#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gby n LEU 3 N 0.00 0.00 0.02 1.20 -0.00 -1.26 -4.58 117.00 112.39 2gby n LEU 3 Ca 0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 56.01 55.83 2gby n LEU 3 Cb 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 43.29 2gby n LEU 3 CO 0.00 0.00 0.17 0.50 -0.00 0.00 0.00 177.39 178.06 2gby h LYS 4 N 0.00 0.33 0.00 1.96 3.64 -2.00 -3.12 116.57 117.38 2gby h LYS 4 Ca 0.00 -0.44 0.00 0.00 -1.27 0.00 0.00 60.65 58.94 2gby h LYS 4 Cb 0.08 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 2gby h LYS 4 CO 0.00 1.15 0.00 -0.44 -2.27 0.00 0.00 179.45 177.89 2gby h ASP 5 N -0.29 0.00 -0.17 4.20 3.32 -1.99 -2.02 116.42 119.47 2gby h ASP 5 Ca -0.10 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.93 2gby h ASP 5 Cb 1.44 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.98 2gby h ASP 5 CO 0.13 0.00 0.02 0.50 -1.72 0.00 0.00 179.24 178.17 2gby h LYS 6 N 0.00 0.28 0.66 3.56 1.63 -1.79 -0.53 116.57 120.39 2gby h LYS 6 Ca 0.00 -0.08 -0.03 0.00 -0.85 0.00 0.00 60.65 59.69 2gby h LYS 6 Cb 0.41 -0.03 0.01 0.00 -0.60 0.00 0.00 32.23 32.01 2gby h LYS 6 CO 0.00 0.46 -0.32 0.82 -3.45 0.00 0.00 179.45 176.96 2gby h ILE 7 N 0.06 0.32 -0.92 2.00 1.08 -1.34 -0.10 117.51 118.61 2gby h ILE 7 Ca 0.05 -0.10 0.22 0.00 -0.39 0.00 0.00 64.86 64.64 2gby h ILE 7 Cb 0.32 0.35 -0.12 0.00 -3.07 0.00 0.00 36.82 34.30 2gby h ILE 7 CO 0.00 0.01 0.46 -0.07 -0.69 0.00 0.00 178.15 177.87 2gby h LEU 8 N -0.96 0.47 0.47 1.44 3.38 -1.42 0.29 115.31 118.98 2gby h LEU 8 Ca -0.09 0.14 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 2gby h LEU 8 Cb 0.70 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.54 2gby h LEU 8 CO 0.15 0.07 -0.22 1.23 0.09 0.00 0.00 178.44 179.75 2gby h GLY 9 N 0.49 -0.66 1.02 0.83 0.00 -0.85 -1.24 103.07 102.66 2gby h GLY 9 Ca 0.57 0.24 0.06 0.00 0.00 0.00 0.00 47.33 48.21 2gby h GLY 9 CO -0.49 -0.24 0.50 -2.08 0.00 0.00 0.00 176.54 174.23 2gby h VAL 10 N -1.12 1.04 0.08 4.60 2.07 -0.71 -1.42 116.25 120.79 2gby h VAL 10 Ca -0.06 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.17 2gby h VAL 10 Cb 0.53 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 2gby h VAL 10 CO 0.11 0.15 -0.04 0.00 0.02 0.00 0.00 177.57 177.81 2gby h ALA 11 N 1.58 -0.11 -0.74 1.67 0.00 -0.48 -2.26 119.26 118.94 2gby h ALA 11 Ca 0.32 -0.13 0.10 0.00 0.00 0.00 0.00 54.91 55.20 2gby h ALA 11 Cb 0.22 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 17.98 2gby h ALA 11 CO -0.11 -0.44 0.38 -0.22 0.00 0.00 0.00 179.25 178.86 2gby h LYS 12 N -0.35 0.62 -0.07 0.00 3.64 -0.81 0.13 116.57 119.73 2gby h LYS 12 Ca -0.01 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.31 2gby h LYS 12 Cb 0.30 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 2gby h LYS 12 CO 0.02 0.41 -0.05 1.49 -2.27 0.00 0.00 179.45 179.05 2gby h GLU 13 N 0.64 0.10 0.09 1.90 4.57 -1.13 -2.55 114.58 118.19 2gby h GLU 13 Ca 0.36 -0.01 -0.12 0.00 -1.18 0.00 0.00 59.36 58.41 2gby h GLU 13 Cb 0.38 -0.02 0.01 0.00 -0.16 0.00 0.00 28.75 28.96 2gby h GLU 13 CO -0.27 0.16 -0.52 -0.07 -1.18 0.00 0.00 179.01 177.13 2gby h LEU 14 N 0.10 0.31 -2.24 1.64 3.38 -0.44 -2.50 115.31 115.55 2gby h LEU 14 Ca 0.02 -0.96 0.05 0.00 0.09 0.00 0.00 57.88 57.08 2gby h LEU 14 Cb 0.16 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2gby h LEU 14 CO 0.01 1.25 0.19 -0.26 0.09 0.00 0.00 178.44 179.71 2gby h PHE 15 N -0.58 0.00 0.07 1.13 0.05 -0.90 0.88 116.94 117.59 2gby h PHE 15 Ca -0.09 0.00 -0.31 0.00 3.82 0.00 0.00 57.97 61.39 2gby h PHE 15 Cb 1.41 0.00 -0.02 0.00 2.00 0.00 0.00 35.95 39.33 2gby h PHE 15 CO 0.22 0.00 -1.64 0.82 -0.18 0.00 0.00 178.31 177.53 2gby h ILE 16 N 0.00 0.99 0.15 -0.55 2.04 -1.52 -0.57 117.51 118.05 2gby h ILE 16 Ca 0.08 -2.72 -0.25 0.00 1.00 0.00 0.00 64.86 62.97 2gby h ILE 16 Cb 0.46 2.60 0.03 0.00 -0.74 0.00 0.00 36.82 39.17 2gby h ILE 16 CO -0.00 0.74 -1.07 0.50 0.00 0.00 0.00 178.15 178.32 2gby h LYS 17 N 0.04 0.46 0.00 2.37 3.64 -0.56 -3.39 116.57 119.13 2gby h LYS 17 Ca -0.27 -0.69 0.00 0.00 -1.27 0.00 0.00 60.65 58.41 2gby h LYS 17 Cb 2.00 0.24 0.00 0.00 -0.41 0.00 0.00 32.23 34.06 2gby h LYS 17 CO 0.12 1.31 -0.35 0.09 -2.27 0.00 0.00 179.45 178.35 2gby n ASN 18 N -3.95 1.00 0.00 4.20 3.02 0.29 -5.08 115.26 114.73 2gby n ASN 18 Ca -0.14 -0.45 0.00 0.00 -0.03 0.00 0.00 54.58 53.95 2gby n ASN 18 Cb 0.92 1.03 0.00 0.00 -0.61 0.00 0.00 39.78 41.12 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 1.33 -0.17 0.28 7.41 0.00 -0.22 -4.33 105.19 109.49 2gby n GLY 19 Ca 0.00 -1.80 -0.11 0.00 0.00 0.00 0.00 46.02 44.11 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 -0.65 -0.54 1.61 3.20 -1.80 -3.26 116.97 115.52 2gby h TYR 20 Ca 0.00 -0.02 0.12 0.00 3.14 0.00 0.00 58.73 61.98 2gby h TYR 20 Cb 0.00 0.22 -0.03 0.00 1.54 0.00 0.00 36.73 38.46 2gby h TYR 20 CO 0.00 -0.40 0.38 -0.91 -1.64 0.00 0.00 178.16 175.58 2gby h ASN 21 N -0.70 0.17 1.05 -2.11 2.35 -1.93 -2.15 115.58 112.25 2gby h ASN 21 Ca -0.07 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 2gby h ASN 21 Cb 0.54 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.88 2gby h ASN 21 CO 0.12 0.10 -0.06 0.00 -1.65 0.00 0.00 177.43 175.94 2gby n ALA 22 N -2.58 2.44 -2.47 -0.83 0.00 -1.25 -4.70 120.51 111.13 2gby n ALA 22 Ca 0.09 -0.11 -0.43 0.00 0.00 0.00 0.00 53.44 53.00 2gby n ALA 22 Cb 0.48 -1.43 -0.10 0.00 0.00 0.00 0.00 19.45 18.40 2gby n ALA 22 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2gby s THR 23 N -3.02 5.23 0.13 0.00 2.01 -0.81 -5.02 115.64 114.16 2gby s THR 23 Ca 0.13 -0.59 -0.03 0.00 0.31 0.00 0.00 61.69 61.50 2gby s THR 23 Cb 0.17 -3.94 -0.05 0.00 0.01 0.00 0.00 72.50 68.69 2gby s THR 23 CO 0.56 -0.32 0.34 0.42 -0.69 0.00 0.00 174.62 174.94 2gby s THR 24 N 1.75 5.22 0.45 -0.82 -4.23 -1.26 -4.96 115.64 111.78 2gby s THR 24 Ca 0.06 -0.10 0.12 0.00 -1.18 0.00 0.00 61.69 60.60 2gby s THR 24 Cb -0.19 -3.64 0.30 0.00 1.34 0.00 0.00 72.50 70.32 2gby s THR 24 CO 0.11 0.04 2.04 0.71 -0.54 0.00 0.00 174.62 176.97 2gby h THR 25 N 2.00 0.98 -0.09 3.99 1.35 -1.98 -0.99 112.91 118.17 2gby h THR 25 Ca -0.46 -0.13 0.03 0.00 -0.55 0.00 0.00 66.41 65.30 2gby h THR 25 Cb 1.17 0.58 -0.06 0.00 -1.73 0.00 0.00 68.15 68.11 2gby h THR 25 CO 0.73 0.07 -0.50 1.23 -0.25 0.00 0.00 175.52 176.80 2gby h GLY 26 N 0.37 -1.14 1.74 5.82 0.00 -2.00 0.74 103.07 108.59 2gby h GLY 26 Ca 0.18 0.68 -0.07 0.00 0.00 0.00 0.00 47.33 48.12 2gby h GLY 26 CO -0.04 -0.24 -0.17 -2.09 0.00 0.00 0.00 176.54 174.00 2gby h GLU 27 N -0.56 0.32 0.28 4.80 4.81 -1.78 -2.50 114.58 119.95 2gby h GLU 27 Ca 0.02 -0.09 -0.00 0.00 -0.13 0.00 0.00 59.36 59.16 2gby h GLU 27 Cb 0.64 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 2gby h GLU 27 CO -0.38 0.49 -0.23 0.82 -0.73 0.00 0.00 179.01 178.98 2gby h ILE 28 N 0.30 0.52 0.29 2.32 2.04 -0.23 -2.71 117.51 120.03 2gby h ILE 28 Ca 0.05 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.90 2gby h ILE 28 Cb 0.48 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 37.08 2gby h ILE 28 CO 0.03 0.00 -0.14 0.58 0.00 0.00 0.00 178.15 178.62 2gby h VAL 29 N -0.52 0.74 0.00 1.67 2.07 -0.81 -2.77 116.25 116.63 2gby h VAL 29 Ca -0.02 -0.50 0.00 0.00 0.82 0.00 0.00 66.70 67.00 2gby h VAL 29 Cb 0.46 1.