#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i7y s LYS 2 N 0.00 3.40 0.14 2.12 2.20 -1.26 -4.72 119.74 121.61 1i7y s LYS 2 Ca 0.00 0.77 0.01 0.00 -0.36 0.00 0.00 55.97 56.39 1i7y s LYS 2 Cb 0.00 -4.09 -0.04 0.00 -1.51 0.00 0.00 37.83 32.18 1i7y s LYS 2 CO 0.00 -1.79 -0.00 0.95 -0.36 0.00 0.00 175.35 174.15 1i7y s THR 3 N 5.98 0.50 0.56 3.43 -4.23 -1.26 -1.73 115.64 118.88 1i7y s THR 3 Ca 0.60 -1.94 0.25 0.00 -1.18 0.00 0.00 61.69 59.41 1i7y s THR 3 Cb -0.13 -1.96 0.34 0.00 1.34 0.00 0.00 72.50 72.09 1i7y s THR 3 CO 0.29 -0.60 2.14 -0.65 -0.54 0.00 0.00 174.62 175.26 1i7y h PRO 4 N 2.83 0.00 0.12 3.99 0.11 -1.80 -1.01 132.00 136.24 1i7y h PRO 4 Ca -0.36 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.58 1i7y h PRO 4 Cb 1.19 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.32 1i7y h PRO 4 CO 0.63 0.00 -0.75 0.82 -0.21 0.00 0.00 178.00 178.49 1i7y h ILE 5 N 0.00 1.51 0.00 4.15 2.04 -1.93 -2.75 117.51 120.53 1i7y h ILE 5 Ca 0.06 -2.46 -0.09 0.00 1.00 0.00 0.00 64.86 63.37 1i7y h ILE 5 Cb 0.28 3.12 -0.01 0.00 -0.74 0.00 0.00 36.82 39.47 1i7y h ILE 5 CO -0.00 0.70 -0.43 0.71 0.00 0.00 0.00 178.15 179.12 1i7y h THR 6 N -0.36 1.20 -0.41 -0.27 1.35 -1.77 -2.16 112.91 110.49 1i7y h THR 6 Ca -0.13 -1.54 -0.15 0.00 -0.55 0.00 0.00 66.41 64.05 1i7y h THR 6 Cb 1.57 1.85 -0.01 0.00 -1.73 0.00 0.00 68.15 69.83 1i7y h THR 6 CO 0.14 0.43 -0.31 -0.08 -0.25 0.00 0.00 175.52 175.44 1i7y h GLU 7 N 0.00 0.93 -0.48 4.72 4.57 -1.28 -0.48 114.58 122.56 1i7y h GLU 7 Ca -0.00 -0.45 -0.03 0.00 -1.18 0.00 0.00 59.36 57.70 1i7y h GLU 7 Cb 0.82 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.38 1i7y h GLU 7 CO 0.06 1.11 0.18 0.00 -1.18 0.00 0.00 179.01 179.17 1i7y h ALA 8 N 0.85 0.63 0.00 2.92 0.00 -1.13 -2.14 119.26 120.40 1i7y h ALA 8 Ca 0.08 -0.16 -0.19 0.00 0.00 0.00 0.00 54.91 54.64 1i7y h ALA 8 Cb 0.90 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1i7y h ALA 8 CO 0.08 0.25 -0.90 -0.84 0.00 0.00 0.00 179.25 177.84 1i7y h ILE 9 N 0.64 1.63 -0.69 0.00 3.07 -1.32 -3.02 117.51 117.82 1i7y h ILE 9 Ca 0.16 -3.03 -0.02 0.00 1.55 0.00 0.00 64.86 63.52 1i7y h ILE 9 Cb 0.22 2.65 -0.03 0.00 -0.27 0.00 0.00 36.82 39.38 1i7y h ILE 9 CO -0.01 0.87 0.35 0.00 -1.05 0.00 0.00 178.15 178.31 1i7y h ALA 10 N 1.08 0.88 -0.16 0.16 0.00 -0.94 0.17 119.26 120.46 1i7y h ALA 10 Ca -0.01 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1i7y h ALA 10 Cb 1.59 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 1i7y h ALA 10 CO 0.12 0.43 0.10 0.00 0.00 0.00 0.00 179.25 179.90 1i7y h ALA 11 N 1.17 0.20 -0.75 0.00 0.00 -1.40 -0.54 119.26 117.94 1i7y h ALA 11 Ca 0.24 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 1i7y h ALA 11 Cb 0.09 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1i7y h ALA 11 CO -0.03 -0.31 0.25 0.00 0.00 0.00 0.00 179.25 179.16 1i7y h ALA 12 N 1.05 1.02 -0.37 0.00 0.00 -1.34 -2.92 119.26 116.69 1i7y h ALA 12 Ca 0.06 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 1i7y h ALA 12 Cb -0.01 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1i7y h ALA 12 CO -0.01 0.66 0.10 0.22 0.00 0.00 0.00 179.25 180.22 1i7y h ASP 13 N 1.11 0.56 -0.66 0.00 -0.00 -0.29 -0.47 116.42 116.68 1i7y h ASP 13 Ca 0.25 -0.23 -0.04 0.00 -0.00 0.00 0.00 57.03 57.01 1i7y h ASP 13 Cb 0.28 -0.15 -0.03 0.00 -0.00 0.00 0.00 39.33 39.43 1i7y h ASP 13 CO -0.01 0.64 0.26 0.71 -0.00 0.00 0.00 179.24 180.85 1i7y h THR 14 N 0.46 1.24 0.00 2.25 1.35 -1.06 0.93 112.91 118.07 1i7y h THR 14 Ca 0.12 -0.75 0.00 0.00 -0.55 0.00 0.00 66.41 65.23 1i7y h THR 14 Cb 0.30 0.43 0.00 0.00 -1.73 0.00 0.00 68.15 67.15 1i7y h THR 14 CO 0.00 0.30 0.00 0.00 -0.25 0.00 0.00 175.52 175.57 1i7y n GLN 15 N -4.30 0.96 -3.66 4.72 6.02 -1.11 -4.89 117.38 115.13 1i7y n GLN 15 Ca 0.06 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.77 1i7y n GLN 15 Cb 0.18 -1.26 0.02 0.00 1.02 0.00 0.00 30.24 30.19 1i7y n GLN 15 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1i7y n GLY 16 N 0.70 -0.50 3.42 1.08 0.00 0.32 -4.97 105.19 105.23 1i7y n GLY 16 Ca 0.12 0.16 -0.21 0.00 0.00 0.00 0.00 46.02 46.09 1i7y n GLY 16 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1i7y s ARG 17 N -6.35 1.67 0.69 1.61 1.70 -0.26 -5.01 118.95 113.00 1i7y s ARG 17 Ca 0.55 -1.96 -0.12 0.00 -0.47 0.00 0.00 55.73 53.74 1i7y s ARG 17 Cb -0.28 -0.51 0.01 0.00 -0.57 0.00 0.00 34.95 33.60 1i7y s ARG 17 CO 0.68 -0.35 1.06 -0.06 -1.08 0.00 0.00 175.30 175.56 1i7y s PHE 18 N -3.43 3.03 0.59 5.89 0.08 -1.26 -4.35 117.98 118.53 1i7y s PHE 18 Ca 0.33 1.45 -0.19 0.00 0.12 0.00 0.00 56.93 58.64 1i7y s PHE 18 Cb 0.06 -2.92 -0.04 0.00 -0.57 0.00 0.00 43.02 39.55 1i7y s PHE 18 CO 0.15 -1.28 1.22 -0.51 -0.10 0.00 0.00 175.22 174.70 1i7y s LEU 19 N -5.42 3.67 0.00 -0.37 1.43 -1.26 -4.95 118.68 111.78 1i7y s LEU 19 Ca 0.59 2.42 0.01 0.00 -1.03 0.00 0.00 54.13 56.12 1i7y s LEU 19 Cb -0.15 -4.58 -0.01 0.00 0.03 0.00 0.00 46.19 41.48 1i7y s LEU 19 CO 0.52 -1.61 0.05 -1.54 0.23 0.00 0.00 176.35 174.01 1i7y n SER 20 N -1.57 1.84 0.22 2.29 3.41 -1.26 -5.01 113.62 113.54 1i7y n SER 20 Ca 0.14 -2.30 0.06 0.00 -0.26 0.00 0.00 58.87 56.50 1i7y n SER 20 Cb 0.49 0.44 0.55 0.00 -0.26 0.00 0.00 64.21 65.44 1i7y n SER 20 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 1i7y h ASN 21 N 0.86 0.03 0.43 4.04 -1.24 -1.99 -2.05 115.58 115.66 1i7y h ASN 21 Ca -0.21 -0.00 -0.01 0.00 0.71 0.00 0.00 56.30 56.78 1i7y h ASN 21 Cb 0.74 -0.01 -0.02 0.00 0.73 0.00 0.00 38.32 39.76 1i7y h ASN 21 CO 0.35 0.12 -0.41 0.74 -1.29 0.00 0.00 177.43 176.94 1i7y h THR 22 N 0.03 0.17 -0.65 -3.57 2.02 -2.01 -1.82 112.91 107.08 1i7y h THR 22 Ca 0.01 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.11 1i7y h THR 22 Cb 0.18 0.17 -0.03 0.00 -1.74 0.00 0.00 68.15 66.73 1i7y h THR 22 CO 0.01 0.00 0.10 -0.33 0.37 0.00 0.00 175.52 175.67 1i7y h GLU 23 N -0.86 1.08 -0.96 6.66 3.07 -1.85 -3.12 114.58 118.61 1i7y h GLU 23 Ca -0.04 -0.30 0.05 0.00 -0.50 0.00 0.00 59.36 58.57 1i7y h GLU 23 Cb 0.76 -0.12 -0.06 0.00 -0.84 0.00 0.00 28.75 28.48 1i7y h GLU 23 CO -0.06 1.00 0.62 -0.07 -1.40 0.00 0.00 179.01 179.11 1i7y h LEU 24 N 1.00 1.02 -1.82 1.33 4.07 -1.19 -1.16 115.31 118.56 1i7y h LEU 24 Ca 0.20 -0.00 -0.03 0.00 0.08 0.00 0.00 57.88 58.13 1i7y h LEU 24 Cb 0.45 -0.22 -0.00 0.00 1.08 0.00 0.00 40.66 41.97 1i7y h LEU 24 CO 0.01 0.68 -0.13 1.56 -1.08 0.00 0.00 178.44 179.48 1i7y h GLN 25 N 1.17 0.00 -0.25 1.13 4.20 -1.27 -1.22 115.11 118.87 1i7y h GLN 25 Ca 0.40 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.92 1i7y h GLN 25 Cb 0.07 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.85 1i7y h GLN 25 CO -0.14 0.13 -0.58 0.00 -0.67 0.00 0.00 178.83 177.57 1i7y h ALA 26 N 1.87 0.50 -0.23 3.87 0.00 -1.24 -0.68 119.26 123.34 1i7y h ALA 26 Ca -0.00 -0.53 -0.17 0.00 0.00 0.00 0.00 54.91 54.21 1i7y h ALA 26 Cb 0.26 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1i7y h ALA 26 CO 0.02 0.69 -0.55 0.28 0.00 0.00 0.00 179.25 179.69 1i7y h VAL 27 N 0.61 1.30 0.00 0.00 2.07 -0.93 -2.06 116.25 117.24 1i7y h VAL 27 Ca 0.01 -1.76 -0.07 0.00 0.82 0.00 0.00 66.70 65.69 1i7y h VAL 27 Cb 1.18 1.70 -0.01 0.00 -1.52 0.00 0.00 31.29 32.64 1i7y h VAL 27 CO 0.12 0.56 -0.35 -0.78 0.02 0.00 0.00 177.57 177.14 1i7y h ASP 28 N 0.54 0.00 -0.51 0.57 3.58 -1.21 0.25 116.42 119.63 1i7y h ASP 28 Ca 0.01 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.44 1i7y h ASP 28 Cb 1.12 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.14 1i7y h ASP 28 CO 0.11 0.35 0.25 1.23 -2.88 0.00 0.00 179.24 178.31 1i7y h GLY 29 N 1.26 0.78 1.32 -0.78 0.00 -0.47 -1.11 103.07 104.07 1i7y h GLY 29 Ca -0.00 -0.38 -0.19 0.00 0.00 0.00 0.00 47.33 46.75 1i7y h GLY 29 CO 0.05 0.37 -0.64 0.07 0.00 0.00 0.00 176.54 176.39 1i7y h ARG 30 N 0.68 0.70 -0.71 4.80 -0.00 -0.80 -2.72 114.38 116.33 1i7y h ARG 30 Ca 0.18 -0.49 0.05 0.00 -0.00 0.00 0.00 59.98 59.71 1i7y h ARG 30 Cb 0.11 0.08 -0.05 0.00 -0.00 0.00 0.00 29.97 30.10 1i7y h ARG 30 CO -0.02 1.11 0.42 0.74 -0.00 0.00 0.00 179.97 182.22 1i7y h PHE 31 N 0.51 0.77 0.00 4.08 0.05 -0.66 -0.12 116.94 121.57 1i7y h PHE 31 Ca -0.01 0.02 -0.12 0.00 3.82 0.00 0.00 57.97 61.68 1i7y h PHE 31 Cb 1.23 -0.24 -0.02 0.00 2.00 0.00 0.00 35.95 38.92 1i7y h PHE 31 CO 0.06 0.40 -0.57 0.87 -0.18 0.00 0.00 178.31 178.89 1i7y h LYS 32 N 0.78 0.00 0.00 1.51 1.57 -1.18 -3.00 116.57 116.26 1i7y h LYS 32 Ca 0.31 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.09 1i7y h LYS 32 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.44 1i7y h LYS 32 CO -0.16 0.57 -0.14 -0.09 -0.57 0.00 0.00 179.45 179.06 1i7y h ARG 33 N 0.00 0.00 -0.81 3.15 9.65 -1.05 -3.33 114.38 121.99 1i7y h ARG 33 Ca -0.01 0.00 0.17 0.00 -1.10 0.00 0.00 59.98 59.04 1i7y h ARG 33 Cb 1.02 0.00 -0.06 0.00 -1.39 0.00 0.00 29.97 29.55 1i7y h ARG 33 CO 0.07 0.00 0.54 0.00 2.80 0.00 0.00 179.97 183.38 1i7y h ALA 34 N 2.15 2.14 -0.27 2.80 0.00 -0.89 -2.26 119.26 122.94 1i7y h ALA 34 Ca 0.00 0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.96 1i7y h ALA 34 Cb 0.93 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.62 1i7y h ALA 34 CO 0.00 -0.37 -0.02 0.28 0.00 0.00 0.00 179.25 179.14 1i7y h VAL 35 N 0.42 0.78 -0.14 0.00 2.07 -1.75 0.31 116.25 117.93 1i7y h VAL 35 Ca 0.40 -0.02 -0.15 0.00 0.82 0.00 0.00 66.70 67.75 1i7y h VAL 35 Cb 0.95 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 1i7y h VAL 35 CO -0.14 0.01 -0.55 0.00 0.02 0.00 0.00 177.57 176.91 1i7y h ALA 36 N 1.24 0.78 -0.07 1.67 0.00 -1.69 -2.80 119.26 118.38 1i7y h ALA 36 Ca 0.13 -0.51 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 1i7y h ALA 36 Cb 0.18 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1i7y h ALA 36 CO -0.23 0.69 0.02 0.77 0.00 0.00 0.00 179.25 180.50 1i7y h SER 37 N 0.33 0.11 -0.82 0.00 0.02 -1.00 -2.28 113.55 109.92 1i7y h SER 37 Ca 0.00 -0.23 0.00 0.00 -0.84 0.00 0.00 61.79 60.73 1i7y h SER 37 Cb 1.07 -0.03 -0.04 0.00 0.14 0.00 0.00 62.40 63.54 1i7y h SER 37 CO 0.10 0.31 0.52 0.24 -1.14 0.00 0.00 176.83 176.86 1i7y h MET 38 N -0.09 1.10 -0.71 3.45 2.86 -0.43 -0.30 114.93 120.81 1i7y h MET 38 Ca 0.02 -0.08 -0.03 0.00 -2.06 0.00 0.00 59.70 57.55 1i7y h MET 38 Cb 0.24 -0.24 -0.03 0.00 0.06 0.00 0.00 31.60 31.63 1i7y h MET 38 CO 0.00 0.75 0.33 1.49 1.06 0.00 0.00 176.91 180.54 1i7y h GLU 39 N 1.13 1.03 0.27 1.72 4.81 -1.37 -0.52 114.58 121.64 1i7y h GLU 39 Ca 0.30 -0.16 -0.01 0.00 -0.13 0.00 0.00 59.36 59.35 1i7y h GLU 39 Cb -0.09 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.11 1i7y h GLU 39 CO -0.06 0.82 -0.13 0.00 -0.73 0.00 0.00 179.01 178.91 1i7y h ALA 40 N 1.16 -0.36 -0.58 2.92 0.00 -0.76 -2.21 119.26 119.42 1i7y h ALA 40 Ca 0.24 -0.16 0.11 0.00 0.00 0.00 0.00 54.91 55.10 1i7y h ALA 40 Cb 0.14 0.14 -0.09 0.00 0.00 0.00 0.00 17.79 17.99 1i7y h ALA 40 CO -0.03 -0.58 0.09 0.00 0.00 0.00 0.00 179.25 178.73 1i7y h ALA 41 N 0.05 0.65 -0.03 0.00 0.00 -0.91 -0.23 119.26 118.79 1i7y h ALA 41 Ca -0.04 0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1i7y h ALA 41 Cb 0.44 