#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yau h ARG 5 N 0.00 -0.12 -0.63 -1.58 3.08 -2.06 -0.63 114.38 112.44 1yau h ARG 5 Ca 0.00 0.01 -0.06 0.00 0.07 0.00 0.00 59.98 60.00 1yau h ARG 5 Cb 0.00 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.05 1yau h ARG 5 CO 0.00 -0.08 0.16 0.00 -1.07 0.00 0.00 179.97 178.98 1yau h ALA 6 N 1.02 1.10 -0.48 0.04 0.00 -2.05 -2.84 119.26 116.05 1yau h ALA 6 Ca 0.12 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1yau h ALA 6 Cb 0.30 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1yau h ALA 6 CO -0.28 0.60 0.32 0.00 0.00 0.00 0.00 179.25 179.90 1yau h ALA 7 N 1.23 0.61 -0.69 0.00 0.00 -1.72 -0.53 119.26 118.16 1yau h ALA 7 Ca 0.20 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.18 1yau h ALA 7 Cb 0.32 -0.20 -0.08 0.00 0.00 0.00 0.00 17.79 17.84 1yau h ALA 7 CO -0.00 0.06 0.31 -0.07 0.00 0.00 0.00 179.25 179.54 1yau h LEU 8 N 0.65 0.35 0.04 0.00 3.38 -1.01 -0.19 115.31 118.53 1yau h LEU 8 Ca 0.18 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.22 1yau h LEU 8 Cb -0.07 0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1yau h LEU 8 CO -0.04 0.19 -0.02 0.40 0.09 0.00 0.00 178.44 179.06 1yau h ILE 9 N 0.51 1.23 -0.84 1.22 2.04 -1.25 -2.46 117.51 117.97 1yau h ILE 9 Ca 0.36 -0.89 0.11 0.00 1.00 0.00 0.00 64.86 65.43 1yau h ILE 9 Cb 0.44 1.83 -0.08 0.00 -0.74 0.00 0.00 36.82 38.26 1yau h ILE 9 CO -0.31 0.23 0.47 -0.61 0.00 0.00 0.00 178.15 177.92 1yau h GLN 10 N -0.45 0.72 -0.64 2.37 5.75 -1.00 0.06 115.11 121.93 1yau h GLN 10 Ca -0.01 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.45 1yau h GLN 10 Cb 0.41 -0.16 -0.03 0.00 1.07 0.00 0.00 27.48 28.77 1yau h GLN 10 CO 0.01 0.48 0.40 -0.91 -2.65 0.00 0.00 178.83 176.16 1yau h ASN 11 N 0.74 0.75 -0.48 -0.69 2.35 -0.99 0.15 115.58 117.42 1yau h ASN 11 Ca 0.42 -0.04 0.08 0.00 -0.55 0.00 0.00 56.30 56.21 1yau h ASN 11 Cb 0.46 -0.19 -0.07 0.00 0.05 0.00 0.00 38.32 38.57 1yau h ASN 11 CO -0.28 0.57 0.08 0.25 -1.65 0.00 0.00 177.43 176.40 1yau h LEU 12 N 0.87 -0.03 0.13 1.61 5.85 -0.84 -2.08 115.31 120.82 1yau h LEU 12 Ca 0.23 0.09 -0.29 0.00 0.84 0.00 0.00 57.88 58.75 1yau h LEU 12 Cb -0.06 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.10 1yau h LEU 12 CO -0.05 0.02 -1.37 0.03 -0.34 0.00 0.00 178.44 176.73 1yau h ARG 13 N 0.21 0.27 -0.50 1.25 3.08 -0.59 -2.53 114.38 115.57 1yau h ARG 13 Ca 0.24 -0.47 -0.06 0.00 0.07 0.00 0.00 59.98 59.76 1yau h ARG 13 Cb 0.32 0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.52 1yau h ARG 13 CO -0.33 1.19 0.06 -0.44 -1.07 0.00 0.00 179.97 179.38 1yau h ASP 14 N 0.07 0.75 1.15 7.04 3.32 -0.75 -2.99 116.42 125.00 1yau h ASP 14 Ca -0.18 -0.15 -0.11 0.00 0.02 0.00 0.00 57.03 56.60 1yau h ASP 14 Cb 2.00 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 41.33 1yau h ASP 14 CO 0.19 0.78 -0.55 -1.28 -1.72 0.00 0.00 179.24 176.66 1yau h SER 15 N 0.75 0.00 -3.51 6.45 0.87 -1.37 -3.39 113.55 113.35 1yau h SER 15 Ca 0.16 0.00 -0.62 0.00 -1.23 0.00 0.00 61.79 60.10 1yau h SER 15 Cb 0.37 0.00 -0.40 0.00 -0.44 0.00 0.00 62.40 61.93 1yau h SER 15 CO 0.01 0.55 -0.73 -0.31 -0.53 0.00 0.00 176.83 175.82 1yau s TYR 16 N -3.17 2.54 0.48 2.24 1.51 -0.96 -5.04 117.35 114.95 1yau s TYR 16 Ca 0.02 -2.41 0.08 0.00 -1.01 0.00 0.00 57.07 53.74 1yau s TYR 16 Cb 0.09 -2.23 0.03 0.00 -0.11 0.00 0.00 41.96 39.73 1yau s TYR 16 CO 0.74 -0.87 0.54 0.95 -1.11 0.00 0.00 175.55 175.80 1yau s THR 17 N 0.95 2.43 0.60 -0.71 -4.23 -1.23 -4.70 115.64 108.75 1yau s THR 17 Ca 0.12 -1.20 0.31 0.00 -1.18 0.00 0.00 61.69 59.74 1yau s THR 17 Cb -0.20 -2.62 0.36 0.00 1.34 0.00 0.00 72.50 71.38 1yau s THR 17 CO -0.12 0.00 2.14 -0.08 -0.54 0.00 0.00 174.62 176.02 1yau h GLU 18 N 0.66 0.00 -0.28 3.99 4.22 -1.94 -1.88 114.58 119.35 1yau h GLU 18 Ca -0.37 0.00 -0.12 0.00 0.08 0.00 0.00 59.36 58.94 1yau h GLU 18 Cb 1.28 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.53 1yau h GLU 18 CO 0.50 0.00 -0.31 1.15 -2.18 0.00 0.00 179.01 178.17 1yau h THR 19 N 0.00 1.30 -0.45 0.32 2.02 -1.98 0.87 112.91 115.00 1yau h THR 19 Ca 0.06 -1.49 0.08 0.00 0.77 0.00 0.00 66.41 65.84 1yau h THR 19 Cb 0.39 1.61 -0.07 0.00 -1.74 0.00 0.00 68.15 68.33 1yau h THR 19 CO -0.00 0.48 -0.00 0.28 0.37 0.00 0.00 175.52 176.64 1yau h SER 20 N 0.44 -0.19 -0.12 4.18 0.02 -1.72 0.30 113.55 116.47 1yau h SER 20 Ca 0.04 0.11 -0.20 0.00 -0.84 0.00 0.00 61.79 60.89 1yau h SER 20 Cb 0.89 0.19 0.01 0.00 0.14 0.00 0.00 62.40 63.63 1yau h SER 20 CO 0.08 -0.06 -0.72 0.77 -1.14 0.00 0.00 176.83 175.75 1yau h SER 21 N 0.11 0.84 -0.79 3.07 4.64 -1.50 -2.97 113.55 116.96 1yau h SER 21 Ca 0.22 -0.65 0.05 0.00 -0.47 0.00 0.00 61.79 60.94 1yau h SER 21 Cb 0.33 -0.25 -0.05 0.00 -0.31 0.00 0.00 62.40 62.11 1yau h SER 21 CO -0.37 1.36 0.49 0.15 -0.87 0.00 0.00 176.83 177.58 1yau h PHE 22 N 0.38 0.91 -0.50 4.77 3.57 -0.65 -1.99 116.94 123.44 1yau h PHE 22 Ca -0.06 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.55 1yau h PHE 22 Cb 1.36 -0.29 -0.07 0.00 2.79 0.00 0.00 35.95 39.74 1yau h PHE 22 CO 0.10 0.49 0.13 0.00 -2.23 0.00 0.00 178.31 176.79 1yau h ALA 23 N 1.36 0.58 -0.53 2.41 0.00 -0.39 -0.71 119.26 121.98 1yau h ALA 23 Ca 0.33 0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.38 1yau h ALA 23 Cb 0.10 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 1yau h ALA 23 CO -0.15 -0.28 0.27 0.28 0.00 0.00 0.00 179.25 179.38 1yau h VAL 24 N 0.27 0.96 -0.47 0.00 2.07 -1.28 -0.40 116.25 117.40 1yau h VAL 24 Ca 0.25 -0.18 -0.02 0.00 0.82 0.00 0.00 66.70 67.56 1yau h VAL 24 Cb 0.31 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 1yau h VAL 24 CO -0.30 0.10 0.21 0.40 0.02 0.00 0.00 177.57 178.00 1yau h ILE 25 N 0.53 1.20 -0.76 4.57 1.08 -0.65 0.53 117.51 124.01 1yau h ILE 25 Ca 0.23 -0.59 -0.02 0.00 -0.39 0.00 0.00 64.86 64.10 1yau h ILE 25 Cb 0.14 0.70 -0.04 0.00 -3.07 0.00 0.00 36.82 34.55 1yau h ILE 25 CO -0.16 0.22 0.41 -0.33 -0.69 0.00 0.00 178.15 177.60 1yau h GLU 26 N 0.62 1.06 -0.24 2.37 5.08 -0.94 0.12 114.58 122.66 1yau h GLU 26 Ca 0.16 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1yau h GLU 26 Cb 0.16 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 1yau h GLU 26 CO -0.02 0.80 0.07 1.49 -1.00 0.00 0.00 179.01 180.35 1yau h GLU 27 N 1.05 0.38 -0.71 2.33 4.57 -0.61 -2.93 114.58 118.66 1yau h GLU 27 Ca 0.27 -0.09 0.09 0.00 -1.18 0.00 0.00 59.36 58.46 1yau h GLU 27 Cb 0.05 -0.05 -0.07 0.00 -0.16 0.00 0.00 28.75 28.51 1yau h GLU 27 CO -0.04 0.47 0.35 -1.49 -1.18 0.00 0.00 179.01 177.12 1yau h TRP 28 N 0.22 0.63 0.00 0.92 6.55 0.45 -2.40 115.95 122.32 1yau h TRP 28 Ca 0.08 0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.95 1yau h TRP 28 Cb 0.25 -0.18 0.00 0.00 -0.86 0.00 0.00 29.16 28.38 1yau h TRP 28 CO 0.01 0.22 0.00 0.00 -1.05 0.00 0.00 178.44 177.62 1yau h ALA 29 N 1.43 1.00 -3.00 1.49 0.00 -0.61 -3.15 119.26 116.42 1yau h ALA 29 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1yau h ALA 29 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1yau h ALA 29 CO -0.27 0.00 0.00 0.00 0.00 0.00 0.00 179.25 178.98 1yau n ALA 30 N -1.91 0.48 -0.30 0.00 0.00 -0.97 -4.77 120.51 113.04 1yau n ALA 30 Ca 0.01 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.41 1yau n ALA 30 Cb 0.24 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.71 1yau n ALA 30 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1yau h GLY 31 N 0.00 -0.07 0.76 0.00 0.00 -1.73 -2.72 103.07 99.31 1yau h GLY 31 Ca 0.00 0.50 