#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gby h LEU 3 N 0.00 0.00 -0.02 1.20 5.85 -1.98 1.16 115.31 121.52 2gby h LEU 3 Ca 0.00 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.60 2gby h LEU 3 Cb 0.00 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.04 2gby h LEU 3 CO 0.00 0.00 -0.44 0.50 -0.34 0.00 0.00 178.44 178.16 2gby h LYS 4 N 0.00 0.33 -0.75 1.25 3.64 -1.98 -2.41 116.57 116.65 2gby h LYS 4 Ca 0.04 -0.33 -0.03 0.00 -1.27 0.00 0.00 60.65 59.06 2gby h LYS 4 Cb 0.19 0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.07 2gby h LYS 4 CO -0.00 1.01 0.35 -0.44 -2.27 0.00 0.00 179.45 178.10 2gby h ASP 5 N -0.23 0.98 -0.46 4.20 3.32 -1.54 -1.82 116.42 120.87 2gby h ASP 5 Ca -0.05 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 56.88 2gby h ASP 5 Cb 1.16 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 40.43 2gby h ASP 5 CO 0.09 0.84 0.27 0.50 -1.72 0.00 0.00 179.24 179.22 2gby h LYS 6 N 1.07 0.63 -0.06 3.56 1.63 0.13 -0.46 116.57 123.07 2gby h LYS 6 Ca 0.26 -0.06 0.02 0.00 -0.85 0.00 0.00 60.65 60.01 2gby h LYS 6 Cb 0.13 -0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 31.61 2gby h LYS 6 CO -0.03 0.46 -0.04 0.82 -3.45 0.00 0.00 179.45 177.22 2gby h ILE 7 N 0.61 0.89 -0.38 2.00 2.04 -0.99 -0.45 117.51 121.22 2gby h ILE 7 Ca 0.16 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.03 2gby h ILE 7 Cb 0.00 0.89 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 2gby h ILE 7 CO -0.03 0.00 0.24 -0.07 0.00 0.00 0.00 178.15 178.29 2gby h LEU 8 N -0.04 0.45 -0.11 1.44 3.38 -1.02 0.13 115.31 119.54 2gby h LEU 8 Ca 0.04 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 2gby h LEU 8 Cb 0.09 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.73 2gby h LEU 8 CO -0.08 0.33 -0.26 1.23 0.09 0.00 0.00 178.44 179.75 2gby h GLY 9 N 0.54 0.41 1.04 0.83 0.00 -0.55 -0.60 103.07 104.75 2gby h GLY 9 Ca 0.14 -0.50 -0.11 0.00 0.00 0.00 0.00 47.33 46.86 2gby h GLY 9 CO -0.03 0.45 -0.14 -2.08 0.00 0.00 0.00 176.54 174.75 2gby h VAL 10 N -0.05 1.27 -0.39 4.60 2.07 -0.86 -2.38 116.25 120.52 2gby h VAL 10 Ca -0.00 -1.27 0.02 0.00 0.82 0.00 0.00 66.70 66.27 2gby h VAL 10 Cb 0.86 1.15 -0.03 0.00 -1.52 0.00 0.00 31.29 31.75 2gby h VAL 10 CO 0.06 0.43 0.23 0.00 0.02 0.00 0.00 177.57 178.31 2gby h ALA 11 N 0.86 0.49 -0.45 1.67 0.00 -0.75 0.12 119.26 121.20 2gby h ALA 11 Ca 0.11 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.07 2gby h ALA 11 Cb 0.69 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 2gby h ALA 11 CO 0.05 -0.11 0.16 -0.22 0.00 0.00 0.00 179.25 179.13 2gby h LYS 12 N 0.46 0.33 -0.57 0.00 3.64 -0.84 0.08 116.57 119.67 2gby h LYS 12 Ca 0.15 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.48 2gby h LYS 12 Cb 0.01 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 2gby h LYS 12 CO -0.07 0.22 0.24 0.93 -2.27 0.00 0.00 179.45 178.49 2gby h GLU 13 N 0.34 0.85 -0.35 1.90 4.39 -0.85 -1.52 114.58 119.34 2gby h GLU 13 Ca 0.21 -0.15 0.01 0.00 0.34 0.00 0.00 59.36 59.77 2gby h GLU 13 Cb 0.20 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.70 2gby h GLU 13 CO -0.21 0.72 0.22 -0.07 -1.16 0.00 0.00 179.01 178.51 2gby h LEU 14 N 0.78 0.38 -1.28 1.33 3.38 -0.09 -0.36 115.31 119.45 2gby h LEU 14 Ca 0.19 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 2gby h LEU 14 Cb 0.18 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 2gby h LEU 14 CO -0.02 0.28 0.30 -0.26 0.09 0.00 0.00 178.44 178.83 2gby h PHE 15 N 0.46 0.78 -0.07 1.13 0.05 -0.80 -0.16 116.94 118.32 2gby h PHE 15 Ca 0.13 -0.01 -0.03 0.00 3.82 0.00 0.00 57.97 61.88 2gby h PHE 15 Cb -0.04 -0.25 -0.00 0.00 2.00 0.00 0.00 35.95 37.66 2gby h PHE 15 CO -0.06 0.56 -0.07 0.82 -0.18 0.00 0.00 178.31 179.38 2gby h ILE 16 N 0.80 1.37 0.00 -0.55 2.04 -0.62 0.58 117.51 121.13 2gby h ILE 16 Ca 0.20 -1.23 -0.09 0.00 1.00 0.00 0.00 64.86 64.74 2gby h ILE 16 Cb 0.04 2.04 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 2gby h ILE 16 CO -0.03 0.34 -0.44 0.50 0.00 0.00 0.00 178.15 178.52 2gby h LYS 17 N -0.27 0.00 0.00 2.37 3.64 -0.88 -3.36 116.57 118.06 2gby h LYS 17 Ca 0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2gby h LYS 17 Cb 0.58 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 2gby h LYS 17 CO 0.02 0.44 0.00 0.09 -2.27 0.00 0.00 179.45 177.72 2gby n ASN 18 N -3.92 0.44 0.00 4.20 3.02 -0.09 -5.10 115.26 113.82 2gby n ASN 18 Ca -0.01 -1.07 0.00 0.00 -0.03 0.00 0.00 54.58 53.47 2gby n ASN 18 Cb 0.47 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.64 2gby n ASN 18 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2gby n GLY 19 N -0.04 -1.39 0.41 7.41 0.00 0.20 -4.19 105.19 107.61 2gby n GLY 19 Ca 0.00 -1.58 -0.16 0.00 0.00 0.00 0.00 46.02 44.28 2gby n GLY 19 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2gby h TYR 20 N 0.00 -0.99 -0.58 1.61 3.20 -1.81 -2.89 116.97 115.51 2gby h TYR 20 Ca 0.00 -0.02 0.09 0.00 3.14 0.00 0.00 58.73 61.94 2gby h TYR 20 Cb 0.00 0.33 -0.07 0.00 1.54 0.00 0.00 36.73 38.53 2gby h TYR 20 CO 0.00 -0.60 0.20 -0.91 -1.64 0.00 0.00 178.16 175.21 2gby h ASN 21 N -1.03 0.19 0.28 -2.11 2.35 -1.93 -2.58 115.58 110.74 2gby h ASN 21 Ca -0.10 0.08 -0.07 0.00 -0.55 0.00 0.00 56.30 55.65 2gby h ASN 21 Cb 0.79 0.07 -0.01 0.00 0.05 0.00 0.00 38.32 39.22 2gby h ASN 21 CO 0.15 0.12 -0.32 0.00 -1.65 0.00 0.00 177.43 175.73 2gby h ALA 22 N 1.40 1.40 -2.48 -0.83 0.00 -1.73 -3.43 119.26 113.59 2gby h ALA 22 Ca 0.29 -0.31 -0.53 0.00 0.00 0.00 0.00 54.91 54.35 2gby h ALA 22 Cb 0.36 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.09 2gby h ALA 22 CO -0.30 0.44 0.70 0.99 0.00 0.00 0.00 179.25 181.08 2gby s THR 23 N -4.31 3.64 0.03 0.00 2.01 -0.98 -5.03 115.64 111.01 2gby s THR 23 Ca -0.04 1.15 0.04 0.00 0.31 0.00 0.00 61.69 63.15 2gby s THR 23 Cb 0.15 -3.74 -0.04 0.00 0.01 0.00 0.00 72.50 68.88 2gby s THR 23 CO 0.73 0.07 -0.05 0.42 -0.69 0.00 0.00 174.62 175.10 2gby s THR 24 N 1.41 3.75 0.46 -0.82 -4.23 -1.26 -4.98 115.64 109.97 2gby s THR 24 Ca 0.62 -0.85 0.40 0.00 -1.18 0.00 0.00 61.69 60.68 2gby s THR 24 Cb -0.33 -2.68 0.42 0.00 1.34 0.00 0.00 72.50 71.25 2gby s THR 24 CO 0.29 0.30 2.22 0.71 -0.54 0.00 0.00 174.62 177.61 2gby h THR 25 N 3.49 0.04 0.03 3.99 1.35 -1.98 -0.61 112.91 119.23 2gby h THR 25 Ca -0.48 -0.21 -0.00 0.00 -0.55 0.00 0.00 66.41 65.17 2gby h THR 25 Cb 1.17 1.20 0.00 0.00 -1.73 0.00 0.00 68.15 68.78 2gby h THR 25 CO 0.55 0.01 -0.01 1.23 -0.25 0.00 0.00 175.52 177.04 2gby