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 2gby h VAL 29 CO -0.02 0.10 0.00 2.29 0.02 0.00 0.00 177.57 179.97 2gby n LYS 30 N -5.14 0.06 0.00 1.57 2.85 -0.95 -1.45 118.16 115.09 2gby n LYS 30 Ca -0.10 0.28 0.07 0.00 -1.05 0.00 0.00 58.31 57.52 2gby n LYS 30 Cb 0.25 -1.50 -0.08 0.00 -0.65 0.00 0.00 35.03 33.05 2gby n LYS 30 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 177.40 177.24 2gby n LEU 31 N -1.39 0.79 -0.31 -5.58 7.94 -1.02 -4.28 117.00 113.15 2gby n LEU 31 Ca 0.03 -0.52 0.03 0.00 -1.11 0.00 0.00 56.01 54.44 2gby n LEU 31 Cb 0.08 0.00 0.07 0.00 0.53 0.00 0.00 43.42 44.10 2gby n LEU 31 CO 0.07 0.19 0.50 -1.54 -1.11 0.00 0.00 177.39 175.50 2gby n SER 32 N -1.27 2.21 -3.14 1.96 3.41 -0.53 -5.02 113.62 111.24 2gby n SER 32 Ca 0.03 -1.78 -0.05 0.00 -0.26 0.00 0.00 58.87 56.81 2gby n SER 32 Cb 0.25 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.11 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 0.13 -1.48 -0.77 4.33 -0.58 -0.72 -4.83 120.64 116.72 2gby n GLU 33 Ca 0.05 1.47 0.00 0.00 -0.42 0.00 0.00 57.16 58.27 2gby n GLU 33 Cb 0.29 -5.26 0.00 0.00 -0.57 0.00 0.00 31.44 25.90 2gby n GLU 33 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 2gby n SER 34 N -1.69 0.00 -4.40 1.62 2.88 -1.06 -5.05 113.62 105.92 2gby n SER 34 Ca -0.03 -0.65 -0.24 0.00 -1.33 0.00 0.00 58.87 56.62 2gby n SER 34 Cb 0.52 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.87 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 -0.01 3.20 0.08 -3.46 1.04 -1.26 -4.58 113.70 108.70 2gby s SER 35 Ca 0.00 -0.91 -0.26 0.00 0.48 0.00 0.00 55.95 55.27 2gby s SER 35 Cb 0.00 -0.23 -0.16 0.00 0.10 0.00 0.00 66.02 65.73 2gby s SER 35 CO 0.00 0.04 1.66 0.50 0.98 0.00 0.00 173.24 176.43 2gby h LYS 36 N 2.99 -0.24 -0.05 4.02 3.64 -1.96 -2.08 116.57 122.89 2gby h LYS 36 Ca -0.43 0.02 0.02 0.00 -1.27 0.00 0.00 60.65 58.98 2gby h LYS 36 Cb 1.22 0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 33.09 2gby h LYS 36 CO 0.52 -0.13 0.04 0.78 -2.27 0.00 0.00 179.45 178.39 2gby h GLY 37 N -0.29 0.00 1.01 5.01 0.00 -2.00 -1.19 103.07 105.61 2gby h GLY 37 Ca -0.03 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.26 2gby h GLY 37 CO 0.04 0.00 0.19 -0.57 0.00 0.00 0.00 176.54 176.20 2gby h ASN 38 N 0.00 0.87 -0.90 0.19 -0.73 -1.80 0.72 115.58 113.93 2gby h ASN 38 Ca 0.02 -0.21 0.03 0.00 1.87 0.00 0.00 56.30 58.02 2gby h ASN 38 Cb 0.11 -0.23 -0.05 0.00 0.27 0.00 0.00 38.32 38.42 2gby h ASN 38 CO -0.00 0.85 0.59 0.25 -0.37 0.00 0.00 177.43 178.75 2gby h LEU 39 N 0.84 0.98 -0.45 0.34 6.46 -0.80 -0.40 115.31 122.29 2gby h LEU 39 Ca 0.19 -0.01 -0.17 0.00 -0.12 0.00 0.00 57.88 57.76 2gby h LEU 39 Cb 0.29 -0.23 -0.00 0.00 -0.73 0.00 0.00 40.66 39.98 2gby h LEU 39 CO -0.01 0.68 -0.64 1.88 -0.62 0.00 0.00 178.44 179.73 2gby h TYR 40 N 1.14 0.66 -0.10 1.25 -1.99 -1.28 0.37 116.97 117.02 2gby h TYR 40 Ca 0.35 -0.26 0.03 0.00 2.00 0.00 0.00 58.73 60.85 2gby h TYR 40 Cb -0.00 -0.11 -0.00 0.00 2.00 0.00 0.00 36.73 38.61 2gby h TYR 40 CO -0.00 1.01 0.11 -0.92 -0.00 0.00 0.00 178.16 178.36 2gby h TYR 41 N 0.37 0.00 0.00 4.88 3.20 0.82 0.15 116.97 126.39 2gby h TYR 41 Ca -0.01 0.00 -0.27 0.00 3.14 0.00 0.00 58.73 61.59 2gby h TYR 41 Cb 1.20 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 39.43 2gby h TYR 41 CO 0.05 0.00 -1.90 0.72 -1.64 0.00 0.00 178.16 175.39 2gby n HIS 42 N -3.83 0.00 0.42 -3.82 8.25 -0.83 -4.82 115.22 110.59 2gby n HIS 42 Ca -0.00 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.50 2gby n HIS 42 Cb 0.22 -0.58 -0.01 0.00 1.12 0.00 0.00 29.99 30.74 2gby n HIS 42 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 2gby n PHE 43 N -3.64 0.00 0.00 4.41 3.01 0.11 -5.05 117.46 116.29 2gby n PHE 43 Ca -0.31 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.15 2gby n PHE 43 Cb 0.73 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.20 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 -0.46 0.00 -4.25 -1.08 5.02 0.53 -4.27 118.16 113.65 2gby n LYS 44 Ca 0.03 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 56.03 2gby n LYS 44 Cb 0.18 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.10 2gby n LYS 44 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 2gby s THR 45 N 0.00 3.36 0.35 -0.18 -1.32 -1.26 -4.05 115.64 112.54 2gby s THR 45 Ca 0.00 -1.25 0.10 0.00 -1.21 0.00 0.00 61.69 59.32 2gby s THR 45 Cb 0.00 -2.56 0.33 0.00 -1.51 0.00 0.00 72.50 68.76 2gby s THR 45 CO 0.00 0.13 1.82 0.50 -2.21 0.00 0.00 174.62 174.86 2gby h LYS 46 N 3.66 0.64 -0.46 7.08 3.64 -1.95 0.26 116.57 129.44 2gby h LYS 46 Ca -0.49 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 58.81 2gby h LYS 46 Cb 1.17 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.82 2gby h LYS 46 CO 0.52 0.42 0.10 1.05 -2.27 0.00 0.00 179.45 179.28 2gby h GLU 47 N 0.66 0.70 -0.24 1.90 -0.00 -1.95 -1.96 114.58 113.68 2gby h GLU 47 Ca 0.52 -0.13 -0.15 0.00 -0.00 0.00 0.00 59.36 59.59 2gby h GLU 47 Cb 0.93 -0.11 -0.01 0.00 -0.00 0.00 0.00 28.75 29.56 2gby h GLU 47 CO -0.27 0.64 -0.47 -0.97 -0.00 0.00 0.00 179.01 177.94 2gby h ASN 48 N 0.68 0.68 -0.84 3.06 -1.24 -0.80 -2.13 115.58 115.00 2gby h ASN 48 Ca 0.15 -0.33 0.05 0.00 0.71 0.00 0.00 56.30 56.88 2gby h ASN 48 Cb 0.27 -0.19 -0.06 0.00 0.73 0.00 0.00 38.32 39.06 2gby h ASN 48 CO -0.00 1.04 0.53 0.25 -1.29 0.00 0.00 177.43 177.96 2gby h LEU 49 N 0.50 0.84 -0.68 0.34 5.85 -0.53 -1.85 115.31 119.79 2gby h LEU 49 Ca 0.03 0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.62 2gby h LEU 49 Cb 1.00 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.85 2gby h LEU 