#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i5i n GLN 2 N 0.00 0.00 -1.58 -1.46 6.02 -1.26 -4.98 117.38 114.12 3i5i n GLN 2 Ca 0.00 0.00 -0.52 0.00 -0.01 0.00 0.00 57.00 56.47 3i5i n GLN 2 Cb 0.00 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.20 3i5i n GLN 2 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3i5i n LEU 3 N 0.00 1.40 -4.51 1.08 4.77 -1.26 -4.85 117.00 113.63 3i5i n LEU 3 Ca 0.00 1.13 -0.29 0.00 -0.03 0.00 0.00 56.01 56.82 3i5i n LEU 3 Cb 0.00 -1.16 0.24 0.00 -2.33 0.00 0.00 43.42 40.17 3i5i n LEU 3 CO 0.00 -1.21 0.54 0.42 -1.33 0.00 0.00 177.39 175.81 3i5i s THR 4 N 0.31 1.83 0.09 -5.08 -4.23 -1.26 -4.72 115.64 102.59 3i5i s THR 4 Ca 0.83 0.00 -0.30 0.00 -1.18 0.00 0.00 61.69 61.04 3i5i s THR 4 Cb -0.98 -2.21 -0.14 0.00 1.34 0.00 0.00 72.50 70.50 3i5i s THR 4 CO 0.49 0.00 1.64 0.11 -0.54 0.00 0.00 174.62 176.31 3i5i h LYS 5 N -2.61 -0.65 -0.60 3.99 1.57 -2.00 -0.17 116.57 116.10 3i5i h LYS 5 Ca -0.56 0.04 0.05 0.00 -1.87 0.00 0.00 60.65 58.31 3i5i h LYS 5 Cb 1.33 0.15 -0.03 0.00 0.08 0.00 0.00 32.23 33.76 3i5i h LYS 5 CO 0.47 -0.43 0.40 -0.44 -0.57 0.00 0.00 179.45 178.88 3i5i h ASP 6 N -0.67 0.55 -0.48 0.86 3.32 -1.99 0.06 116.42 118.06 3i5i h ASP 6 Ca -0.04 -0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.03 3i5i h ASP 6 Cb 0.58 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.98 3i5i h ASP 6 CO 0.00 0.37 0.30 -0.33 -1.72 0.00 0.00 179.24 177.86 3i5i h GLU 7 N 0.63 0.59 0.35 3.56 5.08 -1.67 -0.91 114.58 122.20 3i5i h GLU 7 Ca 0.25 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.56 3i5i h GLU 7 Cb 0.20 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.32 3i5i h GLU 7 CO -0.07 0.39 -0.17 0.82 -1.00 0.00 0.00 179.01 178.98 3i5i h ILE 8 N 0.61 0.67 -0.94 3.13 2.04 0.28 -0.41 117.51 122.89 3i5i h ILE 8 Ca 0.18 -0.32 0.27 0.00 1.00 0.00 0.00 64.86 66.00 3i5i h ILE 8 Cb -0.03 0.83 -0.14 0.00 -0.74 0.00 0.00 36.82 36.74 3i5i h ILE 8 CO -0.06 0.06 0.39 -0.33 0.00 0.00 0.00 178.15 178.21 3i5i h GLU 9 N -0.64 0.27 -0.17 2.37 5.08 -0.81 0.54 114.58 121.21 3i5i h GLU 9 Ca -0.05 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 3i5i h GLU 9 Cb 0.46 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 3i5i h GLU 9 CO 0.08 0.18 -0.00 0.93 -1.00 0.00 0.00 179.01 179.19 3i5i h GLU 10 N 0.28 0.30 -0.36 2.33 5.08 -0.70 -1.15 114.58 120.34 3i5i h GLU 10 Ca 0.63 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.90 3i5i h GLU 10 Cb 1.35 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.55 3i5i h GLU 10 CO -0.63 0.52 0.23 0.28 -1.00 0.00 0.00 179.01 178.42 3i5i h VAL 11 N 0.04 1.11 -0.16 3.13 2.07 0.13 -2.85 116.25 119.71 3i5i h VAL 11 Ca 0.05 -0.22 0.02 0.00 0.82 0.00 0.00 66.70 67.37 3i5i h VAL 11 Cb 0.39 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 30.71 3i5i h VAL 11 CO 0.01 0.10 -0.34 -0.09 0.02 0.00 0.00 177.57 177.27 3i5i h ARG 12 N 0.49 -0.30 -0.49 1.57 2.43 0.01 0.27 114.38 118.37 3i5i h ARG 12 Ca 0.13 0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.37 3i5i h ARG 12 Cb -0.03 0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 29.53 3i5i h ARG 12 CO -0.03 -0.20 -0.29 0.39 -1.51 0.00 0.00 179.97 178.34 3i5i n GLU 13 N -4.33 -0.21 -0.18 0.20 1.02 -0.45 0.63 120.64 117.32 3i5i n GLU 13 Ca -0.03 1.07 -0.03 0.00 -0.02 0.00 0.00 57.16 58.15 3i5i n GLU 13 Cb 0.22 -1.58 0.07 0.00 -0.02 0.00 0.00 31.44 30.12 3i5i n GLU 13 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3i5i h VAL 14 N 0.00 0.92 -0.26 2.62 2.07 -1.24 -2.56 116.25 117.80 3i5i h VAL 14 Ca 0.08 -0.17 0.06 0.00 0.82 0.00 0.00 66.70 67.49 3i5i h VAL 14 Cb 0.20 0.38 -0.07 0.00 -1.52 0.00 0.00 31.29 30.28 3i5i h VAL 14 CO -0.46 0.09 -0.23 0.15 0.02 0.00 0.00 177.57 177.14 3i5i h PHE 15 N 0.49 -0.62 -0.39 1.57 3.57 0.39 -1.75 116.94 120.21 3i5i h PHE 15 Ca 0.25 0.04 0.07 0.00 3.53 0.00 0.00 57.97 61.85 3i5i h PHE 15 Cb 0.18 0.31 -0.06 0.00 2.79 0.00 0.00 35.95 39.18 3i5i h PHE 15 CO -0.11 -0.31 0.03 -0.44 -2.23 0.00 0.00 178.31 175.24 3i5i h ASP 16 N -0.23 -0.11 -0.69 0.41 3.32 0.05 -0.41 116.42 118.76 3i5i h ASP 16 Ca 0.14 0.08 0.15 0.00 0.02 0.00 0.00 57.03 57.42 3i5i h ASP 16 Cb 0.45 0.14 -0.12 0.00 0.22 0.00 0.00 39.33 40.02 3i5i h ASP 16 CO -0.39 -0.02 -0.01 0.25 -1.72 0.00 0.00 179.24 177.35 3i5i h LEU 17 N 0.13 -0.34 -0.20 1.55 5.85 -0.96 0.97 115.31 122.32 3i5i h LEU 17 Ca 0.19 0.18 -0.05 0.00 0.84 0.00 0.00 57.88 59.04 3i5i h LEU 17 Cb 0.26 0.32 -0.01 0.00 0.37 0.00 0.00 40.66 41.60 3i5i h LEU 17 CO -0.30 -0.15 -0.06 -0.26 -0.34 0.00 0.00 178.44 177.33 3i5i h PHE 18 N 0.10 0.45 0.00 1.25 -1.00 -0.64 -1.56 116.94 115.54 3i5i h PHE 18 Ca 0.36 -0.10 -0.03 0.00 2.81 0.00 0.00 57.97 61.01 3i5i h PHE 18 Cb 0.61 -0.11 -0.00 0.00 3.61 0.00 0.00 35.95 40.06 3i5i h PHE 18 CO -0.41 0.66 -0.14 0.38 -1.61 0.00 0.00 178.31 177.19 3i5i h ASP 19 N 0.11 0.00 0.80 2.17 2.03 0.03 -2.21 116.42 119.35 3i5i h ASP 19 Ca 0.05 0.00 -0.04 0.00 -0.73 0.00 0.00 57.03 56.31 3i5i h ASP 19 Cb 0.53 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 39.03 3i5i h ASP 19 CO 0.02 0.14 -0.39 0.15 -1.03 0.00 0.00 179.24 178.14 3i5i h PHE 20 N 0.00 -1.00 0.00 4.15 3.57 0.15 -0.50 116.94 123.31 