h GLY 26 N 0.75 -0.04 0.86 5.82 0.00 -1.98 0.62 103.07 109.10 2gby h GLY 26 Ca -0.00 0.01 0.01 0.00 0.00 0.00 0.00 47.33 47.35 2gby h GLY 26 CO 0.00 -0.01 -0.10 0.83 0.00 0.00 0.00 176.54 177.26 2gby h GLU 27 N -0.18 -0.21 -0.94 4.80 5.08 -1.55 -1.20 114.58 120.38 2gby h GLU 27 Ca -0.00 0.01 0.12 0.00 -1.00 0.00 0.00 59.36 58.49 2gby h GLU 27 Cb 0.17 0.05 -0.08 0.00 0.50 0.00 0.00 28.75 29.39 2gby h GLU 27 CO 0.01 -0.14 0.57 0.82 -1.00 0.00 0.00 179.01 179.26 2gby h ILE 28 N -0.22 0.89 0.82 3.13 2.04 -1.12 0.80 117.51 123.85 2gby h ILE 28 Ca 0.01 -0.31 -0.04 0.00 1.00 0.00 0.00 64.86 65.52 2gby h ILE 28 Cb 0.22 -0.08 0.01 0.00 -0.74 0.00 0.00 36.82 36.22 2gby h ILE 28 CO -0.04 0.16 -0.39 0.58 0.00 0.00 0.00 178.15 178.46 2gby h VAL 29 N 0.90 0.00 -0.54 1.67 2.07 0.11 -2.52 116.25 117.94 2gby h VAL 29 Ca 0.47 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.96 2gby h VAL 29 Cb 0.47 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.22 2gby h VAL 29 CO -0.27 0.00 0.35 0.50 0.02 0.00 0.00 177.57 178.16 2gby h LYS 30 N -1.12 0.71 0.00 1.57 1.63 -0.89 -1.76 116.57 116.71 2gby h LYS 30 Ca -0.11 -0.05 -0.02 0.00 -0.85 0.00 0.00 60.65 59.61 2gby h LYS 30 Cb 0.84 -0.16 -0.00 0.00 -0.60 0.00 0.00 32.23 32.31 2gby h LYS 30 CO 0.18 0.49 -0.12 -0.07 -3.45 0.00 0.00 179.45 176.48 2gby h LEU 31 N 0.72 0.00 -3.09 5.20 3.38 -0.90 -1.22 115.31 119.40 2gby h LEU 31 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2gby h LEU 31 Cb -0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2gby h LEU 31 CO -0.04 0.12 0.00 -1.54 0.09 0.00 0.00 178.44 177.06 2gby n SER 32 N -3.74 4.52 -4.01 -0.43 3.41 -0.95 -4.94 113.62 107.48 2gby n SER 32 Ca -0.02 -2.41 -0.29 0.00 -0.26 0.00 0.00 58.87 55.90 2gby n SER 32 Cb 0.22 -0.54 -0.02 0.00 -0.26 0.00 0.00 64.21 63.61 2gby n SER 32 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2gby n GLU 33 N 1.04 -3.55 0.00 4.33 1.02 -0.46 -4.81 120.64 118.21 2gby n GLU 33 Ca 0.24 0.42 0.00 0.00 -0.02 0.00 0.00 57.16 57.81 2gby n GLU 33 Cb 0.83 -4.81 0.00 0.00 -0.02 0.00 0.00 31.44 27.45 2gby n GLU 33 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2gby n SER 34 N -2.88 0.00 -3.80 1.62 2.88 -0.69 -5.04 113.62 105.70 2gby n SER 34 Ca -0.17 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.28 2gby n SER 34 Cb 0.62 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 64.01 2gby n SER 34 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2gby s SER 35 N 0.47 0.00 0.21 -3.46 1.04 -1.26 -4.73 113.70 105.97 2gby s SER 35 Ca 0.00 -0.58 -0.10 0.00 0.48 0.00 0.00 55.95 55.75 2gby s SER 35 Cb 0.00 0.39 0.19 0.00 0.10 0.00 0.00 66.02 66.70 2gby s SER 35 CO 0.00 -0.79 1.85 0.11 0.98 0.00 0.00 173.24 175.39 2gby h LYS 36 N 2.61 0.84 -0.18 4.02 1.57 -1.94 -1.27 116.57 122.22 2gby h LYS 36 Ca -0.34 -0.05 0.03 0.00 -1.87 0.00 0.00 60.65 58.43 2gby h LYS 36 Cb 1.22 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 33.31 2gby h LYS 36 CO 0.52 0.55 -0.03 0.78 -0.57 0.00 0.00 179.45 180.71 2gby h GLY 37 N 0.86 0.15 0.95 3.86 0.00 -1.99 0.14 103.07 107.05 2gby h GLY 37 Ca 0.28 0.04 0.01 0.00 0.00 0.00 0.00 47.33 47.66 2gby h GLY 37 CO -0.10 -0.05 0.25 -0.57 0.00 0.00 0.00 176.54 176.06 2gby h ASN 38 N 0.02 0.42 -0.55 0.19 -0.00 -1.87 0.16 115.58 113.96 2gby h ASN 38 Ca 0.08 -0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.38 2gby h ASN 38 Cb 0.12 -0.10 -0.03 0.00 -0.00 0.00 0.00 38.32 38.32 2gby h ASN 38 CO -0.17 0.30 0.36 0.25 -0.00 0.00 0.00 177.43 178.18 2gby h LEU 39 N 0.51 0.63 -0.07 0.34 6.46 -0.81 -1.61 115.31 120.76 2gby h LEU 39 Ca 0.15 -0.02 0.00 0.00 -0.12 0.00 0.00 57.88 57.89 2gby h LEU 39 Cb -0.03 -0.16 -0.00 0.00 -0.73 0.00 0.00 40.66 39.74 2gby h LEU 39 CO -0.05 0.47 0.04 0.22 -0.62 0.00 0.00 178.44 178.49 2gby h TYR 40 N 0.74 0.07 -0.60 1.25 3.20 -0.23 0.20 116.97 121.61 2gby h TYR 40 Ca 0.20 0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.15 2gby h TYR 40 Cb -0.08 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.13 2gby h TYR 40 CO -0.03 0.04 0.40 -0.92 -1.64 0.00 0.00 178.16 176.01 2gby h TYR 41 N 0.08 0.52 0.08 -3.82 3.20 -0.72 0.50 116.97 116.81 2gby h TYR 41 Ca 0.03 0.01 -0.33 0.00 3.14 0.00 0.00 58.73 61.58 2gby h TYR 41 Cb -0.00 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.07 2gby h TYR 41 CO -0.08 0.27 -1.80 0.45 -1.64 0.00 0.00 178.16 175.35 2gby h HIS 42 N 0.51 0.31 0.00 -3.82 3.86 -0.92 -3.43 115.15 111.65 2gby h HIS 42 Ca 0.27 -0.22 0.00 0.00 -1.16 0.00 0.00 60.37 59.25 2gby h HIS 42 Cb 0.39 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.84 2gby h HIS 42 CO -0.00 1.43 -0.13 1.19 0.86 0.00 0.00 177.93 181.28 2gby n PHE 43 N -3.32 0.00 0.00 2.45 3.01 0.67 -5.01 117.46 115.26 2gby n PHE 43 Ca -0.23 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.23 2gby n PHE 43 Cb 1.05 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.52 2gby n PHE 43 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 2gby n LYS 44 N -0.55 0.00 -4.08 -1.08 4.01 0.17 -4.33 118.16 112.31 2gby n LYS 44 Ca 0.00 0.00 -0.09 0.00 -0.51 0.00 0.00 58.31 57.71 2gby n LYS 44 Cb 0.00 0.00 -0.09 0.00 -0.51 0.00 0.00 35.03 34.43 2gby n LYS 44 CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 2gby s THR 45 N 0.00 0.11 0.23 -0.18 -4.23 -1.26 -4.76 115.64 105.54 2gby s THR 45 Ca 0.00 -1.73 -0.08 0.00 -1.18 0.00 0.00 61.69 58.70 2gby s THR 45 Cb 0.00 -1.90 0.21 0.00 1.34 0.00 0.00 72.50 72.15 2gby s THR 45 CO 0.00 -0.49 1.88 0.50 -0.54 0.00 0.00 174.62 175.97 2gby h LYS 46 N 2.81 1.20 -0.64 3.99 3.64 -1.98 0.94 116.57 126.53 2gby h LYS 46 Ca -0.34 -0.10 0.07 0.00 -1.27 0.00 0.00 60.65 59.00 2gby h LYS 46 Cb 1.20 -0.25 -0.06 0.00 -0.41 0.00 0.00 32.23 32.71 2gby h LYS 46 CO 0.57 0.84 0.34 0.93 -2.27 0.00 0.00 179.45 179.85 2gby h GLU 47 N 1.22 0.59 -0.26 1.90 3.07 -1.96 0.18 114.58 119.33 2gby h GLU 47 Ca 0.32 -0.04 -0.17 0.00 -0.50 0.00 0.00 59.36 58.98 2gby h GLU 47 Cb -0.06 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 27.71 2gby h GLU 47 CO -0.06 0.39 -0.50 -0.97 -1.40 0.00 0.00 179.01 176.48 2gby h ASN 48 N 0.61 0.89 -0.31 1.42 -1.24 -1.61 -1.84 115.58 113.50 2gby h ASN 48 Ca 0.30 -0.54 0.06 0.00 0.71 0.00 0.00 56.30 56.83 2gby h ASN 48 Cb 0.23 -0.26 -0.05 0.00 0.73 0.00 0.00 38.32 38.97 2gby h ASN 48 CO -0.21 1.26 -0.03 0.25 -1.29 0.00 0.00 177.43 177.41 2gby h LEU 49 N 0.56 -0.18 -1.21 0.34 6.46 -0.05 -1.21 115.31 120.01 2gby h LEU 49 Ca 0.01 0.08 0.00 0.00 -0.12 