cb -0.22 -3.01 0.07 0.00 0.01 0.00 0.00 42.46 39.31 1xng s ILE 219 CO 0.52 0.00 0.08 -0.62 0.00 0.00 0.00 174.94 174.92 1xng s ASP 220 N 0.45 5.08 0.56 3.58 -1.08 -1.26 -4.97 116.67 119.03 1xng s ASP 220 Ca 0.63 -1.52 0.33 0.00 -0.52 0.00 0.00 52.55 51.47 1xng s ASP 220 Cb -0.48 -1.77 1.66 0.00 -1.46 0.00 0.00 42.92 40.86 1xng s ASP 220 CO 0.50 -0.37 2.12 0.71 0.52 0.00 0.00 175.17 178.66 1xng h THR 221 N 6.39 0.32 -0.19 1.71 1.35 -1.98 -2.40 112.91 118.11 1xng h THR 221 Ca -0.18 -0.40 -0.21 0.00 -0.55 0.00 0.00 66.41 65.06 1xng h THR 221 Cb 1.06 1.30 0.01 0.00 -1.73 0.00 0.00 68.15 68.78 1xng h THR 221 CO 0.60 0.06 -0.72 -0.33 -0.25 0.00 0.00 175.52 174.88 1xng h GLU 222 N 0.00 0.80 -0.57 4.72 5.08 -1.98 -1.35 114.58 121.28 1xng h GLU 222 Ca -0.00 -0.62 -0.05 0.00 -1.00 0.00 0.00 59.36 57.69 1xng h GLU 222 Cb 0.29 0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 1xng h GLU 222 CO 0.01 1.23 0.17 1.15 -1.00 0.00 0.00 179.01 180.56 1xng h THR 223 N 0.57 1.24 -0.09 1.13 2.02 -1.87 -0.66 112.91 115.24 1xng h THR 223 Ca -0.04 -0.84 -0.09 0.00 0.77 0.00 0.00 66.41 66.22 1xng h THR 223 Cb 1.34 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 68.44 1xng h THR 223 CO 0.15 0.31 -0.34 -0.07 0.37 0.00 0.00 175.52 175.94 1xng h LEU 224 N 0.81 0.18 -0.62 2.58 3.38 -1.44 -2.37 115.31 117.82 1xng h LEU 224 Ca 0.18 -0.06 -0.13 0.00 0.09 0.00 0.00 57.88 57.96 1xng h LEU 224 Cb 0.30 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1xng h LEU 224 CO -0.00 0.52 -0.33 0.00 0.09 0.00 0.00 178.44 178.72 1xng h ALA 225 N 1.50 0.80 0.00 1.53 0.00 -0.72 -2.66 119.26 119.71 1xng h ALA 225 Ca 0.02 -0.41 -0.04 0.00 0.00 0.00 0.00 54.91 54.48 1xng h ALA 225 Cb 0.68 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1xng h ALA 225 CO 0.05 0.65 -0.19 1.96 0.00 0.00 0.00 179.25 181.72 1xng h GLN 226 N 0.61 0.00 0.00 0.00 4.20 -0.63 -2.27 115.11 117.03 1xng h GLN 226 Ca 0.07 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.74 1xng h GLN 226 Cb 0.85 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.63 1xng h GLN 226 CO 0.07 0.19 -0.16 -0.07 -0.67 0.00 0.00 178.83 178.19 1xng h LEU 227 N 0.00 0.00 0.00 1.46 3.38 -1.11 -3.47 115.31 115.57 1xng h LEU 227 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xng h LEU 227 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1xng h LEU 227 CO 0.02 0.16 0.00 0.61 0.09 0.00 0.00 178.44 179.33 1xng n GLY 228 N 0.45 0.94 3.77 0.83 0.00 -0.85 -5.10 105.19 105.23 1xng n GLY 228 