3i5i h PHE 20 Ca -0.00 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 3i5i h PHE 20 Cb 0.45 0.33 0.00 0.00 2.79 0.00 0.00 35.95 39.52 3i5i h PHE 20 CO 0.00 -0.61 0.00 0.91 -2.23 0.00 0.00 178.31 176.38 3i5i n TRP 21 N -5.52 0.00 -0.38 0.41 7.02 -0.64 -0.92 117.44 117.42 3i5i n TRP 21 Ca -0.14 0.00 0.04 0.00 -1.02 0.00 0.00 57.50 56.38 3i5i n TRP 21 Cb 0.43 -0.49 0.07 0.00 -2.42 0.00 0.00 31.31 28.90 3i5i n TRP 21 CO 0.00 0.00 0.00 -0.40 -2.02 0.00 0.00 177.69 175.27 3i5i n ASP 22 N -1.49 2.30 0.00 -0.99 5.68 -1.01 -5.02 116.55 116.03 3i5i n ASP 22 Ca 0.00 -2.36 0.00 0.00 -0.50 0.00 0.00 54.79 51.93 3i5i n ASP 22 Cb 0.01 -0.18 0.00 0.00 -1.14 0.00 0.00 41.12 39.82 3i5i n ASP 22 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3i5i n GLY 23 N -0.66 0.78 1.33 6.12 0.00 -0.10 -4.95 105.19 107.72 3i5i n GLY 23 Ca 0.07 -0.62 -0.08 0.00 0.00 0.00 0.00 46.02 45.40 3i5i n GLY 23 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3i5i n ARG 24 N 0.00 0.00 -0.23 1.61 0.63 -0.49 -4.64 116.66 113.54 3i5i n ARG 24 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 3i5i n ARG 24 Cb 0.00 -0.39 0.00 0.00 0.45 0.00 0.00 32.46 32.53 3i5i n ARG 24 CO 0.00 0.00 0.00 -0.40 -2.51 0.00 0.00 177.63 174.72 3i5i n ASP 25 N 2.08 0.07 0.00 6.15 5.75 -1.26 -5.00 116.55 124.34 3i5i n ASP 25 Ca 0.23 -1.51 0.00 0.00 -0.01 0.00 0.00 54.79 53.50 3i5i n ASP 25 Cb 0.07 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.06 3i5i n ASP 25 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3i5i n GLY 26 N -0.03 1.03 3.28 6.12 0.00 -1.26 -5.02 105.19 109.31 3i5i n GLY 26 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 3i5i n GLY 26 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3i5i s ASP 27 N -3.03 2.46 0.09 1.61 1.01 -1.26 -4.21 116.67 113.35 3i5i s ASP 27 Ca 0.00 -0.71 0.07 0.00 0.71 0.00 0.00 52.55 52.63 3i5i s ASP 27 Cb 0.00 -0.13 -0.03 0.00 1.01 0.00 0.00 42.92 43.77 3i5i s ASP 27 CO 0.00 0.03 -0.19 -0.69 0.21 0.00 0.00 175.17 174.53 3i5i s VAL 28 N -1.32 1.55 0.02 -1.27 1.01 -0.67 -4.40 120.40 115.31 3i5i s VAL 28 Ca 0.07 -1.47 -0.28 0.00 0.00 0.00 0.00 61.98 60.29 3i5i s VAL 28 Cb -0.09 -1.43 -0.04 0.00 0.00 0.00 0.00 36.38 34.82 3i5i s VAL 28 CO 0.04 -0.10 0.90 -0.62 0.00 0.00 0.00 175.10 175.33 3i5i s ASP 29 N -1.85 7.32 0.41 3.32 -1.08 -1.26 -1.03 116.67 122.49 3i5i s ASP 29 Ca 0.04 1.59 0.22 0.00 -0.52 0.00 0.00 52.55 53.88 3i5i s ASP 29 Cb -0.10 -2.54 1.23 0.00 -1.46 0.00 0.00 42.92 40.05 3i5i s ASP 29 CO 0.04 -0.16 1.70 0.00 0.52 0.00 0.00 175.17 177.27 3i5i h ALA 30 N 6.38 2.38 -0.79 3.66 0.00 -1.73 1.22 119.26 130.38 3i5i h ALA 30 Ca -0.42 0.10 0.14 0.00 0.00 0.00 0.00 54.91 54.73 3i5i h ALA 30 Cb 1.21 0.11 -0.09 0.00 0.00 0.00 0.00 17.79 19.03 3i5i h ALA 30 CO 0.74 -0.91 0.37 0.00 0.00 0.00 0.00 179.25 179.45 3i5i h ALA 31 N 1.65 1.15 0.00 0.00 0.00 -1.76 0.22 119.26 120.52 3i5i h ALA 31 Ca 0.70 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.71 3i5i h ALA 31 Cb 1.94 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.76 3i5i h ALA 31 CO -0.39 -0.14 0.00 1.63 0.00 0.00 0.00 179.25 180.35 3i5i n LYS 32 N -4.93 0.82 0.19 0.00 4.76 0.42 -3.75 118.16 115.67 3i5i n LYS 32 Ca 0.15 0.00 0.03 0.00 -2.87 0.00 0.00 58.31 55.62 3i5i n LYS 32 Cb 0.41 -1.24 0.39 0.00 -1.84 0.00 0.00 35.03 32.75 3i5i n LYS 32 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 3i5i h VAL 33 N 0.00 1.22 0.55 -0.18 2.07 -0.52 -0.11 116.25 119.27 3i5i h VAL 33 Ca 0.00 -1.17 -0.03 0.00 0.82 0.00 0.00 66.70 66.32 3i5i h VAL 33 Cb 0.00 1.64 0.01 0.00 -1.52 0.00 0.00 31.29 31.41 3i5i h VAL 33 CO 0.00 0.33 -0.26 1.23 0.02 0.00 0.00 177.57 178.89 3i5i h GLY 34 N 1.05 -0.76 0.08 2.17 0.00 -1.76 -1.93 103.07 101.92 3i5i h GLY 34 Ca -0.00 0.28 0.02 0.00 0.00 0.00 0.00 47.33 47.63 3i5i h GLY 34 CO 0.04 -0.28 -0.50 -0.55 0.00 0.00 0.00 176.54 175.26 3i5i h ASP 35 N -1.15 -1.52 -0.82 0.19 3.32 -1.78 0.38 116.42 115.04 3i5i h ASP 35 Ca -0.07 0.17 0.09 0.00 0.02 0.00 0.00 57.03 57.23 3i5i h ASP 35 Cb 0.56 0.58 -0.11 0.00 0.22 0.00 0.00 39.33 40.57 3i5i h ASP 35 CO 0.12 -0.51 -0.55 0.25 -1.72 0.00 0.00 179.24 176.83 3i5i h LEU 36 N -0.66 -1.98 -1.08 1.55 5.85 -1.11 0.73 115.31 118.60 3i5i h LEU 36 Ca 0.02 0.30 0.24 0.00 0.84 0.00 0.00 57.88 59.28 3i5i h LEU 36 Cb 0.71 0.87 -0.11 0.00 0.37 0.00 0.00 40.66 42.50 3i5i h LEU 36 CO -0.33 -0.29 0.61 -0.07 -0.34 0.00 0.00 178.44 178.03 3i5i h LEU 37 N -0.12 0.65 -1.12 2.25 3.38 -0.47 0.55 115.31 120.44 3i5i h LEU 37 Ca 0.16 0.12 -0.08 0.00 0.09 0.00 0.00 57.88 58.16 3i5i h LEU 37 Cb 0.48 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 3i5i h LEU 37 CO -0.84 0.14 -0.27 0.03 0.09 0.00 0.00 178.44 177.59 3i5i h ARG 38 N 0.59 0.29 0.00 1.13 3.08 0.25 -2.39 114.38 117.31 3i5i h ARG 38 Ca 0.62 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 60.57 3i5i h ARG 38 Cb 1.21 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.23 3i5i h ARG 38 CO -0.42 0.54 0.00 0.00 -1.07 0.00 0.00 179.97 179.02 3i5i h LEU 40 N 0.00 0.00 0.00 0.00 3.38 -0.86 -3.47 115.31 114.36 3i5i h LEU 40 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3i5i h LEU 40 Cb 0.72 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.47 