49 CO 0.09 0.56 -0.43 0.15 -0.34 0.00 0.00 178.44 178.47 2gby h PHE 50 N 0.98 0.62 -0.55 1.25 3.04 -1.20 -1.88 116.94 119.20 2gby h PHE 50 Ca 0.36 -0.19 -0.03 0.00 3.98 0.00 0.00 57.97 62.09 2gby h PHE 50 Cb 0.11 -0.13 -0.03 0.00 2.56 0.00 0.00 35.95 38.46 2gby h PHE 50 CO -0.03 0.86 0.22 -0.07 -2.02 0.00 0.00 178.31 177.28 2gby h LEU 51 N 0.42 0.73 0.08 0.59 3.38 -0.68 -0.13 115.31 119.70 2gby h LEU 51 Ca 0.03 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 2gby h LEU 51 Cb 0.93 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.49 2gby h LEU 51 CO 0.08 0.65 -0.04 -0.08 0.09 0.00 0.00 178.44 179.15 2gby h GLU 52 N 0.79 -0.10 -0.87 1.13 4.81 -1.17 -1.46 114.58 117.71 2gby h GLU 52 Ca 0.19 0.01 0.23 0.00 -0.13 0.00 0.00 59.36 59.65 2gby h GLU 52 Cb 0.15 0.02 -0.14 0.00 0.63 0.00 0.00 28.75 29.42 2gby h GLU 52 CO -0.02 0.39 0.27 0.82 -0.73 0.00 0.00 179.01 179.74 2gby h ILE 53 N -0.65 0.36 -0.82 2.32 1.08 -1.09 0.51 117.51 119.22 2gby h ILE 53 Ca -0.01 -0.09 -0.03 0.00 -0.39 0.00 0.00 64.86 64.34 2gby h ILE 53 Cb 0.53 0.09 -0.04 0.00 -3.07 0.00 0.00 36.82 34.33 2gby h ILE 53 CO 0.02 0.05 0.40 0.25 -0.69 0.00 0.00 178.15 178.17 2gby h LEU 54 N 0.25 1.07 -0.83 1.44 5.85 -0.81 0.01 115.31 122.29 2gby h LEU 54 Ca 0.55 -0.12 -0.12 0.00 0.84 0.00 0.00 57.88 59.02 2gby h LEU 54 Cb 1.08 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.83 2gby h LEU 54 CO -0.62 0.89 -0.47 0.78 -0.34 0.00 0.00 178.44 178.68 2gby h ASN 55 N 1.17 0.28 0.32 1.25 2.35 0.96 -1.28 115.58 120.63 2gby h ASN 55 Ca 0.28 -0.13 -0.02 0.00 -0.55 0.00 0.00 56.30 55.89 2gby h ASN 55 Cb 0.11 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.40 2gby h ASN 55 CO -0.04 0.71 -0.15 0.40 -1.65 0.00 0.00 177.43 176.70 2gby h ILE 56 N 0.21 0.00 -0.93 2.81 1.08 -0.10 -2.43 117.51 118.15 2gby h ILE 56 Ca 0.01 -0.17 0.19 0.00 -0.39 0.00 0.00 64.86 64.50 2gby h ILE 56 Cb 0.92 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 34.59 2gby h ILE 56 CO 0.07 0.00 0.60 -0.33 -0.69 0.00 0.00 178.15 177.80 2gby h GLU 57 N -0.60 0.55 0.28 2.37 4.39 -1.08 -0.95 114.58 119.54 2gby h GLU 57 Ca -0.04 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.61 2gby h GLU 57 Cb 0.33 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.86 2gby h GLU 57 CO 0.07 0.36 -0.13 1.49 -1.16 0.00 0.00 179.01 179.64 2gby h GLU 58 N 0.57 -0.36 -0.26 2.33 4.22 -1.24 -3.10 114.58 116.73 2gby h GLU 58 Ca 0.49 0.02 -0.10 0.00 0.08 0.00 0.00 59.36 59.86 2gby h GLU 58 Cb 0.99 0.08 -0.00 0.00 0.50 0.00 0.00 28.75 30.32 2gby h GLU 58 CO -0.23 -0.15 -0.23 0.66 -2.18 0.00 0.00 179.01 176.88 2gby h SER 59 N -0.50 0.66 0.00 1.04 4.64 -0.91 -2.47 113.55 116.01 2gby h SER 59 Ca -0.04 -0.46 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 2gby h SER 59 Cb 0.37 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 2gby h SER 59 CO 0.06 0.98 0.00 0.29 -0.87 0.00 0.00 176.83 177.29 2gby n LYS 60 N -4.35 0.22 -0.03 4.77 5.02 -0.41 -1.86 118.16 121.52 2gby n LYS 60 Ca -0.04 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.18 2gby n LYS 60 Cb 0.43 -1.09 -0.02 0.00 -0.02 0.00 0.00 35.03 34.33 2gby n LYS 60 CO 0.00 0.00 0.00 1.87 -0.52 0.00 0.00 177.40 178.75 2gby n TRP 61 N -0.59 0.00 0.24 2.13 -0.00 -1.05 -4.06 117.44 114.12 2gby n TRP 61 Ca 0.01 0.00 0.03 0.00 -0.00 0.00 0.00 57.50 57.54 2gby n TRP 61 Cb 0.00 -0.22 0.15 0.00 -0.00 0.00 0.00 31.31 31.24 2gby n TRP 61 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 177.69 178.63 2gby n GLN 62 N -3.31 0.02 -0.12 5.87 7.27 -0.89 -1.36 117.38 124.85 2gby n GLN 62 Ca -0.12 0.35 -0.22 0.00 0.07 0.00 0.00 57.00 57.09 2gby n GLN 62 Cb 0.56 -1.50 -0.08 0.00 2.41 0.00 0.00 30.24 31.62 2gby n GLN 62 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 2gby n GLU 63 N -1.45 0.56 0.13 3.69 2.13 -0.78 -3.42 120.64 121.50 2gby n GLU 63 Ca 0.02 0.36 0.18 0.00 0.66 0.00 0.00 57.16 58.37 2gby n GLU 63 Cb 0.07 -1.56 0.76 0.00 0.27 0.00 0.00 31.44 30.98 2gby n GLU 63 CO 0.00 0.00 0.00 0.37 -0.41 0.00 0.00 177.13 177.09 2gby h GLN 64 N -1.00 0.00 0.05 5.31 4.15 -1.61 0.23 115.11 122.24 2gby h GLN 64 Ca -0.43 0.00 -0.23 0.00 0.77 0.00 0.00 58.65 58.76 2gby h GLN 64 Cb 1.32 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 29.01 2gby h GLN 64 CO -0.26 0.00 -1.04 2.35 -1.93 0.00 0.00 178.83 177.96 2gby h TRP 65 N 0.00 0.38 -0.42 3.99 -0.00 -1.39 -3.02 115.95 115.49 2gby h TRP 65 Ca 0.15 -0.24 -0.10 0.00 -0.00 0.00 0.00 58.89 58.69 2gby h TRP 65 Cb 0.71 -0.03 -0.01 0.00 -0.00 0.00 0.00 29.16 29.83 2gby h TRP 65 CO 0.00 1.12 -0.13 -0.22 -0.00 0.00 0.00 178.44 179.21 2gby h LYS 66 N 0.10 0.83 0.00 2.65 1.63 -0.60 0.32 116.57 121.50 2gby h LYS 66 Ca -0.08 -0.33 0.00 0.00 -0.85 0.00 0.00 60.65 59.39 2gby h LYS 66 Cb 1.72 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 33.31 2gby h LYS 66 CO 0.16 0.96 0.00 1.63 -3.45 0.00 0.00 179.45 178.76 2gby n LYS 67 N -4.28 0.74 0.00 1.90 5.02 -0.55 -3.32 118.16 117.67 2gby n LYS 67 Ca -0.01 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2gby n LYS 67 Cb 0.39 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.90 2gby n LYS 67 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2gby n GLU 68 N -1.03 3.19 0.08 1.97 1.02 -0.99 -4.70 120.64 120.18 2gby n GLU 68 Ca 0.18 -0.04 0.13 0.00 -0.02 0.00 0.00 57.16 57.41 2gby n GLU 68 Cb 0.10 -0.34 0.46 0.00 -0.02 0.00 0.00 31.44 31.64 2gby n GLU 68 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2gby n GLN 69 N -0.47 0.19 -0.10 3.49 10.64 0.11 -3.28 117.38 127.97 2gby n GLN 69 Ca 0.00 0.19 -0.07 0.00 -1.83 0.00 0.00 57.00 55.29 2gby n GLN 69 Cb 0.02 -1.74 0.10 0.00 -0.86 0.00 0.00 30.24 27.76 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 1.26 0.00 -0.39 2.04 -1.82 -2.82 117.51 115.78 2gby h ILE 70 Ca 0.00 -1.25 0.00 0.00 1.00 0.00 0.00 64.86 64.61 2gby h ILE 70 Cb 0.64 1.