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 1xng n GLY 228 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xng s TYR 229 N -2.00 2.79 0.31 1.61 1.51 -1.16 -4.96 117.35 115.44 1xng s TYR 229 Ca 0.00 1.49 -0.29 0.00 -1.01 0.00 0.00 57.07 57.26 1xng s TYR 229 Cb 0.00 -3.50 -0.10 0.00 -0.11 0.00 0.00 41.96 38.25 1xng s TYR 229 CO 0.00 -1.82 1.35 0.34 -1.11 0.00 0.00 175.55 174.32 1xng s ASP 230 N -1.16 6.71 0.26 2.29 2.15 -1.26 -4.66 116.67 121.00 1xng s ASP 230 Ca 0.63 2.70 -0.02 0.00 0.43 0.00 0.00 52.55 56.29 1xng s ASP 230 Cb -0.32 -2.64 0.48 0.00 -0.30 0.00 0.00 42.92 40.13 1xng s ASP 230 CO 0.40 -0.60 1.80 -0.08 -0.17 0.00 0.00 175.17 176.51 1xng h GLU 231 N 3.84 0.75 -0.31 4.34 4.81 -1.98 -1.28 114.58 124.75 1xng h GLU 231 Ca -0.48 -0.05 -0.14 0.00 -0.13 0.00 0.00 59.36 58.56 1xng h GLU 231 Cb 1.22 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 30.43 1xng h GLU 231 CO 0.69 0.50 -0.37 0.82 -0.73 0.00 0.00 179.01 179.92 1xng h ILE 232 N 0.77 1.29 -0.11 2.32 1.08 -1.99 -1.65 117.51 119.22 1xng h ILE 232 Ca 0.44 -1.55 0.00 0.00 -0.39 0.00 0.00 64.86 63.37 1xng h ILE 232 Cb 0.50 1.54 -0.01 0.00 -3.07 0.00 0.00 36.82 35.79 1xng h ILE 232 CO -0.29 0.50 0.06 0.25 -0.69 0.00 0.00 178.15 177.98 1xng h LEU 233 N 0.58 0.09 -0.31 1.44 5.85 -1.83 0.45 115.31 121.58 1xng h LEU 233 Ca 0.04 0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.78 1xng h LEU 233 Cb 0.96 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.94 1xng h LEU 233 CO 0.09 0.07 0.16 0.58 -0.34 0.00 0.00 178.44 179.00 1xng h VAL 234 N 0.13 1.00 -0.35 1.05 2.07 -1.20 -0.64 116.25 118.31 1xng h VAL 234 Ca 0.04 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.45 1xng h VAL 234 Cb -0.00 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 1xng h VAL 234 CO -0.02 0.06 0.23 0.11 0.02 0.00 0.00 177.57 177.97 1xng h LYS 235 N 0.34 0.47 0.68 1.57 1.57 -1.05 0.05 116.57 120.21 1xng h LYS 235 Ca 0.13 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.84 1xng h LYS 235 Cb 0.03 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.24 1xng h LYS 235 CO -0.08 0.33 -0.36 -0.97 -0.57 0.00 0.00 179.45 177.81 1xng h ASN 236 N 0.47 -0.87 -0.53 0.86 -0.73 -0.65 -1.86 115.58 112.28 1xng h ASN 236 Ca 0.13 0.04 -0.06 0.00 1.87 0.00 0.00 56.30 58.27 1xng h ASN 236 Cb -0.03 0.24 -0.02 0.00 0.27 0.00 0.00 38.32 38.78 1xng h ASN 236 CO -0.03 -0.59 0.08 0.40 -0.37 0.00 0.00 177.43 176.92 1xng h ILE 237 N -0.96 1.25 -0.81 2.57 1.08 -1.10 -2.16 117.51 117.39 1xng h ILE 237 Ca -0.09 -0.96 -0.02 0.00 -0.39 0.00 0.00 64.86 63.40 1xng h ILE 237 Cb 0.75 0.85 -0.04 0.00 -3.07 0.00 0.00 36.82 35.32 1xng h ILE 237 CO 0.13 0.34 0.42 0.74 -0.69 0.00 0.00 178.15 179.09 1xng h THR 238 N 0.76 1.24 -0.27 -0.27 2.02 -1.00 -1.79 112.91 113.60 1xng h THR 238 Ca 0.16 -0.65 -0.04 0.00 0.77 0.00 0.00 66.41 66.66 1xng h THR 238 Cb 0.41 0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 1xng h THR 238 CO 0.01 0.28 0.03 -1.28 0.37 0.00 0.00 175.52 174.93 1xng h SER 239 N 1.14 0.44 -0.60 4.18 0.87 -1.10 -1.94 113.55 116.53 1xng h SER 239 Ca 0.28 -0.28 0.03 0.00 -1.23 0.00 0.00 61.79 60.60 1xng h SER 239 Cb 0.07 -0.12 -0.04 0.00 -0.44 0.00 0.00 62.40 61.87 1xng h SER 239 CO -0.04 0.60 0.36 0.03 -0.53 0.00 0.00 176.83 177.25 1xng h ARG 240 N 0.25 0.68 -0.01 2.24 3.08 -1.13 0.86 114.38 120.35 1xng h ARG 240 Ca 0.08 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.09 1xng h ARG 240 Cb 0.36 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.26 1xng h ARG 240 CO 0.01 0.45 0.00 0.82 -1.07 0.00 0.00 179.97 180.18 1xng h ILE 241 N 0.70 1.16 -0.34 2.04 2.04 -1.22 -1.82 117.51 120.06 1xng h ILE 241 Ca 0.25 -0.46 -0.14 0.00 1.00 0.00 0.00 64.86 65.51 1xng h ILE 241 Cb 0.05 1.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.57 1xng h ILE 241 CO -0.12 0.12 -0.35 1.56 0.00 0.00 0.00 178.15 179.36 1xng h GLN 242 N -0.18 0.78 -0.09 2.37 4.20 -1.20 -2.31 115.11 118.68 1xng h GLN 242 Ca 0.00 -0.38 -0.11 0.00 0.06 0.00 0.00 58.65 58.22 1xng h GLN 242 Cb 0.19 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.96 1xng h GLN 242 CO -0.00 1.01 -0.43 -0.22 -0.67 0.00 0.00 178.83 178.51 1xng h LYS 243 N 0.65 0.22 -0.36 1.46 3.64 -0.83 -3.27 116.57 118.07 1xng h LYS 243 Ca 0.06 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1xng h LYS 243 Cb 0.90 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.72 1xng h LYS 243 CO 0.08 0.62 0.00 0.09 -2.27 0.00 0.00 179.45 177.97 1xng n ASN 244 N -4.01 3.64 0.22 4.20 3.02 -0.69 -4.55 115.26 117.09 1xng n ASN 244 Ca -0.02 -2.49 0.07 0.00 -0.03 0.00 0.00 54.58 52.11 1xng n ASN 244 Cb 0.49 -0.42 0.59 0.00 -0.61 0.00 0.00 39.78 39.84 1xng n ASN 244 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xng h ALA 245 N 2.28 1.92 -0.28 5.41 0.00 -1.47 -1.83 119.26 125.29 1xng h ALA 245 Ca 0.00 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 54.97 1xng h ALA 245 Cb 1.15 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1xng h ALA 245 CO 0.13 0.06 0.26 0.27 0.00 0.00 0.00 179.25 179.97 1xng h PHE 