3i5i h LEU 40 CO 0.00 0.38 0.00 0.61 0.09 0.00 0.00 178.44 179.52 3i5i n GLY 41 N 0.77 0.21 3.95 0.83 0.00 -0.83 -5.11 105.19 105.00 3i5i n GLY 41 Ca 0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.79 3i5i n GLY 41 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3i5i s MET 42 N 0.00 2.26 -0.44 1.61 -1.94 -0.99 -5.01 119.30 114.80 3i5i s MET 42 Ca 0.00 -0.52 0.04 0.00 -1.71 0.00 0.00 55.69 53.50 3i5i s MET 42 Cb 0.00 -2.30 0.17 0.00 2.01 0.00 0.00 34.83 34.72 3i5i s MET 42 CO 0.00 -1.07 0.37 0.09 -0.01 0.00 0.00 175.02 174.39 3i5i n ASN 43 N -2.71 -0.10 -4.87 3.03 3.02 -1.26 -4.19 115.26 108.19 3i5i n ASN 43 Ca 0.09 -2.48 -0.32 0.00 -0.03 0.00 0.00 54.58 51.84 3i5i n ASN 43 Cb 0.60 -0.58 -0.05 0.00 -0.61 0.00 0.00 39.78 39.14 3i5i n ASN 43 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3i5i s PRO 44 N -0.17 3.81 0.44 3.52 0.04 -1.26 -5.01 135.00 136.37 3i5i s PRO 44 Ca 0.32 0.31 -0.07 0.00 0.04 0.00 0.00 61.00 61.60 3i5i s PRO 44 Cb 0.04 -2.61 -0.05 0.00 0.04 0.00 0.00 34.50 31.92 3i5i s PRO 44 CO -0.19 0.28 0.76 0.95 0.04 0.00 0.00 177.00 178.84 3i5i s THR 45 N -1.87 4.87 0.20 1.26 -4.23 -1.26 -4.90 115.64 109.71 3i5i s THR 45 Ca 0.48 0.34 -0.10 0.00 -1.18 0.00 0.00 61.69 61.22 3i5i s THR 45 Cb -0.11 -3.81 0.13 0.00 1.34 0.00 0.00 72.50 70.05 3i5i s THR 45 CO 0.22 -0.69 1.81 -0.33 -0.54 0.00 0.00 174.62 175.09 3i5i h GLU 46 N 0.72 0.65 -0.06 3.99 5.08 -1.99 -1.04 114.58 121.93 3i5i h GLU 46 Ca -0.47 -0.04 0.04 0.00 -1.00 0.00 0.00 59.36 57.89 3i5i h GLU 46 Cb 1.20 -0.15 -0.05 0.00 0.50 0.00 0.00 28.75 30.25 3i5i h GLU 46 CO 0.63 0.43 -0.28 0.00 -1.00 0.00 0.00 179.01 178.79 3i5i h ALA 47 N 1.32 -0.34 -0.63 3.43 0.00 -1.99 0.29 119.26 121.34 3i5i h ALA 47 Ca 0.28 0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.32 3i5i h ALA 47 Cb 0.14 0.51 -0.12 0.00 0.00 0.00 0.00 17.79 18.32 3i5i h ALA 47 CO -0.16 -0.76 -0.27 1.96 0.00 0.00 0.00 179.25 180.01 3i5i h GLN 48 N -0.38 -0.10 -0.79 0.00 4.20 -1.67 0.42 115.11 116.78 3i5i h GLN 48 Ca 0.08 0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.78 3i5i h GLN 48 Cb 0.50 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.27 3i5i h GLN 48 CO -0.28 -0.06 0.41 0.28 -0.67 0.00 0.00 178.83 178.51 3i5i h VAL 49 N -0.10 1.24 -0.35 -0.54 2.07 -0.33 -2.70 116.25 115.54 3i5i h VAL 49 Ca 0.27 -0.64 -0.09 0.00 0.82 0.00 0.00 66.70 67.07 3i5i h VAL 49 Cb 0.53 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 3i5i h VAL 49 CO -0.69 0.28 -0.13 0.45 0.02 0.00 0.00 177.57 177.50 3i5i h HIS 50 N 1.11 0.81 0.00 1.57 3.86 0.32 -1.42 115.15 121.39 3i5i h HIS 50 Ca 0.28 -0.19 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 3i5i h HIS 50 Cb 0.07 -0.19 0.00 0.00 1.06 0.00 0.00 27.41 28.35 3i5i h HIS 50 CO 0.01 0.89 0.00 1.04 0.86 0.00 0.00 177.93 180.72 3i5i n GLN 51 N -4.36 0.02 -0.10 2.45 6.02 0.01 -2.43 117.38 119.00 3i5i n GLN 51 Ca -0.02 0.36 0.09 0.00 -0.01 0.00 0.00 57.00 57.42 3i5i n GLN 51 Cb 0.37 -1.50 0.14 0.00 1.02 0.00 0.00 30.24 30.27 3i5i n GLN 51 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 3i5i n HIS 52 N -1.44 0.00 0.00 1.08 8.25 -0.89 -5.01 115.22 117.21 3i5i n HIS 52 Ca 0.02 -0.97 0.00 0.00 -0.26 0.00 0.00 57.72 56.50 3i5i n HIS 52 Cb 0.06 -0.15 0.00 0.00 1.12 0.00 0.00 29.99 31.02 3i5i n HIS 52 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3i5i n GLY 53 N -1.37 0.90 3.66 -1.41 0.00 -1.02 -4.96 105.19 100.99 3i5i n GLY 53 Ca 0.15 -0.14 -0.51 0.00 0.00 0.00 0.00 46.02 45.52 3i5i n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i5i n GLY 54 N 0.00 0.92 4.00 -0.02 0.00 -0.59 -4.89 105.19 104.61 3i5i n GLY 54 Ca 0.00 0.79 -0.18 0.00 0.00 0.00 0.00 46.02 46.62 3i5i n GLY 54 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3i5i s THR 55 N 2.13 3.58 -0.14 2.61 -4.23 -1.24 -4.54 115.64 113.82 3i5i s THR 55 Ca 0.89 -0.97 -0.10 0.00 -1.18 0.00 0.00 61.69 60.33 3i5i s THR 55 Cb -0.87 -3.23 -0.04 0.00 1.34 0.00 0.00 72.50 69.70 3i5i s THR 55 CO 0.51 -0.09 -0.15 1.17 -0.54 0.00 0.00 174.62 175.51 3i5i n LYS 56 N -1.76 0.46 -0.16 3.99 3.00 -1.26 -3.76 118.16 118.66 3i5i n LYS 56 Ca 0.04 0.54 -0.04 0.00 -0.00 0.00 0.00 58.31 58.85 3i5i n LYS 56 Cb 0.58 -1.70 0.03 0.00 0.00 0.00 0.00 35.03 33.94 3i5i n LYS 56 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 3i5i n LYS 57 N -4.61 -0.90 -0.01 1.64 2.85 -1.26 -4.76 118.16 111.12 3i5i n LYS 57 Ca -0.08 -0.23 0.10 0.00 -1.05 0.00 0.00 58.31 57.04 3i5i n LYS 57 Cb 0.28 -0.19 -0.14 0.00 -0.65 0.00 0.00 35.03 34.34 3i5i n LYS 57 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 177.40 176.02 3i5i n MET 58 N -1.72 0.60 -0.01 -1.58 2.81 -1.26 -4.34 117.12 111.62 3i5i n MET 58 Ca 0.02 -0.10 0.11 0.00 -1.81 0.00 0.00 57.70 55.91 3i5i n MET 58 Cb 0.07 -1.45 -0.16 0.00 -0.71 0.00 0.00 33.22 30.97 3i5i n MET 58 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3i5i n GLY 59 N 1.41 -0.99 0.00 3.03 0.00 -1.26 -4.78 105.19 102.59 3i5i n GLY 59 Ca -0.00 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.48 3i5i n GLY 59 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3i5i n GLU 60 N -2.11 0.00 -4.19 1.61 1.02 -1.26 -4.86 120.64 110.85 3i5i n