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.83 2gby h ILE 70 CO 0.00 0.42 0.00 0.29 0.00 0.00 0.00 178.15 178.86 2gby n LYS 71 N -4.14 0.16 -3.60 2.37 5.02 -1.21 -4.21 118.16 112.55 2gby n LYS 71 Ca 0.01 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.05 2gby n LYS 71 Cb 0.40 -1.05 -0.17 0.00 -0.02 0.00 0.00 35.03 34.19 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 -1.34 0.34 -0.01 7.82 0.00 -1.06 -5.05 121.76 122.45 2gby s ALA 72 Ca 0.00 -0.21 -0.08 0.00 0.00 0.00 0.00 51.96 51.66 2gby s ALA 72 Cb 0.00 -1.02 -0.05 0.00 0.00 0.00 0.00 23.12 22.05 2gby s ALA 72 CO 0.00 -1.12 0.59 1.57 0.00 0.00 0.00 175.76 176.80 2gby h LYS 73 N 8.41 -0.29 -6.92 0.00 2.10 -1.84 -3.44 116.57 114.59 2gby h LYS 73 Ca -0.15 0.02 -0.49 0.00 -2.00 0.00 0.00 60.65 58.03 2gby h LYS 73 Cb 1.15 0.07 0.02 0.00 -0.90 0.00 0.00 32.23 32.57 2gby h LYS 73 CO 0.28 -0.20 0.44 0.95 -2.00 0.00 0.00 179.45 178.92 2gby s THR 74 N -2.73 3.57 0.48 0.07 -4.23 -1.26 -4.92 115.64 106.61 2gby s THR 74 Ca -0.04 1.31 0.29 0.00 -1.18 0.00 0.00 61.69 62.07 2gby s THR 74 Cb 0.00 -3.74 0.33 0.00 1.34 0.00 0.00 72.50 70.43 2gby s THR 74 CO 0.13 0.12 2.15 0.78 -0.54 0.00 0.00 174.62 177.26 2gby h ASN 75 N 2.87 0.00 -0.87 3.99 4.21 -1.92 -0.80 115.58 123.07 2gby h ASN 75 Ca -0.48 0.00 0.03 0.00 1.21 0.00 0.00 56.30 57.06 2gby h ASN 75 Cb 1.22 0.00 -0.05 0.00 -1.12 0.00 0.00 38.32 38.37 2gby h ASN 75 CO 0.64 0.07 0.56 -0.09 -1.29 0.00 0.00 177.43 177.31 2gby h ARG 76 N 0.00 1.06 -0.18 0.81 2.43 -1.93 0.12 114.38 116.68 2gby h ARG 76 Ca -0.00 -0.06 -0.19 0.00 -0.81 0.00 0.00 59.98 58.92 2gby h ARG 76 Cb 0.21 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 29.52 2gby h ARG 76 CO 0.01 0.70 -0.64 0.93 -1.51 0.00 0.00 179.97 179.46 2gby h GLU 77 N 1.09 0.67 -0.45 0.20 5.08 -1.55 -2.84 114.58 116.78 2gby h GLU 77 Ca 0.34 -0.48 0.01 0.00 -1.00 0.00 0.00 59.36 58.24 2gby h GLU 77 Cb -0.01 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 2gby h GLU 77 CO -0.11 1.10 0.30 0.87 -1.00 0.00 0.00 179.01 180.16 2gby h LYS 78 N 0.49 0.56 0.56 2.33 1.57 -0.55 0.19 116.57 121.72 2gby h LYS 78 Ca -0.01 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.71 2gby h LYS 78 Cb 1.23 -0.13 0.01 0.00 0.08 0.00 0.00 32.23 33.42 2gby h LYS 78 CO 0.13 0.37 -0.27 0.35 -0.57 0.00 0.00 179.45 179.46 2gby h PHE 79 N 0.57 -0.70 -0.81 -1.35 3.57 -0.59 -0.48 116.94 117.15 2gby h PHE 79 Ca 0.17 -0.02 0.20 0.00 3.53 0.00 0.00 57.97 61.85 2gby h PHE 79 Cb -0.01 0.23 -0.13 0.00 2.79 0.00 0.00 35.95 38.83 2gby h PHE 79 CO -0.00 -0.43 0.19 1.88 -2.23 0.00 0.00 178.31 177.72 2gby h TYR 80 N -0.88 0.28 -0.29 0.41 0.05 -1.26 -1.96 116.97 113.33 2gby h TYR 80 Ca -0.08 0.05 -0.03 0.00 0.05 0.00 0.00 58.73 58.72 2gby h TYR 80 Cb 0.58 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.31 2gby h TYR 80 CO 0.06 -0.16 0.08 1.25 -1.05 0.00 0.00 178.16 178.34 2gby h LEU 81 N 0.23 0.44 0.14 3.88 5.85 -0.54 -0.87 115.31 124.43 2gby h LEU 81 Ca 0.48 -0.23 -0.00 0.00 0.84 0.00 0.00 57.88 58.97 2gby h LEU 81 Cb 0.91 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.82 2gby h LEU 81 CO -0.60 0.55 -0.09 0.22 -0.34 0.00 0.00 178.44 178.18 2gby h TYR 82 N 0.31 -0.24 -0.73 1.25 3.20 -0.36 0.87 116.97 121.28 2gby h TYR 82 Ca 0.09 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 61.99 2gby h TYR 82 Cb 0.28 0.09 -0.04 0.00 1.54 0.00 0.00 36.73 38.60 2gby h TYR 82 CO 0.01 -0.15 0.48 -0.91 -1.64 0.00 0.00 178.16 175.95 2gby h ASN 83 N -0.23 0.76 0.53 -2.11 -0.26 -1.37 -0.95 115.58 111.95 2gby h ASN 83 Ca -0.01 -0.01 -0.03 0.00 -0.56 0.00 0.00 56.30 55.69 2gby h ASN 83 Cb 0.20 -0.18 0.01 0.00 -1.06 0.00 0.00 38.32 37.28 2gby h ASN 83 CO 0.01 0.53 -0.25 -0.08 -1.06 0.00 0.00 177.43 176.57 2gby h GLU 84 N 0.89 -0.69 -0.81 0.81 4.81 -0.85 -3.19 114.58 115.55 2gby h GLU 84 Ca 0.29 0.05 0.19 0.00 -0.13 0.00 0.00 59.36 59.76 2gby h GLU 84 Cb 0.05 0.16 -0.05 0.00 0.63 0.00 0.00 28.75 29.53 2gby h GLU 84 CO -0.08 -0.39 0.55 -0.07 -0.73 0.00 0.00 179.01 178.28 2gby h LEU 85 N -1.09 0.27 -1.94 1.64 3.38 -0.56 -1.15 115.31 115.86 2gby h LEU 85 Ca -0.07 0.02 0.21 0.00 0.09 0.00 0.00 57.88 58.13 2gby h LEU 85 Cb 0.61 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 2gby h LEU 85 CO 0.12 0.12 0.52 0.28 0.09 0.00 0.00 178.44 179.57 2gby h SER 86 N 0.27 0.05 1.01 -0.43 0.02 -1.16 0.29 113.55 113.61 2gby h SER 86 Ca 0.40 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 61.16 2gby h SER 86 Cb 1.16 -0.01 -0.03 0.00 0.14 0.00 0.00 62.40 63.66 2gby h SER 86 CO -0.10 0.02 -1.02 -0.07 -1.14 0.00 0.00 176.83 174.52 2gby h LEU 87 N 0.05 0.00 0.00 5.07 3.38 -1.33 -3.35 115.31 119.14 2gby h LEU 87 Ca 0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.32 2gby h LEU 87 Cb 1.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.08 2gby h LEU 87 CO -0.02 0.90 -1.15 0.35 0.09 0.00 0.00 178.44 178.61 2gby n THR 88 N -3.28 0.00 -1.30 0.22 -2.24 -0.20 -4.99 114.28 102.49 2gby n THR 88 Ca -0.02 -0.14 -0.32 0.00 -2.27 0.00 0.00 64.05 61.30 2gby n THR 88 Cb 0.92 0.78 0.10 0.00 -2.10 0.00 0.00 70.33 70.02 2gby n THR 88 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2gby s THR 89 N -2.97 2.82 -0.90 4.28 -1.32 0.86 -4.95 115.64 113.46 2gby s THR 89 Ca 0.04 0.32 0.22 0.00 -1.21 0.00 0.00 61.69 61.06 2gby s THR 89 Cb 0.14 -2.73 -0.20 0.00 -1.51 0.00 0.00 72.50 68.20 2gby s THR 89 CO 0.81 -0.30 0.95 -1.84 -2.21 0.00 0.00 174.62 172.03 2gby n GLU 90 N -3.23 0.07 -4.08 7.08 0.28 -1.26 -4.89 120.64 114.61 2gby n GLU 90 Ca 0.11 -0.02 -0.25 0.00 -0.16 0.00 0.00 57.16 56.85 2gby n GLU 90 Cb 0.52 -1.51 -0.05 0.00 1.43 0.00 0.00 31.44 31.83 2gby n GLU 90 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 2gby s TYR 91 N -3.05 3.18 0.00 -1.84 1.51 -1.26 -4.77 117.35 111.12 2gby s TYR 91 Ca 0.07 -0.03 0.00 0.00 -1.01 0.00 0.00 57.07 56.10 2gby s TYR 91 Cb 0.16 -1.49 0.00 0.00 -0.11 0.00 0.00 41.96 40.51 2gby s TYR 91 CO 0.85 0.52 0.00 0.98 -1.11 0.00 0.00 175.55 176.78 2gby n TYR 92 N -0.67 0.00 -0.56 2.71 4.19 -1.25 -4.29 117.16 117.30 2gby n TYR 92 Ca -0.08 0.00 0.42 0.00 3.31 0.00 0.00 57.90 61.55 2gby n TYR 92 Cb 0.56 0.00 0.66 0.00 0.49 0.00 0.00 39.34 41.04 2gby n TYR 92 CO 0.00 0.00 0.00 0.66 0.91 0.00 0.00 176.86 178.43 2gby n TYR 93 N 0.00 0.07 0.66 2.98 4.01 -1.26 0.30 117.16 123.92 2gby n TYR 93 Ca 0.00 0.07 0.10 0.00 -0.16 0.00 0.00 57.90 57.91 2gby n TYR 93 Cb 0.00 -0.47 0.43 0.00 -0.31 0.00 0.00 39.34 38.99 2gby n TYR 93 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 2gby n PRO 94 N -3.65 0.02 0.00 -0.72 -0.02 -1.26 -3.02 135.00 126.36 2gby n PRO 94 Ca 0.36 0.18 0.12 0.00 -2.02 0.00 0.00 63.50 62.14 2gby n PRO 94 Cb 1.60 -1.54 0.12 0.00 -0.02 0.00 0.00 33.50 33.66 2gby n PRO 94 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2gby n LEU 95 N -1.58 2.63 -0.21 2.45 4.77 0.15 -4.56 117.00 120.64 2gby n LEU 95 Ca 0.05 -0.89 0.01 0.00 -0.03 0.00 0.00 56.01 55.15 2gby n LEU 95 Cb 0.24 -0.00 0.10 0.00 -2.33 0.00 0.00 43.42 