0.00 0.00 57.88 57.85 2gby h LEU 49 Cb 1.10 0.15 -0.04 0.00 -0.73 0.00 0.00 40.66 41.14 2gby h LEU 49 CO 0.11 -0.06 0.48 0.15 -0.62 0.00 0.00 178.44 178.51 2gby h PHE 50 N 0.06 0.97 -0.26 1.25 3.04 -0.53 -1.99 116.94 119.48 2gby h PHE 50 Ca 0.15 0.01 -0.07 0.00 3.98 0.00 0.00 57.97 62.04 2gby h PHE 50 Cb 0.21 -0.33 -0.01 0.00 2.56 0.00 0.00 35.95 38.38 2gby h PHE 50 CO -0.25 0.63 -0.13 -0.07 -2.02 0.00 0.00 178.31 176.47 2gby h LEU 51 N 1.04 0.42 -0.59 0.59 3.38 -0.42 -1.45 115.31 118.28 2gby h LEU 51 Ca 0.28 -0.11 -0.15 0.00 0.09 0.00 0.00 57.88 57.99 2gby h LEU 51 Cb -0.08 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 2gby h LEU 51 CO -0.06 0.58 -0.62 -0.33 0.09 0.00 0.00 178.44 178.11 2gby h GLU 52 N 0.40 0.32 -0.13 1.13 4.39 -0.60 -1.05 114.58 119.05 2gby h GLU 52 Ca 0.08 -0.23 -0.02 0.00 0.34 0.00 0.00 59.36 59.53 2gby h GLU 52 Cb 0.48 0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.16 2gby h GLU 52 CO 0.03 0.84 0.00 0.82 -1.16 0.00 0.00 179.01 179.54 2gby h ILE 53 N 0.24 1.25 -0.58 3.13 2.04 -0.98 -1.11 117.51 121.50 2gby h ILE 53 Ca -0.01 -0.79 0.09 0.00 1.00 0.00 0.00 64.86 65.15 2gby h ILE 53 Cb 1.14 1.52 -0.03 0.00 -0.74 0.00 0.00 36.82 38.70 2gby h ILE 53 CO 0.10 0.23 0.39 -0.07 0.00 0.00 0.00 178.15 178.80 2gby h LEU 54 N -0.03 0.37 0.03 1.44 4.07 -1.14 0.25 115.31 120.30 2gby h LEU 54 Ca 0.04 0.01 -0.00 0.00 0.08 0.00 0.00 57.88 58.00 2gby h LEU 54 Cb 0.35 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.02 2gby h LEU 54 CO 0.01 0.23 -0.01 -1.13 -1.08 0.00 0.00 178.44 176.45 2gby h ASN 55 N 0.42 -0.03 -0.39 -0.43 -1.24 -0.79 0.94 115.58 114.06 2gby h ASN 55 Ca 0.27 -0.34 0.00 0.00 0.71 0.00 0.00 56.30 56.94 2gby h ASN 55 Cb 0.50 0.01 -0.02 0.00 0.73 0.00 0.00 38.32 39.54 2gby h ASN 55 CO -0.07 0.32 0.25 0.40 -1.29 0.00 0.00 177.43 177.04 2gby h ILE 56 N -0.39 1.11 -0.71 2.57 2.04 0.06 -1.16 117.51 121.03 2gby h ILE 56 Ca -0.00 -0.21 0.05 0.00 1.00 0.00 0.00 64.86 65.70 2gby h ILE 56 Cb 0.37 0.55 -0.05 0.00 -0.74 0.00 0.00 36.82 36.95 2gby h ILE 56 CO 0.01 0.11 0.42 -0.33 0.00 0.00 0.00 178.15 178.35 2gby h GLU 57 N 0.52 0.76 -0.64 2.37 4.39 -0.48 -1.04 114.58 120.47 2gby h GLU 57 Ca 0.14 -0.05 0.08 0.00 0.34 0.00 0.00 59.36 59.88 2gby h GLU 57 Cb -0.04 -0.17 -0.06 0.00 -0.10 0.00 0.00 28.75 28.37 2gby h GLU 57 CO -0.03 0.50 0.30 1.49 -1.16 0.00 0.00 179.01 180.11 2gby h GLU 58 N 0.78 0.52 -0.22 2.33 4.57 0.03 -0.84 114.58 121.74 2gby h GLU 58 Ca 0.31 -0.03 -0.00 0.00 -1.18 0.00 0.00 59.36 58.46 2gby h GLU 58 Cb 0.15 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.61 2gby h GLU 58 CO -0.16 0.35 0.13 0.77 -1.18 0.00 0.00 179.01 178.92 2gby h SER 59 N 0.54 0.26 -0.66 1.04 0.02 -0.04 -1.81 113.55 112.90 2gby h SER 59 Ca 0.31 -0.05 0.04 0.00 -0.84 0.00 0.00 61.79 61.26 2gby h SER 59 Cb 0.30 -0.07 -0.05 0.00 0.14 0.00 0.00 62.40 62.73 2gby h SER 59 CO -0.25 0.23 0.38 0.11 -1.14 0.00 0.00 176.83 176.17 2gby h LYS 60 N 0.27 0.71 -0.86 3.45 1.57 -0.76 0.59 116.57 121.55 2gby h LYS 60 Ca 0.08 -0.04 0.03 0.00 -1.87 0.00 0.00 60.65 58.85 2gby h LYS 60 Cb 0.02 -0.16 -0.05 0.00 0.08 0.00 0.00 32.23 32.12 2gby h LYS 60 CO -0.02 0.47 0.55 2.35 -0.57 0.00 0.00 179.45 182.24 2gby h TRP 61 N 0.73 1.04 0.02 -1.35 2.91 -0.81 0.19 115.95 118.68 2gby h TRP 61 Ca 0.28 0.03 -0.00 0.00 1.13 0.00 0.00 58.89 60.33 2gby h TRP 61 Cb 0.11 -0.35 0.00 0.00 -0.51 0.00 0.00 29.16 28.41 2gby h TRP 61 CO -0.06 0.61 -0.01 1.96 -1.03 0.00 0.00 178.44 179.90 2gby h GLN 62 N 1.08 -0.03 -0.75 2.65 4.20 -0.43 -0.53 115.11 121.31 2gby h GLN 62 Ca 0.34 0.00 0.15 0.00 0.06 0.00 0.00 58.65 59.20 2gby h GLN 62 Cb -0.01 0.01 -0.10 0.00 0.30 0.00 0.00 27.48 27.68 2gby h GLN 62 CO -0.11 0.23 0.26 1.49 -0.67 0.00 0.00 178.83 180.02 2gby h GLU 63 N -0.28 0.37 0.75 1.46 4.22 -0.29 0.12 114.58 120.92 2gby h GLU 63 Ca -0.00 -0.02 -0.04 0.00 0.08 0.00 0.00 59.36 59.38 2gby h GLU 63 Cb 0.27 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 29.44 2gby h GLU 63 CO 0.01 0.24 -0.37 1.96 -2.18 0.00 0.00 179.01 178.66 2gby h GLN 64 N 0.38 -0.98 -0.93 1.92 4.20 -0.41 -2.98 115.11 116.30 2gby h GLN 64 Ca 0.42 0.07 0.19 0.00 0.06 0.00 0.00 58.65 59.38 2gby h GLN 64 Cb 0.67 0.22 -0.11 0.00 0.30 0.00 0.00 27.48 28.56 2gby h GLN 64 CO -0.44 -0.66 0.50 2.35 -0.67 0.00 0.00 178.83 179.92 2gby h TRP 65 N -1.02 0.87 -0.91 2.96 -0.00 -0.04 0.95 115.95 118.76 2gby h TRP 65 Ca -0.10 0.04 0.07 0.00 -0.00 0.00 0.00 58.89 58.89 2gby h TRP 65 Cb 0.79 -0.24 -0.06 0.00 -0.00 0.00 0.00 29.16 29.65 2gby h TRP 65 CO -0.03 0.13 0.59 -0.22 -0.00 0.00 0.00 178.44 178.91 2gby h LYS 66 N 0.62 1.00 0.00 2.65 3.64 -0.66 0.22 116.57 124.04 2gby h LYS 66 Ca 0.55 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.87 2gby h LYS 66 Cb 0.90 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.49 2gby h LYS 66 CO -0.42 0.66 -1.01 0.36 -2.27 0.00 0.00 179.45 176.77 2gby n LYS 67 N -4.49 0.26 0.00 1.90 2.85 -0.32 -4.16 118.16 114.20 2gby n LYS 67 Ca 0.14 -0.01 -0.09 0.00 -1.05 0.00 0.00 58.31 57.31 2gby n LYS 67 Cb 0.21 -1.58 -0.14 0.00 -0.65 0.00 0.00 35.03 32.87 2gby n LYS 67 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 177.40 178.84 2gby h GLU 68 N 0.00 0.02 0.00 -1.58 4.57 -0.08 -3.35 114.58 114.16 2gby h GLU 68 Ca 0.00 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.15 2gby h GLU 68 Cb 0.71 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.31 2gby h GLU 68 CO 0.00 0.66 0.00 0.00 -1.18 0.00 0.00 179.01 178.49 2gby n GLN 69 N -3.15 0.62 0.22 1.92 10.64 0.71 -2.66 117.38 125.67 2gby n GLN 69 Ca -0.13 0.00 0.14 0.00 -1.83 0.00 0.00 57.00 55.19 2gby n GLN 69 Cb 1.02 -1.47 0.48 0.00 -0.86 0.00 0.00 30.24 29.41 2gby n GLN 69 CO 0.00 0.00 0.00 0.82 -1.83 0.00 0.00 177.06 176.05 2gby h ILE 70 N 0.00 0.00 0.00 -0.39 2.04 -1.79 -2.42 117.51 114.95 2gby h ILE 70 Ca 0.00 -0.60 0.00 0.00 1.00 0.00 0.00 64.86 65.26 2gby h ILE 70 Cb 0.00 1.55 0.00 0.00 -0.74 0.00 0.00 36.82 37.63 2gby h ILE 70 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 178.15 178.44 2gby n LYS 71 N -2.85 0.07 -3.90 2.37 5.02 -1.09 -4.45 118.16 113.34 2gby n LYS 71 Ca 0.02 0.01 -0.32 0.00 -2.02 0.00 0.00 58.31 56.00 2gby n LYS 71 Cb 0.37 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 33.75 2gby n LYS 71 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2gby s ALA 72 N -2.93 3.26 0.16 7.82 0.00 -0.91 -4.99 121.76 124.17 2gby s ALA 72 Ca 0.16 -3.04 -0.16 0.00 0.00 0.00 0.00 51.96 