GLU 60 Ca -0.02 0.54 -0.13 0.00 -0.02 0.00 0.00 57.16 57.52 3i5i n GLU 60 Cb 0.52 -1.02 -0.10 0.00 -0.02 0.00 0.00 31.44 30.82 3i5i n GLU 60 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 3i5i s LYS 61 N -1.24 0.88 0.18 3.49 2.20 -1.26 -5.10 119.74 118.89 3i5i s LYS 61 Ca 0.00 -1.27 0.05 0.00 -0.36 0.00 0.00 55.97 54.39 3i5i s LYS 61 Cb 0.00 -0.45 -0.05 0.00 -1.51 0.00 0.00 37.83 35.82 3i5i s LYS 61 CO 0.00 0.05 -0.09 0.00 -0.36 0.00 0.00 175.35 174.95 3i5i s ALA 62 N -2.96 1.67 -0.01 3.13 0.00 -1.26 -1.95 121.76 120.38 3i5i s ALA 62 Ca 0.09 -1.60 0.01 0.00 0.00 0.00 0.00 51.96 50.47 3i5i s ALA 62 Cb 0.01 0.12 0.00 0.00 0.00 0.00 0.00 23.12 23.25 3i5i s ALA 62 CO -0.01 -0.10 -0.03 0.71 0.00 0.00 0.00 175.76 176.33 3i5i s TYR 63 N -3.27 0.35 0.65 0.00 4.12 -0.20 -4.88 117.35 114.12 3i5i s TYR 63 Ca 0.21 -0.06 -0.11 0.00 0.02 0.00 0.00 57.07 57.13 3i5i s TYR 63 Cb 0.03 -0.28 0.15 0.00 -1.52 0.00 0.00 41.96 40.34 3i5i s TYR 63 CO 0.04 -0.04 0.88 1.63 0.02 0.00 0.00 175.55 178.08 3i5i n LYS 64 N 3.27 -0.86 0.02 -0.62 5.02 -1.26 -1.67 118.16 122.06 3i5i n LYS 64 Ca -0.16 -1.36 -0.19 0.00 -2.02 0.00 0.00 58.31 54.58 3i5i n LYS 64 Cb 0.57 -0.90 -0.10 0.00 -0.02 0.00 0.00 35.03 34.57 3i5i n LYS 64 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 3i5i h LEU 65 N 0.00 0.86 0.00 -0.35 5.85 -2.01 -3.11 115.31 116.56 3i5i h LEU 65 Ca -0.28 -0.72 0.00 0.00 0.84 0.00 0.00 57.88 57.72 3i5i h LEU 65 Cb 0.78 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.55 3i5i h LEU 65 CO 0.20 1.46 0.00 -0.62 -0.34 0.00 0.00 178.44 179.14 3i5i n GLU 66 N -3.93 0.04 -0.06 1.25 4.71 -1.26 -1.76 120.64 119.62 3i5i n GLU 66 Ca -0.10 0.30 -0.15 0.00 -0.01 0.00 0.00 57.16 57.19 3i5i n GLU 66 Cb 0.82 -1.50 -0.14 0.00 -1.01 0.00 0.00 31.44 29.61 3i5i n GLU 66 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 3i5i n GLU 67 N -1.45 0.69 -0.12 3.49 1.02 -1.19 -4.33 120.64 118.75 3i5i n GLU 67 Ca 0.03 0.18 -0.13 0.00 -0.02 0.00 0.00 57.16 57.22 3i5i n GLU 67 Cb 0.10 -1.64 -0.02 0.00 -0.02 0.00 0.00 31.44 29.87 3i5i n GLU 67 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3i5i h ILE 68 N 0.02 1.27 -0.58 -3.67 2.04 -1.36 -3.25 117.51 111.99 3i5i h ILE 68 Ca -0.46 -1.54 0.12 0.00 1.00 0.00 0.00 64.86 63.97 3i5i h ILE 68 Cb 2.04 1.35 -0.11 0.00 -0.74 0.00 0.00 36.82 39.36 3i5i h ILE 68 CO 0.03 0.52 -0.17 -0.07 0.00 0.00 0.00 178.15 178.46 3i5i h LEU 69 N 0.78 -0.61 -1.38 1.44 3.38 -1.54 0.29 115.31 117.68 3i5i h LEU 69 Ca 0.07 0.18 -0.03 0.00 0.09 0.00 0.00 57.88 58.19 3i5i h LEU 69 Cb 0.97 0.39 -0.00 0.00 0.09 0.00 0.00 40.66 42.10 3i5i h LEU 69 CO 0.09 -0.21 -0.14 1.55 0.09 0.00 0.00 178.44 179.82 3i5i h PRO 70 N -0.03 0.00 0.28 1.13 0.13 -1.76 -1.58 132.00 130.17 3i5i h PRO 70 Ca 0.28 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.39 3i5i h PRO 70 Cb 0.45 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.58 3i5i h PRO 70 CO -0.61 0.14 -0.13 0.82 -0.23 0.00 0.00 178.00 177.99 3i5i h ILE 71 N 0.00 0.72 -0.97 -3.56 2.04 -0.63 -0.82 117.51 114.30 3i5i h ILE 71 Ca -0.00 -0.69 0.29 0.00 1.00 0.00 0.00 64.86 65.46 3i5i h ILE 71 Cb 0.60 1.07 -0.14 0.00 -0.74 0.00 0.00 36.82 37.61 3i5i h ILE 71 CO 0.02 0.13 0.48 0.22 0.00 0.00 0.00 178.15 179.00 3i5i h TYR 72 N -0.77 0.78 0.00 1.37 3.20 -0.14 0.65 116.97 122.06 3i5i h TYR 72 Ca -0.04 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 3i5i h TYR 72 Cb 0.50 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.59 3i5i h TYR 72 CO 0.03 -0.16 -0.66 1.05 -1.64 0.00 0.00 178.16 176.79 3i5i h GLU 73 N 0.32 0.00 0.33 1.82 4.11 -1.08 -0.77 114.58 119.31 3i5i h GLU 73 Ca 0.67 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 60.09 3i5i h GLU 73 Cb 1.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.72 3i5i h GLU 73 CO -0.61 0.03 -0.16 0.93 0.07 0.00 0.00 179.01 179.28 3i5i h GLU 74 N 0.00 -0.43 -0.95 1.06 4.39 0.40 -2.85 114.58 116.20 3i5i h GLU 74 Ca -0.01 0.03 0.29 0.00 0.34 0.00 0.00 59.36 60.01 3i5i h GLU 74 Cb 1.04 0.10 -0.16 0.00 -0.10 0.00 0.00 28.75 29.63 3i5i h GLU 74 CO 0.00 -0.14 0.26 1.98 -1.16 0.00 0.00 179.01 179.95 3i5i h MET 75 N -1.01 0.10 0.00 2.33 4.05 -1.02 3.38 114.93 122.77 3i5i h MET 75 Ca -0.05 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.37 3i5i h MET 75 Cb 0.49 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.26 3i5i h MET 75 CO 0.08 0.07 0.00 -1.13 0.23 0.00 0.00 176.91 176.15 3i5i n SER 76 N -5.31 0.00 -0.03 1.39 3.41 -0.30 -2.78 113.62 110.01 3i5i n SER 76 Ca 0.26 -1.33 0.12 0.00 -0.26 0.00 0.00 58.87 57.66 3i5i n SER 76 Cb 0.86 0.00 0.28 0.00 -0.26 0.00 0.00 64.21 65.09 3i5i n SER 76 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3i5i n SER 77 N -0.65 0.55 -4.85 4.04 7.64 1.12 -4.88 113.62 116.59 3i5i n SER 77 Ca 0.05 -0.31 -0.29 0.00 1.01 0.00 0.00 58.87 59.34 3i5i n SER 77 Cb 0.03 0.22 0.11 0.00 -1.01 0.00 0.00 64.21 63.55 3i5i n SER 77 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 3i5i s LYS 78 N -2.94 1.65 0.00 1.43 2.47 -1.12 -5.01 119.74 116.22 3i5i s LYS 78 Ca 0.13 0.21 0.00 0.00 -1.56 0.00 0.00 55.97 54.74 3i5i s LYS 78 Cb 0.18 -1.91 0.00 0.00 -1.46 0.00 0.00 37.83 34.64 3i5i s LYS 78 CO 0.67 -1.83 