0.03 0.00 0.00 0.00 0.00 47.33 47.86 1yau h GLY 31 CO 0.00 -0.19 0.07 -0.84 0.00 0.00 0.00 176.54 175.58 1yau h THR 32 N -0.08 0.91 -0.29 4.70 2.02 -1.60 -0.33 112.91 118.24 1yau h THR 32 Ca 0.28 -0.06 -0.06 0.00 0.77 0.00 0.00 66.41 67.34 1yau h THR 32 Cb 0.57 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 1yau h THR 32 CO -0.84 0.03 -0.09 -0.07 0.37 0.00 0.00 175.52 174.92 1yau h LEU 33 N 0.18 0.45 -0.33 2.58 3.38 -1.46 -1.10 115.31 119.02 1yau h LEU 33 Ca 0.11 -0.11 -0.18 0.00 0.09 0.00 0.00 57.88 57.80 1yau h LEU 33 Cb 0.09 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 1yau h LEU 33 CO -0.13 0.59 -0.52 1.56 0.09 0.00 0.00 178.44 180.03 1yau h GLN 34 N 0.45 0.87 -0.30 1.13 4.20 -1.16 -2.24 115.11 118.05 1yau h GLN 34 Ca 0.09 -0.54 -0.00 0.00 0.06 0.00 0.00 58.65 58.26 1yau h GLN 34 Cb 0.44 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 1yau h GLN 34 CO 0.02 1.17 0.18 1.49 -0.67 0.00 0.00 178.83 181.03 1yau h GLU 35 N 0.67 0.41 -0.85 1.46 4.57 -0.82 -1.28 114.58 118.75 1yau h GLU 35 Ca 0.02 -0.04 0.08 0.00 -1.18 0.00 0.00 59.36 58.25 1yau h GLU 35 Cb 1.12 -0.09 -0.07 0.00 -0.16 0.00 0.00 28.75 29.56 1yau h GLU 35 CO 0.12 0.32 0.51 0.82 -1.18 0.00 0.00 179.01 179.60 1yau h ILE 36 N 0.39 0.96 -0.27 2.32 2.04 -1.20 -1.01 117.51 120.75 1yau h ILE 36 Ca 0.11 -0.30 -0.09 0.00 1.00 0.00 0.00 64.86 65.57 1yau h ILE 36 Cb 0.02 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.09 1yau h ILE 36 CO -0.02 0.16 -0.23 -0.08 0.00 0.00 0.00 178.15 177.98 1yau h GLU 37 N 0.88 0.51 0.41 2.37 4.81 -1.17 -1.03 114.58 121.36 1yau h GLU 37 Ca 0.40 -0.19 -0.01 0.00 -0.13 0.00 0.00 59.36 59.43 1yau h GLU 37 Cb 0.30 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 1yau h GLU 37 CO -0.22 0.70 -0.29 0.78 -0.73 0.00 0.00 179.01 179.26 1yau h GLY 38 N 1.00 -0.73 0.86 1.92 0.00 -0.12 -0.68 103.07 105.31 1yau h GLY 38 Ca 0.07 0.32 0.05 0.00 0.00 0.00 0.00 47.33 47.77 1yau h GLY 38 CO 0.05 -0.27 0.63 -2.22 0.00 0.00 0.00 176.54 174.73 1yau h ILE 39 N -0.68 1.13 -0.75 2.60 2.04 -1.13 0.22 117.51 120.94 1yau h ILE 39 Ca -0.04 -0.40 -0.01 0.00 1.00 0.00 0.00 64.86 65.40 1yau h ILE 39 Cb 0.58 -0.15 -0.04 0.00 -0.74 0.00 0.00 36.82 36.47 1yau h ILE 39 CO 0.02 0.21 0.41 0.00 0.00 0.00 0.00 178.15 178.80 1yau h ALA 40 N 1.45 0.96 -0.14 1.87 0.00 -1.08 0.41 119.26 122.73 1yau h ALA 40 Ca 0.40 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.16 1yau h ALA 40 Cb 0.09 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1yau h ALA 40 CO -0.14 0.47 -0.06 0.87 0.00 0.00 0.00 179.25 180.39 1yau h LYS 41 N 1.03 0.29 -0.49 0.00 1.57 0.10 -1.23 116.57 117.85 1yau h LYS 41 Ca 0.26 -0.12 0.07 0.00 -1.87 0.00 0.00 60.65 58.99 1yau h LYS 41 Cb 0.03 -0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.27 1yau h LYS 41 CO -0.04 0.61 0.14 0.00 -0.57 0.00 0.00 179.45 179.59 1yau h ALA 42 N 0.67 0.57 -0.51 3.86 0.00 -0.57 -0.68 119.26 122.61 1yau h ALA 42 Ca 0.03 0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.07 1yau h ALA 42 Cb 0.52 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.34 1yau h ALA 42 CO 0.02 -0.26 0.24 0.00 0.00 0.00 0.00 179.25 179.25 1yau h ALA 43 N 1.35 0.65 -0.46 0.00 0.00 -0.71 -1.31 119.26 118.77 1yau h ALA 43 Ca 0.24 0.03 -0.14 0.00 0.00 0.00 0.00 54.91 55.04 1yau h ALA 43 Cb 0.28 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1yau h ALA 43 CO -0.27 -0.12 -0.27 0.00 0.00 0.00 0.00 179.25 178.59 1yau h ALA 44 N 1.29 0.65 0.34 0.00 0.00 -0.86 -0.95 119.26 119.73 1yau h ALA 44 Ca 0.23 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1yau h ALA 44 Cb 0.17 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1yau h ALA 44 CO -0.18 0.68 -0.47 1.49 0.00 0.00 0.00 179.25 180.77 1yau h GLU 45 N 0.84 -0.81 -0.58 0.00 4.81 -0.90 -0.58 114.58 117.36 1yau h GLU 45 Ca 0.10 0.06 0.11 0.00 -0.13 0.00 0.00 59.36 59.50 1yau h GLU 45 Cb 0.86 0.18 -0.03 0.00 0.63 0.00 0.00 28.75 30.39 1yau h GLU 45 CO 0.08 -0.54 0.40 0.00 -0.73 0.00 0.00 179.01 178.21 1yau h ALA 46 N -0.86 2.14 -0.13 2.92 0.00 -1.20 -2.55 119.26 119.59 1yau h ALA 46 Ca -0.04 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 1yau h ALA 46 Cb 0.76 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1yau h ALA 46 CO -0.13 -0.29 -0.26 1.25 0.00 0.00 0.00 179.25 179.82 1yau h HIS 47 N 0.30 0.51 -0.91 0.00 -0.00 -0.47 -2.63 115.15 111.95 1yau h HIS 47 Ca 0.27 -0.18 0.10 0.00 -0.00 0.00 0.00 60.37 60.55 1yau h HIS 47 Cb 0.68 -0.09 -0.07 0.00 -0.00 0.00 0.00 27.41 27.93 1yau h HIS 47 CO -0.00 0.88 0.58 0.78 -0.00 0.00 0.00 177.93 180.17 1yau h GLY 48 N -0.01 1.32 0.89 5.26 0.00 -0.74 -1.08 103.07 108.71 1yau h GLY 48 Ca 0.00 -0.38 -0.00 0.00 0.00 0.00 0.00 47.33 46.95 1yau h GLY 48 CO 0.06 0.21 0.04 -2.08 0.00 0.00 0.00 176.54 174.77 1yau h VAL 49 N 0.91 1.12 -0.64 4.60 2.07 -1.38 -2.58 116.25 120.36 1yau h VAL 49 Ca 0.42 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.57 1yau h VAL 49 Cb 0.39 1.20 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 1yau h VAL 49 CO -0.18 0.10 0.32 0.40 0.02 0.00 0.00 177.57 178.23 1yau h ILE 50 N -0.00 1.22 -0.03 4.57 2.04 -1.29 -3.28 117.51 120.74 1yau h ILE 50 Ca 0.03 -0.60 0.03 0.00 1.00 0.00 0.00 64.86 65.32 1yau h ILE 50 Cb 0.13 0.43 -0.04 0.00 -0.74 0.00 0.00 36.82 36.60 1yau h ILE 50 CO -0.00 0.25 -0.23 -0.09 0.00 0.00 0.00 178.15 178.08 1yau h ARG 51 N 0.88 -0.33 -4.22 2.37 2.43 -1.02 -3.20 114.38 111.29 1yau h ARG 51 Ca 0.22 0.02 -0.77 0.00 -0.81 0.00 0.00 59.98 58.65 1yau h ARG 51 Cb 0.11 0.08 -0.22 0.00 -0.42 0.00 0.00 29.97 29.51 1yau h ARG 51 CO -0.03 -0.22 0.95 0.54 -1.51 0.00 0.00 179.97 179.70 1yau s ASN 52 N -4.93 7.19 -0.30 -3.80 2.20 -0.99 -4.90 114.94 109.41 1yau s ASN 52 Ca -0.15 -3.27 -0.21 0.00 -0.94 0.00 0.00 52.86 48.29 1yau s ASN 52 Cb 0.09 -2.32 0.19 0.00 -2.00 0.00 0.00 41.25 37.22 1yau s ASN 52 CO 0.66 -0.54 1.29 -0.94 -2.94 0.00 0.00 177.10 174.63 1yau s SER 53 N 2.15 -0.14 -0.02 3.54 1.04 -1.21 -4.93 113.70 114.13 1yau s SER 53 Ca 0.37 0.24 -0.03 0.00 0.48 0.00 0.00 55.95 57.02 1yau s SER 53 Cb -0.06 0.65 -0.04 0.00 0.10 0.00 0.00 66.02 66.67 1yau s SER 53 CO -0.04 -0.04 0.15 -0.89 0.98 0.00 0.00 173.24 173.41 1yau s THR 54 N 0.58 5.27 -0.12 2.02 2.01 -1.26 -5.00 115.64 119.13 1yau s THR 54 Ca -0.01 -0.17 -0.01 0.00 0.31 0.00 0.00 61.69 61.81 1yau s THR 54 Cb -0.04 -3.43 -0.02 0.00 0.01 0.00 0.00 72.50 69.02 1yau s THR 54 CO -0.12 0.37 -0.10 -0.31 -0.69 0.00 0.00 174.62 173.77 1yau s TYR 55 N -1.26 2.88 0.00 4.92 1.51 -1.26 -5.05 117.35 119.09 1yau s TYR 55 Ca 0.25 -0.43 0.00 0.00 -1.01 0.00 0.00 57.07 55.87 1yau s TYR 55 Cb -0.12 -1.84 0.00 0.00 -0.11 0.00 0.00 41.96 39.88 1yau s TYR 55 CO 0.16 -0.07 0.00 0.41 -1.11 0.00 0.00 175.55 174.94 1yau n GLY 56 N 3.29 4.52 0.41 0.71 0.00 -1.26 -4.96 105.19 107.90 1yau n GLY 56 Ca -0.18 -2.09 0.21 0.00 0.00 0.00 0.00 46.02 43.96 1yau n GLY 56 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1yau h ARG 57 N 0.00 0.16 -0.38 1.61 2.43 -1.99 -1.82 114.38 114.39 1yau h ARG 57 Ca 0.00 -0.01 0.11 0.00 -0.81 0.00 0.00 59.98 59.27 1yau h ARG 57 Cb 0.00 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.50 1yau h ARG 57 CO 0.00 0.10 0.27 0.00 -1.51 0.00 0.00 179.97 178.84 1yau h ALA 58 N 1.65 2.35 0.00 2.80 0.00 -2.00 -1.34 119.26 122.72 1yau h ALA 58 Ca 0.36 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.17 1yau h ALA 58 Cb 1.18 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1yau h ALA 58 CO -0.06 -0.46 -0.40 1.96 0.00 0.00 0.00 179.25 180.29 1yau h GLN 59 N 0.01 0.00 0.00 0.00 7.50 -1.63 -2.91 115.11 118.07 1yau h GLN 59 Ca 0.18 0.00 -0.04 0.00 0.50 0.00 0.00 58.65 59.29 1yau h GLN 59 Cb 0.71 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 28.23 1yau h GLN 59 CO -0.00 0.40 -0.20 0.00 -1.50 0.00 0.00 178.83 177.53 1yau h ALA 60 N 1.60 0.95 0.00 3.87 0.00 -1.39 -3.35 119.26 120.94 1yau h ALA 60 Ca -0.00 -0.18 -0.24 0.00 0.00 0.00 0.00 54.91 54.48 1yau h ALA 60 Cb 1.04 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.76 1yau h ALA 60 CO 0.05 0.25 -1.43 0.93 0.00 0.00 0.00 179.25 179.05 1yau h GLU 61 N 0.00 0.00 -5.08 0.00 5.08 -1.44 -3.45 114.58 109.69 1yau h GLU 61 Ca -0.00 0.00 -0.45 0.00 -1.00 0.00 0.00 59.36 57.91 1yau h GLU 61 Cb 0.86 0.00 -0.29 0.00 0.50 0.00 0.00 28.75 29.82 1yau h GLU 61 CO 0.03 0.56 -0.80 -1.59 -1.00 0.00 0.00 179.01 176.21 1yau s LYS 62 N -2.70 1.00 -0.03 2.33 -2.85 -1.21 -5.14 119.74 111.14 1yau s LYS 62 Ca -0.03 -0.44 -0.27 0.00 -1.00 0.00 0.00 55.97 54.23 1yau s LYS 62 Cb 0.08 -0.97 -0.03 0.00 -2.06 0.00 0.00 37.83 34.86 1yau s LYS 62 CO 0.82 0.26 0.86 0.45 0.10 0.00 0.00 175.35 177.84 1yau s SER 63 N -0.28 7.21 -0.29 0.03 0.15 -1.26 -4.79 113.70 114.47 1yau s SER 63 Ca 0.05 1.47 -0.29 0.00 0.70 0.00 0.00 55.95 57.87 1yau s SER 63 Cb -0.05 -2.50 -0.01 0.00 -1.71 0.00 0.00 66.02 61.75 1yau s SER 63 CO -0.00 -0.20 1.44 -2.84 1.20 0.00 0.00 173.24 172.83 1yau s PRO 64 N 0.91 3.80 0.38 5.44 0.02 -1.26 -4.91 135.00 139.38 1yau s PRO 64 Ca 0.46 1.34 0.28 0.00 0.02 0.00 0.00 61.00 63.09 1yau s PRO 64 Cb -0.20 -3.96 1.13 0.00 0.02 0.00 0.00 34.50 31.50 1yau s PRO 64 CO 0.24 -1.27 1.82 1.49 -0.33 0.00 0.00 177.00 178.95 1yau h GLU 65 N 10.10 0.00 -0.03 5.54 4.81 -1.99 -2.75 114.58 130.25 1yau h GLU 65 Ca -0.29 0.00 -0.22 0.00 -0.13 0.00 0.00 59.36 58.72 1yau h GLU 65 Cb 1.12 0.00 0.02 0.00 0.63 0.00 0.00 28.75 30.52 1yau h GLU 65 CO 1.03 0.00 -0.84 0.37 -0.73 0.00 0.00 179.01 178.84 1yau h GLN 66 N 0.00 0.63 -0.44 1.92 4.15 -1.99 -2.30 115.11 117.07 1yau h GLN 66 Ca 0.00 -0.63 -0.14 0.00 0.77 0.00 0.00 58.65 58.64 1yau h GLN 66 Cb 0.43 0.17 -0.01 0.00 0.21 0.00 0.00 27.48 28.28 1yau h GLN 66 CO 0.00 1.24 -0.28 -0.07 -1.93 0.00 0.00 178.83 177.79 1yau h LEU 67 N 0.26 1.01 -0.93 -2.39 3.38 -1.92 -2.00 115.31 112.72 1yau h LEU 67 Ca -0.10 -0.41 0.08 0.00 0.09 0.00 0.00 57.88 57.54 1yau h LEU 67 Cb 1.51 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 41.91 1yau h LEU 67 CO 0.17 1.21 0.58 -0.07 0.09 0.00 0.00 178.44 180.42 1yau h LEU 68 N 0.82 0.90 0.63 1.67 3.38 -1.57 -1.45 115.31 119.68 1yau h LEU 68 Ca 0.09 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 1yau h LEU 68 Cb 0.87 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 1yau h LEU 68 CO 0.08 0.55 -0.40 1.23 0.09 0.00 0.00 178.44 179.99 1yau h GLY 69 N 1.02 -1.06 -0.26 0.83 0.00 -0.80 -0.28 103.07 102.52 1yau h GLY 69 Ca 0.42 0.44 0.09 0.00 0.00 0.00 0.00 47.33 48.28 1yau h GLY 69 CO -0.20 -0.37 -0.31 -2.08 0.00 0.00 0.00 176.54 173.58 1yau h VAL 70 N -0.97 0.23 -0.22 4.60 2.07 -1.37 0.16 116.25 120.75 1yau h VAL 70 Ca -0.08 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.39 1yau h VAL 70 Cb 0.79 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1yau h VAL 70 CO 0.07 0.00 -0.09 -0.07 0.02 0.00 0.00 177.57 177.50 1yau h LEU 71 N -0.19 0.32 -0.12 2.57 3.38 -1.06 0.13 115.31 120.34 1yau h LEU 71 Ca 0.21 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 1yau h LEU 71 Cb 0.53 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 1yau h LEU 71 CO -0.60 0.46 -0.17 -0.61 0.09 0.00 0.00 178.44 177.61 1yau h GLN 72 N 0.33 0.32 -0.53 1.13 5.75 -0.81 -1.54 115.11 119.76 1yau h GLN 72 Ca 0.07 -0.19 0.09 0.00 -0.15 0.00 0.00 58.65 58.47 1yau h GLN 72 Cb 0.37 0.02 -0.07 0.00 1.07 0.00 0.00 27.48 28.87 1yau h GLN 72 CO 0.02 0.76 0.15 0.00 -2.65 0.00 0.00 178.83 177.10 1yau h ARG 73 N -0.09 0.29 -0.74 1.69 3.08 -0.02 -2.17 114.38 116.41 1yau h ARG 73 Ca 0.01 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.06 1yau h ARG 73 Cb 0.72 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.67 1yau h ARG 73 CO 0.04 0.19 0.49 -0.92 -1.07 0.00 0.00 179.97 178.70 1yau h TYR 74 N 0.30 0.92 -0.48 3.04 3.20 -0.70 -2.66 116.97 120.59 1yau h TYR 74 Ca 0.27 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 62.05 1yau h TYR 74 Cb 0.34 -0.31 -0.02 0.00 1.54 0.00 0.00 36.73 38.28 1yau h TYR 74 CO -0.20 0.57 -0.14 0.37 -1.64 0.00 0.00 178.16 177.12 1yau h GLN 75 N 0.99 0.93 -0.11 1.82 4.15 -0.89 -1.90 115.11 120.09 1yau h GLN 75 Ca 0.28 -0.35 -0.01 0.00 0.77 0.00 0.00 58.65 59.34 1yau h GLN 75 Cb -0.09 -0.06 -0.00 0.00 0.21 0.00 0.00 27.48 27.54 1yau h GLN 75 CO -0.07 1.00 0.02 -0.44 -1.93 0.00 0.00 178.83 177.41 1yau h ASP 76 N 0.82 0.18 -0.25 -0.69 3.32 -1.26 -0.33 116.42 118.21 1yau h ASP 76 Ca 0.12 -0.27 0.05 0.00 0.02 0.00 0.00 57.03 56.95 1yau h ASP 76 Cb 0.69 -0.05 -0.05 0.00 0.22 0.00 0.00 39.33 40.14 1yau h ASP 76 CO 0.05 0.41 -0.05 0.25 -1.72 0.00 0.00 179.24 178.18 1yau h LEU 77 N -0.04 -0.21 -0.68 1.55 7.12 -1.46 -1.21 115.31 120.37 1yau h LEU 77 Ca 0.03 0.07 0.08 0.00 0.13 0.00 0.00 57.88 58.20 1yau h LEU 77 Cb 0.30 0.15 -0.06 0.00 -0.53 0.00 0.00 40.66 40.52 1yau h LEU 77 CO 0.00 -0.07 0.35 0.00 -0.13 0.00 0.00 178.44 178.59 1yau h HIS 79 N 0.62 0.61 -0.23 0.00 -0.00 -0.60 -0.61 115.15 114.95 1yau h HIS 79 Ca 0.32 0.02 -0.03 0.00 -0.00 0.00 0.00 60.37 60.69 1yau h HIS 79 Cb 0.29 -0.18 -0.01 0.00 -0.00 0.00 0.00 27.41 27.51 1yau h HIS 79 CO -0.10 0.29 0.02 -0.91 -0.00 0.00 0.00 177.93 177.23 1yau h ASN 80 N 0.62 0.37 0.03 3.26 2.35 -0.51 -2.40 115.58 119.30 1yau h ASN 80 Ca 0.28 -0.28 0.01 0.00 -0.55 0.00 0.00 56.30 55.76 1yau h ASN 80 Cb 0.18 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.44 1yau h ASN 80 CO -0.18 0.56 -0.06 0.58 -1.65 0.00 0.00 177.43 176.68 1yau h VAL 81 N 0.17 0.86 -0.77 2.81 2.07 -0.86 -0.96 116.25 119.57 1yau h VAL 81 Ca 0.07 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.72 1yau h VAL 81 Cb 0.35 0.86 -0.09 0.00 -1.52 0.00 0.00 31.29 30.89 1yau h VAL 81 CO 0.01 0.00 0.36 0.22 0.02 0.00 0.00 177.57 178.17 1yau h TYR 82 N -0.11 0.62 -0.36 1.57 3.20 -1.12 0.11 116.97 120.87 1yau h TYR 82 Ca 0.01 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.85 1yau h TYR 82 Cb 0.13 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.22 1yau h TYR 82 CO -0.11 0.14 -0.04 0.00 -1.64 0.00 0.00 178.16 176.51 1yau h GLN 84 N 0.48 0.61 -1.00 0.00 4.20 -0.71 -2.64 115.11 116.04 1yau h GLN 84 Ca 0.10 -0.04 0.05 0.00 0.06 0.00 0.00 58.65 58.82 1yau h GLN 84 Cb 0.52 -0.14 -0.06 0.00 0.30 0.00 0.00 27.48 28.10 1yau h GLN 84 CO 0.03 0.40 0.65 0.00 -0.67 0.00 0.00 178.83 179.24 1yau h ALA 85 N 1.23 1.36 0.00 3.87 0.00 -0.75 -2.11 119.26 122.86 1yau h ALA 85 Ca 0.21 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1yau h ALA 85 Cb 0.02 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 1yau h ALA 85 CO -0.09 0.52 -0.17 0.93 0.00 0.00 0.00 179.25 180.44 1yau h GLU 86 N 1.24 0.00 0.24 0.00 4.39 -1.25 0.27 114.58 119.47 1yau h GLU 86 Ca 0.41 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 60.10 1yau h GLU 86 Cb 0.05 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.70 1yau h GLU 86 CO -0.14 0.17 -0.11 1.15 -1.16 0.00 0.00 179.01 178.92 1yau h THR 87 N 0.00 0.82 -0.10 1.13 2.02 -1.03 -0.39 112.91 115.37 1yau h THR 87 Ca -0.00 -0.37 0.03 0.00 0.77 0.00 0.00 66.41 66.84 1yau h THR 