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1i7y h ALA 41 CO 0.06 -0.33 -0.04 0.00 0.00 0.00 0.00 179.25 178.93 1i7y h ARG 42 N 0.22 -0.06 -0.56 0.00 3.08 -1.05 -0.64 114.38 115.37 1i7y h ARG 42 Ca 0.30 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.34 1i7y h ARG 42 Cb 0.46 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.50 1i7y h ARG 42 CO -0.42 -0.04 0.29 0.00 -1.07 0.00 0.00 179.97 178.73 1i7y h ALA 43 N 0.96 0.72 -0.77 0.04 0.00 -0.84 -0.90 119.26 118.46 1i7y h ALA 43 Ca 0.03 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 1i7y h ALA 43 Cb 0.11 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1i7y h ALA 43 CO -0.07 0.25 0.29 -0.07 0.00 0.00 0.00 179.25 179.65 1i7y h LEU 44 N 0.75 1.08 -0.57 0.00 -0.00 -0.89 -2.49 115.31 113.20 1i7y h LEU 44 Ca 0.19 -0.18 -0.13 0.00 -0.00 0.00 0.00 57.88 57.76 1i7y h LEU 44 Cb 0.07 -0.28 -0.01 0.00 -0.00 0.00 0.00 40.66 40.44 1i7y h LEU 44 CO -0.03 0.97 -0.30 0.74 -0.00 0.00 0.00 178.44 179.83 1i7y h THR 45 N 1.13 1.28 0.00 0.22 2.02 -0.78 -1.74 112.91 115.04 1i7y h THR 45 Ca 0.26 -1.45 -0.08 0.00 0.77 0.00 0.00 66.41 65.91 1i7y h THR 45 Cb 0.24 1.30 -0.01 0.00 -1.74 0.00 0.00 68.15 67.93 1i7y h THR 45 CO -0.02 0.48 -0.36 0.78 0.37 0.00 0.00 175.52 176.78 1i7y h ASN 46 N 0.70 0.00 -0.33 4.18 -0.26 -1.09 -3.11 115.58 115.68 1i7y h ASN 46 Ca 0.08 0.00 -0.09 0.00 -0.56 0.00 0.00 56.30 55.73 1i7y h ASN 46 Cb 0.84 0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 38.05 1i7y h ASN 46 CO 0.07 0.36 0.01 0.59 -1.06 0.00 0.00 177.43 177.40 1i7y n ASN 47 N -3.54 3.42 0.17 5.81 4.13 -0.95 -4.79 115.26 119.50 1i7y n ASN 47 Ca -0.00 -3.30 -0.16 0.00 1.68 0.00 0.00 54.58 52.80 1i7y n ASN 47 Cb 0.49 -0.59 -0.09 0.00 -1.54 0.00 0.00 39.78 38.05 1i7y n ASN 47 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1i7y h ALA 48 N 1.50 -1.03 -0.41 5.41 0.00 -1.24 -2.53 119.26 120.96 1i7y h ALA 48 Ca 0.10 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 54.97 1i7y h ALA 48 Cb 1.59 0.82 -0.09 0.00 0.00 0.00 0.00 17.79 20.11 1i7y h ALA 48 CO 0.32 -1.12 -0.21 1.96 0.00 0.00 0.00 179.25 180.20 1i7y h GLN 49 N -0.80 -0.13 -0.44 0.00 1.08 -1.86 0.22 115.11 113.18 1i7y h GLN 49 Ca -0.02 0.01 -0.09 0.00 -1.45 0.00 0.00 58.65 57.09 1i7y h GLN 49 Cb 0.76 0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 28.20 1i7y h GLN 49 CO -0.20 -0.09 -0.10 0.66 -0.95 0.00 0.00 178.83 178.16 1i7y h SER 50 N -0.13 0.78 -0.54 1.46 4.64 -1.93 0.11 113.55 117.93 1i7y h SER 50 Ca 0.20 -0.23 -0.11 0.00 -0.47 0.00 0.00 61.79 61.18 1i7y h SER 50 Cb 0.44 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 62.30 1i7y h SER 50 CO -0.49 0.90 -0.08 -0.07 -0.87 0.00 0.00 176.83 176.22 1i7y h LEU 51 N 0.72 1.00 -0.11 5.97 3.38 -1.06 0.14 115.31 125.35 1i7y h LEU 51 Ca 0.12 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 1i7y h LEU 51 Cb 0.57 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 1i7y h LEU 51 CO 0.04 1.11 0.01 0.40 0.09 0.00 0.00 178.44 180.09 1i7y h ILE 52 N 0.88 1.22 -0.23 1.22 2.04 -0.68 0.89 117.51 122.84 1i7y h ILE 52 Ca 0.14 -0.70 -0.06 0.00 1.00 0.00 0.00 64.86 65.25 1i7y h ILE 52 Cb 0.64 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 38.19 1i7y h ILE 52 CO 0.04 0.20 -0.10 0.44 0.00 0.00 0.00 178.15 178.74 1i7y h ASP 53 N -0.06 0.35 -0.12 1.72 3.32 -0.71 -1.73 116.42 119.19 1i7y h ASP 53 Ca 0.03 -0.08 -0.09 0.00 0.02 0.00 0.00 57.03 56.92 1i7y h ASP 53 Cb 0.30 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.76 1i7y h ASP 53 CO 0.00 0.49 -0.26 1.23 -1.72 0.00 0.00 179.24 178.98 1i7y h GLY 54 N 0.82 0.43 1.11 2.75 0.00 -0.51 -3.10 103.07 104.56 1i7y h GLY 54 Ca 0.07 -0.52 -0.02 0.00 0.00 0.00 0.00 47.33 46.87 1i7y h GLY 54 CO 0.02 0.46 0.46 0.00 0.00 0.00 0.00 176.54 177.49 1i7y h ALA 55 N 0.52 1.23 -0.17 3.60 0.00 -0.64 -1.40 119.26 122.41 1i7y h ALA 55 Ca 0.00 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1i7y h ALA 55 Cb 0.86 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1i7y h ALA 55 CO 0.06 0.62 0.09 0.00 0.00 0.00 0.00 179.25 180.02 1i7y h ALA 56 N 1.34 0.22 -0.92 0.00 0.00 -1.37 -2.06 119.26 116.46 1i7y h ALA 56 Ca 0.30 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.16 1i7y h ALA 56 Cb 0.02 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.70 1i7y h ALA 56 CO -0.05 -0.25 0.61 1.96 0.00 0.00 0.00 179.25 181.52 1i7y h GLN 57 N 0.17 1.21 -0.82 0.00 1.08 -1.40 -0.99 115.11 114.37 1i7y h GLN 57 Ca 0.06 -0.08 0.03 0.00 -1.45 0.00 0.00 58.65 57.22 1i7y h GLN 57 Cb 0.07 -0.27 -0.05 0.00 -0.05 0.00 0.00 27.48 27.18 1i7y h GLN 57 CO -0.01 0.81 0.54 0.00 -0.95 0.00 0.00 178.83 179.21 1i7y h ALA 58 N 1.33 1.50 -0.09 3.87 0.00 -0.93 0.23 119.26 125.17 1i7y h ALA 58 Ca 0.34 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 1i7y h ALA 58 Cb -0.14 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.36 1i7y h ALA 58 CO -0.07 0.42 -0.03 0.28 0.00 0.00 0.00 179.25 179.85 1i7y h VAL 59 N 1.01 1.30 -0.05 0.00 2.07 -0.62 -1.87 116.25 118.09 1i7y h VAL 59 Ca 0.32 -0.98 -0.04 0.00 0.82 0.00 0.00 66.70 66.82 1i7y h VAL 59 Cb 0.03 1.76 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 1i7y h VAL 59 CO -0.09 0.28 -0.15 1.88 0.02 0.00 0.00 177.57 179.51 1i7y h TYR 60 N -0.15 0.08 -0.23 1.57 0.05 -0.49 -0.46 116.97 117.34 1i7y h TYR 60 Ca 0.02 -0.01 -0.11 0.00 0.05 0.00 0.00 58.73 58.69 1i7y h TYR 60 Cb 0.45 -0.02 -0.00 0.00 1.01 0.00 0.00 36.73 38.16 1i7y h TYR 60 CO 0.06 0.23 -0.28 1.96 -1.05 0.00 0.00 178.16 179.08 1i7y h GLN 61 N 0.07 0.59 -0.06 4.88 4.20 -0.42 -2.49 115.11 121.87 1i7y h GLN 61 Ca 0.01 -0.33 -0.23 0.00 0.06 0.00 0.00 58.65 58.17 1i7y h GLN 61 Cb 0.31 0.02 0.01 0.00 0.30 0.00 0.00 27.48 28.12 1i7y h GLN 61 CO 0.02 0.93 -0.87 -0.22 -0.67 0.00 0.00 178.83 178.02 1i7y h LYS 62 N 0.28 0.59 -2.27 1.46 1.63 -1.04 -3.35 116.57 113.86 1i7y h LYS 62 Ca 0.03 -0.55 -0.59 0.00 -0.85 0.00 0.00 60.65 58.69 1i7y h LYS 62 Cb 0.85 0.14 -0.42 0.00 -0.60 0.00 0.00 32.23 32.19 1i7y h LYS 62 CO 0.07 1.17 -0.61 1.19 -3.45 0.00 0.00 179.45 177.82 1i7y n PHE 63 N -3.85 3.98 -0.40 1.91 3.72 -0.21 -4.93 117.46 117.69 1i7y n PHE 63 Ca -0.07 -4.01 0.39 0.00 -0.05 0.00 0.00 57.45 53.71 1i7y n PHE 63 Cb 0.79 -0.51 0.72 0.00 -0.94 0.00 0.00 39.48 39.54 1i7y n PHE 63 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1i7y h PRO 64 N 3.21 0.00 0.00 -1.08 0.13 -1.59 0.61 132.00 133.28 1i7y h PRO 64 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1i7y h PRO 64 Cb 0.53 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.66 1i7y h PRO 64 CO 0.83 0.00 0.00 0.10 -0.23 0.00 0.00 178.00 178.70 1i7y h TYR 65 N 0.00 0.00 0.00 1.56 -0.00 -1.91 -1.83 116.97 114.79 1i7y h TYR 65 Ca 0.65 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 59.38 1i7y h TYR 65 Cb 2.82 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 39.55 1i7y h TYR 65 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 178.16 178.41 1i7y n THR 66 N -3.01 0.64 -0.01 -0.90 -2.24 0.21 -1.49 114.28 107.47 1i7y n THR 66 Ca -0.01 0.16 0.08 0.00 -2.27 0.00 0.00 64.05 62.00 1i7y n THR 66 Cb 0.16 -0.84 -0.13 0.00 -2.10 0.00 0.00 70.33 67.41 1i7y n THR 66 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1i7y n THR 67 N -1.44 0.06 -0.10 4.28 -2.24 -0.69 -0.71 114.28 113.44 1i7y n THR 67 Ca 0.06 -0.41 -0.13 0.00 -2.27 0.00 0.00 64.05 61.29 1i7y n THR 67 Cb 0.20 0.07 -0.10 0.00 -2.10 0.00 0.00 70.33 68.40 1i7y n THR 67 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1i7y n THR 68 N -2.13 1.14 -1.65 4.28 -2.24 -1.16 -4.04 114.28 108.47 1i7y n THR 68 Ca -0.04 -0.46 -0.39 0.00 -2.27 0.00 0.00 64.05 60.88 1i7y n THR 68 Cb 0.48 -1.15 0.03 0.00 -2.10 0.00 0.00 70.33 67.60 1i7y n THR 68 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 1i7y n MET 69 N -3.04 1.34 -3.65 -0.78 0.00 -0.55 -4.95 117.12 105.49 1i7y n MET 69 Ca -0.34 0.49 -0.36 0.00 0.00 0.00 0.00 57.70 57.48 1i7y n MET 69 Cb 0.89 -2.25 -0.07 0.00 0.00 0.00 0.00 33.22 31.79 1i7y n MET 69 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 175.97 174.83 1i7y s GLN 70 N -2.50 4.03 0.00 2.12 0.74 -1.26 -4.51 119.66 118.28 1i7y s GLN 70 Ca 0.69 0.01 0.00 0.00 0.05 0.00 0.00 55.36 56.11 1i7y s GLN 70 Cb -0.47 -3.35 0.00 0.00 1.10 0.00 0.00 33.01 30.29 1i7y s GLN 70 CO 0.52 0.42 0.00 0.41 -0.55 0.00 0.00 175.29 176.09 1i7y n GLY 71 N 2.94 3.89 0.16 2.59 0.00 -1.26 -4.98 105.19 108.52 1i7y n GLY 71 Ca -0.15 -0.82 0.13 0.00 0.00 0.00 0.00 46.02 45.18 1i7y n GLY 71 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1i7y h SER 72 N 0.00 0.00 1.14 1.61 4.64 -1.98 -2.85 113.55 116.10 1i7y h SER 72 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1i7y h SER 72 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1i7y h SER 72 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 1i7y n GLN 73 N -2.41 0.09 -3.46 4.77 0.00 -1.26 -4.86 117.38 110.24 1i7y n GLN 73 Ca 0.02 0.08 -0.19 0.00 0.00 0.00 0.00 57.00 56.91 1i7y n GLN 73 Cb 0.25 -1.60 -0.00 0.00 0.00 0.00 0.00 30.24 28.89 1i7y n GLN 73 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.06 177.77 1i7y s TYR 74 N -3.03 3.11 -0.76 2.61 2.02 -1.08 -4.93 117.35 115.29 1i7y s TYR 74 Ca 0.13 -0.22 -0.02 0.00 -0.37 0.00 0.00 57.07 56.58 1i7y s TYR 74 Cb 0.17 -2.00 0.40 0.00 -0.40 0.00 0.00 41.96 40.12 1i7y s TYR 74 CO 0.55 -0.02 2.02 0.00 -1.57 0.00 0.00 175.55 176.53 1i7y n ALA 75 N -1.64 6.43 0.07 3.71 0.00 0.11 -4.42 120.51 124.77 1i7y n ALA 75 Ca 0.00 -3.83 0.08 0.00 0.00 0.00 0.00 53.44 49.69 1i7y n ALA 75 Cb 0.58 -1.88 0.26 0.00 0.00 0.00 0.00 19.45 18.41 1i7y n ALA 75 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1i7y n SER 76 N -0.72 3.38 -3.97 0.00 3.41 -1.17 -4.47 113.62 110.08 1i7y n SER 76 Ca 0.58 -2.18 -0.09 0.00 -0.26 0.00 0.00 58.87 56.91 1i7y n SER 76 Cb 0.43 -0.44 -0.10 0.00 -0.26 0.00 0.00 64.21 63.84 1i7y n SER 76 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1i7y s THR 77 N -1.54 0.12 0.43 6.66 -1.32 -1.26 -4.93 115.64 113.80 1i7y s THR 77 Ca 0.38 -1.01 0.15 0.00 -1.21 0.00 0.00 61.69 60.00 1i7y s THR 77 Cb 0.22 -0.53 0.35 0.00 -1.51 0.00 0.00 72.50 71.03 1i7y s THR 77 CO 0.22 -0.56 1.94 1.55 -2.21 0.00 0.00 174.62 175.56 1i7y h PRO 78 N 4.27 0.39 -0.26 7.08 0.13 -1.97 -0.43 132.00 141.21 1i7y h PRO 78 Ca -0.32 -0.02 -0.04 0.00 -0.87 0.00 0.00 66.00 64.74 1i7y h PRO 78 Cb 1.20 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 1i7y h PRO 78 CO 0.45 0.26 -0.00 0.93 -0.23 0.00 0.00 178.00 179.41 1i7y h GLU 79 N 0.40 0.46 -0.44 0.86 3.07 -1.96 -2.02 114.58 114.96 1i7y h GLU 79 Ca 0.33 -0.15 -0.04 0.00 -0.50 0.00 0.00 59.36 59.00 1i7y h GLU 79 Cb 0.73 -0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.58 1i7y h GLU 79 CO -0.10 0.63 0.12 0.78 -1.40 0.00 0.00 179.01 179.04 1i7y h GLY 80 N 0.24 0.69 1.69 -3.84 0.00 -1.44 -1.79 103.07 98.63 1i7y h GLY 80 Ca 0.07 -0.37 -0.14 0.00 0.00 0.00 0.00 47.33 46.90 1i7y h GLY 80 CO 0.01 0.35 -0.51 0.50 0.00 0.00 0.00 176.54 176.89 1i7y h LYS 81 N 0.63 0.33 -0.14 4.80 1.57 -1.00 -1.30 116.57 121.46 1i7y h LYS 81 Ca 