0.00 -0.25 0.16 0.00 0.00 175.35 174.10 3i5i n ASP 79 N -3.50 0.00 -3.57 1.43 8.00 -1.26 -4.82 116.55 112.83 3i5i n ASP 79 Ca 0.07 -1.00 -0.36 0.00 0.71 0.00 0.00 54.79 54.21 3i5i n ASP 79 Cb 0.60 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.69 3i5i n ASP 79 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 3i5i n THR 80 N 0.00 4.55 0.13 -3.53 5.66 -1.26 -4.49 114.28 115.34 3i5i n THR 80 Ca 0.00 -5.75 0.06 0.00 -3.05 0.00 0.00 64.05 55.31 3i5i n THR 80 Cb 0.25 -1.79 0.03 0.00 -1.55 0.00 0.00 70.33 67.27 3i5i n THR 80 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 175.07 173.25 3i5i h GLY 81 N 4.33 0.00 0.00 1.09 0.00 -1.95 -3.49 103.07 103.05 3i5i h GLY 81 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.62 3i5i h GLY 81 CO 1.09 0.00 0.00 2.41 0.00 0.00 0.00 176.54 180.04 3i5i n THR 82 N -3.01 0.00 -2.79 4.70 -1.04 -1.26 -4.98 114.28 105.90 3i5i n THR 82 Ca -0.01 0.00 -0.09 0.00 -2.04 0.00 0.00 64.05 61.91 3i5i n THR 82 Cb 0.68 0.00 0.04 0.00 -1.82 0.00 0.00 70.33 69.23 3i5i n THR 82 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3i5i n ALA 83 N 2.71 0.38 0.00 2.41 0.00 -1.26 -5.01 120.51 119.73 3i5i n ALA 83 Ca 0.00 -0.92 -0.10 0.00 0.00 0.00 0.00 53.44 52.42 3i5i n ALA 83 Cb 0.00 0.21 -0.08 0.00 0.00 0.00 0.00 19.45 19.58 3i5i n ALA 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i5i h ALA 84 N 0.00 -0.11 -0.94 0.00 0.00 -2.02 -2.63 119.26 113.56 3i5i h ALA 84 Ca -0.13 -0.27 0.17 0.00 0.00 0.00 0.00 54.91 54.68 3i5i h ALA 84 Cb 0.55 0.04 -0.17 0.00 0.00 0.00 0.00 17.79 18.22 3i5i h ALA 84 CO 0.17 -0.17 -0.31 -0.44 0.00 0.00 0.00 179.25 178.50 3i5i h ASP 85 N -0.90 -1.15 -0.57 0.00 3.32 -1.98 1.26 116.42 116.39 3i5i h ASP 85 Ca -0.01 0.29 0.00 0.00 0.02 0.00 0.00 57.03 57.33 3i5i h ASP 85 Cb 0.57 0.66 -0.03 0.00 0.22 0.00 0.00 39.33 40.75 3i5i h ASP 85 CO 0.02 -0.30 0.37 -0.33 -1.72 0.00 0.00 179.24 177.28 3i5i h GLU 86 N -0.01 0.76 0.00 3.56 5.08 -1.96 -1.78 114.58 120.23 3i5i h GLU 86 Ca 0.39 -0.05 -0.13 0.00 -1.00 0.00 0.00 59.36 58.57 3i5i h GLU 86 Cb 0.64 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 3i5i h GLU 86 CO -0.96 0.51 -0.73 0.74 -1.00 0.00 0.00 179.01 177.57 3i5i h PHE 87 N 0.78 0.00 0.05 4.33 0.05 0.16 -3.28 116.94 119.02 3i5i h PHE 87 Ca 0.21 0.00 -0.00 0.00 3.82 0.00 0.00 57.97 62.00 3i5i h PHE 87 Cb -0.07 0.00 0.00 0.00 2.00 0.00 0.00 35.95 37.88 3i5i h PHE 87 CO 0.00 0.58 -0.02 1.98 -0.18 0.00 0.00 178.31 180.66 3i5i h MET 88 N 0.00 -0.06 -0.26 1.51 4.05 0.95 -2.57 114.93 118.55 3i5i h MET 88 Ca -0.03 0.00 0.08 0.00 -0.28 0.00 0.00 59.70 59.47 3i5i h MET 88 Cb 1.47 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 32.27 3i5i h MET 88 CO 0.07 0.57 0.22 0.93 0.23 0.00 0.00 176.91 178.93 3i5i h GLU 89 N -0.83 0.00 0.02 0.39 4.39 -1.49 -0.89 114.58 116.17 3i5i h GLU 89 Ca -0.01 0.00 -0.25 0.00 0.34 0.00 0.00 59.36 59.45 3i5i h GLU 89 Cb 0.66 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.28 3i5i h GLU 89 CO 0.01 0.00 -1.27 0.00 -1.16 0.00 0.00 179.01 176.59 3i5i h ALA 90 N 1.81 0.45 -0.07 3.43 0.00 -1.62 -3.24 119.26 120.02 3i5i h ALA 90 Ca 0.13 -1.09 -0.25 0.00 0.00 0.00 0.00 54.91 53.70 3i5i h ALA 90 Cb 0.56 0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.45 3i5i h ALA 90 CO -0.00 1.32 -0.92 0.74 0.00 0.00 0.00 179.25 180.39 3i5i h PHE 91 N 0.01 1.07 -1.00 0.00 0.05 -0.81 -3.17 116.94 113.09 3i5i h PHE 91 Ca -0.12 -0.53 0.22 0.00 3.82 0.00 0.00 57.97 61.36 3i5i h PHE 91 Cb 1.88 -0.14 -0.10 0.00 2.00 0.00 0.00 35.95 39.58 3i5i h PHE 91 CO 0.01 1.37 0.62 0.87 -0.18 0.00 0.00 178.31 181.00 3i5i h LYS 92 N 0.47 0.57 -1.33 1.51 1.57 -1.30 0.27 116.57 118.33 3i5i h LYS 92 Ca -0.09 -0.03 0.39 0.00 -1.87 0.00 0.00 60.65 59.04 3i5i h LYS 92 Cb 1.56 -0.13 -0.08 0.00 0.08 0.00 0.00 32.23 33.66 3i5i h LYS 92 CO 0.18 0.38 0.91 0.00 -0.57 0.00 0.00 179.45 180.36 3i5i h THR 93 N 0.59 0.29 0.00 -0.16 1.03 -1.57 0.56 112.91 113.65 3i5i h THR 93 Ca 0.58 -0.04 0.00 0.00 -0.01 0.00 0.00 66.41 66.94 3i5i h THR 93 Cb 1.15 0.18 0.00 0.00 -1.07 0.00 0.00 68.15 68.41 3i5i h THR 93 CO -0.35 0.02 -1.54 0.49 -0.01 0.00 0.00 175.52 174.13 3i5i n PHE 94 N -4.36 0.40 -1.86 0.00 3.01 0.93 -4.82 117.46 110.75 3i5i n PHE 94 Ca 0.32 0.12 -0.25 0.00 1.01 0.00 0.00 57.45 58.64 3i5i n PHE 94 Cb 1.35 -0.67 -0.05 0.00 -0.01 0.00 0.00 39.48 40.10 3i5i n PHE 94 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 3i5i s ASP 95 N -4.79 4.73 0.14 4.37 -1.08 0.20 -4.82 116.67 115.41 3i5i s ASP 95 Ca -0.04 -0.15 -0.23 0.00 -0.52 0.00 0.00 52.55 51.61 3i5i s ASP 95 Cb 0.12 -2.55 -0.00 0.00 -1.46 0.00 0.00 42.92 39.03 3i5i s ASP 95 CO 0.86 -3.04 1.65 0.03 0.52 0.00 0.00 175.17 175.19 3i5i h ARG 96 N 13.01 -0.24 -0.24 4.34 3.08 -1.82 -3.19 114.38 129.33 3i5i h ARG 96 Ca -0.02 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3i5i h ARG 96 Cb 1.05 0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.16 3i5i h ARG 96 CO 1.15 -0.16 0.00 0.39 -1.07 0.00 0.00 179.97 180.28 3i5i n GLU 97 N -5.34 2.44 -2.25 0.04 1.02 -1.26 -5.02 120.64 110.27 3i5i n GLU 97 Ca -0.02 -2.14 0.00 0.00 -0.02 0.00 0.00 57.16 54.98 3i5i n GLU 97 Cb 0.26 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.19 