87 Cb 0.31 1.03 -0.03 0.00 -1.74 0.00 0.00 68.15 67.72 1yau h THR 87 CO 0.02 0.08 -0.07 0.40 0.37 0.00 0.00 175.52 176.32 1yau h ILE 88 N -0.51 0.78 -0.96 3.11 2.04 -1.29 -0.05 117.51 120.63 1yau h ILE 88 Ca -0.03 0.00 0.15 0.00 1.00 0.00 0.00 64.86 65.98 1yau h ILE 88 Cb 0.38 0.78 -0.08 0.00 -0.74 0.00 0.00 36.82 37.15 1yau h ILE 88 CO 0.05 0.00 0.61 0.03 0.00 0.00 0.00 178.15 178.84 1yau h ARG 89 N -0.08 0.78 -0.16 2.37 3.08 -0.45 -1.14 114.38 118.77 1yau h ARG 89 Ca 0.07 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 60.03 1yau h ARG 89 Cb 0.18 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 1yau h ARG 89 CO -0.15 0.51 -0.06 1.15 -1.07 0.00 0.00 179.97 180.36 1yau h THR 90 N 0.80 1.30 -0.58 2.04 2.02 -0.44 -0.40 112.91 117.64 1yau h THR 90 Ca 0.49 -1.05 0.04 0.00 0.77 0.00 0.00 66.41 66.66 1yau h THR 90 Cb 0.70 1.66 -0.03 0.00 -1.74 0.00 0.00 68.15 68.74 1yau h THR 90 CO -0.26 0.31 0.39 0.58 0.37 0.00 0.00 175.52 176.91 1yau h VAL 91 N 0.02 1.05 0.09 3.16 2.07 -0.02 -2.74 116.25 119.87 1yau h VAL 91 Ca 0.04 -0.22 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 1yau h VAL 91 Cb 0.51 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.63 1yau h VAL 91 CO 0.02 0.12 -0.04 0.40 0.02 0.00 0.00 177.57 178.08 1yau h ILE 92 N 0.64 0.86 -0.29 4.57 2.04 -1.15 -3.37 117.51 120.82 1yau h ILE 92 Ca 0.24 -1.40 0.04 0.00 1.00 0.00 0.00 64.86 64.74 1yau h ILE 92 Cb 0.15 1.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 1yau h ILE 92 CO -0.07 0.26 0.20 0.00 0.00 0.00 0.00 178.15 178.54 1yau h ALA 93 N -0.42 2.00 -0.08 1.87 0.00 -0.92 0.15 119.26 121.86 1yau h ALA 93 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1yau h ALA 93 Cb 0.52 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1yau h ALA 93 CO 0.02 -0.05 0.00 0.44 0.00 0.00 0.00 179.25 179.66 1yau n ILE 94 N -4.49 0.10 -0.31 0.00 -5.35 -1.05 -3.03 119.36 105.23 1yau n ILE 94 Ca 0.03 -0.17 0.03 0.00 -0.27 0.00 0.00 62.75 62.36 1yau n ILE 94 Cb 0.20 0.04 0.04 0.00 -1.74 0.00 0.00 39.64 38.18 1yau n ILE 94 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1yau n ARG 95 N -0.24 2.47 -2.20 6.28 1.74 0.52 -4.91 116.66 120.32 1yau n ARG 95 Ca 0.16 -1.76 -0.42 0.00 -0.77 0.00 0.00 57.85 55.05 1yau n ARG 95 Cb 0.20 -1.12 -0.03 0.00 -1.02 0.00 0.00 32.46 30.50 1yau n ARG 95 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1yau s ILE 96 N -1.46 3.75 0.94 0.55 1.01 -1.14 -4.77 121.20 120.08 1yau s ILE 96 Ca 0.08 1.07 -0.14 0.00 0.00 0.00 0.00 60.65 61.66 1yau s ILE 96 Cb 0.07 -3.69 0.16 0.00 0.01 0.00 0.00 42.46 39.02 1yau s ILE 96 CO 0.01 -0.04 1.20 -2.16 0.00 0.00 0.00 174.94 173.95 1yau s PRO 97 N 2.92 0.88 0.05 2.79 0.05 -1.26 -4.97 135.00 135.45 1yau s PRO 97 Ca 0.65 0.01 -0.35 0.00 0.05 0.00 0.00 61.00 61.36 1yau s PRO 97 Cb -0.30 -1.83 -0.18 0.00 0.05 0.00 0.00 34.50 32.23 1yau s PRO 97 CO 0.25 -2.32 0.87 -1.91 0.05 0.00 0.00 177.00 173.95 1yau n GLU 98 N -3.79 0.00 -2.27 4.56 2.13 -1.26 -4.85 120.64 115.15 1yau n GLU 98 Ca 0.10 0.00 -0.43 0.00 0.66 0.00 0.00 57.16 57.49 1yau n GLU 98 Cb 0.60 -1.29 -0.02 0.00 0.27 0.00 0.00 31.44 30.99 1yau n GLU 98 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 1yau s HIS 99 N -0.24 2.43 0.17 4.31 5.65 -1.26 -5.00 115.29 121.34 1yau s HIS 99 Ca 0.79 0.71 0.05 0.00 0.25 0.00 0.00 55.06 56.86 1yau s HIS 99 Cb -1.11 -3.87 -0.05 0.00 -1.18 0.00 0.00 32.58 26.37 1yau s HIS 99 CO 0.53 -2.35 -0.10 0.15 -0.65 0.00 0.00 174.74 172.33 1yau s LYS 100 N 4.25 1.14 0.00 2.88 1.02 -1.26 -5.02 119.74 122.75 1yau s LYS 100 Ca 0.63 -1.50 0.11 0.00 0.02 0.00 0.00 55.97 55.23 1yau s LYS 100 Cb -0.22 -0.71 0.39 0.00 -0.52 0.00 0.00 37.83 36.77 1yau s LYS 100 CO 0.25 0.08 1.29 0.39 -0.92 0.00 0.00 175.35 176.44 1yau n GLU 101 N -0.25 1.56 -3.97 1.68 -0.58 -1.26 -4.89 120.64 112.92 1yau n GLU 101 Ca -0.09 -0.86 -0.10 0.00 -0.42 0.00 0.00 57.16 55.69 1yau n GLU 101 Cb 0.61 -1.24 -0.06 0.00 -0.57 0.00 0.00 31.44 30.18 1yau n GLU 101 CO 0.00 0.00 0.00 -1.83 -0.48 0.00 0.00 177.13 174.82 1yau s GLU 102 N -1.72 1.35 -1.53 3.49 -1.05 -1.26 -4.90 118.70 113.08 1yau s GLU 102 Ca 0.20 -1.21 -0.14 0.00 -0.15 0.00 0.00 54.97 53.67 1yau s GLU 102 Cb 0.11 0.42 0.09 0.00 -0.44 0.00 0.00 34.13 34.30 1yau s GLU 102 CO 0.15 -0.53 0.99 -3.47 0.95 0.00 0.00 175.26 173.35 1yau n ASP 103 N -0.31 -4.89 -1.72 0.83 2.03 -1.26 -4.90 116.55 106.33 1yau n ASP 103 Ca -0.04 -0.77 -0.01 0.00 0.52 0.00 0.00 54.79 54.48 1yau n ASP 103 Cb 0.63 -3.90 0.31 0.00 -0.72 0.00 0.00 41.12 37.43 1yau n ASP 103 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1yau n ASN 104 N -2.83 4.62 -0.07 1.67 3.02 -1.26 -4.67 115.26 115.73 1yau n ASN 104 Ca 0.05 -3.19 -0.13 0.00 -0.03 0.00 0.00 54.58 51.28 1yau n ASN 104 Cb 0.52 -0.69 -0.06 0.00 -0.61 0.00 0.00 39.78 38.95 1yau n ASN 104 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1yau h LEU 105 N 2.58 0.49 -0.42 3.41 3.38 -1.91 -0.39 115.31 122.45 1yau h LEU 105 Ca 0.17 -0.43 -0.09 0.00 0.09 0.00 0.00 57.88 57.62 1yau h LEU 105 Cb 2.07 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 42.67 1yau h LEU 105 CO 0.58 0.81 -0.10 1.23 0.09 0.00 0.00 178.44 181.06 1yau h GLY 106 N 0.16 0.88 0.74 0.83 0.00 -1.83 -2.70 103.07 101.15 1yau h GLY 106 Ca 0.04 -0.72 0.13 0.00 0.00 0.00 0.00 47.33 46.78 1yau h GLY 106 CO 0.04 0.66 0.51 -2.08 0.00 0.00 0.00 176.54 175.67 1yau h VAL 107 N 0.63 0.86 -0.43 4.60 2.07 -1.72 -1.20 116.25 121.07 1yau h VAL 107 Ca 0.11 -0.20 -0.11 0.00 0.82 0.00 0.00 66.70 67.32 1yau h VAL 107 Cb 0.63 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 1yau h VAL 107 CO 0.04 0.10 -0.19 0.00 0.02 0.00 0.00 177.57 177.54 1yau h ALA 108 N 1.63 0.85 -0.25 1.67 0.00 -0.75 -1.54 119.26 120.87 1yau h ALA 108 Ca 0.38 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.93 1yau h ALA 108 Cb 0.66 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1yau h ALA 108 CO -0.14 0.64 0.12 0.28 0.00 0.00 0.00 179.25 180.15 1yau h VAL 109 N 0.73 1.00 -0.15 0.00 2.07 -1.01 -0.12 116.25 118.78 1yau h VAL 109 Ca 0.11 -0.09 0.04 0.00 0.82 0.00 0.00 66.70 67.58 1yau h VAL 109 Cb 0.72 0.71 -0.04 0.00 -1.52 0.00 0.00 31.29 31.15 1yau h VAL 109 CO 0.06 0.05 -0.12 1.56 0.02 0.00 0.00 177.57 179.13 1yau h GLN 110 N 0.26 -0.13 -0.92 1.57 4.20 -1.04 -0.63 115.11 118.43 1yau h GLN 110 Ca 0.10 0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.83 1yau h GLN 110 Cb 0.02 0.03 -0.05 0.00 0.30 0.00 0.00 27.48 27.79 1yau h GLN 110 CO -0.07 -0.09 0.61 0.45 -0.67 0.00 0.00 178.83 179.07 1yau h HIS 111 N -0.13 1.16 0.15 2.96 3.86 -1.25 -0.66 115.15 121.24 1yau h HIS 111 Ca 0.09 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.33 1yau h HIS 111 Cb 0.27 -0.39 -0.00 0.00 1.06 0.00 0.00 27.41 28.35 1yau h HIS 111 CO -0.25 0.73 -0.08 0.00 0.86 0.00 0.00 177.93 179.19 1yau h ALA 112 N 1.42 -0.21 -0.55 2.45 0.00 -0.42 -1.48 119.26 120.46 1yau h ALA 112 Ca 0.34 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 55.09 1yau h ALA 112 Cb -0.14 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1yau h ALA 112 CO -0.07 -0.62 -0.11 0.28 0.00 0.00 0.00 179.25 178.73 1yau h VAL 113 N -0.22 1.27 -0.97 0.00 2.07 -1.05 -2.40 116.25 114.95 1yau h VAL 113 Ca -0.02 -1.27 0.09 0.00 0.82 0.00 0.00 66.70 66.32 1yau h VAL 113 Cb 0.18 0.95 -0.07 0.00 -1.52 0.00 0.00 31.29 30.83 1yau h VAL 113 CO 0.02 0.45 0.62 -0.07 0.02 0.00 0.00 177.57 178.62 1yau h LEU 114 N 0.93 0.94 -0.19 2.57 3.38 -1.06 -1.51 115.31 120.36 1yau h LEU 114 