41.43 2gby n LEU 95 CO 0.19 0.45 0.80 1.56 -1.33 0.00 0.00 177.39 179.06 2gby h GLN 96 N 3.95 0.08 -0.65 3.23 7.50 -1.67 1.61 115.11 129.16 2gby h GLN 96 Ca 0.00 -0.00 0.17 0.00 0.50 0.00 0.00 58.65 59.32 2gby h GLN 96 Cb 0.90 -0.02 -0.03 0.00 0.05 0.00 0.00 27.48 28.38 2gby h GLN 96 CO 0.00 0.05 0.46 -0.97 -1.50 0.00 0.00 178.83 176.87 2gby h ASN 97 N 0.08 0.09 0.13 1.46 -0.73 -1.85 0.47 115.58 115.23 2gby h ASN 97 Ca 0.33 0.01 -0.36 0.00 1.87 0.00 0.00 56.30 58.14 2gby h ASN 97 Cb 0.53 -0.01 -0.04 0.00 0.27 0.00 0.00 38.32 39.07 2gby h ASN 97 CO -0.58 0.04 -2.12 0.00 -0.37 0.00 0.00 177.43 174.41 2gby n ALA 98 N -2.63 1.15 0.31 1.57 0.00 1.00 -3.63 120.51 118.28 2gby n ALA 98 Ca 0.12 -0.80 0.19 0.00 0.00 0.00 0.00 53.44 52.96 2gby n ALA 98 Cb 0.65 -0.51 1.02 0.00 0.00 0.00 0.00 19.45 20.62 2gby n ALA 98 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2gby h ILE 99 N 0.04 0.17 0.02 0.00 2.04 0.32 -1.23 117.51 118.87 2gby h ILE 99 Ca -0.46 -0.15 -0.00 0.00 1.00 0.00 0.00 64.86 65.25 2gby h ILE 99 Cb 2.01 1.13 0.00 0.00 -0.74 0.00 0.00 36.82 39.22 2gby h ILE 99 CO 0.04 0.02 -0.01 0.40 0.00 0.00 0.00 178.15 178.59 2gby h ILE 100 N 0.00 0.00 -0.83 -0.67 1.08 -0.22 -2.96 117.51 113.91 2gby h ILE 100 Ca -0.00 -0.07 0.19 0.00 -0.39 0.00 0.00 64.86 64.59 2gby h ILE 100 Cb 0.12 0.00 -0.15 0.00 -3.07 0.00 0.00 36.82 33.72 2gby h ILE 100 CO 0.00 0.00 -0.07 -0.33 -0.69 0.00 0.00 178.15 177.06 2gby h GLU 101 N -0.10 0.04 -0.94 2.37 5.08 -1.60 0.42 114.58 119.85 2gby h GLU 101 Ca -0.00 -0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.49 2gby h GLU 101 Cb 0.03 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.19 2gby h GLU 101 CO 0.01 0.03 0.60 0.35 -1.00 0.00 0.00 179.01 178.99 2gby h PHE 102 N 0.05 0.97 -0.04 4.33 3.04 -1.36 -2.36 116.94 121.57 2gby h PHE 102 Ca 0.44 0.03 -0.18 0.00 3.98 0.00 0.00 57.97 62.25 2gby h PHE 102 Cb 0.78 -0.30 0.01 0.00 2.56 0.00 0.00 35.95 39.00 2gby h PHE 102 CO -0.53 0.36 -0.67 -0.92 -2.02 0.00 0.00 178.31 174.53 2gby h TYR 103 N 0.82 0.75 0.00 0.41 5.03 0.00 -2.34 116.97 121.65 2gby h TYR 103 Ca 0.48 -0.38 0.00 0.00 2.58 0.00 0.00 58.73 61.41 2gby h TYR 103 Cb 0.64 -0.10 0.00 0.00 1.55 0.00 0.00 36.73 38.82 2gby h TYR 103 CO -0.00 1.19 0.00 0.25 -1.32 0.00 0.00 178.16 178.28 2gby n THR 104 N -4.14 1.31 -0.05 1.81 -2.24 -0.82 -0.94 114.28 109.21 2gby n THR 104 Ca -0.10 0.35 -0.02 0.00 -2.27 0.00 0.00 64.05 62.01 2gby n THR 104 Cb 0.70 -1.22 -0.12 0.00 -2.10 0.00 0.00 70.33 67.59 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 -1.61 1.16 -0.03 -0.78 2.13 -0.92 -4.63 120.64 115.96 2gby n GLU 105 Ca 0.02 -0.06 0.02 0.00 0.66 0.00 0.00 57.16 57.80 2gby n GLU 105 Cb 0.11 -1.40 0.03 0.00 0.27 0.00 0.00 31.44 30.46 2gby n GLU 105 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 2gby n TYR 106 N -2.41 0.05 0.16 4.31 4.01 -0.89 -4.58 117.16 117.81 2gby n TYR 106 Ca -0.18 -0.57 0.02 0.00 -0.16 0.00 0.00 57.90 57.01 2gby n TYR 106 Cb 0.81 -0.07 0.27 0.00 -0.31 0.00 0.00 39.34 40.04 2gby n TYR 106 CO 0.00 0.00 0.00 0.10 -0.46 0.00 0.00 176.86 176.50 2gby h TYR 107 N 0.18 0.00 0.00 -0.72 -0.00 -1.28 -3.30 116.97 111.85 2gby h TYR 107 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 2gby h TYR 107 Cb 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.33 2gby h TYR 107 CO 0.02 0.49 0.00 1.17 -0.00 0.00 0.00 178.16 179.84 2gby n LYS 108 N -3.73 0.00 -1.44 0.10 3.00 -1.26 -4.50 118.16 110.33 2gby n LYS 108 Ca -0.01 0.27 -0.54 0.00 -0.00 0.00 0.00 58.31 58.04 2gby n LYS 108 Cb 0.54 -1.22 -0.08 0.00 0.00 0.00 0.00 35.03 34.27 2gby n LYS 108 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 2gby n THR 109 N -1.23 0.17 -0.03 3.15 -2.24 -1.24 -4.81 114.28 108.04 2gby n THR 109 Ca 0.00 -0.17 0.23 0.00 -2.27 0.00 0.00 64.05 61.84 2gby n THR 109 Cb 0.00 -1.33 0.72 0.00 -2.10 0.00 0.00 70.33 67.62 2gby n THR 109 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 175.07 173.37 2gby h ASN 110 N 10.84 0.00 0.00 3.42 -1.24 -1.85 -2.92 115.58 123.83 2gby h ASN 110 Ca -0.26 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.75 2gby h ASN 110 Cb 1.34 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.39 2gby h ASN 110 CO 1.03 0.00 0.00 -0.24 -1.29 0.00 0.00 177.43 176.93 2gby n SER 111 N -4.17 0.00 0.10 1.15 2.88 -1.26 -2.85 113.62 109.47 2gby n SER 111 Ca 0.12 0.81 0.18 0.00 -1.33 0.00 0.00 58.87 58.65 2gby n SER 111 Cb 0.71 -0.31 0.74 0.00 -0.75 0.00 0.00 64.21 64.60 2gby n SER 111 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 2gby h ILE 112 N 0.00 0.62 -0.15 2.46 1.08 -1.82 -2.67 117.51 117.04 2gby h ILE 112 Ca 0.00 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.47 2gby h ILE 112 Cb 0.00 0.78 -0.01 0.00 -3.07 0.00 0.00 36.82 34.52 2gby h ILE 112 CO 0.00 0.00 0.09 -1.13 -0.69 0.00 0.00 178.15 176.42 2gby h ASN 113 N 0.00 0.17 -0.54 1.72 -1.24 -1.48 -2.72 115.58 111.50 2gby h ASN 113 Ca 0.17 -0.05 0.10 0.00 0.71 0.00 0.00 56.30 57.23 2gby h ASN 113 Cb 0.77 -0.04 -0.08 0.00 0.73 0.00 0.00 38.32 39.69 2gby h ASN 113 CO -0.00 0.17 0.05 -0.33 -1.29 0.00 0.00 177.43 176.03 2gby h GLU 114 N 0.17 0.17 -0.10 6.67 5.08 -1.32 -1.71 114.58 123.53 2gby h GLU 114 Ca 0.05 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.43 2gby h GLU 114 Cb 0.03 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 2gby h GLU 114 CO -0.01 0.11 -0.06 0.87 -1.00 0.00 0.00 179.01 178.92 2gby h LYS 115 N 0.17 -0.07 -0.80 2.33 1.57 -1.63 -0.90 116.57 117.25 2gby h LYS 115 Ca 0.27 0.00 0.12 0.00 -1.87 0.00 0.00 60.65 59.18 2gby h LYS 115 Cb 0.41 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.68 2gby h LYS 115 CO -0.41 -0.04 0.52 0.52 -0.57 0.00 0.00 179.45 179.47 2gby h MET 116 N -0.07 0.63 -0.15 3.15 2.86 -1.08 -1.70 114.93 118.57 2gby h MET 116 Ca 0.06 -0.04 -0.11 0.00 -2.06 0.00 0.00 59.70 57.55 2gby h MET 116 Cb 0.16 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 31.68 2gby h MET 116 CO -0.14 0.42 -0.35 -0.91 1.06 0.00 0.00 176.91 176.99 2gby h ASN 117 N 0.65 0.57 0.16 1.22 4.21 -0.64 -2.24 115.58 119.51 2gby h ASN 117 Ca 0.38 -0.57 0.01 0.00 1.21 0.00 0.00 56.30 57.33 2gby h ASN 117 Cb 0.58 -0.16 -0.04 0.00 -1.12 0.00 0.00 38.32 37.57 2gby h ASN 117 CO -0.15 1.03 -0.53 0.50 -1.29 0.00 0.00 177.43 177.00 2gby h LYS 118 N 0.13 -0.75 -0.75 0.81 3.64 -0.30 -1.41 116.57 117.94 2gby h LYS 118 Ca -0.00 0.05 0.13 0.00 -1.27 0.00 0.00 60.65 59.56 2gby h