3i5i n GLU 97 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3i5i n GLY 98 N 1.45 0.94 0.00 0.62 0.00 -1.21 -5.00 105.19 102.00 3i5i n GLY 98 Ca 0.17 -0.63 -0.00 0.00 0.00 0.00 0.00 46.02 45.56 3i5i n GLY 98 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3i5i n GLN 99 N -0.48 0.96 0.00 1.61 1.13 -1.26 -5.01 117.38 114.34 3i5i n GLN 99 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 3i5i n GLN 99 Cb 0.45 -1.01 0.00 0.00 0.11 0.00 0.00 30.24 29.79 3i5i n GLN 99 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3i5i n GLY 100 N 3.36 1.42 3.58 1.08 0.00 -1.26 -5.08 105.19 108.28 3i5i n GLY 100 Ca -0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 3i5i n GLY 100 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3i5i s LEU 101 N 0.00 3.09 -0.11 0.99 1.43 -1.26 -1.85 118.68 120.96 3i5i s LEU 101 Ca 0.00 -0.24 -0.07 0.00 -1.03 0.00 0.00 54.13 52.79 3i5i s LEU 101 Cb 0.00 -1.81 0.04 0.00 0.03 0.00 0.00 46.19 44.45 3i5i s LEU 101 CO 0.00 0.25 0.27 -0.63 0.23 0.00 0.00 176.35 176.47 3i5i s ILE 102 N -1.06 -0.03 0.55 -0.59 1.01 -0.40 -4.63 121.20 116.05 3i5i s ILE 102 Ca 0.18 0.10 -0.18 0.00 0.00 0.00 0.00 60.65 60.75 3i5i s ILE 102 Cb -0.11 -0.41 -0.10 0.00 0.01 0.00 0.00 42.46 41.85 3i5i s ILE 102 CO 0.10 0.04 0.45 -0.24 0.00 0.00 0.00 174.94 175.29 3i5i n SER 103 N 3.90 -1.33 0.05 3.58 2.88 -1.26 -1.21 113.62 120.23 3i5i n SER 103 Ca -0.22 0.74 -0.11 0.00 -1.33 0.00 0.00 58.87 57.95 3i5i n SER 103 Cb 0.55 -1.13 -0.13 0.00 -0.75 0.00 0.00 64.21 62.74 3i5i n SER 103 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 3i5i h SER 104 N 0.25 0.17 -0.74 -3.46 4.64 -1.92 -2.27 113.55 110.21 3i5i h SER 104 Ca -0.45 -0.21 0.19 0.00 -0.47 0.00 0.00 61.79 60.84 3i5i h SER 104 Cb 1.41 -0.05 -0.04 0.00 -0.31 0.00 0.00 62.40 63.40 3i5i h SER 104 CO 0.47 1.18 0.51 0.00 -0.87 0.00 0.00 176.83 178.12 3i5i h ALA 105 N 0.80 2.44 0.04 5.18 0.00 -1.99 0.51 119.26 126.24 3i5i h ALA 105 Ca -0.14 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 3i5i h ALA 105 Cb 1.91 0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.72 3i5i h ALA 105 CO 0.14 -0.65 -0.22 0.93 0.00 0.00 0.00 179.25 179.45 3i5i h GLU 106 N 0.18 0.08 -0.64 0.00 5.08 -1.86 -1.58 114.58 115.83 3i5i h GLU 106 Ca 0.36 -0.14 0.04 0.00 -1.00 0.00 0.00 59.36 58.62 3i5i h GLU 106 Cb 1.17 0.05 -0.05 0.00 0.50 0.00 0.00 28.75 30.42 3i5i h GLU 106 CO -0.06 1.07 0.38 0.82 -1.00 0.00 0.00 179.01 180.21 3i5i h ILE 107 N -0.83 1.04 -0.91 3.13 2.04 -0.80 0.27 117.51 121.45 3i5i h ILE 107 Ca -0.04 -0.25 -0.00 0.00 1.00 0.00 0.00 64.86 65.57 3i5i h ILE 107 Cb 1.17 0.24 -0.04 0.00 -0.74 0.00 0.00 36.82 37.45 3i5i h ILE 107 CO 0.04 0.13 0.56 0.03 0.00 0.00 0.00 178.15 178.92 3i5i h ARG 108 N 0.74 1.22 -0.26 2.37 3.08 -1.03 0.12 114.38 120.62 3i5i h ARG 108 Ca 0.27 -0.10 -0.00 0.00 0.07 0.00 0.00 59.98 60.22 3i5i h ARG 108 Cb 0.08 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 29.85 3i5i h ARG 108 CO -0.13 0.84 0.16 -0.91 -1.07 0.00 0.00 179.97 178.86 3i5i h ASN 109 N 1.24 0.31 0.44 7.04 2.35 -0.00 0.69 115.58 127.66 3i5i h ASN 109 Ca 0.33 -0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 56.02 3i5i h ASN 109 Cb -0.08 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.19 3i5i h ASN 109 CO -0.06 0.26 -0.45 0.58 -1.65 0.00 0.00 177.43 176.11 3i5i h VAL 110 N 0.33 0.00 -0.38 2.81 2.07 0.43 0.49 116.25 122.01 3i5i h VAL 110 Ca 0.09 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.68 3i5i h VAL 110 Cb 0.01 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.76 3i5i h VAL 110 CO -0.02 0.00 0.26 -0.07 0.02 0.00 0.00 177.57 177.76 3i5i h LEU 111 N -0.89 0.20 0.06 2.57 3.38 -0.53 0.72 115.31 120.81 3i5i h LEU 111 Ca -0.06 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.55 3i5i h LEU 111 Cb 0.77 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 41.43 3i5i h LEU 111 CO -0.06 0.13 -2.18 0.29 0.09 0.00 0.00 178.44 176.71 3i5i n LYS 112 N -4.47 0.70 0.08 1.13 5.02 0.24 -1.46 118.16 119.41 3i5i n LYS 112 Ca 0.05 0.20 -0.23 0.00 -2.02 0.00 0.00 58.31 56.31 3i5i n LYS 112 Cb 0.29 -1.63 -0.15 0.00 -0.02 0.00 0.00 35.03 33.52 3i5i n LYS 112 CO 0.00 0.00 0.00 0.52 -0.52 0.00 0.00 177.40 177.40 3i5i h MET 113 N 0.03 0.42 -6.20 1.97 2.86 0.00 -3.32 114.93 110.69 3i5i h MET 113 Ca -0.48 -0.72 -0.49 0.00 -2.06 0.00 0.00 59.70 55.95 3i5i h MET 113 Cb 2.00 0.27 -0.03 0.00 0.06 0.00 0.00 31.60 33.89 3i5i h MET 113 CO 0.02 1.34 -0.43 -0.51 1.06 0.00 0.00 176.91 178.39 3i5i s LEU 114 N -7.39 3.58 0.00 1.22 1.43 0.24 -4.83 118.68 112.94 3i5i s LEU 114 Ca -0.15 -0.53 0.00 0.00 -1.03 0.00 0.00 54.13 52.43 3i5i s LEU 114 Cb 0.05 -2.22 0.00 0.00 0.03 0.00 0.00 46.19 44.05 3i5i s LEU 114 CO 0.87 -0.42 0.00 0.61 0.23 0.00 0.00 176.35 177.64 3i5i n GLY 115 N -1.43 0.05 3.57 -3.19 0.00 -1.26 -3.91 105.19 99.02 3i5i n GLY 115 Ca -0.01 -0.97 -0.40 0.00 0.00 0.00 0.00 46.02 44.64 3i5i n GLY 115 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3i5i s GLU 116 N 0.00 2.79 0.52 1.61 2.02 -1.26 -4.87 118.70 119.52 3i5i s GLU 116 Ca 0.00 1.04 -0.18 0.00 0.02 0.00 0.00 54.97 55.85 3i5i s GLU 116 Cb 0.00 -4.36 -0.15 0.00 0.10 0.00 0.00 34.13 