48.92 2gby s ALA 72 Cb 0.19 -2.25 0.09 0.00 0.00 0.00 0.00 23.12 21.14 2gby s ALA 72 CO 0.51 -1.94 1.70 -0.22 0.00 0.00 0.00 175.76 175.81 2gby h LYS 73 N 7.00 0.09 -6.15 0.00 3.64 -1.80 -3.42 116.57 115.94 2gby h LYS 73 Ca -0.06 -0.01 -0.60 0.00 -1.27 0.00 0.00 60.65 58.71 2gby h LYS 73 Cb 0.95 -0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 32.68 2gby h LYS 73 CO 0.66 0.06 -0.56 0.95 -2.27 0.00 0.00 179.45 178.29 2gby s THR 74 N -6.18 4.68 0.51 1.00 -4.23 -1.26 -5.02 115.64 105.14 2gby s THR 74 Ca -0.13 -0.86 0.18 0.00 -1.18 0.00 0.00 61.69 59.70 2gby s THR 74 Cb 0.13 -3.33 0.31 0.00 1.34 0.00 0.00 72.50 70.95 2gby s THR 74 CO 0.71 0.00 2.08 0.78 -0.54 0.00 0.00 174.62 177.65 2gby h ASN 75 N 2.77 0.08 -0.28 3.99 2.35 -1.91 -0.63 115.58 121.94 2gby h ASN 75 Ca -0.47 -0.00 0.04 0.00 -0.55 0.00 0.00 56.30 55.32 2gby h ASN 75 Cb 1.18 -0.02 -0.04 0.00 0.05 0.00 0.00 38.32 39.49 2gby h ASN 75 CO 0.66 0.05 0.03 -0.09 -1.65 0.00 0.00 177.43 176.43 2gby h ARG 76 N 0.09 0.12 -0.65 0.81 2.43 -1.95 0.12 114.38 115.35 2gby h ARG 76 Ca 0.11 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.21 2gby h ARG 76 Cb 0.32 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.82 2gby h ARG 76 CO -0.01 0.08 0.16 0.93 -1.51 0.00 0.00 179.97 179.61 2gby h GLU 77 N 0.12 1.01 -0.34 0.20 5.08 -1.51 -1.85 114.58 117.29 2gby h GLU 77 Ca 0.13 -0.23 -0.02 0.00 -1.00 0.00 0.00 59.36 58.24 2gby h GLU 77 Cb 0.16 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 2gby h GLU 77 CO -0.20 0.90 0.12 0.87 -1.00 0.00 0.00 179.01 179.70 2gby h LYS 78 N 0.97 0.48 0.18 2.33 1.57 -0.26 0.22 116.57 122.06 2gby h LYS 78 Ca 0.21 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.92 2gby h LYS 78 Cb 0.34 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.56 2gby h LYS 78 CO 0.00 0.41 -0.09 0.35 -0.57 0.00 0.00 179.45 179.55 2gby h PHE 79 N 0.48 -0.23 -0.06 -1.35 3.57 -0.01 -0.07 116.94 119.27 2gby h PHE 79 Ca 0.12 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.64 2gby h PHE 79 Cb 0.12 0.08 -0.04 0.00 2.79 0.00 0.00 35.95 38.90 2gby h PHE 79 CO 0.00 0.04 -0.16 1.88 -2.23 0.00 0.00 178.31 177.85 2gby h TYR 80 N -0.48 -0.40 -0.25 0.41 0.05 -0.89 -2.41 116.97 112.98 2gby h TYR 80 Ca -0.03 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.76 2gby h TYR 80 Cb 0.37 0.19 -0.01 0.00 1.01 0.00 0.00 36.73 38.29 2gby h TYR 80 CO 0.00 -0.23 0.10 1.25 -1.05 0.00 0.00 178.16 178.24 2gby h LEU 81 N -0.23 0.35 -0.91 3.88 5.85 -0.55 -1.96 115.31 121.74 2gby h LEU 81 Ca 0.07 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.63 2gby h LEU 81 Cb 0.33 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.22 2gby h LEU 81 CO -0.19 0.42 0.58 0.22 -0.34 0.00 0.00 178.44 179.13 2gby h TYR 82 N 0.26 1.16 -0.38 1.25 3.20 -0.96 0.18 116.97 121.67 2gby h TYR 82 Ca 0.08 0.02 -0.14 0.00 3.14 0.00 0.00 58.73 61.83 2gby h TYR 82 Cb 0.18 -0.39 -0.01 0.00 1.54 0.00 0.00 36.73 38.05 2gby h TYR 82 CO -0.01 0.74 -0.33 -0.91 -1.64 0.00 0.00 178.16 176.01 2gby h ASN 83 N 1.24 0.91 -0.40 -2.11 -0.26 -1.35 -1.32 115.58 112.29 2gby h ASN 83 Ca 0.33 -0.39 -0.11 0.00 -0.56 0.00 0.00 56.30 55.57 2gby h ASN 83 Cb -0.11 -0.25 -0.01 0.00 -1.06 0.00 0.00 38.32 36.88 2gby h ASN 83 CO -0.07 1.16 -0.18 -0.08 -1.06 0.00 0.00 177.43 177.20 2gby h GLU 84 N 0.72 0.83 -0.85 0.81 4.81 -0.89 -2.46 114.58 117.56 2gby h GLU 84 Ca 0.07 -0.36 0.01 0.00 -0.13 0.00 0.00 59.36 58.95 2gby h GLU 84 Cb 0.90 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 30.21 2gby h GLU 84 CO 0.08 0.99 0.55 -0.07 -0.73 0.00 0.00 179.01 179.83 2gby h LEU 85 N 0.64 0.98 -1.16 1.64 4.07 -0.49 0.11 115.31 121.10 2gby h LEU 85 Ca 0.09 -0.03 -0.07 0.00 0.08 0.00 0.00 57.88 57.95 2gby h LEU 85 Cb 0.74 -0.25 -0.01 0.00 1.08 0.00 0.00 40.66 42.21 2gby h LEU 85 CO 0.06 0.72 -0.13 0.28 -1.08 0.00 0.00 178.44 178.29 2gby h SER 86 N 1.16 0.42 0.08 -0.43 0.02 -1.04 0.32 113.55 114.08 2gby h SER 86 Ca 0.31 -0.10 -0.15 0.00 -0.84 0.00 0.00 61.79 61.01 2gby h SER 86 Cb -0.12 -0.11 0.02 0.00 0.14 0.00 0.00 62.40 62.33 2gby h SER 86 CO -0.07 0.58 -0.63 0.25 -1.14 0.00 0.00 176.83 175.83 2gby h LEU 87 N 0.41 0.41 0.03 5.07 6.46 -0.86 -3.14 115.31 123.68 2gby h LEU 87 Ca 0.08 -0.90 -0.00 0.00 -0.12 0.00 0.00 57.88 56.93 2gby h LEU 87 Cb 0.47 -0.13 0.00 0.00 -0.73 0.00 0.00 40.66 40.27 2gby h LEU 87 CO 0.03 1.27 -0.01 0.71 -0.62 0.00 0.00 178.44 179.82 2gby h THR 88 N -0.40 1.39 -0.58 1.05 1.35 -0.93 -3.04 112.91 111.75 2gby h THR 88 Ca -0.10 -1.45 0.06 0.00 -0.55 0.00 0.00 66.41 64.37 2gby h THR 88 Cb 1.44 2.34 -0.03 0.00 -1.73 0.00 0.00 68.15 70.17 2gby h THR 88 CO 0.12 0.36 0.39 0.71 -0.25 0.00 0.00 175.52 176.85 2gby h THR 89 N -0.69 0.99 0.00 6.82 1.35 -1.10 -0.81 112.91 119.46 2gby h THR 89 Ca -0.00 -0.19 -0.01 0.00 -0.55 0.00 0.00 66.41 65.66 2gby h THR 89 Cb 0.62 0.40 -0.00 0.00 -1.73 0.00 0.00 68.15 67.44 2gby h THR 89 CO 0.01 0.10 -0.06 1.05 -0.25 0.00 0.00 175.52 176.36 2gby h GLU 90 N 0.54 0.00 -0.38 4.72 -0.00 -1.60 -2.95 114.58 114.92 2gby h GLU 90 Ca 0.25 0.00 0.08 0.00 -0.00 0.00 0.00 59.36 59.70 2gby h GLU 90 Cb 0.30 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 29.03 2gby h GLU 90 CO -0.07 0.06 0.26 -0.92 -0.00 0.00 0.00 179.01 178.34 2gby h TYR 91 N 0.00 0.14 -0.44 2.06 3.20 -1.02 -2.61 116.97 118.30 2gby h TYR 91 Ca -0.00 0.00 -0.33 0.00 3.14 0.00 0.00 58.73 61.55 2gby h TYR 91 Cb 0.85 -0.04 -0.33 0.00 1.54 0.00 0.00 36.73 38.75 2gby h TYR 91 CO 0.00 0.07 -0.85 2.48 -1.64 0.00 0.00 178.16 178.22 2gby n TYR 92 N -4.46 1.54 -3.12 -3.82 0.18 -1.16 -5.01 117.16 101.32 2gby n TYR 92 Ca 0.05 -1.87 -0.41 0.00 1.88 0.00 0.00 57.90 57.55 2gby n TYR 92 Cb 0.36 -0.27 -0.07 0.00 -0.38 0.00 0.00 39.34 38.98 2gby n TYR 92 CO 0.00 0.00 0.00 -0.47 -2.08 0.00 0.00 176.86 174.31 2gby s TYR 93 N -3.19 3.19 0.38 -3.48 6.04 -0.99 -4.95 117.35 114.34 2gby s TYR 93 Ca 0.41 0.48 0.08 0.00 0.04 0.00 0.00 57.07 58.07 2gby s TYR 93 Cb 0.38 -3.05 0.75 0.00 -1.04 0.00 0.00 41.96 39.00 2gby s TYR 93 CO -0.02 -0.54 1.92 -1.35 -1.54 0.00 0.00 175.55 174.02 2gby h PRO 94 N 8.30 0.36 0.00 4.97 0.11 -1.92 -2.88 132.00 140.94 2gby h PRO 94 Ca -0.27 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2gby h PRO 94 Cb 1.12 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2gby h PRO 94 CO 0.81 0.42 0.00 1.28 -0.21 0.00 0.00 178.00 180.30 2gby n LEU 95 N -4.31 0.75 -0.27 2.35 4.77 -1.26 -4.02 117.00 115.02 2gby n LEU 95 Ca 0.00 0.59 0.09 