246 N 0.09 0.00 0.00 0.00 -5.15 -1.85 -1.54 116.94 108.49 1xng h PHE 246 Ca 0.02 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.79 1xng h PHE 246 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.19 1xng h PHE 246 CO 0.00 0.00 0.00 0.87 -2.00 0.00 0.00 178.31 177.18 1xng h LYS 247 N 0.00 0.00 -0.59 6.09 1.57 -1.69 -2.17 116.57 119.78 1xng h LYS 247 Ca 0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1xng h LYS 247 Cb 0.65 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.96 1xng h LYS 247 CO -0.00 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.16 1xng n LEU 248 N -2.93 3.60 -4.46 2.94 4.77 -0.58 -4.95 117.00 115.39 1xng n LEU 248 Ca -0.00 -1.72 -0.23 0.00 -0.03 0.00 0.00 56.01 54.03 1xng n LEU 248 Cb 0.21 -0.39 -0.10 0.00 -2.33 0.00 0.00 43.42 40.81 1xng n LEU 248 CO 0.23 0.86 -0.39 -1.61 -1.33 0.00 0.00 177.39 175.15 1xng s GLU 249 N -1.23 1.63 0.80 3.23 0.41 -0.82 -5.15 118.70 117.58 1xng s GLU 249 Ca 0.44 -1.82 -0.12 0.00 -0.41 0.00 0.00 54.97 53.06 1xng s GLU 249 Cb 0.24 -1.40 0.07 0.00 -1.78 0.00 0.00 34.13 31.27 1xng s GLU 249 CO 0.32 0.11 1.16 -0.51 -0.49 0.00 0.00 175.26 175.85 1xng s LEU 250 N -3.49 2.52 0.76 1.80 2.01 -1.26 -5.01 118.68 116.01 1xng s LEU 250 Ca 0.30 0.87 -0.12 0.00 0.01 0.00 0.00 54.13 55.19 1xng s LEU 250 Cb 0.02 -3.40 0.06 0.00 0.01 0.00 0.00 46.19 42.87 1xng s LEU 250 CO 0.13 -1.88 1.11 -2.16 1.01 0.00 0.00 176.35 174.57 1xng s PRO 251 N -5.50 2.19 -0.28 1.29 0.04 -1.26 -4.96 135.00 126.52 1xng s PRO 251 Ca 0.61 1.33 -0.27 0.00 0.04 0.00 0.00 61.00 62.72 1xng s PRO 251 Cb -0.11 -1.88 0.01 0.00 0.04 0.00 0.00 34.50 32.55 1xng s PRO 251 CO 0.50 -1.72 0.95 0.00 0.04 0.00 0.00 177.00 176.77 1xng s ALA 252 N -2.65 3.58 -0.13 8.56 0.00 -1.26 -5.03 121.76 124.83 1xng s ALA 252 Ca 0.64 -0.11 -0.01 0.00 0.00 0.00 0.00 51.96 52.48 1xng s ALA 252 Cb -0.20 -3.48 -0.02 0.00 0.00 0.00 0.00 23.12 19.43 1xng s ALA 252 CO 0.52 -1.21 -0.10 0.42 0.00 0.00 0.00 175.76 175.39 1xng s ILE 253 N 3.22 3.35 0.07 0.00 -1.09 -1.26 -5.08 121.20 120.41 1xng s ILE 253 Ca 0.40 -0.56 -0.31 0.00 -2.23 0.00 0.00 60.65 57.95 1xng s ILE 253 Cb -0.14 -2.42 -0.08 0.00 -1.58 0.00 0.00 42.46 38.24 1xng s ILE 253 CO 0.11 0.53 1.56 0.00 -1.23 0.00 0.00 174.94 175.90 1xng s ALA 254 N 0.19 3.66 0.88 9.38 0.00 -1.26 -4.97 121.76 129.64 1xng s ALA 254 Ca -0.06 1.15 -0.11 0.00 0.00 0.00 0.00 51.96 52.94 1xng s ALA 254 Cb -0.15 -3.65 0.12 0.00 0.00 0.00 0.00 23.12 19.45 1xng s ALA 254 CO 0.04 -0.96 1.09 0.15 0.00 0.00 