29.73 3i5i s GLU 116 CO 0.00 -2.52 -0.13 0.54 0.02 0.00 0.00 175.26 173.17 3i5i n ARG 117 N 8.90 0.01 -4.75 1.61 5.12 -1.25 -4.98 116.66 121.32 3i5i n ARG 117 Ca 0.24 0.00 -0.28 0.00 -1.93 0.00 0.00 57.85 55.89 3i5i n ARG 117 Cb 0.51 -1.02 -0.14 0.00 -1.16 0.00 0.00 32.46 30.65 3i5i n ARG 117 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 3i5i s ILE 118 N -1.99 1.92 0.78 0.55 1.01 -0.53 -5.00 121.20 117.93 3i5i s ILE 118 Ca 0.57 -1.32 -0.12 0.00 0.00 0.00 0.00 60.65 59.77 3i5i s ILE 118 Cb -0.48 -1.66 0.07 0.00 0.01 0.00 0.00 42.46 40.40 3i5i s ILE 118 CO 0.66 0.27 1.14 -0.89 0.00 0.00 0.00 174.94 176.13 3i5i s THR 119 N -0.82 2.68 0.07 2.92 2.01 -1.26 -4.34 115.64 116.89 3i5i s THR 119 Ca 0.10 0.26 -0.24 0.00 0.31 0.00 0.00 61.69 62.12 3i5i s THR 119 Cb -0.09 -2.64 -0.16 0.00 0.01 0.00 0.00 72.50 69.61 3i5i s THR 119 CO 0.02 -0.24 1.66 -0.08 -0.69 0.00 0.00 174.62 175.29 3i5i h GLU 120 N -0.93 -0.11 0.21 4.92 4.57 -1.98 -1.28 114.58 119.99 3i5i h GLU 120 Ca -0.45 0.01 0.01 0.00 -1.18 0.00 0.00 59.36 57.75 3i5i h GLU 120 Cb 1.26 0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 29.84 3i5i h GLU 120 CO 0.48 -0.01 -0.41 0.22 -1.18 0.00 0.00 179.01 178.12 3i5i h ASP 121 N -0.18 -1.17 -0.96 1.04 1.82 -2.00 -1.58 116.42 113.40 3i5i h ASP 121 Ca -0.01 0.12 0.22 0.00 -0.39 0.00 0.00 57.03 56.97 3i5i h ASP 121 Cb 0.14 0.42 -0.08 0.00 0.68 0.00 0.00 39.33 40.50 3i5i h ASP 121 CO 0.02 -0.50 0.63 1.56 -1.61 0.00 0.00 179.24 179.33 3i5i h GLN 122 N -0.70 0.41 -0.07 0.28 4.20 -1.89 -0.34 115.11 117.00 3i5i h GLN 122 Ca 0.00 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.66 3i5i h GLN 122 Cb 0.69 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.38 3i5i h GLN 122 CO -0.18 0.27 -0.07 0.00 -0.67 0.00 0.00 178.83 178.17 3i5i h ASN 124 N -0.28 0.34 0.82 0.00 2.35 -0.30 -1.75 115.58 116.76 3i5i h ASN 124 Ca 0.01 0.03 -0.04 0.00 -0.55 0.00 0.00 56.30 55.75 3i5i h ASN 124 Cb 0.59 -0.03 0.01 0.00 0.05 0.00 0.00 38.32 38.94 3i5i h ASN 124 CO 0.02 0.24 -0.39 0.44 -1.65 0.00 0.00 177.43 176.08 3i5i h ASP 125 N 0.48 -0.93 -0.63 5.81 3.32 -1.09 0.64 116.42 124.02 3i5i h ASP 125 Ca 0.22 0.03 0.17 0.00 0.02 0.00 0.00 57.03 57.46 3i5i h ASP 125 Cb 0.13 0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.89 3i5i h ASP 125 CO -0.16 -0.66 0.44 -0.29 -1.72 0.00 0.00 179.24 176.86 3i5i h ILE 126 N -1.12 0.72 0.00 0.35 6.09 -1.27 0.11 117.51 122.39 3i5i h ILE 126 Ca -0.11 -0.03 -0.15 0.00 -1.37 0.00 0.00 64.86 63.20 3i5i h ILE 126 Cb 0.85 0.63 -0.02 0.00 0.47 0.00 0.00 36.82 38.75 3i5i h ILE 126 CO 0.18 0.01 -0.74 -0.26 -3.07 0.00 0.00 178.15 174.28 3i5i h PHE 127 N 0.08 0.00 0.16 2.19 0.05 -0.75 -2.73 116.94 115.94 3i5i h PHE 127 Ca 0.30 0.00 -0.31 0.00 3.82 0.00 0.00 57.97 61.78 3i5i h PHE 127 Cb 1.09 0.00 0.01 0.00 2.00 0.00 0.00 35.95 39.05 3i5i h PHE 127 CO -0.00 0.74 -1.49 1.15 -0.18 0.00 0.00 178.31 178.53 3i5i h THR 128 N 0.00 1.23 0.00 -1.55 2.02 0.12 -3.25 112.91 111.47 3i5i h THR 128 Ca -0.01 -2.80 -0.02 0.00 0.77 0.00 0.00 66.41 64.35 3i5i h THR 128 Cb 1.43 2.86 -0.00 0.00 -1.74 0.00 0.00 68.15 70.70 3i5i h THR 128 CO 0.10 0.84 -0.11 -0.26 0.37 0.00 0.00 175.52 176.45 3i5i h PHE 129 N 0.09 0.00 0.00 3.16 0.05 -0.91 -3.16 116.94 116.16 3i5i h PHE 129 Ca -0.23 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.56 3i5i h PHE 129 Cb 2.05 0.00 0.00 0.00 2.00 0.00 0.00 35.95 40.00 3i5i h PHE 129 CO 0.08 0.11 -1.26 0.00 -0.18 0.00 0.00 178.31 177.07 3i5i n ASP 131 N -2.38 -2.93 -4.09 0.00 2.03 -1.20 -4.98 116.55 103.01 3i5i n ASP 131 Ca -0.00 -0.15 -0.32 0.00 0.52 0.00 0.00 54.79 54.83 3i5i n ASP 131 Cb 0.52 -1.53 -0.16 0.00 -0.72 0.00 0.00 41.12 39.24 3i5i n ASP 131 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3i5i s ILE 132 N -3.08 2.01 0.22 5.18 1.01 -1.23 -5.03 121.20 120.28 3i5i s ILE 132 Ca 0.09 -1.07 0.10 0.00 0.00 0.00 0.00 60.65 59.76 3i5i s ILE 132 Cb -0.01 -1.91 -0.04 0.00 0.01 0.00 0.00 42.46 40.50 3i5i s ILE 132 CO 0.16 0.38 -0.08 -0.13 0.00 0.00 0.00 174.94 175.27 3i5i s ARG 133 N 1.27 2.07 0.17 2.79 1.81 -1.26 -4.86 118.95 120.95 3i5i s ARG 133 Ca 0.01 -1.40 0.06 0.00 -1.72 0.00 0.00 55.73 52.68 3i5i s ARG 133 Cb -0.15 -2.10 -0.04 0.00 -0.45 0.00 0.00 34.95 32.22 3i5i s ARG 133 CO -0.11 0.39 0.11 -1.83 -0.68 0.00 0.00 175.30 173.19 3i5i s GLU 134 N -3.21 2.79 0.02 3.54 -1.05 -1.25 -4.52 118.70 115.01 3i5i s GLU 134 Ca 0.28 -0.94 0.05 0.00 -0.15 0.00 0.00 54.97 54.21 3i5i s GLU 134 Cb -0.07 -2.57 -0.02 0.00 -0.44 0.00 0.00 34.13 31.03 3i5i s GLU 134 CO 0.17 0.47 -0.15 0.34 0.95 0.00 0.00 175.26 177.03 3i5i s ASP 135 N -3.12 1.81 0.00 0.83 -1.08 -0.67 -5.03 116.67 109.42 3i5i s ASP 135 Ca 0.30 -0.38 0.00 0.00 -0.52 0.00 0.00 52.55 51.95 3i5i s ASP 135 Cb -0.10 -0.16 0.00 0.00 -1.46 0.00 0.00 42.92 41.20 3i5i s ASP 135 CO 0.22 0.12 0.00 -0.38 0.52 0.00 0.00 175.17 175.65 3i5i n ILE 136 N 2.26 0.00 -3.67 4.11 5.41 -1.26 -0.03 119.36 126.18 3i5i n ILE 136 Ca -0.16 0.00 -0.27 0.00 1.00 0.00 0.00 62.75 63.31 3i5i n ILE 136 Cb 0.55 0.00 -0.11 0.00 -0.71 0.00 0.00 39.64 39.37 3i5i n ILE 136 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 3i5i n ASP 137 N 0.00 2.36 -3.29 4.38 