0.00 -0.03 0.00 0.00 56.01 56.66 2gby n LEU 95 Cb 0.23 -0.38 0.22 0.00 -2.33 0.00 0.00 43.42 41.16 2gby n LEU 95 CO 0.38 -0.26 0.91 -0.61 -1.33 0.00 0.00 177.39 176.48 2gby h GLN 96 N 0.00 0.20 -0.42 3.23 5.75 -1.88 -0.86 115.11 121.12 2gby h GLN 96 Ca 0.00 -0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.47 2gby h GLN 96 Cb 0.64 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 29.13 2gby h GLN 96 CO 0.00 0.13 0.20 -0.91 -2.65 0.00 0.00 178.83 175.60 2gby h ASN 97 N 0.21 0.56 0.09 -0.69 2.35 -1.81 -0.72 115.58 115.58 2gby h ASN 97 Ca 0.47 -0.14 -0.05 0.00 -0.55 0.00 0.00 56.30 56.04 2gby h ASN 97 Cb 0.88 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 39.10 2gby h ASN 97 CO -0.61 0.54 -0.17 0.00 -1.65 0.00 0.00 177.43 175.54 2gby h ALA 98 N 1.04 1.51 0.07 -0.83 0.00 -1.53 -1.02 119.26 118.51 2gby h ALA 98 Ca 0.15 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2gby h ALA 98 Cb 0.13 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2gby h ALA 98 CO -0.02 0.35 -0.03 0.82 0.00 0.00 0.00 179.25 180.37 2gby h ILE 99 N 0.16 1.13 -0.26 0.00 2.04 -0.65 0.13 117.51 120.06 2gby h ILE 99 Ca 0.03 -0.73 0.06 0.00 1.00 0.00 0.00 64.86 65.22 2gby h ILE 99 Cb 0.41 1.61 -0.08 0.00 -0.74 0.00 0.00 36.82 38.02 2gby h ILE 99 CO 0.03 0.18 -0.40 0.40 0.00 0.00 0.00 178.15 178.36 2gby h ILE 100 N -0.43 0.16 -0.78 -0.67 1.08 -0.70 0.28 117.51 116.46 2gby h ILE 100 Ca -0.01 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.60 2gby h ILE 100 Cb 0.37 0.16 -0.09 0.00 -3.07 0.00 0.00 36.82 34.19 2gby h ILE 100 CO 0.02 0.00 0.34 -0.08 -0.69 0.00 0.00 178.15 177.74 2gby h GLU 101 N -0.39 0.48 -0.09 2.37 4.81 -1.07 -0.86 114.58 119.83 2gby h GLU 101 Ca 0.11 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.29 2gby h GLU 101 Cb 0.59 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.86 2gby h GLU 101 CO -0.47 0.32 -0.04 0.35 -0.73 0.00 0.00 179.01 178.44 2gby h PHE 102 N 0.50 0.20 0.67 0.92 3.04 0.97 -3.06 116.94 120.18 2gby h PHE 102 Ca 0.42 -0.05 -0.03 0.00 3.98 0.00 0.00 57.97 62.30 2gby h PHE 102 Cb 0.63 -0.05 -0.01 0.00 2.56 0.00 0.00 35.95 39.08 2gby h PHE 102 CO -0.14 0.53 -0.46 -0.92 -2.02 0.00 0.00 178.31 175.30 2gby h TYR 103 N -0.18 -1.23 0.00 0.41 3.20 -0.14 -1.12 116.97 117.91 2gby h TYR 103 Ca 0.02 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.88 2gby h TYR 103 Cb 0.47 0.45 0.00 0.00 1.54 0.00 0.00 36.73 39.19 2gby h TYR 103 CO 0.06 -0.67 0.00 0.25 -1.64 0.00 0.00 178.16 176.16 2gby n THR 104 N -5.58 0.00 0.00 1.81 -2.24 -0.36 -1.94 114.28 105.97 2gby n THR 104 Ca -0.13 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 2gby n THR 104 Cb 0.46 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.43 2gby n THR 104 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2gby n GLU 105 N 0.23 2.39 -0.26 -0.78 0.00 -0.81 -4.81 120.64 116.60 2gby n GLU 105 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 57.16 57.24 2gby n GLU 105 Cb 0.13 -0.75 0.13 0.00 0.00 0.00 0.00 31.44 30.95 2gby n GLU 105 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 2gby n TYR 106 N -1.07 0.00 0.57 4.31 4.01 -0.49 -4.64 117.16 119.85 2gby n TYR 106 Ca 0.00 -0.95 0.07 0.00 -0.16 0.00 0.00 57.90 56.87 2gby n TYR 106 Cb 0.16 -0.16 0.21 0.00 -0.31 0.00 0.00 39.34 39.24 2gby n TYR 106 CO 0.00 0.00 0.00 0.98 -0.46 0.00 0.00 176.86 177.38 2gby n TYR 107 N -1.14 0.60 -0.09 -0.72 9.36 -0.82 -3.55 117.16 120.79 2gby n TYR 107 Ca 0.14 -0.30 -0.10 0.00 3.32 0.00 0.00 57.90 60.97 2gby n TYR 107 Cb 0.67 0.00 -0.13 0.00 -0.63 0.00 0.00 39.34 39.25 2gby n TYR 107 CO 0.00 0.00 0.00 0.36 0.22 0.00 0.00 176.86 177.44 2gby n LYS 108 N 0.83 1.07 -3.34 2.98 2.85 -1.26 -4.90 118.16 116.39 2gby n LYS 108 Ca 0.15 0.01 -0.39 0.00 -1.05 0.00 0.00 58.31 57.03 2gby n LYS 108 Cb 0.38 -1.45 -0.08 0.00 -0.65 0.00 0.00 35.03 33.23 2gby n LYS 108 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 2gby s THR 109 N -2.43 5.14 -1.59 0.58 2.01 -1.23 -4.93 115.64 113.19 2gby s THR 109 Ca -0.11 0.69 0.21 0.00 0.31 0.00 0.00 61.69 62.79 2gby s THR 109 Cb 0.06 -3.75 0.44 0.00 0.01 0.00 0.00 72.50 69.26 2gby s THR 109 CO 0.69 0.15 1.67 -3.20 -0.69 0.00 0.00 174.62 173.24 2gby n ASN 110 N 5.27 0.00 0.10 3.53 2.85 -1.26 -2.27 115.26 123.48 2gby n ASN 110 Ca -0.07 -0.20 -0.04 0.00 -0.11 0.00 0.00 54.58 54.16 2gby n ASN 110 Cb 0.50 -0.20 -0.02 0.00 1.24 0.00 0.00 39.78 41.30 2gby n ASN 110 CO 0.00 0.00 0.00 -1.28 -2.11 0.00 0.00 177.26 173.87 2gby h SER 111 N 0.00 -0.23 0.55 1.20 0.87 -1.91 -2.35 113.55 111.68 2gby h SER 111 Ca 0.00 0.01 -0.14 0.00 -1.23 0.00 0.00 61.79 60.43 2gby h SER 111 Cb 0.14 0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.14 2gby h SER 111 CO 0.00 -0.15 -0.62 0.40 -0.53 0.00 0.00 176.83 175.93 2gby h ILE 112 N -0.30 1.43 -0.01 2.23 5.03 -1.84 -2.87 117.51 121.17 2gby h ILE 112 Ca -0.03 -2.10 0.00 0.00 -0.12 0.00 0.00 64.86 62.61 2gby h ILE 112 Cb 0.21 2.12 -0.00 0.00 -3.03 0.00 0.00 36.82 36.11 2gby h ILE 112 CO 0.05 0.61 0.03 -1.13 -0.68 0.00 0.00 178.15 177.02 2gby h ASN 113 N 0.05 0.00 0.30 1.72 -0.00 -1.51 -2.42 115.58 113.72 2gby h ASN 113 Ca -0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 56.30 56.28 2gby h ASN 113 Cb 1.11 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.44 2gby h ASN 113 CO 0.09 0.00 -0.14 -0.08 -0.00 0.00 0.00 177.43 177.29 2gby h GLU 114 N 0.00 -0.38 -0.06 6.67 4.22 -1.18 -3.27 114.58 120.58 2gby h GLU 114 Ca 0.00 0.03 0.02 0.00 0.08 0.00 0.00 59.36 59.49 2gby h GLU 114 Cb 0.06 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.39 2gby h GLU 114 CO -0.00 -0.25 0.11 0.87 -2.18 0.00 0.00 179.01 177.55 2gby h LYS 115 N -0.95 0.00 0.00 1.92 1.57 -1.63 -1.19 116.57 116.29 2gby h LYS 115 Ca -0.04 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.63 2gby h LYS 115 Cb 0.30 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 2gby h LYS 115 CO 0.07 0.00 -0.52 0.52 -0.57 0.00 0.00 179.45 178.94 2gby h MET 116 N 0.00 0.00 -0.02 3.15 2.86 -1.51 -2.74 114.93 116.66 2gby h MET 116 Ca 0.03 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.51 2gby h MET 116 Cb 0.24 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.89 2gby h MET 116 CO -0.00 0.52 -0.72 -0.91 1.06 0.00 0.00 176.91 176.86 2gby h ASN 117 N 0.00 0.16 -0.79 1.22 4.21 -1.27 0.89 115.58 120.01 2gby h ASN 117 Ca -0.01 -0.11 -0.00 0.00 1.21 0.00 0.00 56.30 57.39 2gby h ASN 117 Cb 0.94 -0.05 -0.04 0.00 -1.12 0.00 0.00 38.32 38.05 