LYS 118 Cb 0.95 0.17 -0.09 0.00 -0.41 0.00 0.00 32.23 32.85 2gby h LYS 118 CO 0.08 -0.50 0.32 -0.07 -2.27 0.00 0.00 179.45 177.01 2gby h LEU 119 N -0.78 0.35 -2.13 5.20 3.38 -1.47 -0.28 115.31 119.57 2gby h LEU 119 Ca -0.01 0.09 0.06 0.00 0.09 0.00 0.00 57.88 58.11 2gby h LEU 119 Cb 0.77 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 2gby h LEU 119 CO -0.26 0.16 0.17 -0.08 0.09 0.00 0.00 178.44 178.52 2gby h GLU 120 N 0.50 0.00 -0.08 1.13 4.81 -0.65 -1.45 114.58 118.84 2gby h GLU 120 Ca 0.40 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.49 2gby h GLU 120 Cb 0.55 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 2gby h GLU 120 CO -0.36 0.00 -0.55 -0.91 -0.73 0.00 0.00 179.01 176.46 2gby h ASN 121 N 0.00 0.25 -0.20 1.04 2.35 -0.05 -2.01 115.58 116.96 2gby h ASN 121 Ca 0.10 -0.13 -0.18 0.00 -0.55 0.00 0.00 56.30 55.53 2gby h ASN 121 Cb 0.44 -0.07 0.01 0.00 0.05 0.00 0.00 38.32 38.74 2gby h ASN 121 CO -0.00 0.74 -0.60 0.11 -1.65 0.00 0.00 177.43 176.04 2gby h LYS 122 N 0.17 0.75 -0.98 0.81 1.57 -1.29 0.71 116.57 118.32 2gby h LYS 122 Ca 0.00 -0.55 0.13 0.00 -1.87 0.00 0.00 60.65 58.37 2gby h LYS 122 Cb 1.02 0.09 -0.09 0.00 0.08 0.00 0.00 32.23 33.33 2gby h LYS 122 CO 0.08 1.17 0.60 -0.92 -0.57 0.00 0.00 179.45 179.81 2gby h TYR 123 N 0.48 1.07 0.00 -1.35 3.20 -1.26 -0.08 116.97 119.03 2gby h TYR 123 Ca -0.02 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 2gby h TYR 123 Cb 1.22 -0.33 -0.00 0.00 1.54 0.00 0.00 36.73 39.15 2gby h TYR 123 CO 0.09 0.38 -0.69 0.82 -1.64 0.00 0.00 178.16 177.11 2gby h ILE 124 N 0.90 0.03 -0.39 1.81 1.08 -1.27 -3.37 117.51 116.30 2gby h ILE 124 Ca 0.50 -1.05 0.05 0.00 -0.39 0.00 0.00 64.86 63.98 2gby h ILE 124 Cb 0.57 1.68 -0.05 0.00 -3.07 0.00 0.00 36.82 35.96 2gby h ILE 124 CO -0.30 0.02 0.11 -0.78 -0.69 0.00 0.00 178.15 176.52 2gby h ASP 125 N 0.00 0.10 -0.70 1.72 -0.00 0.11 -0.96 116.42 116.69 2gby h ASP 125 Ca -0.00 0.05 0.14 0.00 -0.00 0.00 0.00 57.03 57.22 2gby h ASP 125 Cb 1.02 0.05 -0.13 0.00 -0.00 0.00 0.00 39.33 40.27 2gby h ASP 125 CO 0.00 0.09 -0.15 0.00 -0.00 0.00 0.00 179.24 179.18 2gby h ALA 126 N 1.27 0.49 -0.40 -0.78 0.00 -1.70 0.75 119.26 118.88 2gby h ALA 126 Ca 0.18 0.27 -0.14 0.00 0.00 0.00 0.00 54.91 55.22 2gby h ALA 126 Cb 0.18 0.51 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2gby h ALA 126 CO -0.21 -0.42 -0.27 1.88 0.00 0.00 0.00 179.25 180.23 2gby h TYR 127 N 0.01 1.06 -0.55 0.00 0.05 -1.71 -2.24 116.97 113.59 2gby h TYR 127 Ca 0.34 -0.29 0.02 0.00 0.05 0.00 0.00 58.73 58.86 2gby h TYR 127 Cb 0.53 -0.23 -0.03 0.00 1.01 0.00 0.00 36.73 38.00 2gby h TYR 127 CO -0.54 1.09 0.34 1.25 -1.05 0.00 0.00 178.16 179.24 2gby h HIS 128 N 0.72 0.63 0.45 4.88 2.76 0.64 -1.44 115.15 123.79 2gby h HIS 128 Ca 0.08 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.25 2gby h HIS 128 Cb 0.85 -0.21 0.00 0.00 1.55 0.00 0.00 27.41 29.61 2gby h HIS 128 CO 0.06 0.37 -0.23 0.28 -1.30 0.00 0.00 177.93 177.11 2gby h VAL 129 N 0.67 0.53 -0.04 5.26 2.07 0.44 -0.24 116.25 124.94 2gby h VAL 129 Ca 0.22 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.77 2gby h VAL 129 Cb 0.01 0.53 -0.06 0.00 -1.52 0.00 0.00 31.29 30.25 2gby h VAL 129 CO -0.09 0.00 -0.45 0.40 0.02 0.00 0.00 177.57 177.45 2gby h ILE 130 N -0.62 0.11 -0.79 4.57 2.04 -1.13 0.24 117.51 121.94 2gby h ILE 130 Ca -0.06 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.79 2gby h ILE 130 Cb 0.48 0.11 -0.04 0.00 -0.74 0.00 0.00 36.82 36.64 2gby h ILE 130 CO 0.09 0.00 0.43 -0.26 0.00 0.00 0.00 178.15 178.41 2gby h PHE 131 N -0.58 1.07 0.10 1.37 0.04 -1.28 0.22 116.94 117.88 2gby h PHE 131 Ca 0.05 -0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.79 2gby h PHE 131 Cb 0.66 -0.34 -0.00 0.00 2.20 0.00 0.00 35.95 38.47 2gby h PHE 131 CO -0.47 0.74 -0.07 -0.22 -0.60 0.00 0.00 178.31 177.69 2gby h LYS 132 N 1.10 -0.16 -0.82 1.51 3.64 -0.23 -0.88 116.57 120.73 2gby h LYS 132 Ca 0.28 0.01 0.21 0.00 -1.27 0.00 0.00 60.65 59.88 2gby h LYS 132 Cb 0.02 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 31.83 2gby h LYS 132 CO -0.05 -0.11 0.57 0.93 -2.27 0.00 0.00 179.45 178.53 2gby h GLU 133 N -0.17 0.19 -0.11 1.90 4.39 -0.92 -0.19 114.58 119.67 2gby h GLU 133 Ca -0.01 -0.01 0.01 0.00 0.34 0.00 0.00 59.36 59.69 2gby h GLU 133 Cb 0.14 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 2gby h GLU 133 CO 0.00 0.13 0.04 0.78 -1.16 0.00 0.00 179.01 178.80 2gby h GLY 134 N 0.20 0.13 1.16 -3.84 0.00 -0.02 0.13 103.07 100.82 2gby h GLY 134 Ca 0.41 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.72 2gby h GLY 134 CO -0.08 0.02 0.53 3.43 0.00 0.00 0.00 176.54 180.44 2gby h ASN 135 N 0.09 0.99 -0.07 0.19 2.35 0.37 0.97 115.58 120.47 2gby h ASN 135 Ca 0.05 -0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2gby h ASN 135 Cb 0.02 -0.25 -0.00 0.00 0.05 0.00 0.00 38.32 38.14 2gby h ASN 135 CO -0.05 0.74 0.03 -0.07 -1.65 0.00 0.00 177.43 176.43 2gby h LEU 136 N 1.15 0.10 -0.61 1.61 3.38 -0.89 -1.71 115.31 118.34 2gby h LEU 136 Ca 0.31 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2gby h LEU 136 Cb -0.09 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.63 2gby h LEU 136 CO -0.06 0.23 0.00 0.59 0.09 0.00 0.00 178.44 179.29 2gby n ASN 137 N -4.95 0.47 -2.07 -0.43 4.13 0.38 -4.82 115.26 107.98 2gby n ASN 137 Ca -0.06 -1.55 -0.11 0.00 1.68 0.00 0.00 54.58 54.54 2gby n ASN 137 Cb 0.11 -0.23 -0.02 0.00 -1.54 0.00 0.00 39.78 38.10 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 0.18 0.02 0.25 7.41 0.00 -0.64 -4.80 105.19 107.60 2gby n GLY 138 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 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 0.00 0.00 -2.42 1.61 5.08 -1.06 -3.47 114.58 114.32 2gby h GLU 139 Ca -0.25 0.00 0.21 0.00 -1.00 0.00 0.00 59.36 58.33 2gby h GLU 139 Cb 1.03 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.24 2gby h GLU 139 CO 0.31 0.10 0.68 1.67 -1.00 0.00 0.00 179.01 180.77 2gby s TRP 140 N -3.59 0.06 -0.17 4.33 -2.14 -1.25 -5.02 118.94 111.17 2gby s TRP 140 Ca 0.02 -0.38 -0.01 0.00 2.66 0.00 0.00 56.10 58.38 2gby s TRP 140 Cb 0.09 0.66 0.05 0.00 -3.10 0.00 0.00 33.47 31.17 2gby s TRP 140 CO 0.60 -0.74 -0.01 0.45 -2.66 0.00 0.00 176.95 174.59 2gby s SER 141 N -3.52 2.80 -0.16 -2.66 0.15 -1.26 -4.18 113.70 104.87 2gby s SER 141 Ca 0.24 -0.70 -0.00 0.00 0.70 0.00 0.00 55.95 56.19 2gby s SER 141 Cb -0.02 -0.75 0.04 0.00 -1.71 0.00 