Ca 0.14 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 1yau h LEU 114 Cb 0.68 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1yau h LEU 114 CO 0.05 0.55 0.06 0.50 0.09 0.00 0.00 178.44 179.69 1yau h LYS 115 N 1.04 0.30 -0.32 1.13 3.64 -0.89 0.31 116.57 121.77 1yau h LYS 115 Ca 0.45 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.73 1yau h LYS 115 Cb 0.34 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 1yau h LYS 115 CO -0.20 0.41 0.04 0.97 -2.27 0.00 0.00 179.45 178.39 1yau h ILE 116 N 0.13 1.17 -0.23 2.00 2.10 -1.16 -1.18 117.51 120.34 1yau h ILE 116 Ca 0.06 -0.64 -0.15 0.00 1.08 0.00 0.00 64.86 65.22 1yau h ILE 116 Cb 0.23 0.89 -0.01 0.00 -1.09 0.00 0.00 36.82 36.84 1yau h ILE 116 CO -0.00 0.22 -0.46 0.40 -1.08 0.00 0.00 178.15 177.23 1yau h ILE 117 N 0.47 1.31 -0.30 2.19 2.04 -1.04 -2.42 117.51 119.75 1yau h ILE 117 Ca 0.11 -1.66 0.03 0.00 1.00 0.00 0.00 64.86 64.34 1yau h ILE 117 Cb 0.24 1.63 -0.03 0.00 -0.74 0.00 0.00 36.82 37.92 1yau h ILE 117 CO 0.00 0.52 0.12 0.44 0.00 0.00 0.00 178.15 179.24 1yau h ASP 118 N 0.47 0.16 -0.81 1.72 3.32 -0.45 -0.65 116.42 120.18 1yau h ASP 118 Ca 0.03 0.03 0.08 0.00 0.02 0.00 0.00 57.03 57.18 1yau h ASP 118 Cb 0.99 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.47 1yau h ASP 118 CO 0.09 0.13 0.47 -0.08 -1.72 0.00 0.00 179.24 178.13 1yau h GLU 119 N 0.27 0.80 -0.68 3.56 4.81 -1.15 0.26 114.58 122.45 1yau h GLU 119 Ca 0.13 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.25 1yau h GLU 119 Cb 0.08 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 29.25 1yau h GLU 119 CO -0.12 0.53 0.18 1.25 -0.73 0.00 0.00 179.01 180.12 1yau h LEU 120 N 0.83 1.01 0.00 1.64 5.85 -1.12 0.99 115.31 124.51 1yau h LEU 120 Ca 0.38 -0.22 -0.00 0.00 0.84 0.00 0.00 57.88 58.87 1yau h LEU 120 Cb 0.28 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.04 1yau h LEU 120 CO -0.22 0.97 -0.02 -0.33 -0.34 0.00 0.00 178.44 178.50 1yau h GLU 121 N 1.00 0.00 0.05 1.25 5.08 -0.68 -2.52 114.58 118.77 1yau h GLU 121 Ca 0.21 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1yau h GLU 121 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1yau h GLU 121 CO -0.00 0.98 -0.02 0.82 -1.00 0.00 0.00 179.01 179.79 1yau h ILE 122 N -1.00 0.00 0.01 3.13 1.08 -0.58 -3.20 117.51 116.95 1yau h ILE 122 Ca -0.01 -0.68 -0.04 0.00 -0.39 0.00 0.00 64.86 63.74 1yau h ILE 122 Cb 0.99 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.74 1yau h ILE 122 CO -0.00 0.00 -0.15 0.11 -0.69 0.00 0.00 178.15 177.41 1yau h LYS 123 N -0.75 0.08 -0.26 2.37 1.57 -1.24 -1.98 116.57 116.36 1yau h LYS 123 Ca -0.01 -0.10 -0.20 0.00 -1.87 0.00 0.00 60.65 58.47 1yau h LYS 123 Cb 0.05 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1yau h LYS 123 CO 0.01 0.94 -0.61 1.15 -0.57 0.00 0.00 179.45 180.37 1yau h THR 124 N -0.73 1.27 -0.02 -0.16 2.02 -0.93 -3.17 112.91 111.20 1yau h THR 124 Ca -0.02 -1.79 0.00 0.00 0.77 0.00 0.00 66.41 65.37 1yau h THR 124 Cb 1.00 1.71 0.00 0.00 -1.74 0.00 0.00 68.15 69.13 1yau h THR 124 CO 0.03 0.58 -0.21 0.18 0.37 0.00 0.00 175.52 176.47 1yau n LEU 125 N -3.99 1.75 -4.19 2.58 4.77 -0.95 -4.82 117.00 112.16 1yau n LEU 125 Ca -0.05 -0.58 -0.37 0.00 -0.03 0.00 0.00 56.01 54.98 1yau n LEU 125 Cb 0.66 -0.04 -0.04 0.00 -2.33 0.00 0.00 43.42 41.67 1yau n LEU 125 CO 0.51 0.31 -0.33 0.61 -1.33 0.00 0.00 177.39 177.16 1yau n GLY 126 N 1.32 -0.42 0.22 -0.72 0.00 -0.75 -0.98 105.19 103.86 1yau n GLY 126 Ca 0.13 0.24 0.12 0.00 0.00 0.00 0.00 46.02 46.52 1yau n GLY 126 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1yau h SER 127 N -2.12 0.00 -4.33 1.61 4.64 -1.55 -3.27 113.55 108.52 1yau h SER 127 Ca -0.68 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.17 1yau h SER 127 Cb 1.40 0.00 0.09 0.00 -0.31 0.00 0.00 62.40 63.58 1yau h SER 127 CO 0.63 0.00 0.36 -0.83 -0.87 0.00 0.00 176.83 176.11 1yau s GLY 128 N -4.16 1.62 -0.10 -0.77 0.00 -1.26 -5.03 107.32 97.61 1yau s GLY 128 Ca 0.07 -0.62 -0.27 0.00 0.00 0.00 0.00 44.72 43.90 1yau s GLY 128 CO 0.65 -0.20 0.86 0.83 0.00 0.00 0.00 173.10 175.24 1yau h GLU 129 N -0.78 0.09 -5.17 2.90 5.08 -2.02 -3.44 114.58 111.25 1yau h GLU 129 Ca -0.45 -0.14 -0.66 0.00 -1.00 0.00 0.00 59.36 57.11 1yau h GLU 129 Cb 1.30 0.05 -0.30 0.00 0.50 0.00 0.00 28.75 30.30 1yau h GLU 129 CO 0.64 1.02 -0.79 0.15 -1.00 0.00 0.00 179.01 179.03 1yau s LYS 130 N -2.49 3.25 0.51 2.33 1.02 -1.26 -5.12 119.74 117.97 1yau s LYS 130 Ca -0.17 -0.73 -0.19 0.00 0.02 0.00 0.00 55.97 54.91 1yau s LYS 130 Cb -0.01 -2.69 -0.08 0.00 -0.52 0.00 0.00 37.83 34.53 1yau s LYS 130 CO 0.73 -0.01 1.02 -1.54 -0.92 0.00 0.00 175.35 174.63 1yau s SER 131 N 0.89 6.36 0.77 2.83 1.04 -1.26 -5.06 113.70 119.27 1yau s SER 131 Ca -0.03 1.81 0.00 0.00 0.48 0.00 0.00 55.95 58.20 1yau s SER 131 Cb -0.15 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.43 1yau s SER 131 CO -0.01 -0.77 0.00 0.61 0.98 0.00 0.00 173.24 174.05 1yau n GLY 132 N -0.69 -2.30 0.21 7.32 0.00 -1.26 -4.87 105.19 103.60 1yau n GLY 132 Ca 0.08 -1.45 0.14 0.00 0.00 0.00 0.00 46.02 44.80 1yau n GLY 132 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1yau h SER 133 N -0.73 0.00 0.31 1.61 4.64 -2.08 -2.73 113.55 114.56 1yau h SER 133 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1yau h SER 133 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1yau h SER 133 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1yau n GLY 134 N 0.45 -0.97 3.45 -0.77 0.00 -1.26 -4.99 105.19 101.11 1yau n GLY 134 Ca 0.02 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1yau n GLY 134 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yau n GLY 135 N -0.74 0.13 2.54 -0.02 0.00 -1.03 -4.75 105.19 101.33 1yau n GLY 135 Ca 0.01 -1.41 -0.24 0.00 0.00 0.00 0.00 46.02 44.38 1yau n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yau s ALA 136 N -1.69 0.51 0.26 4.61 0.00 -1.26 -4.15 121.76 120.05 1yau s ALA 136 Ca 0.00 -1.68 0.19 0.00 0.00 0.00 0.00 51.96 50.47 1yau s ALA 136 Cb 0.00 -1.77 0.82 0.00 0.00 0.00 0.00 23.12 22.17 1yau s ALA 136 CO 0.00 -2.10 1.81 -1.00 0.00 0.00 0.00 175.76 174.47 1yau h PRO 137 N 6.65 0.00 -6.87 0.00 0.13 -1.85 -3.44 132.00 126.61 1yau h PRO 137 Ca 0.10 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.72 1yau h PRO 137 Cb 0.99 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.16 1yau h PRO 137 CO 0.25 0.34 0.53 -0.08 -0.23 0.00 0.00 178.00 178.81 1yau s THR 138 N -3.83 3.16 0.43 1.56 -1.32 -1.26 -4.92 115.64 109.47 1yau s THR 138 Ca -0.01 1.10 0.17 0.00 -1.21 0.00 0.00 61.69 61.74 1yau s THR 138 Cb 0.12 -3.68 0.37 0.00 -1.51 0.00 0.00 72.50 67.80 1yau s THR 138 CO 0.68 0.21 1.91 -0.65 -2.21 0.00 0.00 174.62 174.56 1yau h PRO 139 N 3.30 0.37 -2.17 7.08 0.11 -1.87 -3.43 132.00 135.39 1yau h PRO 139 Ca -0.48 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.55 1yau h PRO 139 Cb 1.22 -0.08 -0.22 0.00 0.11 0.00 0.00 31.00 32.03 1yau h PRO 139 CO 0.65 0.24 0.05 -1.50 -0.21 0.00 0.00 178.00 177.23 1yau s ILE 140 N -5.38 -0.00 0.00 4.15 2.07 -1.26 -4.94 121.20 115.84 1yau s ILE 140 Ca -0.08 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.16 1yau s ILE 140 Cb 0.21 -0.91 0.00 0.00 0.13 0.00 0.00 42.46 41.90 1yau s ILE 140 CO 0.77 0.00 0.00 0.61 -1.91 0.00 0.00 174.94 174.41 1yau n GLY 141 N 2.75 -0.07 0.32 1.50 0.00 -1.26 -4.81 105.19 103.62 1yau n GLY 141 Ca -0.14 -1.80 -0.08 0.00 0.00 0.00 0.00 46.02 44.01 1yau n GLY 141 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1yau