2gby h ASN 117 CO 0.07 0.83 0.49 0.11 -1.29 0.00 0.00 177.43 177.64 2gby h LYS 118 N 0.09 1.06 -0.03 0.81 6.56 -1.48 0.19 116.57 123.77 2gby h LYS 118 Ca -0.02 -0.08 -0.01 0.00 -1.06 0.00 0.00 60.65 59.48 2gby h LYS 118 Cb 1.28 -0.23 -0.00 0.00 -0.57 0.00 0.00 32.23 32.71 2gby h LYS 118 CO 0.10 0.73 -0.03 1.25 -2.06 0.00 0.00 179.45 179.45 2gby h LEU 119 N 1.09 0.08 -1.14 2.94 5.85 -1.20 -3.07 115.31 119.86 2gby h LEU 119 Ca 0.29 -0.47 0.00 0.00 0.84 0.00 0.00 57.88 58.54 2gby h LEU 119 Cb -0.07 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 2gby h LEU 119 CO -0.06 0.53 0.52 -0.33 -0.34 0.00 0.00 178.44 178.76 2gby h GLU 120 N -0.37 1.10 -0.90 1.25 5.08 -0.45 -1.53 114.58 118.75 2gby h GLU 120 Ca 0.01 -0.08 0.11 0.00 -1.00 0.00 0.00 59.36 58.40 2gby h GLU 120 Cb 0.51 -0.24 -0.08 0.00 0.50 0.00 0.00 28.75 29.44 2gby h GLU 120 CO 0.01 0.75 0.53 -0.91 -1.00 0.00 0.00 179.01 178.39 2gby h ASN 121 N 1.12 0.76 -0.89 1.42 -0.26 -0.59 0.79 115.58 117.94 2gby h ASN 121 Ca 0.30 0.05 0.02 0.00 -0.56 0.00 0.00 56.30 56.11 2gby h ASN 121 Cb -0.09 -0.09 -0.05 0.00 -1.06 0.00 0.00 38.32 37.03 2gby h ASN 121 CO -0.06 0.41 0.59 0.11 -1.06 0.00 0.00 177.43 177.41 2gby h LYS 122 N 0.85 1.13 0.00 0.81 1.57 -1.18 -0.43 116.57 119.32 2gby h LYS 122 Ca 0.45 -0.07 -0.10 0.00 -1.87 0.00 0.00 60.65 59.06 2gby h LYS 122 Cb 0.46 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 2gby h LYS 122 CO -0.27 0.75 -0.48 1.88 -0.57 0.00 0.00 179.45 180.76 2gby h TYR 123 N 1.16 0.00 0.00 -1.35 -1.99 -0.77 -2.82 116.97 111.21 2gby h TYR 123 Ca 0.33 0.00 -0.15 0.00 2.00 0.00 0.00 58.73 60.92 2gby h TYR 123 Cb -0.08 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.63 2gby h TYR 123 CO -0.00 0.48 -0.70 0.82 -0.00 0.00 0.00 178.16 178.76 2gby h ILE 124 N 0.00 1.34 -0.79 -2.88 2.04 -0.04 -3.22 117.51 113.97 2gby h ILE 124 Ca -0.00 -2.52 0.11 0.00 1.00 0.00 0.00 64.86 63.44 2gby h ILE 124 Cb 0.84 2.42 -0.08 0.00 -0.74 0.00 0.00 36.82 39.27 2gby h ILE 124 CO 0.06 0.68 0.42 0.44 0.00 0.00 0.00 178.15 179.75 2gby h ASP 125 N 0.00 0.55 -0.84 1.72 3.45 -0.86 -0.45 116.42 119.99 2gby h ASP 125 Ca -0.01 0.07 0.14 0.00 0.43 0.00 0.00 57.03 57.66 2gby h ASP 125 Cb 1.37 -0.03 -0.15 0.00 -0.56 0.00 0.00 39.33 39.96 2gby h ASP 125 CO 0.09 0.29 -0.34 0.00 -1.57 0.00 0.00 179.24 177.71 2gby h ALA 126 N 1.48 0.16 -0.21 3.45 0.00 -1.63 0.26 119.26 122.76 2gby h ALA 126 Ca 0.40 0.25 -0.02 0.00 0.00 0.00 0.00 54.91 55.54 2gby h ALA 126 Cb 0.45 0.88 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 2gby h ALA 126 CO -0.29 -0.61 0.06 1.88 0.00 0.00 0.00 179.25 180.29 2gby h TYR 127 N -0.06 0.36 -0.37 0.00 0.05 -1.35 -2.52 116.97 113.09 2gby h TYR 127 Ca 0.32 -0.04 0.06 0.00 0.05 0.00 0.00 58.73 59.12 2gby h TYR 127 Cb 0.59 -0.10 -0.09 0.00 1.01 0.00 0.00 36.73 38.14 2gby h TYR 127 CO -0.76 0.44 -0.44 1.25 -1.05 0.00 0.00 178.16 177.60 2gby h HIS 128 N 0.17 -1.28 -0.30 4.88 2.76 0.78 0.21 115.15 122.37 2gby h HIS 128 Ca 0.07 0.07 0.06 0.00 -2.20 0.00 0.00 60.37 58.37 2gby h HIS 128 Cb 0.26 0.61 -0.06 0.00 1.55 0.00 0.00 27.41 29.77 2gby h HIS 128 CO 0.01 -0.45 -0.10 0.28 -1.30 0.00 0.00 177.93 176.37 2gby h VAL 129 N -0.36 0.64 -0.26 5.26 2.07 -0.56 0.15 116.25 123.20 2gby h VAL 129 Ca 0.12 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.70 2gby h VAL 129 Cb 0.59 0.64 -0.05 0.00 -1.52 0.00 0.00 31.29 30.95 2gby h VAL 129 CO -0.55 0.00 -0.08 0.40 0.02 0.00 0.00 177.57 177.36 2gby h ILE 130 N -0.04 0.71 -0.49 4.57 2.04 -0.73 0.14 117.51 123.71 2gby h ILE 130 Ca 0.15 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.93 2gby h ILE 130 Cb 0.27 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 2gby h ILE 130 CO -0.33 0.00 -0.02 -0.26 0.00 0.00 0.00 178.15 177.54 2gby h PHE 131 N -0.02 0.97 0.75 1.37 0.04 -0.13 0.17 116.94 120.08 2gby h PHE 131 Ca 0.13 -0.17 -0.04 0.00 2.80 0.00 0.00 57.97 60.69 2gby h PHE 131 Cb 0.22 -0.25 0.01 0.00 2.20 0.00 0.00 35.95 38.12 2gby h PHE 131 CO -0.27 0.91 -0.36 -0.22 -0.60 0.00 0.00 178.31 177.77 2gby h LYS 132 N 0.74 -0.97 -0.95 1.51 3.64 -0.44 -2.06 116.57 118.04 2gby h LYS 132 Ca 0.14 0.07 0.24 0.00 -1.27 0.00 0.00 60.65 59.82 2gby h LYS 132 Cb 0.54 0.22 -0.13 0.00 -0.41 0.00 0.00 32.23 32.45 2gby h LYS 132 CO 0.03 -0.65 0.50 0.93 -2.27 0.00 0.00 179.45 177.99 2gby h GLU 133 N -1.09 0.47 -0.81 1.90 4.39 -0.72 0.48 114.58 119.21 2gby h GLU 133 Ca -0.10 -0.03 0.05 0.00 0.34 0.00 0.00 59.36 59.62 2gby h GLU 133 Cb 0.77 -0.11 -0.05 0.00 -0.10 0.00 0.00 28.75 29.27 2gby h GLU 133 CO 0.17 0.31 0.53 0.78 -1.16 0.00 0.00 179.01 179.64 2gby h GLY 134 N 0.48 1.13 0.92 -3.84 0.00 -0.43 -2.50 103.07 98.83 2gby h GLY 134 Ca 0.61 -0.38 -0.01 0.00 0.00 0.00 0.00 47.33 47.56 2gby h GLY 134 CO -0.51 0.31 -0.08 3.43 0.00 0.00 0.00 176.54 179.69 2gby h ASN 135 N 0.95 -0.19 0.00 0.19 -0.26 0.68 -1.60 115.58 115.35 2gby h ASN 135 Ca 0.33 -0.06 0.00 0.00 -0.56 0.00 0.00 56.30 56.01 2gby h ASN 135 Cb 0.12 0.05 0.00 0.00 -1.06 0.00 0.00 38.32 37.43 2gby h ASN 135 CO -0.11 -0.06 0.00 0.18 -1.06 0.00 0.00 177.43 176.38 2gby n LEU 136 N -5.15 0.49 -0.22 1.61 4.32 -0.95 -1.50 117.00 115.60 2gby n LEU 136 Ca -0.09 -0.24 0.00 0.00 -0.02 0.00 0.00 56.01 55.66 2gby n LEU 136 Cb 0.14 -0.24 0.00 0.00 -1.62 0.00 0.00 43.42 41.70 2gby n LEU 136 CO 0.34 0.12 0.23 0.59 -1.22 0.00 0.00 177.39 177.45 2gby n ASN 137 N 0.25 0.00 -2.81 -1.43 4.13 -1.00 -5.00 115.26 109.40 2gby n ASN 137 Ca 0.00 -1.38 -0.14 0.00 1.68 0.00 0.00 54.58 54.75 2gby n ASN 137 Cb 0.12 -0.08 -0.01 0.00 -1.54 0.00 0.00 39.78 38.28 2gby n ASN 137 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2gby n GLY 138 N 0.00 -0.49 0.14 7.41 0.00 -0.56 -4.74 105.19 106.94 2gby n GLY 138 Ca 0.00 0.03 0.02 0.00 0.00 0.00 0.00 46.02 46.07 2gby n GLY 138 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2gby h GLU 139 N -0.33 0.00 -2.18 1.61 5.08 -1.53 -3.48 114.58 113.75 2gby h GLU 139 Ca -0.28 0.00 0.25 0.00 -1.00 0.00 0.00 59.36 58.33 2gby h GLU 139 Cb 1.20 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.38 2gby h GLU 139 CO 0.34 0.52 0.71 1.67 -1.00 0.00 0.00 179.01 181.25 2gby s TRP 140 N -2.98 0.01 -0.22 4.33 -2.14 -1.24 -5.03 118.94 111.68 2gby s TRP 140 Ca 0.04 -0.26 -0.04 0.00 2.66 0.00 0.00 56.10 58.50 2gby s TRP 140 Cb 0.08 0.62 0.07 0.00 -3.10 0.00 0.00 33.47 31.14 2gby s TRP 140 CO 0.75 -0.60 0.09 0.45 -2.66 0.00 0.00 176.95 174.97 2gby s SER 141 N -3.37 2.95 -0.06 -2.66 0.15 -1.26 -4.16 113.70 105.29 2gby s SER 141 Ca 0.21 -0.93 0.05 0.00 0.70 0.00 0.00 55.95 55.98 2gby s SER 141 Cb -0.00 -0.42 -0.01 0.00 -1.71 0.00 0.00 66.02 63.88 2gby s SER 141 CO 0.01 -0.37 -0.22 -0.63 1.20 0.00 0.00 173.24 173.24 2gby s ILE 142 N 2.00 1.80 -0.38 6.45 1.01 -1.26 -4.95 121.20 125.88 2gby s ILE 142 Ca 0.04 -0.91 0.19 0.00 0.00 0.00 0.00 60.65 59.96 2gby s ILE 142 Cb -0.16 -1.54 -0.26 0.00 0.01 0.00 0.00 42.46 40.50 2gby s ILE 142 CO -0.17 0.51 0.58 -0.46 0.00 0.00 0.00 174.94 175.40 2gby n ASN 143 N 3.15 0.69 -2.79 3.58 2.04 -1.26 -4.48 115.26 116.19 2gby n ASN 143 Ca -0.18 -0.39 -0.30 0.00 -0.44 0.00 0.00 54.58 53.27 2gby n ASN 143 Cb 0.52 1.52 -0.01 0.00 -2.53 0.00 0.00 39.78 39.29 2gby n ASN 143 CO 0.00 0.00 0.00 -0.90 -0.44 0.00 0.00 177.26 175.92 2gby n ASP 144 N -1.87 5.26 -0.04 0.53 5.75 -1.26 -4.92 116.55 119.99 2gby n ASP 144 Ca -0.01 -3.72 -0.03 0.00 -0.01 0.00 0.00 54.79 51.02 2gby n ASP 144 Cb 0.42 -0.64 -0.02 0.00 -1.03 0.00 0.00 41.12 39.85 2gby n ASP 144 CO 0.00 0.00 0.00 0.58 -0.11 0.00 0.00 177.20 177.67 2gby h VAL 145 N 2.60 0.00 -0.81 2.12 2.07 -1.98 -1.12 116.25 119.12 2gby h VAL 145 Ca 0.30 0.00 0.23 0.00 0.82 0.00 0.00 66.70 68.05 2gby h VAL 145 Cb 0.61 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.23 2gby h VAL 145 CO 0.95 0.00 0.03 0.59 0.02 0.00 0.00 177.57 179.16 2gby n ASN 146 N -3.33 -0.08 0.17 0.57 3.02 -1.26 -0.30 115.26 114.05 2gby n ASN 146 Ca -0.00 1.38 -0.07 0.00 -0.03 0.00 0.00 54.58 55.85 2gby n ASN 146 Cb 0.07 -0.51 -0.03 0.00 -0.61 0.00 0.00 39.78 38.70 2gby n ASN 146 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2gby h ALA 147 N 1.62 -0.95 -1.16 5.41 0.00 -1.66 -1.66 119.26 120.87 2gby h ALA 147 Ca 0.50 -0.10 0.33 0.00 0.00 0.00 0.00 54.91 55.64 2gby h ALA 147 Cb 1.05 0.17 -0.09 0.00 0.00 0.00 0.00 17.79 18.92 2gby h ALA 147 CO -0.76 -0.91 0.77 0.28 0.00 0.00 0.00 179.25 178.63 2gby h VAL 148 N -0.52 0.39 -0.08 0.00 2.07 -0.25 0.62 116.25 118.48 2gby h VAL 148 Ca -0.05 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 2gby h VAL 148 Cb 0.34 0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 30.26 2gby h VAL 148 CO 0.08 0.04 0.01 0.28 0.02 0.00 0.00 177.57 178.00 2gby h SER 149 N 0.23 0.13 -0.17 0.57 0.02 -0.50 0.83 113.55 114.66 2gby h SER 149 Ca 0.65 -0.26 -0.02 0.00 -0.84 0.00 0.00 61.79 61.32 2gby h SER 149 Cb 1.97 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 64.46 2gby h SER 149 CO -0.25 0.35 0.05 0.11 -1.14 0.00 0.00 176.83 175.95 2gby h LYS 150 N -0.10 0.34 0.52 3.45 1.57 0.06 -0.40 116.57 122.01 2gby h LYS 150 Ca 0.02 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 2gby h LYS 150 Cb 0.28 -0.06 0.01 0.00 0.08 0.00 0.00 32.23 32.53 2gby h LYS 150 CO 0.00 0.32 -0.25 0.82 -0.57 0.00 0.00 179.45 179.78 2gby h ILE 151 N 0.34 0.26 -0.69 1.86 2.04 -0.92 -1.74 117.51 118.66 2gby h ILE 151 Ca 0.08 -0.46 0.12 0.00 1.00 0.00 0.00 64.86 65.60 2gby h ILE 151 Cb 0.14 0.37 -0.09 0.00 -0.74 0.00 0.00 36.82 36.51 2gby h ILE 151 CO -0.00 0.04 0.24 0.00 0.00 0.00 0.00 178.15 178.43 2gby h ALA 152 N -0.86 0.91 0.31 1.87 0.00 -0.62 0.54 119.26 121.41 2gby h ALA 152 Ca -0.07 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2gby h ALA 152 Cb 0.61 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 2gby h ALA 152 CO 0.12 -0.23 -0.40 0.00 0.00 0.00 0.00 179.25 178.74 2gby h ALA 153 N 1.50 -0.83 -0.01 0.00 0.00 -1.04 0.36 119.26 119.24 2gby h ALA 153 Ca 0.37 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 55.03 2gby h ALA 153 Cb 0.53 0.61 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 2gby h ALA 153 CO -0.38 -1.01 -0.60 -0.91 0.00 0.00 0.00 179.25 176.34 2gby h ASN 154 N -0.77 0.04 0.01 0.00 -0.26 -0.66 -0.81 115.58 113.13 2gby h ASN 154 Ca -0.02 -0.02 -0.00 0.00 -0.56 0.00 0.00 56.30 55.70 2gby h ASN 154 Cb 0.71 -0.01 0.00 0.00 -1.06 0.00 0.00 38.32 37.96 2gby h ASN 154 CO -0.12 0.63 -0.01 0.00 -1.06 0.00 0.00 177.43 176.88 2gby h ALA 155 N 1.37 -0.01 -0.43 -0.83 0.00 0.22 -1.84 119.26 117.73 2gby h ALA 155 Ca -0.01 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 54.78 2gby h ALA 155 Cb 1.07 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 2gby h ALA 155 CO 0.08 -0.38 0.27 0.28 0.00 0.00 0.00 179.25 179.51 2gby h VAL 156 N -0.28 1.09 -0.15 0.00 2.07 -0.82 -2.28 116.25 115.89 2gby h VAL 156 Ca -0.00 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 2gby h VAL 156 Cb 0.27 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 2gby h VAL 156 CO 0.00 0.10 0.05 -1.13 0.02 0.00 0.00 177.57 176.61 2gby h ASN 157 N 0.56 0.18 -0.37 0.57 -1.24 -1.06 -1.11 115.58 113.11 2gby h ASN 157 Ca 0.16 -0.01 -0.17 0.00 0.71 0.00 0.00 56.30 56.99 2gby h ASN 157 Cb -0.04 -0.05 -0.00 0.00 0.73 0.00 0.00 38.32 38.96 2gby h ASN 157 CO -0.05 0.18 -0.41 1.23 -1.29 0.00 0.00 177.43 177.09 2gby h GLY 158 N 0.33 1.02 1.03 1.57 0.00 -0.81 0.11 103.07 106.33 2gby h GLY 158 Ca 0.05 -1.07 -0.05 0.00 0.00 0.00 0.00 47.33 46.26 2gby h GLY 158 CO -0.00 0.96 0.24 -2.22 0.00 0.00 0.00 176.54 175.52 2gby h ILE 159 N 0.75 1.25 -0.38 2.60 2.04 -0.83 0.04 117.51 122.99 2gby h ILE 159 Ca 0.05 -0.85 -0.11 0.00 1.00 0.00 0.00 64.86 64.96 2gby h ILE 159 Cb 1.01 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.57 2gby h ILE 159 CO 0.10 0.33 -0.18 0.58 0.00 0.00 0.00 178.15 178.98 2gby h VAL 160 N 1.02 1.28 0.10 1.67 2.07 -1.07 -3.28 116.25 118.05 2gby h VAL 160 Ca 0.23 -1.31 -0.30 0.00 0.82 0.00 0.00 66.70 66.15 2gby h VAL 160 Cb 0.27 1.31 0.03 0.00 -1.52 0.00 0.00 31.29 31.38 2gby h VAL 160 CO -0.01 0.43 -1.22 0.74 0.02 0.00 0.00 177.57 177.53 2gby h THR 161 N 0.60 1.28 -0.62 2.57 2.02 -0.59 -3.38 112.91 114.80 2gby h THR 161 Ca 0.09 -2.44 -0.15 0.00 0.77 0.00 0.00 66.41 64.68 2gby h THR 161 Cb 0.73 2.65 -0.09 0.00 -1.74 0.00 0.00 68.15 69.69 2gby h THR 161 CO 0.05 0.74 0.17 0.49 0.37 0.00 0.00 175.52 177.35 2gby n PHE 162 N -3.79 2.08 -1.72 3.16 3.01 -0.01 -4.34 117.46 115.85 2gby n PHE 162 Ca -0.13 -1.12 -0.01 0.00 1.01 0.00 0.00 57.45 57.20 2gby n PHE 162 Cb 0.97 -0.60 0.16 0.00 -0.01 0.00 0.00 39.48 40.01 2gby n PHE 162 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 2gby n THR 163 N -0.18 2.24 -2.70 4.37 -1.04 -1.24 -4.99 114.28 110.74 2gby n THR 163 Ca 0.36 -3.42 -0.42 0.00 -2.04 0.00 0.00 64.05 58.52 2gby n THR 163 Cb 1.27 -0.41 -0.03 0.00 -1.82 0.00 0.00 70.33 69.33 2gby n THR 163 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 2gby s