0.00 66.02 63.57 2gby s SER 141 CO 0.04 -0.24 -0.07 -0.63 1.20 0.00 0.00 173.24 173.53 2gby s ILE 142 N 1.74 1.22 -0.00 6.45 1.01 -1.26 -4.82 121.20 125.54 2gby s ILE 142 Ca -0.00 -0.62 -0.07 0.00 0.00 0.00 0.00 60.65 59.96 2gby s ILE 142 Cb -0.16 -1.32 -0.04 0.00 0.01 0.00 0.00 42.46 40.95 2gby s ILE 142 CO -0.07 0.22 0.71 0.78 0.00 0.00 0.00 174.94 176.58 2gby h ASN 143 N 8.10 -0.22 -3.05 3.58 -0.26 -1.99 -3.38 115.58 118.37 2gby h ASN 143 Ca -0.27 0.01 -0.73 0.00 -0.56 0.00 0.00 56.30 54.75 2gby h ASN 143 Cb 1.12 0.06 -0.21 0.00 -1.06 0.00 0.00 38.32 38.22 2gby h ASN 143 CO 0.43 -0.10 0.29 -0.62 -1.06 0.00 0.00 177.43 176.37 2gby s ASP 144 N -3.08 6.47 0.10 5.81 3.68 -1.26 -4.85 116.67 123.54 2gby s ASP 144 Ca -0.04 -1.97 -0.17 0.00 2.13 0.00 0.00 52.55 52.50 2gby s ASP 144 Cb 0.00 -2.30 -0.07 0.00 -1.45 0.00 0.00 42.92 39.11 2gby s ASP 144 CO 0.11 -0.94 1.50 0.58 0.13 0.00 0.00 175.17 176.55 2gby h VAL 145 N 5.56 1.28 -0.69 1.11 2.07 -2.00 -2.78 116.25 120.80 2gby h VAL 145 Ca -0.06 -1.10 0.08 0.00 0.82 0.00 0.00 66.70 66.44 2gby h VAL 145 Cb 1.06 1.38 -0.06 0.00 -1.52 0.00 0.00 31.29 32.14 2gby h VAL 145 CO 1.00 0.35 0.36 0.78 0.02 0.00 0.00 177.57 180.08 2gby h ASN 146 N 0.35 0.50 0.04 0.57 4.21 -1.96 0.70 115.58 119.98 2gby h ASN 146 Ca 0.08 0.05 -0.00 0.00 1.21 0.00 0.00 56.30 57.63 2gby h ASN 146 Cb 0.55 -0.04 0.00 0.00 -1.12 0.00 0.00 38.32 37.71 2gby h ASN 146 CO 0.03 0.30 -0.02 0.00 -1.29 0.00 0.00 177.43 176.45 2gby h ALA 147 N 1.40 -0.05 -0.48 -0.83 0.00 -1.95 -0.77 119.26 116.57 2gby h ALA 147 Ca 0.33 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.12 2gby h ALA 147 Cb 0.29 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2gby h ALA 147 CO -0.23 -0.53 -0.14 0.28 0.00 0.00 0.00 179.25 178.63 2gby h VAL 148 N -0.06 1.27 -0.46 0.00 2.07 -1.12 -0.48 116.25 117.47 2gby h VAL 148 Ca -0.01 -1.27 0.03 0.00 0.82 0.00 0.00 66.70 66.27 2gby h VAL 148 Cb 0.04 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 30.82 2gby h VAL 148 CO 0.01 0.44 0.26 0.28 0.02 0.00 0.00 177.57 178.58 2gby h SER 149 N 0.81 0.41 -0.18 0.57 0.02 0.63 0.38 113.55 116.19 2gby h SER 149 Ca 0.12 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.05 2gby h SER 149 Cb 0.68 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.14 2gby h SER 149 CO 0.05 0.29 -0.02 0.50 -1.14 0.00 0.00 176.83 176.51 2gby h LYS 150 N 0.52 0.33 0.18 3.45 3.64 -0.97 -0.52 116.57 123.20 2gby h LYS 150 Ca 0.19 -0.11 0.01 0.00 -1.27 0.00 0.00 60.65 59.47 2gby h LYS 150 Cb 0.05 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.82 2gby h LYS 150 CO -0.11 0.56 -0.25 0.82 -2.27 0.00 0.00 179.45 178.20 2gby h ILE 151 N 0.06 0.45 -0.21 2.00 2.04 -0.77 0.10 117.51 121.18 2gby h ILE 151 Ca 0.05 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.95 2gby h ILE 151 Cb 0.42 0.45 -0.07 0.00 -0.74 0.00 0.00 36.82 36.88 2gby h ILE 151 CO 0.01 0.00 -0.49 0.00 0.00 0.00 0.00 178.15 177.68 2gby h ALA 152 N 0.21 -0.70 0.00 1.87 0.00 -0.18 0.19 119.26 120.64 2gby h ALA 152 Ca 0.01 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.93 2gby h ALA 152 Cb 0.49 0.93 -0.03 0.00 0.00 0.00 0.00 17.79 19.18 2gby h ALA 152 CO -0.11 -1.00 -0.14 0.00 0.00 0.00 0.00 179.25 178.01 2gby h ALA 153 N -0.01 -0.16 -0.20 0.00 0.00 -0.85 -0.76 119.26 117.28 2gby h ALA 153 Ca 0.07 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2gby h ALA 153 Cb 0.64 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 2gby h ALA 153 CO -0.46 -0.63 -0.03 -0.91 0.00 0.00 0.00 179.25 177.22 2gby h ASN 154 N -0.23 0.28 0.09 0.00 -0.26 -0.56 0.24 115.58 115.13 2gby h ASN 154 Ca 0.05 -0.04 -0.00 0.00 -0.56 0.00 0.00 56.30 55.74 2gby h ASN 154 Cb 0.29 -0.07 0.00 0.00 -1.06 0.00 0.00 38.32 37.48 2gby h ASN 154 CO -0.13 0.36 -0.04 0.00 -1.06 0.00 0.00 177.43 176.55 2gby h ALA 155 N 1.68 -0.12 -0.03 -0.83 0.00 -0.22 -1.52 119.26 118.22 2gby h ALA 155 Ca 0.07 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 2gby h ALA 155 Cb 0.25 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 2gby h ALA 155 CO 0.01 -0.35 0.01 0.28 0.00 0.00 0.00 179.25 179.21 2gby h VAL 156 N -0.56 1.10 -0.97 0.00 2.07 -0.99 -0.52 116.25 116.38 2gby h VAL 156 Ca -0.01 -0.28 0.21 0.00 0.82 0.00 0.00 66.70 67.44 2gby h VAL 156 Cb 0.46 1.23 -0.09 0.00 -1.52 0.00 0.00 31.29 31.38 2gby h VAL 156 CO 0.02 0.08 0.62 -1.13 0.02 0.00 0.00 177.57 177.17 2gby h ASN 157 N -0.07 0.58 -0.34 0.57 -0.73 -0.99 0.35 115.58 114.95 2gby h ASN 157 Ca 0.01 0.07 -0.09 0.00 1.87 0.00 0.00 56.30 58.16 2gby h ASN 157 Cb 0.11 -0.03 -0.01 0.00 0.27 0.00 0.00 38.32 38.66 2gby h ASN 157 CO -0.00 0.20 -0.14 1.23 -0.37 0.00 0.00 177.43 178.36 2gby h GLY 158 N 0.56 0.75 0.96 1.57 0.00 -0.54 -1.21 103.07 105.16 2gby h GLY 158 Ca 0.54 -0.66 -0.00 0.00 0.00 0.00 0.00 47.33 47.21 2gby h GLY 158 CO -0.28 0.60 0.09 -2.22 0.00 0.00 0.00 176.54 174.72 2gby h ILE 159 N 0.47 1.07 -0.53 2.60 1.08 0.11 -1.49 117.51 120.83 2gby h ILE 159 Ca 0.08 -0.19 0.05 0.00 -0.39 0.00 0.00 64.86 64.41 2gby h ILE 159 Cb 0.66 0.94 -0.05 0.00 -3.07 0.00 0.00 36.82 35.31 2gby h ILE 159 CO 0.04 0.07 0.27 0.58 -0.69 0.00 0.00 178.15 178.42 2gby h VAL 160 N 0.16 0.96 0.00 1.67 2.07 -0.43 -3.08 116.25 117.59 2gby h VAL 160 Ca 0.05 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.39 2gby h VAL 160 Cb 0.04 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 2gby h VAL 160 CO -0.01 0.10 -0.76 0.35 0.02 0.00 0.00 177.57 177.26 2gby n THR 161 N -4.87 0.04 -0.66 2.57 -2.24 -0.46 -4.08 114.28 104.58 2gby n THR 161 Ca 0.05 -0.06 0.07 0.00 -2.27 0.00 0.00 64.05 61.85 2gby n THR 161 Cb 0.14 0.45 0.22 0.00 -2.10 0.00 0.00 70.33 69.04 2gby n THR 161 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2gby n PHE 162 N -1.61 0.78 -1.87 4.78 3.01 -0.57 -4.38 117.46 117.60 2gby n PHE 162 Ca 0.04 -0.72 0.00 0.00 1.01 0.00 0.00 57.45 57.79 2gby n PHE 162 Cb 0.36 -0.20 0.00 0.00 -0.01 0.00 0.00 39.48 39.63 2gby n PHE 162 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 2gby n THR 163 N -0.05 0.06 -2.05 4.37 -2.24 -1.16 -4.95 114.28 108.26 2gby n THR 163 Ca 0.18 -0.07 -0.42 0.00 -2.27 0.00 0.00 64.05 61.46 2gby n THR 163 Cb 0.71 0.52 0.00 0.00 -2.10 0.00 0.00 70.33 69.47 2gby n THR 163 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 2gby n HIS 164 N -0.05 3.55 0.00 4.78 -0.00 -1.26 -4.15 115.22 118.10 2gby n HIS 164 Ca 0.00 -2.93 0.00 0.00 -0.00 0.00 0.00 