h MET 142 N 0.00 1.12 -2.08 1.61 1.85 -1.11 -3.27 114.93 113.04 1yau h MET 142 Ca 0.00 -0.28 -0.68 0.00 -0.61 0.00 0.00 59.70 58.13 1yau h MET 142 Cb 0.00 -0.14 -0.22 0.00 0.43 0.00 0.00 31.60 31.66 1yau h MET 142 CO 0.00 1.01 0.94 0.66 -0.40 0.00 0.00 176.91 179.12 1yau n TYR 143 N -4.23 2.44 0.04 1.39 4.02 -1.26 -4.60 117.16 114.95 1yau n TYR 143 Ca 0.05 -2.26 -0.03 0.00 -0.01 0.00 0.00 57.90 55.65 1yau n TYR 143 Cb 0.27 -1.31 -0.09 0.00 -0.02 0.00 0.00 39.34 38.19 1yau n TYR 143 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1yau h ALA 144 N 3.28 0.65 0.12 -0.72 0.00 -1.92 -2.80 119.26 117.88 1yau h ALA 144 Ca 0.52 -0.96 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 1yau h ALA 144 Cb 0.32 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1yau h ALA 144 CO 1.22 1.09 -0.06 1.25 0.00 0.00 0.00 179.25 182.75 1yau h LEU 145 N 0.00 -0.14 -0.64 0.00 5.85 -1.82 0.23 115.31 118.79 1yau h LEU 145 Ca -0.15 -0.02 0.10 0.00 0.84 0.00 0.00 57.88 58.65 1yau h LEU 145 Cb 1.69 0.04 -0.08 0.00 0.37 0.00 0.00 40.66 42.68 1yau h LEU 145 CO 0.07 -0.07 0.25 -0.09 -0.34 0.00 0.00 178.44 178.26 1yau h ARG 146 N -0.19 0.43 -0.21 1.25 9.65 -1.93 -0.64 114.38 122.73 1yau h ARG 146 Ca -0.02 -0.03 0.01 0.00 -1.10 0.00 0.00 59.98 58.85 1yau h ARG 146 Cb 0.15 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 28.62 1yau h ARG 146 CO 0.03 0.28 0.11 0.93 2.80 0.00 0.00 179.97 184.12 1yau h GLU 147 N 0.44 0.23 0.45 0.20 5.08 -1.28 -0.55 114.58 119.16 1yau h GLU 147 Ca 0.33 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.65 1yau h GLU 147 Cb 0.41 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1yau h GLU 147 CO -0.32 0.15 -0.22 -0.92 -1.00 0.00 0.00 179.01 176.71 1yau h TYR 148 N 0.23 -0.57 -0.81 4.33 3.20 -0.78 -1.67 116.97 120.90 1yau h TYR 148 Ca 0.08 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.02 1yau h TYR 148 Cb 0.01 0.19 -0.07 0.00 1.54 0.00 0.00 36.73 38.40 1yau h TYR 148 CO -0.08 -0.32 0.47 -0.07 -1.64 0.00 0.00 178.16 176.52 1yau h LEU 149 N -0.68 0.69 -0.05 2.82 3.38 -1.05 -0.26 115.31 120.16 1yau h LEU 149 Ca -0.06 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1yau h LEU 149 Cb 0.50 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 1yau h LEU 149 CO 0.10 0.42 -0.00 -1.28 0.09 0.00 0.00 178.44 177.76 1yau h SER 150 N 0.82 0.10 -0.88 -0.43 0.87 -1.07 -0.09 113.55 112.85 1yau h SER 150 Ca 0.38 -0.33 -0.01 0.00 -1.23 0.00 0.00 61.79 60.60 1yau h SER 150 Cb 0.29 -0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 62.19 1yau h SER 150 CO -0.22 0.41 0.51 0.00 -0.53 0.00 0.00 176.83 176.99 1yau h ALA 151 N 0.70 1.22 -0.22 6.23 0.00 -0.99 -2.81 119.26 123.39 1yau h ALA 151 Ca 0.01 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 1yau h ALA 151 Cb 0.36 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1yau h ALA 151 CO 0.00 0.64 -0.17 -0.09 0.00 0.00 0.00 179.25 179.64 1yau h ARG 152 N 1.23 0.50 -0.47 0.00 2.43 -0.93 -3.13 114.38 114.02 1yau h ARG 152 Ca 0.31 -0.25 -0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1yau h ARG 152 Cb -0.01 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 1yau h ARG 152 CO -0.05 0.81 0.29 0.66 -1.51 0.00 0.00 179.97 180.16 1yau h SER 153 N 0.20 0.55 -0.25 -3.80 4.64 -0.91 0.06 113.55 114.03 1yau h SER 153 Ca 0.04 -0.02 -0.08 0.00 -0.47 0.00 0.00 61.79 61.26 1yau h SER 153 Cb 0.70 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 62.63 1yau h SER 153 CO 0.04 0.42 -0.10 0.74 -0.87 0.00 0.00 176.83 177.06 1yau h THR 154 N 0.64 1.24 0.04 2.95 2.02 -1.45 -0.35 112.91 118.01 1yau h THR 154 Ca 0.17 -1.08 -0.23 0.00 0.77 0.00 0.00 66.41 66.04 1yau h THR 154 Cb -0.03 1.07 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 1yau h THR 154 CO -0.03 0.36 -1.10 0.58 0.37 0.00 0.00 175.52 175.70 1yau h VAL 155 N 0.59 1.62 -0.19 3.16 2.07 -1.33 -3.09 116.25 119.07 1yau h VAL 155 Ca 0.11 -3.29 -0.08 0.00 0.82 0.00 0.00 66.70 64.25 1yau h VAL 155 Cb 0.52 2.86 -0.00 0.00 -1.52 0.00 0.00 31.29 33.15 1yau h VAL 155 CO 0.03 0.94 -0.21 -0.33 0.02 0.00 0.00 177.57 178.02 1yau h GLU 156 N 0.02 0.48 -0.87 1.57 5.08 -0.61 -2.03 114.58 118.22 1yau h GLU 156 Ca -0.06 -0.26 0.07 0.00 -1.00 0.00 0.00 59.36 58.11 1yau h GLU 156 Cb 1.84 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 31.04 1yau h GLU 156 CO 0.15 0.84 0.54 -0.44 -1.00 0.00 0.00 179.01 179.09 1yau h ASP 157 N 0.14 0.83 -0.02 1.42 5.19 -1.16 0.11 116.42 122.94 1yau h ASP 157 Ca 0.03 0.02 -0.09 0.00 -0.62 0.00 0.00 57.03 56.37 1yau h ASP 157 Cb 0.76 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 40.10 1yau h ASP 157 CO 0.05 0.52 -0.26 0.11 -3.12 0.00 0.00 179.24 176.54 1yau h LYS 158 N 0.96 0.44 0.07 3.56 1.57 -1.44 -1.59 116.57 120.13 1yau h LYS 158 Ca 0.39 -0.16 -0.27 0.00 -1.87 0.00 0.00 60.65 58.73 1yau h LYS 158 Cb 0.22 -0.03 0.02 0.00 0.08 0.00 0.00 32.23 32.52 1yau h LYS 158 CO -0.19 0.66 -1.13 -0.07 -0.57 0.00 0.00 179.45 178.15 1yau h LEU 159 N 0.39 0.78 0.00 2.94 3.38 -0.53 0.25 115.31 122.51 1yau h LEU 159 Ca 0.06 -0.68 0.00 0.00 0.09 0.00 0.00 57.88 57.35 1yau h LEU 159 Cb 0.66 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1yau h LEU 159 CO 0.05 1.49 -0.69 -0.07 0.09 0.00 0.00 178.44 179.31 1yau h LEU 160 N 0.28 0.00 0.00 1.67 3.38 -0.79 -3.34 115.31 116.51 1yau h LEU 160 Ca -0.15 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1yau h LEU 160 Cb 1.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.54 1yau h LEU 160 CO 0.21 0.03 0.00 0.61 0.09 0.00 0.00 178.44 179.38 1yau n GLY 161 N 1.21 1.52 3.71 0.83 0.00 -0.60 -4.11 105.19 107.75 1yau n GLY 161 Ca 0.02 -0.64 -0.31 0.00 0.00 0.00 0.00 46.02 45.08 1yau n GLY 161 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1yau s GLY 172 N -0.87 1.69 0.88 -0.02 0.00 -1.26 -5.04 107.32 102.70 1yau s GLY 172 Ca 0.00 0.47 -0.12 0.00 0.00 0.00 0.00 44.72 45.07 1yau s GLY 172 CO 0.00 0.86 1.12 -0.32 0.00 0.00 0.00 173.10 174.76 1yau s GLY 173 N -2.95 1.59 0.44 0.20 0.00 -1.26 -4.99 107.32 100.35 1yau s GLY 173 Ca 0.65 -0.41 -0.24 0.00 0.00 0.00 0.00 44.72 44.71 1yau s GLY 173 CO 0.57 0.11 1.25 -0.45 0.00 0.00 0.00 173.10 174.58 1yau s SER 174 N -3.94 6.17 0.00 1.64 0.15 0.87 -4.94 113.70 113.65 1yau s SER 174 Ca 0.63 2.52 0.23 0.00 0.70 0.00 0.00 55.95 60.03 1yau s SER 174 Cb -0.15 -2.62 0.87 0.00 -1.71 0.00 0.00 66.02 62.41 1yau s SER 174 CO 0.54 -0.94 1.62 0.00 1.20 0.00 0.00 173.24 175.67 1yau n GLN 175 N -0.21 1.68 -2.05 5.44 6.02 -1.26 -4.88 117.38 122.13 1yau n GLN 175 Ca 0.06 -1.01 -0.42 0.00 -0.01 0.00 0.00 57.00 55.61 1yau n GLN 175 Cb 0.45 -1.42 -0.03 0.00 1.02 0.00 0.00 30.24 30.27 1yau n GLN 175 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1yau s SER 176 N -1.71 6.70 0.18 1.08 0.15 -1.26 -4.91 113.70 113.93 1yau s SER 176 Ca 0.34 2.26 -0.09 0.00 0.70 0.00 0.00 55.95 59.16 1yau s SER 176 Cb 0.19 -2.55 0.05 0.00 -1.71 0.00 0.00 66.02 62.00 1yau s SER 176 CO 0.29 -0.86 1.61 1.55 1.20 0.00 0.00 173.24 177.03 1yau h PRO 177 N 8.72 1.05 -0.35 5.44 0.13 -2.01 -3.07 132.00 141.92 1yau h PRO 177 Ca -0.39 -0.38 -0.12 0.00 -0.87 0.00 0.00 66.00 64.24 1yau h PRO 177 Cb 1.18 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 1yau h PRO 177 CO 0.93 1.07 -0.27 0.77 -0.23 0.00 0.00 178.00 180.28 1yau h SER 178 N 0.94 0.73 -0.97 1.44 0.02 -1.99 -2.49 113.55 111.24 1yau h SER 178 Ca 0.15 -0.28 0.07 0.00 -0.84 0.00 0.00 61.79 60.89 1yau h SER 178 Cb 0.65 -0.20 -0.06 0.00 0.14 0.00 0.00 62.40 62.93 1yau