0.15 -0.19 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 1i7y h LYS 81 Cb 0.22 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.55 1i7y h LYS 81 CO -0.00 0.77 -0.08 0.00 -0.57 0.00 0.00 179.45 179.57 1i7y h ALA 82 N 1.20 0.20 -0.87 3.86 0.00 -0.95 -1.81 119.26 120.88 1i7y h ALA 82 Ca 0.01 -0.27 0.05 0.00 0.00 0.00 0.00 54.91 54.70 1i7y h ALA 82 Cb 1.00 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.68 1i7y h ALA 82 CO 0.08 0.00 0.55 0.87 0.00 0.00 0.00 179.25 180.75 1i7y h LYS 83 N -0.05 0.99 -0.20 0.00 1.79 -1.26 0.77 116.57 118.61 1i7y h LYS 83 Ca 0.03 -0.06 -0.01 0.00 -2.18 0.00 0.00 60.65 58.43 1i7y h LYS 83 Cb 0.55 -0.22 -0.01 0.00 -1.58 0.00 0.00 32.23 30.97 1i7y h LYS 83 CO 0.02 0.65 0.10 0.00 -1.08 0.00 0.00 179.45 179.14 1i7y h ALA 85 N 0.96 0.91 -0.01 0.00 0.00 -1.02 -2.19 119.26 117.92 1i7y h ALA 85 Ca 0.07 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.67 1i7y h ALA 85 Cb 0.12 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1i7y h ALA 85 CO -0.01 0.63 -0.04 -0.09 0.00 0.00 0.00 179.25 179.74 1i7y h ARG 86 N 0.82 -0.07 -0.81 0.00 2.43 -0.55 -0.54 114.38 115.67 1i7y h ARG 86 Ca 0.14 0.00 0.06 0.00 -0.81 0.00 0.00 59.98 59.37 1i7y h ARG 86 Cb 0.60 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.11 1i7y h ARG 86 CO 0.04 -0.05 0.53 -0.44 -1.51 0.00 0.00 179.97 178.54 1i7y h ASP 87 N -0.07 0.78 -0.37 -3.80 5.19 -0.68 -0.65 116.42 116.82 1i7y h ASP 87 Ca 0.02 0.00 -0.08 0.00 -0.62 0.00 0.00 57.03 56.36 1i7y h ASP 87 Cb 0.10 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 39.44 1i7y h ASP 87 CO -0.06 0.51 -0.08 0.40 -3.12 0.00 0.00 179.24 176.89 1i7y h ILE 88 N 0.89 1.28 -0.44 0.35 1.08 -0.88 -2.34 117.51 117.45 1i7y h ILE 88 Ca 0.34 -1.15 -0.01 0.00 -0.39 0.00 0.00 64.86 63.65 1i7y h ILE 88 Cb 0.21 1.26 -0.02 0.00 -3.07 0.00 0.00 36.82 35.20 1i7y h ILE 88 CO -0.12 0.38 0.23 1.23 -0.69 0.00 0.00 178.15 179.18 1i7y h GLY 89 N 0.52 0.64 0.93 5.37 0.00 -0.19 -1.27 103.07 109.07 1i7y h GLY 89 Ca 0.09 -0.27 -0.00 0.00 0.00 0.00 0.00 47.33 47.15 1i7y h GLY 89 CO 0.04 0.26 0.08 -0.97 0.00 0.00 0.00 176.54 175.95 1i7y h TYR 90 N 0.61 0.20 0.04 5.60 0.05 -0.69 0.26 116.97 123.05 1i7y h TYR 90 Ca 0.16 -0.01 0.01 0.00 0.05 0.00 0.00 58.73 58.94 1i7y h TYR 90 Cb 0.03 -0.06 -0.01 0.00 1.01 0.00 0.00 36.73 37.70 1i7y h TYR 90 CO 0.00 0.22 -0.07 1.88 -1.05 0.00 0.00 178.16 179.14 1i7y h TYR 91 N 0.13 -0.18 -0.05 4.88 -1.99 -0.87 -0.81 116.97 118.09 1i7y h TYR 91 Ca 0.05 0.00 0.02 0.00 2.00 0.00 0.00 58.73 60.81 1i7y h TYR 91 Cb 0.08 0.07 -0.02 0.00 2.00 0.00 0.00 36.73 38.86 1i7y h TYR 91 CO -0.04 -0.11 -0.08 1.25 -0.00 0.00 0.00 178.16 179.19 1i7y h LEU 92 N -0.14 -0.23 -0.98 3.88 5.85 -1.16 -2.15 115.31 120.37 1i7y h LEU 92 Ca 0.01 0.04 0.11 0.00 0.84 0.00 0.00 57.88 58.89 1i7y h LEU 92 Cb 0.15 0.11 -0.08 0.00 0.37 0.00 0.00 40.66 41.21 1i7y h LEU 92 CO -0.04 -0.11 0.61 -0.09 -0.34 0.00 0.00 178.44 178.47 1i7y h ARG 93 N -0.11 0.97 -0.48 1.25 2.43 -0.79 -2.21 114.38 115.44 1i7y h ARG 93 Ca 0.05 -0.06 -0.11 0.00 -0.81 0.00 0.00 59.98 59.05 1i7y h ARG 93 Cb 0.18 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 1i7y h ARG 93 CO -0.12 0.64 -0.13 0.52 -1.51 0.00 0.00 179.97 179.38 1i7y h MET 94 N 1.00 0.89 0.00 0.20 2.86 -0.62 -2.52 114.93 116.73 1i7y h MET 94 Ca 0.48 -0.32 -0.06 0.00 -2.06 0.00 0.00 59.70 57.73 1i7y h MET 94 Cb 0.43 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.02 1i7y h MET 94 CO -0.25 0.97 -0.30 -0.84 1.06 0.00 0.00 176.91 177.54 1i7y h ILE 95 N 0.80 0.90 -0.14 -1.22 3.07 -0.78 -1.64 117.51 118.49 1i7y h ILE 95 Ca 0.13 -1.17 -0.17 0.00 1.55 0.00 0.00 64.86 65.19 1i7y h ILE 95 Cb 0.65 1.70 -0.00 0.00 -0.27 0.00 0.00 36.82 38.90 1i7y h ILE 95 CO 0.05 0.29 -0.63 0.71 -1.05 0.00 0.00 178.15 177.52 1i7y h THR 96 N 0.00 1.34 -0.84 0.16 1.35 -1.27 -2.32 112.91 111.33 1i7y h THR 96 Ca -0.00 -1.94 -0.01 0.00 -0.55 0.00 0.00 66.41 63.90 1i7y h THR 96 Cb 0.67 1.92 -0.04 0.00 -1.73 0.00 0.00 68.15 68.97 1i7y h THR 96 CO 0.04 0.59 0.47 1.88 -0.25 0.00 0.00 175.52 178.25 1i7y h TYR 97 N 0.37 1.15 -0.21 4.73 0.05 -1.00 -1.07 116.97 120.98 1i7y h TYR 97 Ca -0.01 -0.02 -0.07 0.00 0.05 0.00 0.00 58.73 58.68 1i7y h TYR 97 Cb 1.19 -0.37 -0.01 0.00 1.01 0.00 0.00 36.73 38.55 1i7y h TYR 97 CO 0.05 0.79 -0.16 0.00 -1.05 0.00 0.00 178.16 177.79 1i7y h LEU 99 N 0.33 0.68 -0.59 0.00 3.38 -0.83 0.16 115.31 118.43 1i7y h LEU 99 Ca 0.06 -0.55 -0.10 0.00 0.09 0.00 0.00 57.88 57.37 1i7y h LEU 99 Cb 0.48 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1i7y h LEU 99 CO 0.03 1.11 -0.03 0.58 0.09 0.00 0.00 178.44 180.22 1i7y h VAL 100 N 0.28 1.27 0.00 1.22 2.07 -1.02 -3.09 116.25 116.97 1i7y h VAL 100 Ca 0.00 -1.19 -0.08 0.00 0.82 0.00 0.00 66.70 66.26 1i7y h VAL 100 Cb 1.00 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.60 1i7y h VAL 100 CO 0.09 0.43 -0.42 0.00 0.02 0.00 0.00 177.57 177.69 1i7y h ALA 101 N 0.97 0.76 0.00 1.67 0.00 -1.13 -3.48 119.26 118.05 1i7y h ALA 101 Ca 0.16 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1i7y h ALA 101 Cb 0.60 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1i7y h ALA 101 CO 0.04 0.44 0.00 0.41 0.00 0.00 0.00 179.25 180.14 1i7y n GLY 102 N 1.20 0.50 3.83 0.00 0.00 0.50 -4.53 105.19 106.67 1i7y n GLY 102 Ca 0.02 -0.78 -0.06 0.00 0.00 0.00 0.00 46.02 45.20 1i7y n GLY 102 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1i7y s GLY 103 N -2.71 0.12 0.13 -0.02 0.00 -0.78 -4.26 107.32 99.80 1i7y s GLY 103 Ca 0.00 -0.41 