57.72 54.80 2gby n HIS 164 Cb 0.68 -2.37 0.00 0.00 -0.00 0.00 0.00 29.99 28.30 2gby n HIS 164 CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 176.34 175.49 2gby n GLU 165 N 5.67 0.00 0.00 1.57 0.28 -1.26 -5.13 120.64 121.77 2gby n GLU 165 Ca 0.47 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.47 2gby n GLU 165 Cb 0.39 -0.33 0.00 0.00 1.43 0.00 0.00 31.44 32.93 2gby n GLU 165 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2gby n GLN 166 N -1.74 3.68 -1.69 3.44 0.00 -1.26 -5.07 117.38 114.74 2gby n GLN 166 Ca 0.00 0.00 -0.59 0.00 0.00 0.00 0.00 57.00 56.41 2gby n GLN 166 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 30.24 30.16 2gby n GLN 166 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 2gby n ASN 167 N 0.00 1.93 0.26 2.61 4.05 -1.26 -4.85 115.26 118.01 2gby n ASN 167 Ca 0.00 1.11 0.18 0.00 0.45 0.00 0.00 54.58 56.32 2gby n ASN 167 Cb 0.00 -1.09 0.94 0.00 1.23 0.00 0.00 39.78 40.86 2gby n ASN 167 CO 0.00 0.00 0.00 -0.29 -3.05 0.00 0.00 177.26 173.92 2gby h ILE 168 N 4.79 0.00 0.21 -1.44 6.09 -1.97 -1.62 117.51 123.58 2gby h ILE 168 Ca -0.46 -0.03 -0.30 0.00 -1.37 0.00 0.00 64.86 62.69 2gby h ILE 168 Cb 1.34 0.83 0.03 0.00 0.47 0.00 0.00 36.82 39.48 2gby h ILE 168 CO 0.92 0.00 -1.36 0.78 -3.07 0.00 0.00 178.15 175.42 2gby h ASN 169 N 0.00 0.71 -0.39 2.19 2.35 -1.99 -2.81 115.58 115.64 2gby h ASN 169 Ca 0.00 -0.93 -0.02 0.00 -0.55 0.00 0.00 56.30 54.80 2gby h ASN 169 Cb 0.04 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.16 2gby h ASN 169 CO 0.00 1.65 0.16 -0.33 -1.65 0.00 0.00 177.43 177.26 2gby h GLU 170 N -0.01 0.58 -0.22 0.81 4.39 -1.69 0.10 114.58 118.54 2gby h GLU 170 Ca -0.25 -0.10 0.05 0.00 0.34 0.00 0.00 59.36 59.40 2gby h GLU 170 Cb 2.02 -0.10 -0.05 0.00 -0.10 0.00 0.00 28.75 30.53 2gby h GLU 170 CO 0.22 0.55 -0.08 0.00 -1.16 0.00 0.00 179.01 178.54 2gby h ARG 171 N 0.49 -0.04 -0.33 2.33 3.08 -1.47 0.40 114.38 118.83 2gby h ARG 171 Ca 0.13 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.18 2gby h ARG 171 Cb 0.18 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 2gby h ARG 171 CO -0.01 -0.03 0.18 0.82 -1.07 0.00 0.00 179.97 179.86 2gby h ILE 172 N -0.04 1.10 0.18 2.04 2.04 -1.20 0.94 117.51 122.56 2gby h ILE 172 Ca 0.12 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 2gby h ILE 172 Cb 0.22 0.66 0.00 0.00 -0.74 0.00 0.00 36.82 36.96 2gby h ILE 172 CO -0.26 0.11 -0.09 0.50 0.00 0.00 0.00 178.15 178.42 2gby h LYS 173 N 0.45 -0.23 -0.72 2.37 3.64 0.17 -1.82 116.57 120.43 2gby h LYS 173 Ca 0.12 0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.56 2gby h LYS 173 Cb 0.01 0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.83 2gby h LYS 173 CO -0.02 0.13 0.44 -0.07 -2.27 0.00 0.00 179.45 177.66 2gby h LEU 174 N -0.63 0.70 -0.22 5.20 3.38 -0.00 -1.84 115.31 121.90 2gby h LEU 174 Ca -0.02 0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.00 2gby h LEU 174 Cb 0.46 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.03 2gby h LEU 174 CO 0.04 0.47 -0.05 -0.03 0.09 0.00 0.00 178.44 178.96 2gby h MET 175 N 0.84 0.00 -0.19 1.13 4.05 -0.78 -1.46 114.93 118.52 2gby h MET 175 Ca 0.30 -0.00 -0.04 0.00 -0.28 0.00 0.00 59.70 59.68 2gby h MET 175 Cb 0.08 -0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 30.87 2gby h MET 175 CO -0.14 0.00 -0.07 -0.91 0.23 0.00 0.00 176.91 176.02 2gby h ASN 176 N 0.00 0.28 -0.42 1.39 -0.26 -0.70 -0.30 115.58 115.57 2gby h ASN 176 Ca 0.11 -0.05 -0.09 0.00 -0.56 0.00 0.00 56.30 55.70 2gby h ASN 176 Cb 0.16 -0.07 -0.02 0.00 -1.06 0.00 0.00 38.32 37.33 2gby h ASN 176 CO -0.23 0.39 -0.07 0.50 -1.06 0.00 0.00 177.43 176.97 2gby h LYS 177 N 0.29 0.85 0.70 0.81 3.11 -0.69 -1.88 116.57 119.77 2gby h LYS 177 Ca 0.06 -0.27 -0.03 0.00 -2.81 0.00 0.00 60.65 57.59 2gby h LYS 177 Cb 0.32 -0.08 0.01 0.00 -1.00 0.00 0.00 32.23 31.48 2gby h LYS 177 CO 0.01 0.90 -0.34 0.35 -2.81 0.00 0.00 179.45 177.57 2gby h PHE 178 N 0.78 -0.87 -1.00 1.91 3.57 -0.28 0.26 116.94 121.31 2gby h PHE 178 Ca 0.14 -0.02 0.39 0.00 3.53 0.00 0.00 57.97 62.00 2gby h PHE 178 Cb 0.56 0.29 -0.18 0.00 2.79 0.00 0.00 35.95 39.42 2gby h PHE 178 CO 0.03 -0.54 0.48 0.77 -2.23 0.00 0.00 178.31 176.82 2gby h SER 179 N -1.02 0.25 0.38 0.41 0.02 -0.98 0.53 113.55 113.15 2gby h SER 179 Ca -0.10 0.25 -0.02 0.00 -0.84 0.00 0.00 61.79 61.09 2gby h SER 179 Cb 0.72 0.28 0.00 0.00 0.14 0.00 0.00 62.40 63.54 2gby h SER 179 CO 0.16 -0.39 -0.18 -0.61 -1.14 0.00 0.00 176.83 174.67 2gby h GLN 180 N 0.04 -0.49 -0.68 3.45 4.15 -1.08 -0.41 115.11 120.09 2gby h GLN 180 Ca 0.80 0.03 0.10 0.00 0.77 0.00 0.00 58.65 60.36 2gby h GLN 180 Cb 2.05 0.11 -0.12 0.00 0.21 0.00 0.00 27.48 29.74 2gby h GLN 180 CO -0.77 -0.33 -0.42 0.82 -1.93 0.00 0.00 178.83 176.20 2gby h ILE 181 N -0.81 0.08 0.00 2.39 2.04 0.13 0.16 117.51 121.50 2gby h ILE 181 Ca -0.05 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.84 2gby h ILE 181 Cb 0.39 0.08 -0.05 0.00 -0.74 0.00 0.00 36.82 36.49 2gby h ILE 181 CO 0.09 0.00 -0.37 0.15 0.00 0.00 0.00 178.15 178.01 2gby h PHE 182 N -0.16 -1.04 -0.80 1.37 3.57 -0.13 -0.62 116.94 119.14 2gby h PHE 182 Ca 0.21 0.03 0.09 0.00 3.53 0.00 0.00 57.97 61.84 2gby h PHE 182 Cb 0.56 0.46 -0.07 0.00 2.79 0.00 0.00 35.95 39.68 2gby h PHE 182 CO -0.75 -0.46 0.45 -0.07 -2.23 0.00 0.00 178.31 175.25 2gby h LEU 183 N -0.53 0.64 0.54 0.59 3.38 0.36 -1.63 115.31 118.65 2gby h LEU 183 Ca 0.05 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 2gby h LEU 183 Cb 0.61 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 41.29 2gby h LEU 183 CO -0.29 0.37 -0.26 0.78 0.09 0.00 0.00 178.44 179.13 2gby h ASN 184 N 0.76 -0.61 -0.21 -0.43 2.35 -0.27 -2.50 115.58 114.67 2gby h ASN 184 Ca 0.38 -0.03 0.06 0.00 -0.55 0.00 0.00 56.30 56.16 2gby h ASN 184 Cb 0.35 0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.87 2gby h ASN 184 CO -0.25 -0.35 0.38 1.23 -1.65 0.00 0.00 177.43 176.79 2gby h GLY 185 N -0.86 0.00 1.36 2.83 0.00 -0.82 -2.07 103.07 103.51 2gby h GLY 185 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.26 2gby h GLY 185 CO 0.12 0.00 0.01 1.04 0.00 0.00 0.00 176.54 177.71 2gby n LEU 186 N -3.36 0.00 0.00 3.11 4.77 -0.64 -5.10 117.00 115.79 2gby n LEU 186 Ca 0.03 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 2gby n LEU 186 Cb 0.49 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 2gby n LEU 186 CO 0.21 -0.21 0.00 -1.20 -1.33 0.00 0.00 177.39 174.87