h SER 178 CO 0.04 0.97 0.63 0.25 -1.14 0.00 0.00 176.83 177.58 1yau h LEU 179 N 0.62 0.99 -0.39 5.07 5.85 -1.96 0.39 115.31 125.87 1yau h LEU 179 Ca 0.08 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.76 1yau h LEU 179 Cb 0.77 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.59 1yau h LEU 179 CO 0.06 0.63 0.05 0.25 -0.34 0.00 0.00 178.44 179.09 1yau h LEU 180 N 1.12 0.64 -1.18 2.25 5.85 -1.42 -2.95 115.31 119.61 1yau h LEU 180 Ca 0.42 -0.27 -0.08 0.00 0.84 0.00 0.00 57.88 58.79 1yau h LEU 180 Cb 0.18 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1yau h LEU 180 CO -0.16 0.75 -0.26 -0.07 -0.34 0.00 0.00 178.44 178.36 1yau h LEU 181 N 0.50 0.24 -1.30 2.25 3.38 -0.94 -2.89 115.31 116.55 1yau h LEU 181 Ca 0.12 -0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.03 1yau h LEU 181 Cb 0.39 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.04 1yau h LEU 181 CO 0.01 0.50 0.48 -0.08 0.09 0.00 0.00 178.44 179.44 1yau h GLU 182 N 0.22 0.93 -0.28 1.13 4.81 -0.16 -0.08 114.58 121.15 1yau h GLU 182 Ca 0.03 -0.06 0.04 0.00 -0.13 0.00 0.00 59.36 59.25 1yau h GLU 182 Cb 0.58 -0.21 -0.04 0.00 0.63 0.00 0.00 28.75 29.71 1yau h GLU 182 CO 0.04 0.61 0.04 1.25 -0.73 0.00 0.00 179.01 180.22 1yau h LEU 183 N 0.96 -0.03 -0.80 1.64 5.85 -1.34 0.37 115.31 121.95 1yau h LEU 183 Ca 0.27 0.05 -0.10 0.00 0.84 0.00 0.00 57.88 58.94 1yau h LEU 183 Cb -0.09 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 1yau h LEU 183 CO -0.06 0.02 -0.12 -0.09 -0.34 0.00 0.00 178.44 177.84 1yau h ARG 184 N 0.13 0.78 -0.16 1.25 2.43 -1.56 -2.70 114.38 114.54 1yau h ARG 184 Ca 0.13 -0.26 -0.07 0.00 -0.81 0.00 0.00 59.98 58.96 1yau h ARG 184 Cb 0.15 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1yau h ARG 184 CO -0.19 0.86 -0.23 0.37 -1.51 0.00 0.00 179.97 179.28 1yau h GLN 185 N 0.70 0.28 -0.43 0.20 5.75 -0.24 0.11 115.11 121.48 1yau h GLN 185 Ca 0.12 -0.09 -0.10 0.00 -0.15 0.00 0.00 58.65 58.43 1yau h GLN 185 Cb 0.61 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 29.12 1yau h GLN 185 CO 0.04 0.50 -0.11 0.82 -2.65 0.00 0.00 178.83 177.43 1yau h ILE 186 N 0.25 1.27 0.17 2.39 2.04 -0.20 -0.43 117.51 123.01 1yau h ILE 186 Ca 0.04 -1.22 -0.01 0.00 1.00 0.00 0.00 64.86 64.68 1yau h ILE 186 Cb 0.54 1.18 0.00 0.00 -0.74 0.00 0.00 36.82 37.80 1yau h ILE 186 CO 0.04 0.41 -0.08 0.44 0.00 0.00 0.00 178.15 178.96 1yau h ASP 187 N 0.66 -0.20 -0.32 1.72 3.32 -1.13 -2.17 116.42 118.31 1yau h ASP 187 Ca 0.11 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1yau h ASP 187 Cb 0.64 0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.23 1yau h ASP 187 CO 0.04 -0.09 0.21 0.00 -1.72 0.00 0.00 179.24 177.68 1yau h ALA 188 N 0.54 0.40 0.00 3.45 0.00 -1.01 -3.20 119.26 119.43 1yau h ALA 188 Ca -0.02 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 1yau h ALA 188 Cb 0.22 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1yau h ALA 188 CO 0.04 -0.13 -0.43 -0.44 0.00 0.00 0.00 179.25 178.29 1yau h ASP 189 N 0.43 0.00 0.72 0.00 5.19 -1.03 -1.53 116.42 120.19 1yau h ASP 189 Ca 0.12 0.00 -0.20 0.00 -0.62 0.00 0.00 57.03 56.32 1yau h ASP 189 Cb -0.05 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.45 1yau h ASP 189 CO -0.02 0.43 -0.93 -0.26 -3.12 0.00 0.00 179.24 175.34 1yau h PHE 190 N 0.00 0.20 -0.29 4.55 -1.00 -1.41 0.20 116.94 119.18 1yau h PHE 190 Ca -0.00 -0.12 -0.14 0.00 2.81 0.00 0.00 57.97 60.52 1yau h PHE 190 Cb 0.76 -0.02 -0.00 0.00 3.61 0.00 0.00 35.95 40.30 1yau h PHE 190 CO 0.00 0.98 -0.36 0.52 -1.61 0.00 0.00 178.31 177.84 1yau h MET 191 N 0.06 0.76 -0.29 1.51 2.86 -1.51 -1.99 114.93 116.33 1yau h MET 191 Ca -0.04 -0.43 0.00 0.00 -2.06 0.00 0.00 59.70 57.18 1yau h MET 191 Cb 1.59 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 33.26 1yau h MET 191 CO 0.13 1.05 0.19 1.25 1.06 0.00 0.00 176.91 180.60 1yau h LEU 192 N 0.52 0.33 -1.34 1.22 5.85 -1.18 -1.62 115.31 119.09 1yau h LEU 192 Ca 0.04 -0.01 0.09 0.00 0.84 0.00 0.00 57.88 58.84 1yau h LEU 192 Cb 0.94 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.84 1yau h LEU 192 CO 0.09 0.24 0.52 0.11 -0.34 0.00 0.00 178.44 179.06 1yau h LYS 193 N 0.39 0.73 -0.42 1.25 1.57 -0.90 -1.83 116.57 117.36 1yau h LYS 193 Ca 0.11 -0.04 -0.09 0.00 -1.87 0.00 0.00 60.65 58.75 1yau h LYS 193 Cb -0.04 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.09 1yau h LYS 193 CO -0.02 0.48 -0.10 0.28 -0.57 0.00 0.00 179.45 179.52 1yau h VAL 194 N 0.75 1.27 -0.98 0.50 2.07 -0.55 0.10 116.25 119.41 1yau h VAL 194 Ca 0.36 -1.20 0.03 0.00 0.82 0.00 0.00 66.70 66.72 1yau h VAL 194 Cb 0.41 1.17 -0.06 0.00 -1.52 0.00 0.00 31.29 31.30 1yau h VAL 194 CO -0.14 0.41 0.64 -0.33 0.02 0.00 0.00 177.57 178.17 1yau h GLU 195 N 0.64 1.21 0.08 1.57 5.08 -0.75 -0.05 114.58 122.36 1yau h GLU 195 Ca 0.11 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1yau h GLU 195 Cb 0.63 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1yau h GLU 195 CO 0.04 0.80 -0.04 -0.07 -1.00 0.00 0.00 179.01 178.75 1yau h LEU 196 N 1.25 -0.09 -0.54 1.33 3.38 -1.28 -2.97 115.31 116.39 1yau h LEU 196 Ca 0.39 -0.51 0.08 0.00 0.09 0.00 0.00 57.88 57.92 1yau h LEU 196 Cb -0.02 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 40.69 1yau h LEU 196 CO -0.11 0.53 0.19 0.00 0.09 0.00 0.00 178.44 179.13 1yau h ALA 197 N -0.02 0.67 -0.74 1.53 0.00 -0.86 0.12 119.26 119.95 1yau h ALA 197 Ca -0.01 0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1yau h ALA 197 Cb 0.60 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 1yau h ALA 197 CO 0.02 -0.22 0.24 1.79 0.00 0.00 0.00 179.25 181.08 1yau h THR 198 N 0.36 1.26 0.11 0.00 1.35 -1.12 0.29 112.91 115.16 1yau h THR 198 Ca 0.27 -0.89 -0.01 0.00 -0.55 0.00 0.00 66.41 65.23 1yau h THR 198 Cb 0.31 0.45 0.00 0.00 -1.73 0.00 0.00 68.15 67.18 1yau h THR 198 CO -0.28 0.35 -0.05 0.74 -0.25 0.00 0.00 175.52 176.03 1yau h THR 199 N 1.09 0.90 -0.03 6.82 2.02 -1.23 0.15 112.91 122.63 1yau h THR 199 Ca 0.24 -0.01 -0.04 0.00 0.77 0.00 0.00 66.41 67.36 1yau h THR 199 Cb 0.30 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 1yau h THR 199 CO -0.01 0.00 -0.19 -0.74 0.37 0.00 0.00 175.52 174.95 1yau h HIS 200 N -0.15 0.04 -0.35 3.16 6.17 -0.51 -2.54 115.15 120.97 1yau h HIS 200 Ca -0.01 -0.00 -0.14 0.00 0.71 0.00 0.00 60.37 60.92 1yau h HIS 200 Cb 0.12 -0.01 -0.01 0.00 2.52 0.00 0.00 27.41 30.03 1yau h HIS 200 CO -0.07 0.23 -0.33 1.25 0.71 0.00 0.00 177.93 179.72 1yau h LEU 201 N 0.04 0.89 -0.71 0.26 5.85 0.07 -2.91 115.31 118.80 1yau h LEU 201 Ca 0.01 -0.46 0.03 0.00 0.84 0.00 0.00 57.88 58.30 1yau h LEU 201 Cb 0.36 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.10 1yau h LEU 201 CO 0.03 1.17 0.45 0.28 -0.34 0.00 0.00 178.44 180.03 1yau h SER 202 N 0.63 0.73 -0.48 1.25 0.02 -0.58 -0.60 113.55 114.52 1yau h SER 202 Ca 0.06 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 61.04 1yau h SER 202 Cb 0.91 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 63.26 1yau h SER 202 CO 0.08 0.50 0.27 0.74 -1.14 0.00 0.00 176.83 177.29 1yau h THR 203 N 0.87 1.02 -0.14 -2.27 2.02 -1.43 -0.02 112.91 112.96 1yau h THR 203 Ca 0.29 -0.19 -0.03 0.00 0.77 0.00 0.00 66.41 67.26 1yau h THR 203 Cb 0.03 0.43 -0.00 0.00 -1.74 0.00 0.00 68.15 66.86 1yau h THR 203 CO -0.11 0.10 -0.01 -0.03 0.37 0.00 0.00 175.52 175.83 1yau h MET 204 N 0.54 0.26 -0.64 6.66 -1.53 -1.24 -0.95 114.93 118.03 1yau h MET 204 Ca 0.20 -0.09 -0.02 0.00 -3.44 0.00 0.00 59.70 56.35 1yau h MET 204 Cb 0.05 -0.02 -0.03 0.00 -0.55 0.00 0.00 31.60 31.05 1yau h MET 204 CO -0.11 0.52 0.32 0.28 0.14 0.00 0.00 176.91 178.06 1yau h VAL 205 N -0.02 1.21 -0.67 -5.77 2.07 -1.02 0.18 116.25 112.23 1yau h VAL 205 Ca 0.04 -0.58 -0.03 0.00 0.82 0.00 0.00 66.70 66.95 1yau h VAL 205 Cb 0.41 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.57 1yau h VAL 205 CO 0.01 0.24 0.31 0.03 0.02 0.00 0.00 177.57 178.19 1yau h ARG 206 N 0.88 0.96 -0.33 1.57 3.08 -0.84 -1.34 114.38 118.36 1yau h ARG 206 Ca 0.22 -0.15 -0.09 0.00 0.07 0.00 0.00 59.98 60.04 1yau h ARG 206 Cb 0.09 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 1yau h ARG 206 CO -0.03 0.77 -0.15 0.00 -1.07 0.00 0.00 179.97 179.49 1yau h ALA 207 N 1.14 1.12 -0.23 0.04 0.00 -0.61 -2.15 119.26 118.57 1yau h ALA 207 Ca 0.23 -0.31 -0.15 0.00 0.00 0.00 0.00 54.91 54.68 1yau h ALA 207 Cb 0.13 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1yau h ALA 207 CO -0.03 0.55 -0.48 0.28 0.00 0.00 0.00 179.25 179.57 1yau h VAL 208 N 0.54 1.31 -0.08 0.00 2.07 -0.29 -1.50 116.25 118.29 1yau h VAL 208 Ca 0.09 -1.68 0.01 0.00 0.82 0.00 0.00 66.70 65.94 1yau h VAL 208 Cb 0.57 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 1yau h VAL 208 CO 0.04 0.53 0.03 0.40 0.02 0.00 0.00 177.57 178.58 1yau h ILE 209 N 0.48 0.98 0.13 4.57 2.04 -1.06 0.18 117.51 124.83 1yau h ILE 209 Ca 0.03 -0.02 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 1yau h ILE 209 Cb 1.01 0.91 0.00 0.00 -0.74 0.00 0.00 36.82 38.00 1yau h ILE 209 CO 0.09 0.01 -0.06 -1.13 0.00 0.00 0.00 178.15 177.06 1yau h ASN 210 N 0.07 -0.15 -0.57 1.72 -1.24 -1.37 -1.67 115.58 112.36 1yau h ASN 210 Ca 0.03 -0.11 0.11 0.00 0.71 0.00 0.00 56.30 57.05 1yau h ASN 210 Cb 0.02 0.04 -0.09 0.00 0.73 0.00 0.00 38.32 39.02 1yau h ASN 210 CO -0.04 0.01 0.05 0.00 -1.29 0.00 0.00 177.43 176.16 1yau h ALA 211 N 0.53 0.60 -0.12 1.57 0.00 -1.06 -1.27 119.26 119.50 1yau h ALA 211 Ca -0.02 0.16 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1yau h ALA 211 Cb 0.25 0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 1yau h ALA 211 CO 0.03 -0.36 -0.07 -0.92 0.00 0.00 0.00 179.25 177.93 1yau h TYR 212 N 0.16 0.30 -0.15 0.00 3.20 -0.48 -2.99 116.97 117.02 1yau h TYR 212 Ca 0.30 -0.08 -0.03 0.00 3.14 0.00 0.00 58.73 62.06 1yau h TYR 212 Cb 0.46 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.65 1yau h TYR 212 CO -0.31 0.62 -0.05 -0.07 -1.64 0.00 0.00 178.16 176.71 1yau h LEU 213 N -0.10 0.21 0.00 2.82 3.38 -1.09 -1.22 115.31 119.32 1yau h LEU 213 Ca 0.03 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1yau h LEU 213 Cb 0.54 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1yau h LEU 213 CO 0.02 0.30 -0.02 -0.07 0.09 0.00 0.00 178.44 178.76 1yau h LEU 214 N 0.22 0.00 -0.68 1.67 3.38 -1.22 -3.37 115.31 115.31 1yau h LEU 214 Ca 0.05 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1yau h LEU 214 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1yau h LEU 214 CO 0.01 0.00 0.00 0.59 0.09 0.00 0.00 178.44 179.13 1yau n ASN 215 N -2.43 0.68 0.01 -0.43 3.02 -0.93 -4.87 115.26 110.31 1yau n ASN 215 Ca 0.05 -0.94 0.06 0.00 -0.03 0.00 0.00 54.58 53.73 1yau n ASN 215 Cb 0.45 0.08 0.46 0.00 -0.61 0.00 0.00 39.78 40.16 1yau n ASN 215 CO 0.00 0.00 0.00 4.11 -2.62 0.00 0.00 177.26 178.75 1yau h TRP 216 N 0.00 0.44 -0.08 3.10 5.08 -1.41 -2.36 115.95 120.72 1yau h TRP 216 Ca 0.00 0.01 -0.01 0.00 1.08 0.00 0.00 58.89 59.98 1yau h TRP 216 Cb 0.11 -0.15 -0.00 0.00 -3.00 0.00 0.00 29.16 26.12 1yau h TRP 216 CO 0.00 0.26 0.03 0.87 -1.28 0.00 0.00 178.44 178.33 1yau h LYS 217 N 0.46 0.13 0.00 0.12 1.57 -1.89 -1.56 116.57 115.40 1yau h LYS 217 Ca 0.16 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.88 1yau h LYS 217 Cb 0.06 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.35 1yau h LYS 217 CO -0.04 0.26 -0.16 0.87 -0.57 0.00 0.00 179.45 179.81 1yau h LYS 218 N -0.03 0.00 -0.57 3.15 1.79 -1.66 0.63 116.57 119.88 1yau h LYS 218 Ca 0.03 0.00 -0.09 0.00 -2.18 0.00 0.00 60.65 58.41 1yau h LYS 218 Cb 0.18 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.81 1yau h LYS 218 CO -0.00 0.16 0.02 -0.07 -1.08 0.00 0.00 179.45 178.48 1yau h LEU 219 N 0.00 0.98 0.09 2.94 3.38 -0.98 -2.39 115.31 119.33 1yau h LEU 219 Ca -0.00 -0.30 -0.22 0.00 0.09 0.00 0.00 57.88 57.45 1yau h LEU 219 Cb 0.53 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 1yau h LEU 219 CO 0.02 1.04 -1.12 0.40 0.09 0.00 0.00 178.44 178.87 1yau h ILE 220 N 0.89 1.19 -3.03 1.22 1.08 -1.04 -3.42 117.51 114.40 1yau h ILE 220 Ca 0.16 -2.39 -0.62 0.00 -0.39 0.00 0.00 64.86 61.63 1yau h ILE 220 Cb 0.52 2.81 -0.41 0.00 -3.07 0.00 0.00 36.82 36.67 1yau h ILE 220 CO 0.03 0.64 -0.63 -1.10 -0.69 0.00 0.00 178.15 176.40 1yau s GLN 221 N -2.42 2.21 0.55 2.37 -1.52 0.19 -4.97 119.66 116.06 1yau s GLN 221 Ca -0.20 -3.10 0.31 0.00 -1.95 0.00 0.00 55.36 50.42 1yau s GLN 221 Cb 0.03 -3.15 1.56 0.00 -0.22 0.00 0.00 33.01 31.22 1yau s GLN 221 CO 0.74 -1.28 2.09 -1.00 -0.25 0.00 0.00 175.29 175.60 1yau h PRO 222 N 5.58 0.00 -5.07 2.91 0.13 -1.65 -3.40 132.00 130.50 1yau h PRO 222 Ca 0.13 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.73 1yau h PRO 222 Cb 0.79 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 31.61 1yau h PRO 222 CO 0.67 0.09 -0.82 1.03 -0.23 0.00 0.00 178.00 178.73 1yau s ARG 223 N -4.06 1.60 -0.54 0.86 0.52 -1.26 -3.42 118.95 112.65 1yau s ARG 223 Ca -0.02 -0.52 0.02 0.00 -0.52 0.00 0.00 55.73 54.69 1yau s ARG 223 Cb 0.12 -1.40 0.14 0.00 0.52 0.00 0.00 34.95 34.33 1yau s ARG 223 CO 0.55 0.19 0.30 0.95 0.02 0.00 0.00 175.30 177.32 1yau s THR 224 N 0.13 2.85 -0.66 0.02 -4.23 -1.26 -5.05 115.64 107.45 1yau s THR 224 Ca -0.05 -3.23 0.05 0.00 -1.18 0.00 0.00 61.69 57.28 1yau s THR 224 Cb -0.11 -2.95 0.29 0.00 1.34 0.00 0.00 72.50 71.08 1yau s THR 224 CO 0.02 -0.81 0.93 0.61 -0.54 0.00 0.00 174.62 174.83 1yau n GLY 225 N 3.21 5.25 2.70 3.99 0.00 -1.26 -4.95 105.19 114.13 1yau n GLY 225 Ca 0.06 -2.77 -0.26 0.00 0.00 0.00 0.00 46.02 43.05 1yau n GLY 225 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1yau s SER 226 N -2.81 2.32 0.46 1.61 0.15 -1.26 -5.16 113.70 109.01 1yau s SER 226 Ca 0.43 -0.53 0.03 0.00 0.70 0.00 0.00 55.95 56.58 1yau s SER 226 Cb 0.20 -0.41 0.01 0.00 -1.71 0.00 0.00 66.02 64.11 1yau s SER 226 CO -0.06 -0.29 0.65 1.51 1.20 0.00 0.00 173.24 176.24 1yau s ASP 227 N 2.00 5.67 -0.10 5.45 3.84 -1.26 -5.02 116.67 127.25 1yau s ASP 227 Ca 0.02 0.03 0.15 0.00 -0.00 0.00 0.00 52.55 52.74 1yau s ASP 227 Cb -0.15 -1.18 0.50 0.00 -1.38 0.00 0.00 42.92 40.71 1yau s ASP 227 CO -0.07 -0.79 1.41 1.41 -0.00 0.00 0.00 175.17 177.13 1yau n HIS 228 N -2.05 0.91 -0.19 2.11 8.25 -1.26 -4.65 115.22 118.34 1yau n HIS 228 Ca 0.04 -0.67 -0.10 0.00 -0.26 0.00 0.00 57.72 56.73 1yau n HIS 228 Cb 0.58 -0.19 0.01 0.00 1.12 0.00 0.00 29.99 31.51 1yau n HIS 228 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 1yau h MET 229 N 2.45 0.96 -5.91 -0.41 2.86 -2.06 -3.44 114.93 109.38 1yau h MET 229 Ca 0.00 -0.31 -0.62 0.00 -2.06 0.00 0.00 59.70 56.70 1yau h MET 229 Cb 1.19 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 32.72 1yau h MET 229 CO 0.15 0.98 -0.50 0.08 1.06 0.00 0.00 176.91 178.67 1yau s VAL 230 N -5.00 5.36 0.00 -2.22 1.01 -1.26 -5.35 120.40 112.94 1yau s VAL 230 Ca -0.12 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.48 1yau s VAL 230 Cb 0.12 -3.60 0.00 0.00 0.00 0.00 0.00 36.38 32.90 1yau s VAL 230 CO 0.84 0.16 0.00 -1.54 0.00 0.00 0.00 175.10 174.56