0.26 0.00 0.00 0.00 0.00 44.72 44.57 1i7y s GLY 103 CO 0.00 0.58 1.81 -1.30 0.00 0.00 0.00 173.10 174.19 1i7y n THR 104 N -0.56 0.43 -0.17 0.90 -2.24 -1.26 -4.36 114.28 107.02 1i7y n THR 104 Ca -0.06 -0.11 -0.05 0.00 -2.27 0.00 0.00 64.05 61.57 1i7y n THR 104 Cb 0.60 -0.63 -0.04 0.00 -2.10 0.00 0.00 70.33 68.16 1i7y n THR 104 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1i7y n GLY 105 N 1.19 -1.62 0.18 3.38 0.00 -0.71 -1.01 105.19 106.61 1i7y n GLY 105 Ca 0.06 0.59 -0.05 0.00 0.00 0.00 0.00 46.02 46.62 1i7y n GLY 105 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1i7y h PRO 106 N 0.00 -0.03 -0.49 1.61 0.11 -1.82 -1.75 132.00 129.64 1i7y h PRO 106 Ca 0.07 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.15 1i7y h PRO 106 Cb 0.17 0.01 -0.02 0.00 0.11 0.00 0.00 31.00 31.26 1i7y h PRO 106 CO -0.39 -0.02 0.18 1.98 -0.21 0.00 0.00 178.00 179.55 1i7y h MET 107 N -0.03 0.74 -0.24 1.05 4.05 -1.32 -1.11 114.93 118.08 1i7y h MET 107 Ca 0.19 -0.14 0.04 0.00 -0.28 0.00 0.00 59.70 59.51 1i7y h MET 107 Cb 0.32 -0.12 -0.04 0.00 -0.80 0.00 0.00 31.60 30.96 1i7y h MET 107 CO -0.42 0.67 0.00 -0.44 0.23 0.00 0.00 176.91 176.96 1i7y h ASP 108 N 0.65 -0.08 -0.07 1.39 3.32 -0.47 0.50 116.42 121.66 1i7y h ASP 108 Ca 0.16 0.05 -0.11 0.00 0.02 0.00 0.00 57.03 57.16 1i7y h ASP 108 Cb 0.21 0.09 0.01 0.00 0.22 0.00 0.00 39.33 39.86 1i7y h ASP 108 CO -0.01 -0.01 -0.38 -0.33 -1.72 0.00 0.00 179.24 176.79 1i7y h GLU 109 N 0.08 0.37 0.00 3.56 4.39 -1.30 -2.08 114.58 119.61 1i7y h GLU 109 Ca 0.11 -0.31 -0.21 0.00 0.34 0.00 0.00 59.36 59.29 1i7y h GLU 109 Cb 0.14 0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.82 1i7y h GLU 109 CO -0.18 0.96 -1.16 1.88 -1.16 0.00 0.00 179.01 179.35 1i7y h TYR 110 N -0.11 0.00 0.00 4.33 0.05 -1.18 -3.42 116.97 116.65 1i7y h TYR 110 Ca -0.03 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.75 1i7y h TYR 110 Cb 1.04 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.78 1i7y h TYR 110 CO 0.13 0.85 -0.91 -0.11 -1.05 0.00 0.00 178.16 177.06 1i7y n LEU 111 N -3.18 1.55 -0.07 3.88 0.00 0.16 -4.88 117.00 114.46 1i7y n LEU 111 Ca -0.05 0.00 -0.13 0.00 0.00 0.00 0.00 56.01 55.83 1i7y n LEU 111 Cb 0.92 0.00 -0.06 0.00 0.00 0.00 0.00 43.42 44.28 1i7y n LEU 111 CO 0.45 0.24 0.63 0.40 0.00 0.00 0.00 177.39 179.11 1i7y h ILE 112 N 0.00 1.32 -2.34 1.96 1.08 -1.22 -3.34 117.51 114.97 1i7y h ILE 112 Ca 0.00 -1.26 -0.53 0.00 -0.39 0.00 0.00 64.86 62.67 1i7y h ILE 112 Cb 0.91 1.68 0.02 0.00 -3.07 0.00 0.00 36.82 36.36 1i7y h ILE 112 CO 0.00 0.39 1.26 0.00 -0.69 0.00 0.00 178.15 179.10 1i7y s ALA 113 N -4.46 3.51 0.00 1.87 0.00 -0.78 -1.42 121.76 120.48 1i7y s ALA 113 Ca -0.14 1.29 0.00 0.00 0.00 0.00 0.00 51.96 53.11 1i7y s ALA 113 Cb 0.07 -3.87 0.00 0.00 0.00 0.00 0.00 23.12 19.32 1i7y s ALA 113 CO 0.77 -1.67 0.00 0.41 0.00 0.00 0.00 175.76 175.27 1i7y n GLY 114 N 4.65 1.56 0.32 0.00 0.00 -1.26 -4.96 105.19 105.50 1i7y n GLY 114 Ca 0.21 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.12 1i7y n GLY 114 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1i7y h LEU 115 N 0.00 -1.11 -1.21 0.99 5.85 -1.37 -1.90 115.31 116.57 1i7y h LEU 115 Ca 0.00 0.12 0.19 0.00 0.84 0.00 0.00 57.88 59.03 1i7y h LEU 115 Cb 0.00 0.42 -0.09 0.00 0.37 0.00 0.00 40.66 41.36 1i7y h LEU 115 CO 0.00 -0.35 0.61 0.77 -0.34 0.00 0.00 178.44 179.13 1i7y h SER 116 N -0.45 0.65 0.14 1.25 4.64 -1.93 -0.70 113.55 117.15 1i7y h SER 116 Ca 0.01 0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 61.39 1i7y h SER 116 Cb 0.48 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 1i7y h SER 116 CO -0.24 0.25 -0.07 -0.33 -0.87 0.00 0.00 176.83 175.57 1i7y h GLU 117 N 0.64 -0.18 0.14 4.77 3.07 -1.84 -1.60 114.58 119.59 1i7y h GLU 117 Ca 0.53 0.01 -0.00 0.00 -0.50 0.00 0.00 59.36 59.40 1i7y h GLU 117 Cb 0.98 0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.92 1i7y h GLU 117 CO -0.29 -0.10 -0.11 0.82 -1.40 0.00 0.00 179.01 177.94 1i7y h ILE 118 N -0.22 0.77 0.00 3.13 1.08 -0.46 0.89 117.51 122.69 1i7y h ILE 118 Ca -0.02 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.45 1i7y h ILE 118 Cb 0.17 0.77 -0.00 0.00 -3.07 0.00 0.00 36.82 34.69 1i7y h ILE 118 CO 0.03 0.00 -0.01 0.78 -0.69 0.00 0.00 178.15 178.26 1i7y h ASN 119 N -0.26 0.00 -0.00 1.72 2.35 -1.16 -1.28 115.58 116.95 1i7y h ASN 119 Ca -0.01 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.71 1i7y h ASN 119 Cb 0.23 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.60 1i7y h ASN 119 CO -0.00 0.01 -0.11 -1.28 -1.65 0.00 0.00 177.43 174.40 1i7y h SER 120 N 0.00 0.10 -0.78 5.81 0.87 -0.76 -0.86 113.55 117.94 1i7y h SER 120 Ca -0.00 -0.76 -0.05 0.00 -1.23 0.00 0.00 61.79 59.75 1i7y h SER 120 Cb 0.01 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 61.91 1i7y h SER 120 CO 0.00 0.85 0.30 0.74 -0.53 0.00 0.00 176.83 178.19 1i7y h THR 121 N -0.64 1.26 -0.54 2.23 2.02 -0.34 -3.13 112.91 113.77 1i7y h THR 121 Ca -0.01 -0.84 0.00 0.00 0.77 0.00 0.00 66.41 66.32 1i7y h THR 121 Cb 0.86 0.35 0.00 0.00 -1.74 0.00 0.00 68.15 67.62 1i7y h THR 121 CO 0.02 0.34 0.00 0.49 0.37 0.00 0.00 175.52 176.74 1i7y n PHE 122 N -4.28 1.74 -3.92 3.16 3.72 -0.53 -4.96 117.46 112.38 1i7y n PHE 122 Ca 0.07 -0.72 -0.25 0.00 -0.05 0.00 0.00 57.45 56.50 1i7y n PHE 122 Cb 0.20 -0.41 -0.02 0.00 -0.94 0.00 0.00 39.48 38.31 1i7y n PHE 122 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1i7y n ASP 123 N 0.58 -0.43 -4.74 4.37 2.03 -1.12 -4.70 116.55 112.53 1i7y n ASP 123 Ca 0.26 -0.99 -0.35 0.00 0.52 0.00 0.00 54.79 54.23 1i7y n ASP 123 Cb 1.06 -3.16 -0.08 0.00 -0.72 0.00 0.00 41.12 38.22 1i7y n ASP 123 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1i7y s LEU 124 N -6.93 4.06 -0.14 -2.67 1.43 -0.34 -4.91 118.68 109.18 1i7y s LEU 124 Ca 0.01 0.24 -0.18 0.00 -1.03 0.00 0.00 54.13 53.17 1i7y s LEU 124 Cb -0.00 -2.01 -0.04 0.00 0.03 0.00 0.00 46.19 44.17 1i7y s LEU 124 CO 0.88 0.27 0.47 -0.55 0.23 0.00 0.00 176.35 177.65 1i7y s SER 125 N -0.19 6.64 0.24 2.29 0.15 -1.26 -4.63 113.70 116.93 1i7y s SER 125 Ca 0.09 0.76 -0.06 0.00 0.70 0.00 0.00 55.95 57.44 1i7y s SER 125 Cb -0.12 -2.28 0.34 0.00 -1.71 0.00 0.00 66.02 62.26 1i7y s SER 125 CO 0.01 -0.02 1.83 -0.65 1.20 0.00 0.00 173.24 175.60 1i7y h PRO 126 N 6.86 0.82 -0.08 5.44 0.11 -1.95 -1.59 132.00 141.61 1i7y h PRO 126 Ca -0.40 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 65.69 1i7y h PRO 126 Cb 1.17 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 32.09 1i7y h PRO 126 CO 0.75 0.54 0.14 0.66 -0.21 0.00 0.00 178.00 179.89 1i7y h SER 127 N 0.85 0.00 -0.38 -2.05 4.64 -1.94 0.99 113.55 115.66 1i7y h SER 127 Ca 0.37 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.62 1i7y h SER 127 Cb 0.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 1i7y h SER 127 CO -0.20 0.00 -0.02 -0.50 -0.87 0.00 0.00 176.83 175.23 1i7y h TRP 128 N 0.00 0.75 0.03 4.77 6.55 -1.70 -1.70 115.95 124.65 1i7y h TRP 128 Ca 0.04 -0.14 -0.22 0.00 0.95 0.00 0.00 58.89 59.52 1i7y h TRP 128 Cb 0.32 -0.19 -0.01 0.00 -0.86 0.00 0.00 29.16 28.42 1i7y h TRP 128 CO 0.00 0.79 -0.99 1.88 -1.05 0.00 0.00 178.44 179.07 1i7y h TYR 129 N 0.49 0.28 -0.24 0.49 0.05 -0.99 -2.86 116.97 114.20 1i7y h TYR 129 Ca 0.10 -0.18 -0.06 0.00 0.05 0.00 0.00 58.73 58.65 1i7y h TYR 129 Cb 0.50 -0.02 -0.01 0.00 1.01 0.00 0.00 36.73 38.21 1i7y h TYR 129 CO 0.04 1.05 -0.11 0.82 -1.05 0.00 0.00 178.16 178.92 1i7y h ILE 130 N 0.08 1.20 -0.24 -2.88 2.04 -0.97 -0.91 117.51 115.83 1i7y h ILE 130 Ca -0.06 -0.88 -0.09 0.00 1.00 0.00 0.00 64.86 64.84 1i7y h ILE 130 Cb 1.67 1.14 -0.00 0.00 -0.74 0.00 0.00 36.82 38.89 1i7y h ILE 130 CO 0.15 0.28 -0.18 -0.08 0.00 0.00 0.00 178.15 178.32 1i7y h GLU 131 N 0.37 0.55 -0.49 2.37 4.57 -1.26 -1.90 114.58 118.79 1i7y h GLU 131 Ca 0.07 -0.27 -0.06 0.00 -1.18 0.00 0.00 59.36 57.93 1i7y h GLU 131 Cb 0.41 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.98 1i7y h GLU 131 CO 0.02 0.85 0.07 0.00 -1.18 0.00 0.00 179.01 178.77 1i7y h ALA 132 N 0.69 1.21 -0.15 2.92 0.00 -1.24 -2.46 119.26 120.23 1i7y h ALA 132 Ca 0.04 -0.22 -0.15 0.00 0.00 0.00 0.00 54.91 54.58 1i7y h ALA 132 Cb 0.72 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1i7y h ALA 132 CO 0.05 0.53 -0.55 -0.07 0.00 0.00 0.00 179.25 179.21 1i7y h LEU 133 N 0.73 0.49 -1.11 0.00 3.38 -1.08 -2.68 115.31 115.03 1i7y h LEU 133 Ca 0.15 -0.26 -0.08 0.00 0.09 0.00 0.00 57.88 57.78 1i7y h LEU 133 Cb 0.34 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1i7y h LEU 133 CO 0.01 0.94 -0.29 0.11 0.09 0.00 0.00 178.44 179.29 1i7y h LYS 134 N 0.34 0.26 -0.30 1.13 1.57 -1.01 -0.56 116.57 117.99 1i7y h LYS 134 Ca 0.01 -0.10 -0.09 0.00 -1.87 0.00 0.00 60.65 58.60 1i7y h LYS 134 Cb 1.07 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.35 1i7y h LYS 134 CO 0.10 0.54 -0.15 -0.92 -0.57 0.00 0.00 179.45 178.44 1i7y h TYR 135 N 0.23 0.73 -0.29 -1.35 5.03 -1.30 -1.30 116.97 118.72 1i7y h TYR 135 Ca 0.03 -0.18 -0.08 0.00 2.58 0.00 0.00 58.73 61.08 1i7y h TYR 135 Cb 0.64 -0.17 -0.02 0.00 1.55 0.00 0.00 36.73 38.74 1i7y h TYR 135 CO 0.01 0.87 -0.15 0.82 -1.32 0.00 0.00 178.16 178.38 1i7y h ILE 136 N 0.39 1.24 -0.47 1.81 2.04 -1.24 -1.56 117.51 119.72 1i7y h ILE 136 Ca 0.07 -1.09 -0.07 0.00 1.00 0.00 0.00 64.86 64.77 1i7y h ILE 136 Cb 0.67 1.19 -0.02 0.00 -0.74 0.00 0.00 36.82 37.92 1i7y h ILE 136 CO 0.05 0.35 0.02 0.50 0.00 0.00 0.00 178.15 179.07 1i7y h LYS 137 N 0.47 0.81 0.00 2.37 3.64 -0.85 -2.06 116.57 120.95 1i7y h LYS 137 Ca 0.08 -0.25 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 1i7y h LYS 137 Cb 0.54 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 1i7y h LYS 137 CO 0.03 0.85 -0.14 0.00 -2.27 0.00 0.00 179.45 177.93 1i7y h ALA 138 N 0.93 0.91 0.00 5.00 0.00 -1.01 -3.38 119.26 121.72 1i7y h ALA 138 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1i7y h ALA 138 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1i7y h ALA 138 CO 0.02 0.00 -0.02 0.09 0.00 0.00 0.00 179.25 179.34 1i7y n ASN 139 N -2.36 1.68 0.26 0.00 3.02 -0.61 -4.69 115.26 112.57 1i7y n ASN 139 Ca 0.05 -2.05 0.17 0.00 -0.03 0.00 0.00 54.58 52.72 1i7y n ASN 139 Cb 0.45 -0.09 0.78 0.00 -0.61 0.00 0.00 39.78 40.31 1i7y n ASN 139 CO 0.00 0.00 0.00 1.12 -2.62 0.00 0.00 177.26 175.76 1i7y h HIS 140 N 0.00 0.00 -0.16 3.10 2.07 -1.55 -3.46 115.15 115.15 1i7y h HIS 140 Ca 0.00 0.00 -0.07 0.00 -2.85 0.00 0.00 60.37 57.45 1i7y h HIS 140 Cb 0.70 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 30.66 1i7y h HIS 140 CO 0.00 0.00 -0.06 0.41 -3.07 0.00 0.00 177.93 175.21 1i7y n GLY 143 N -0.35 0.58 3.88 6.13 0.00 -1.26 -4.94 105.19 109.22 1i7y n GLY 143 Ca -0.00 -0.23 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 1i7y n GLY 143 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i7y s LEU 144 N -0.75 3.75 0.31 0.99 1.43 -1.26 -5.10 118.68 118.04 1i7y s LEU 144 Ca 0.00 1.09 0.03 0.00 -1.03 0.00 0.00 54.13 54.22 1i7y s LEU 144 Cb 0.00 -4.00 -0.04 0.00 0.03 0.00 0.00 46.19 42.18 1i7y s LEU 144 CO 0.00 -0.47 0.13 0.42 0.23 