4.64 -1.26 -4.65 116.55 118.74 3i5i n ASP 137 Ca 0.00 -3.08 -0.22 0.00 -1.38 0.00 0.00 54.79 50.11 3i5i n ASP 137 Cb 0.00 -0.70 -0.08 0.00 -1.04 0.00 0.00 41.12 39.30 3i5i n ASP 137 CO 0.00 0.00 0.00 -0.83 -0.82 0.00 0.00 177.20 175.55 3i5i s GLY 138 N -1.37 0.59 0.00 0.27 0.00 0.96 -5.11 107.32 102.65 3i5i s GLY 138 Ca 0.30 -1.87 0.00 0.00 0.00 0.00 0.00 44.72 43.15 3i5i s GLY 138 CO -0.14 2.46 0.00 0.70 0.00 0.00 0.00 173.10 176.11 3i5i n ASN 139 N 3.16 0.00 -4.17 1.64 3.02 -1.26 -1.66 115.26 116.00 3i5i n ASN 139 Ca 0.24 0.00 -0.24 0.00 -0.03 0.00 0.00 54.58 54.54 3i5i n ASN 139 Cb 0.48 0.00 -0.15 0.00 -0.61 0.00 0.00 39.78 39.50 3i5i n ASN 139 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3i5i s ILE 140 N 0.00 1.37 -0.12 2.41 1.01 -0.35 -2.92 121.20 122.61 3i5i s ILE 140 Ca 0.00 -0.81 -0.30 0.00 0.00 0.00 0.00 60.65 59.55 3i5i s ILE 140 Cb 0.00 -1.15 -0.02 0.00 0.01 0.00 0.00 42.46 41.29 3i5i s ILE 140 CO 0.00 0.33 1.27 -0.54 0.00 0.00 0.00 174.94 176.00 3i5i s LYS 141 N -0.55 4.27 0.28 2.79 1.02 -1.26 -1.28 119.74 125.01 3i5i s LYS 141 Ca 0.06 1.71 0.18 0.00 0.02 0.00 0.00 55.97 57.94 3i5i s LYS 141 Cb -0.07 -3.70 0.10 0.00 -0.52 0.00 0.00 37.83 33.64 3i5i s LYS 141 CO -0.00 -0.62 1.37 0.10 -0.92 0.00 0.00 175.35 175.28 3i5i h TYR 142 N 8.01 0.00 -0.11 3.18 -0.00 -1.73 -3.14 116.97 123.17 3i5i h TYR 142 Ca -0.30 0.00 -0.16 0.00 0.00 0.00 0.00 58.73 58.27 3i5i h TYR 142 Cb 1.13 0.00 0.01 0.00 0.00 0.00 0.00 36.73 37.87 3i5i h TYR 142 CO 0.78 0.36 -0.55 1.49 -0.00 0.00 0.00 178.16 180.24 3i5i h GLU 143 N 0.00 0.57 -0.41 0.10 4.81 -1.91 -2.08 114.58 115.67 3i5i h GLU 143 Ca -0.02 -0.46 0.04 0.00 -0.13 0.00 0.00 59.36 58.79 3i5i h GLU 143 Cb 1.30 0.10 -0.07 0.00 0.63 0.00 0.00 28.75 30.71 3i5i h GLU 143 CO 0.04 1.09 -0.40 0.22 -0.73 0.00 0.00 179.01 179.23 3i5i h ASP 144 N 0.20 -1.39 -0.94 1.04 1.82 -1.93 0.60 116.42 115.81 3i5i h ASP 144 Ca -0.04 0.19 0.22 0.00 -0.39 0.00 0.00 57.03 57.02 3i5i h ASP 144 Cb 1.19 0.58 -0.07 0.00 0.68 0.00 0.00 39.33 41.71 3i5i h ASP 144 CO 0.11 -0.25 0.62 0.25 -1.61 0.00 0.00 179.24 178.36 3i5i h LEU 145 N -0.20 0.39 0.41 2.28 5.85 -1.54 -1.74 115.31 120.75 3i5i h LEU 145 Ca 0.07 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 3i5i h LEU 145 Cb 0.39 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.40 3i5i h LEU 145 CO -0.49 0.14 -0.20 -0.03 -0.34 0.00 0.00 178.44 177.52 3i5i h MET 146 N 0.38 -0.53 -0.64 1.25 4.05 0.78 -1.84 114.93 118.38 3i5i h MET 146 Ca 0.50 0.04 0.13 0.00 -0.28 0.00 0.00 59.70 60.09 3i5i h MET 146 Cb 1.30 0.12 -0.10 0.00 -0.80 0.00 0.00 31.60 32.12 3i5i h MET 146 CO -0.19 -0.25 0.11 0.87 0.23 0.00 0.00 176.91 177.68 3i5i h LYS 147 N -1.03 0.22 -0.04 0.39 1.57 -0.18 -0.17 116.57 117.32 3i5i h LYS 147 Ca -0.06 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 3i5i h LYS 147 Cb 0.53 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.79 3i5i h LYS 147 CO 0.09 0.15 -0.06 0.87 -0.57 0.00 0.00 179.45 179.93 3i5i h LYS 148 N 0.23 0.12 -0.54 3.15 1.57 -1.41 -1.64 116.57 118.04 3i5i h LYS 148 Ca 0.35 -0.07 0.07 0.00 -1.87 0.00 0.00 60.65 59.13 3i5i h LYS 148 Cb 0.55 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.81 3i5i h LYS 148 CO -0.46 0.61 0.21 0.28 -0.57 0.00 0.00 179.45 179.52 3i5i h VAL 149 N -0.37 0.83 0.00 0.50 2.07 -1.06 0.12 116.25 118.35 3i5i h VAL 149 Ca 0.00 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.39 3i5i h VAL 149 Cb 0.60 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.76 3i5i h VAL 149 CO 0.01 0.07 0.00 0.23 0.02 0.00 0.00 177.57 177.91 3i5i n MET 150 N -4.98 0.59 -0.00 1.57 2.81 -0.10 -3.39 117.12 113.62 3i5i n MET 150 Ca 0.06 0.01 0.09 0.00 -1.81 0.00 0.00 57.70 56.06 3i5i n MET 150 Cb 0.22 -1.50 -0.12 0.00 -0.71 0.00 0.00 33.22 31.11 3i5i n MET 150 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3i5i n ALA 151 N -1.02 4.47 0.00 3.04 0.00 0.42 -5.04 120.51 122.37 3i5i n ALA 151 Ca 0.14 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 53.03 3i5i n ALA 151 Cb 0.08 -0.72 0.00 0.00 0.00 0.00 0.00 19.45 18.81 3i5i n ALA 151 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i5i n GLY 152 N 1.46 0.02 0.33 0.00 0.00 -1.19 -4.45 105.19 101.36 3i5i n GLY 152 Ca 0.03 -1.53 0.03 0.00 0.00 0.00 0.00 46.02 44.56 3i5i n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3i5i h PRO 153 N 0.00 0.70 -3.43 1.61 0.13 -1.90 -3.21 132.00 125.90 3i5i h PRO 153 Ca 0.00 -0.04 -0.74 0.00 -0.87 0.00 0.00 66.00 64.34 3i5i h PRO 153 Cb 0.00 -0.16 -0.32 0.00 0.13 0.00 0.00 31.00 30.65 3i5i h PRO 153 CO 0.00 0.46 0.11 -0.06 -0.23 0.00 0.00 178.00 178.29 3i5i s PHE 154 N -5.62 4.03 0.00 1.56 0.08 -1.26 -4.96 117.98 111.80 3i5i s PHE 154 Ca -0.09 -2.86 0.00 0.00 0.12 0.00 0.00 56.93 54.10 3i5i s PHE 154 Cb 0.18 -3.49 0.00 0.00 -0.57 0.00 0.00 43.02 39.14 3i5i s PHE 154 CO 0.75 -0.83 0.17 -2.30 -0.10 0.00 0.00 175.22 172.91 3i5i n PRO 155 N 2.55 0.00 0.00 0.24 -0.02 -1.21 -5.15 135.00 131.41 3i5i n PRO 155 Ca 0.22 0.14 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 3i5i n PRO 155 Cb 0.38 -0.67 0.00 0.00 -0.02 0.00 0.00 33.50 33.19 3i5i n PRO 155 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23