0.00 175.76 176.08 1xng s LYS 255 N 2.21 1.39 0.41 0.00 1.02 -1.26 -4.94 119.74 118.57 1xng s LYS 255 Ca 0.70 0.93 -0.26 0.00 0.02 0.00 0.00 55.97 57.37 1xng s LYS 255 Cb -0.38 -1.82 -0.10 0.00 -0.52 0.00 0.00 37.83 35.01 1xng s LYS 255 CO 0.31 -2.18 1.23 0.54 -0.92 0.00 0.00 175.35 174.33 1xng n ARG 256 N -3.86 1.86 -2.81 1.68 5.12 -1.26 -4.91 116.66 112.49 1xng n ARG 256 Ca 0.08 0.66 -0.42 0.00 -1.93 0.00 0.00 57.85 56.24 1xng n ARG 256 Cb 0.55 -2.32 -0.03 0.00 -1.16 0.00 0.00 32.46 29.50 1xng n ARG 256 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 1xng s PHE 257 N -1.19 3.46 -0.38 -1.55 5.99 -1.26 -5.01 117.98 118.04 1xng s PHE 257 Ca 0.60 1.40 0.02 0.00 0.00 0.00 0.00 56.93 58.96 1xng s PHE 257 Cb -0.53 -3.08 0.11 0.00 0.00 0.00 0.00 43.02 39.51 1xng s PHE 257 CO 0.58 -0.23 0.11 -0.80 -0.00 0.00 0.00 175.22 174.89 1xng s ASN 258 N 1.12 4.83 0.48 6.13 0.01 -1.26 -5.10 114.94 121.14 1xng s ASN 258 Ca 0.42 -2.24 -0.24 0.00 -0.71 0.00 0.00 52.86 50.10 1xng s ASN 258 Cb -0.17 -1.68 -0.07 0.00 0.41 0.00 0.00 41.25 39.74 1xng s ASN 258 CO 0.15 -0.40 1.31 -2.16 -1.51 0.00 0.00 177.10 174.49 1xng s PRO 259 N 0.80 3.58 -0.51 -0.60 0.04 -1.26 -4.96 135.00 132.09 1xng s PRO 259 Ca 0.11 2.15 -0.25 0.00 0.04 0.00 0.00 61.00 63.05 1xng s PRO 259 Cb -0.21 -2.49 0.03 0.00 0.04 0.00 0.00 34.50 31.88 1xng s PRO 259 CO -0.06 -0.81 0.92 -1.83 0.04 0.00 0.00 177.00 175.26 1xng s GLU 260 N -2.61 3.41 0.81 4.56 1.03 -1.26 -5.02 118.70 119.61 1xng s GLU 260 Ca 0.64 -0.10 -0.10 0.00 0.03 0.00 0.00 54.97 55.44 1xng s GLU 260 Cb -0.38 -4.00 0.08 0.00 -0.80 0.00 0.00 34.13 29.03 1xng s GLU 260 CO 0.47 -1.36 1.10 -0.51 -1.33 0.00 0.00 175.26 173.62 1xng s LEU 261 N 3.83 2.94 0.35 1.83 1.43 -1.26 -4.93 118.68 122.87 1xng s LEU 261 Ca 0.33 1.86 0.06 0.00 -1.03 0.00 0.00 54.13 55.35 1xng s LEU 261 Cb -0.12 -4.48 0.73 0.00 0.03 0.00 0.00 46.19 42.35 1xng s LEU 261 CO 0.22 -2.27 1.91 1.05 0.23 0.00 0.00 176.35 177.50 1xng h GLU 262 N -1.29 0.76 -0.06 1.70 9.09 -2.07 -1.71 114.58 121.00 1xng h GLU 262 Ca -0.44 -0.05 0.00 0.00 0.05 0.00 0.00 59.36 58.93 1xng h GLU 262 Cb 1.24 -0.17 0.00 0.00 -1.65 0.00 0.00 28.75 28.17 1xng h GLU 262 CO 0.50 0.50 0.00 -2.39 0.05 0.00 0.00 179.01 177.67 1xng n HIS 263 N -4.51 0.06 1.19 2.06 1.44 -1.26 -5.36 115.22 108.84 1xng n HIS 263 Ca 0.14 -0.03 0.09 0.00 -2.01 0.00 0.00 57.72 55.91 1xng n HIS 263 Cb 0.32 0.00 0.56 0.00 0.12 0.00 0.00 29.99 31.00 1xng n HIS 263 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25