0.00 0.00 176.35 176.66 1i7y s THR 145 N -2.51 0.53 0.00 5.49 -4.23 -1.26 -4.66 115.64 109.00 1i7y s THR 145 Ca 0.50 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.01 1i7y s THR 145 Cb -0.10 -2.56 0.00 0.00 1.34 0.00 0.00 72.50 71.18 1i7y s THR 145 CO 0.36 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.05 1i7y n GLY 146 N -0.60 1.77 0.27 3.99 0.00 -1.26 -2.75 105.19 106.61 1i7y n GLY 146 Ca -0.01 -0.50 0.17 0.00 0.00 0.00 0.00 46.02 45.68 1i7y n GLY 146 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1i7y h GLN 147 N 0.00 0.00 -0.15 1.61 1.08 -1.99 -2.45 115.11 113.21 1i7y h GLN 147 Ca 0.00 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.11 1i7y h GLN 147 Cb 0.00 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 1i7y h GLN 147 CO 0.00 0.04 -0.29 0.00 -0.95 0.00 0.00 178.83 177.62 1i7y h ALA 148 N 1.96 1.22 -0.04 3.87 0.00 -1.75 -1.47 119.26 123.05 1i7y h ALA 148 Ca -0.00 -0.34 -0.25 0.00 0.00 0.00 0.00 54.91 54.32 1i7y h ALA 148 Cb 0.50 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 18.21 1i7y h ALA 148 CO 0.00 0.52 -0.96 0.00 0.00 0.00 0.00 179.25 178.82 1i7y h ALA 149 N 1.44 0.22 -0.83 0.00 0.00 -1.25 -2.46 119.26 116.37 1i7y h ALA 149 Ca 0.04 -0.67 -0.01 0.00 0.00 0.00 0.00 54.91 54.26 1i7y h ALA 149 Cb 0.66 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.44 1i7y h ALA 149 CO 0.05 0.71 0.46 0.28 0.00 0.00 0.00 179.25 180.74 1i7y h VAL 150 N 0.41 1.24 0.22 0.00 2.07 -1.33 0.17 116.25 119.03 1i7y h VAL 150 Ca -0.10 -0.59 -0.01 0.00 0.82 0.00 0.00 66.70 66.82 1i7y h VAL 150 Cb 1.60 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 31.50 1i7y h VAL 150 CO 0.19 0.27 -0.11 -0.33 0.02 0.00 0.00 177.57 177.61 1i7y h GLU 161 N 1.15 -0.28 -0.03 1.57 4.39 -1.30 -0.82 114.58 119.26 1i7y h GLU 161 Ca 0.29 0.02 0.02 0.00 0.34 0.00 0.00 59.36 60.04 1i7y h GLU 161 Cb 0.02 0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.70 1i7y h GLU 161 CO -0.05 -0.03 -0.12 0.00 -1.16 0.00 0.00 179.01 177.65 1i7y h ALA 162 N 0.20 -0.12 -0.23 3.43 0.00 -1.23 -2.32 119.26 119.00 1i7y h ALA 162 Ca -0.03 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1i7y h ALA 162 Cb 0.39 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1i7y h ALA 162 CO 0.05 -0.61 0.11 -0.91 0.00 0.00 0.00 179.25 177.90 1i7y h ASN 163 N -0.20 0.28 -0.84 0.00 2.35 -0.67 -2.23 115.58 114.27 1i7y h ASN 163 Ca 0.06 -0.02 0.03 0.00 -0.55 0.00 0.00 56.30 55.82 1i7y h ASN 163 Cb 0.27 -0.07 -0.05 0.00 0.05 0.00 0.00 38.32 38.52 1i7y h ASN 163 CO -0.15 0.24 0.54 0.00 -1.65 0.00 0.00 177.43 176.41 1i7y h ALA 164 N 1.81 1.10 0.00 -0.83 0.00 -0.56 -0.61 119.26 120.17 1i7y h ALA 164 Ca 0.08 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.79 1i7y h ALA 164 Cb 0.03 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1i7y h ALA 164 CO -0.01 0.37 -0.86 1.88 0.00 0.00 0.00 179.25 180.63 1i7y h TYR 165 N 1.04 0.00 0.01 0.00 0.05 -1.36 -2.62 116.97 114.10 1i7y h TYR 165 Ca 0.33 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 59.11 1i7y h TYR 165 Cb 0.01 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.75 1i7y h TYR 165 CO -0.02 0.74 -0.01 0.82 -1.05 0.00 0.00 178.16 178.64 1i7y h ILE 166 N 0.00 1.27 -0.25 -2.88 1.08 -1.03 -2.26 117.51 113.45 1i7y h ILE 166 Ca -0.04 -0.86 -0.02 0.00 -0.39 0.00 0.00 64.86 63.55 1i7y h ILE 166 Cb 1.60 1.86 -0.01 0.00 -3.07 0.00 0.00 36.82 37.19 1i7y h ILE 166 CO 0.09 0.22 0.06 0.44 -0.69 0.00 0.00 178.15 178.27 1i7y h ASP 167 N -0.39 0.31 -0.73 1.72 3.32 -1.20 -0.36 116.42 119.10 1i7y h ASP 167 Ca -0.00 -0.03 -0.04 0.00 0.02 0.00 0.00 57.03 56.98 1i7y h ASP 167 Cb 0.38 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.81 1i7y h ASP 167 CO 0.00 0.33 0.31 0.22 -1.72 0.00 0.00 179.24 178.38 1i7y h TYR 168 N 0.35 1.08 -0.25 4.55 3.20 -1.33 -1.09 116.97 123.48 1i7y h TYR 168 Ca 0.09 -0.07 -0.05 0.00 3.14 0.00 0.00 58.73 61.83 1i7y h TYR 168 Cb 0.14 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 38.08 1i7y h TYR 168 CO 0.00 0.82 -0.05 0.00 -1.64 0.00 0.00 178.16 177.29 1i7y h ALA 169 N 1.15 0.34 -0.52 1.82 0.00 -0.64 -2.66 119.26 118.75 1i7y h ALA 169 Ca 0.25 -0.26 0.10 0.00 0.00 0.00 0.00 54.91 54.99 1i7y h ALA 169 Cb 0.18 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 17.80 1i7y h ALA 169 CO -0.02 0.13 0.07 0.82 0.00 0.00 0.00 179.25 180.25 1i7y h ILE 170 N 0.22 0.65 -0.50 0.00 1.08 -0.63 -1.67 117.51 116.67 1i7y h ILE 170 Ca 0.06 -0.07 -0.04 0.00 -0.39 0.00 0.00 64.86 64.43 1i7y h ILE 170 Cb 0.52 0.45 -0.02 0.00 -3.07 0.00 0.00 36.82 34.69 1i7y h ILE 170 CO 0.02 0.03 0.16 0.78 -0.69 0.00 0.00 178.15 178.45 1i7y h ASN 171 N 0.19 0.68 0.28 1.72 2.35 -1.15 -1.84 115.58 117.81 1i7y h ASN 171 Ca 0.27 -0.10 -0.07 0.00 -0.55 0.00 0.00 56.30 55.85 1i7y h ASN 171 Cb 0.39 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 1i7y h ASN 171 CO -0.38 0.65 -0.30 0.00 -1.65 0.00 0.00 177.43 175.75 1i7y h ALA 172 N 1.45 1.47 -0.01 -0.83 0.00 -0.97 -2.18 119.26 118.19 1i7y h ALA 172 Ca 0.17 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1i7y h ALA 172 Cb 0.22 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1i7y h ALA 172 CO -0.01 0.40 -0.03 1.28 0.00 0.00 0.00 179.25 180.88 1i7y n LEU 173 N -4.17 0.63 0.00 0.00 4.77 -0.72 -4.97 117.00 112.53 1i7y n LEU 173 Ca -0.02 -0.16 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 1i7y n LEU 173 Cb 0.35 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 1i7y n LEU 173 CO 0.38 0.11 0.05 -1.54 -1.33 0.00 0.00 177.39 175.06