HIS 164 N -3.27 2.55 0.00 -1.42 2.46 -1.26 -4.08 115.29 110.27 2gby s HIS 164 Ca 0.41 -0.49 0.00 0.00 0.47 0.00 0.00 55.06 55.44 2gby s HIS 164 Cb 0.38 -4.48 0.00 0.00 -0.13 0.00 0.00 32.58 28.35 2gby s HIS 164 CO -0.05 -1.84 0.00 -0.85 -2.47 0.00 0.00 174.74 169.53 2gby n GLU 165 N 8.40 0.00 -2.20 2.88 0.00 -1.26 -5.16 120.64 123.30 2gby n GLU 165 Ca 0.07 0.00 -0.28 0.00 0.00 0.00 0.00 57.16 56.96 2gby n GLU 165 Cb 0.48 0.00 0.04 0.00 0.00 0.00 0.00 31.44 31.96 2gby n GLU 165 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.13 178.27 2gby s GLN 166 N 0.00 2.73 0.27 3.44 -2.07 -1.26 -5.03 119.66 117.74 2gby s GLN 166 Ca 0.00 0.09 -0.29 0.00 -1.82 0.00 0.00 55.36 53.33 2gby s GLN 166 Cb 0.00 -2.17 -0.10 0.00 -1.09 0.00 0.00 33.01 29.65 2gby s GLN 166 CO 0.00 -0.93 1.33 0.54 -1.32 0.00 0.00 175.29 174.92 2gby s ASN 167 N -4.37 6.80 0.58 12.60 4.22 -1.26 -4.88 114.94 128.62 2gby s ASN 167 Ca 0.56 2.59 0.36 0.00 -2.14 0.00 0.00 52.86 54.24 2gby s ASN 167 Cb -0.11 -2.63 1.33 0.00 1.28 0.00 0.00 41.25 41.13 2gby s ASN 167 CO 0.47 -0.56 1.51 -0.29 -2.04 0.00 0.00 177.10 176.19 2gby h ILE 168 N 3.36 0.08 -0.07 0.54 6.09 -1.99 -0.11 117.51 125.42 2gby h ILE 168 Ca -0.47 0.00 -0.09 0.00 -1.37 0.00 0.00 64.86 62.93 2gby h ILE 168 Cb 1.22 0.11 0.00 0.00 0.47 0.00 0.00 36.82 38.63 2gby h ILE 168 CO 0.72 0.00 -0.33 0.78 -3.07 0.00 0.00 178.15 176.25 2gby h ASN 169 N 0.00 0.40 -0.45 2.19 4.21 -2.00 -2.88 115.58 117.06 2gby h ASN 169 Ca 0.63 -0.65 0.07 0.00 1.21 0.00 0.00 56.30 57.56 2gby h ASN 169 Cb 2.98 -0.12 -0.06 0.00 -1.12 0.00 0.00 38.32 40.00 2gby h ASN 169 CO -0.01 0.99 0.08 -0.08 -1.29 0.00 0.00 177.43 177.12 2gby h GLU 170 N -0.16 0.20 0.37 0.81 4.57 -1.38 0.64 114.58 119.63 2gby h GLU 170 Ca -0.02 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.14 2gby h GLU 170 Cb 0.98 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.49 2gby h GLU 170 CO 0.07 0.13 -0.50 0.00 -1.18 0.00 0.00 179.01 177.53 2gby h ARG 171 N 0.21 -0.87 -1.00 1.92 3.08 -1.58 0.24 114.38 116.38 2gby h ARG 171 Ca 0.22 0.06 0.17 0.00 0.07 0.00 0.00 59.98 60.50 2gby h ARG 171 Cb 0.28 0.20 -0.10 0.00 0.08 0.00 0.00 29.97 30.44 2gby h ARG 171 CO -0.30 -0.58 0.62 0.82 -1.07 0.00 0.00 179.97 179.46 2gby h ILE 172 N -0.90 0.76 -0.23 2.04 2.04 -1.24 0.51 117.51 120.49 2gby h ILE 172 Ca -0.04 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.55 2gby h ILE 172 Cb 0.82 -0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 2gby h ILE 172 CO -0.13 0.15 0.15 0.50 0.00 0.00 0.00 178.15 178.81 2gby h LYS 173 N 0.80 0.30 0.02 2.37 3.11 -0.07 -0.56 116.57 122.54 2gby h LYS 173 Ca 0.55 -0.02 -0.00 0.00 -2.81 0.00 0.00 60.65 58.37 2gby h LYS 173 Cb 0.81 -0.07 0.00 0.00 -1.00 0.00 0.00 32.23 31.98 2gby h LYS 173 CO -0.33 0.20 -0.01 -0.07 -2.81 0.00 0.00 179.45 176.43 2gby h LEU 174 N 0.30 -0.03 -0.94 5.20 3.38 0.21 -1.09 115.31 122.35 2gby h LEU 174 Ca 0.08 -0.28 0.13 0.00 0.09 0.00 0.00 57.88 57.90 2gby h LEU 174 Cb -0.03 0.01 -0.09 0.00 0.09 0.00 0.00 40.66 40.64 2gby h LEU 174 CO -0.02 0.27 0.57 -0.03 0.09 0.00 0.00 178.44 179.32 2gby h MET 175 N -0.32 0.84 -0.34 1.13 4.05 -0.05 0.21 114.93 120.44 2gby h MET 175 Ca -0.00 -0.05 -0.13 0.00 -0.28 0.00 0.00 59.70 59.23 2gby h MET 175 Cb 0.31 -0.19 -0.01 0.00 -0.80 0.00 0.00 31.60 30.91 2gby h MET 175 CO 0.01 0.55 -0.32 -0.91 0.23 0.00 0.00 176.91 176.47 2gby h ASN 176 N 0.86 0.77 -0.85 1.39 2.35 -0.95 -1.10 115.58 118.05 2gby h ASN 176 Ca 0.48 -0.32 0.01 0.00 -0.55 0.00 0.00 56.30 55.93 2gby h ASN 176 Cb 0.55 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 38.66 2gby h ASN 176 CO -0.30 1.03 0.56 0.50 -1.65 0.00 0.00 177.43 177.58 2gby h LYS 177 N 0.63 1.10 0.52 0.81 1.63 0.36 -1.28 116.57 120.34 2gby h LYS 177 Ca 0.07 -0.07 -0.03 0.00 -0.85 0.00 0.00 60.65 59.78 2gby h LYS 177 Cb 0.85 -0.25 0.01 0.00 -0.60 0.00 0.00 32.23 32.23 2gby h LYS 177 CO 0.07 0.73 -0.25 0.35 -3.45 0.00 0.00 179.45 176.90 2gby h PHE 178 N 1.14 -0.65 -0.75 1.91 3.57 -0.18 -0.38 116.94 121.60 2gby h PHE 178 Ca 0.32 -0.02 0.20 0.00 3.53 0.00 0.00 57.97 62.00 2gby h PHE 178 Cb -0.10 0.22 -0.04 0.00 2.79 0.00 0.00 35.95 38.82 2gby h PHE 178 CO -0.01 -0.40 0.52 0.77 -2.23 0.00 0.00 178.31 176.96 2gby h SER 179 N -0.71 0.13 0.37 0.41 0.02 -0.83 0.23 113.55 113.18 2gby h SER 179 Ca -0.07 0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 2gby h SER 179 Cb 0.54 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.07 2gby h SER 179 CO 0.12 0.06 -0.18 -0.61 -1.14 0.00 0.00 176.83 175.08 2gby h GLN 180 N 0.14 -0.48 0.06 3.45 4.15 -0.71 -1.71 115.11 120.01 2gby h GLN 180 Ca 0.36 0.03 0.03 0.00 0.77 0.00 0.00 58.65 59.84 2gby h GLN 180 Cb 1.24 0.11 -0.05 0.00 0.21 0.00 0.00 27.48 28.99 2gby h GLN 180 CO -0.05 -0.20 -0.39 0.82 -1.93 0.00 0.00 178.83 177.07 2gby h ILE 181 N -1.03 0.19 -0.26 2.39 2.04 -0.07 -1.91 117.51 118.88 2gby h ILE 181 Ca -0.05 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.87 2gby h ILE 181 Cb 0.51 0.19 -0.06 0.00 -0.74 0.00 0.00 36.82 36.72 2gby h ILE 181 CO 0.08 0.00 -0.16 0.15 0.00 0.00 0.00 178.15 178.23 2gby h PHE 182 N -0.59 -0.39 0.00 1.37 3.04 -0.68 0.15 116.94 119.84 2gby h PHE 182 Ca 0.04 0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.02 2gby h PHE 182 Cb 0.64 0.21 0.00 0.00 2.56 0.00 0.00 35.95 39.37 2gby h PHE 182 CO -0.37 -0.23 0.00 1.25 -2.02 0.00 0.00 178.31 176.94 2gby h LEU 183 N -0.14 0.00 0.15 0.59 5.85 -1.12 -2.30 115.31 118.35 2gby h LEU 183 Ca 0.14 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.55 2gby h LEU 183 Cb 0.35 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.38 2gby h LEU 183 CO -0.34 0.00 -1.53 -1.13 -0.34 0.00 0.00 178.44 175.10 2gby h ASN 184 N 0.00 0.49 0.00 1.25 -0.00 -0.18 -3.24 115.58 113.90 2gby h ASN 184 Ca 0.00 -0.64 0.00 0.00 -0.00 0.00 0.00 56.30 55.66 2gby h ASN 184 Cb 0.20 -0.16 0.00 0.00 -0.00 0.00 0.00 38.32 38.36 2gby h ASN 184 CO 0.00 1.53 0.00 0.61 -0.00 0.00 0.00 177.43 179.57 2gby n GLY 185 N 1.69 -0.64 0.01 1.57 0.00 -0.59 -2.34 105.19 104.89 2gby n GLY 185 Ca -0.17 -0.08 0.11 0.00 0.00 0.00 0.00 46.02 45.89 2gby n GLY 185 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2gby n LEU 186 N -0.80 0.72 -0.55 0.99 4.77 -1.21 -5.10 117.00 115.84 2gby n LEU 186 Ca 0.09 -0.22 0.14 0.00 -0.03 0.00 0.00 56.01 55.99 2gby n LEU 186 Cb 0.04 -0.11 0.47 0.00 -2.33 0.00 0.00 43.42 41.49 2gby n LEU 186 CO 0.07 0.16 0.84 -1.20 -1.33 0.00 0.00 177.39 175.93