#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y7c n HIS 2 N 0.00 2.44 -3.09 2.03 -0.00 -1.26 -5.00 115.22 110.34 1y7c n HIS 2 Ca 0.00 -2.81 -0.41 0.00 -0.00 0.00 0.00 57.72 54.49 1y7c n HIS 2 Cb 0.00 -1.14 -0.06 0.00 -0.00 0.00 0.00 29.99 28.79 1y7c n HIS 2 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1y7c s LEU 3 N -2.77 4.18 0.60 0.27 1.02 -1.26 -5.02 118.68 115.70 1y7c s LEU 3 Ca 0.32 0.35 -0.16 0.00 0.02 0.00 0.00 54.13 54.66 1y7c s LEU 3 Cb 0.07 -2.84 -0.03 0.00 0.02 0.00 0.00 46.19 43.41 1y7c s LEU 3 CO 0.09 -0.55 1.08 0.42 0.02 0.00 0.00 176.35 177.42 1y7c s THR 4 N 2.70 3.51 0.26 5.49 -4.23 -1.26 -4.78 115.64 117.34 1y7c s THR 4 Ca 0.26 0.76 -0.07 0.00 -1.18 0.00 0.00 61.69 61.46 1y7c s THR 4 Cb -0.15 -3.27 0.34 0.00 1.34 0.00 0.00 72.50 70.76 1y7c s THR 4 CO 0.13 -0.39 1.60 -0.65 -0.54 0.00 0.00 174.62 174.78 1y7c h PRO 5 N 0.47 0.04 0.00 3.99 0.11 -1.99 0.72 132.00 135.33 1y7c h PRO 5 Ca -0.47 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.59 1y7c h PRO 5 Cb 1.24 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1y7c h PRO 5 CO 0.56 0.03 -0.20 1.05 -0.21 0.00 0.00 178.00 179.23 1y7c h GLU 6 N 0.04 0.00 0.00 1.05 9.09 -2.00 -2.02 114.58 120.75 1y7c h GLU 6 Ca 0.44 0.00 -0.23 0.00 0.05 0.00 0.00 59.36 59.62 1y7c h GLU 6 Cb 0.77 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.88 1y7c h GLU 6 CO -0.80 0.20 -0.97 0.93 0.05 0.00 0.00 179.01 178.42 1y7c h GLU 7 N 0.00 0.46 -0.20 1.06 5.08 0.03 -2.90 114.58 118.10 1y7c h GLU 7 Ca -0.00 -0.50 -0.12 0.00 -1.00 0.00 0.00 59.36 57.74 1y7c h GLU 7 Cb 0.55 0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.93 1y7c h GLU 7 CO 0.03 1.15 -0.39 -0.22 -1.00 0.00 0.00 179.01 178.57 1y7c h LYS 8 N 0.26 0.45 -0.17 2.33 3.64 -0.68 -1.66 116.57 120.74 1y7c h LYS 8 Ca -0.09 -0.22 -0.20 0.00 -1.27 0.00 0.00 60.65 58.87 1y7c h LYS 8 Cb 1.61 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.43 1y7c h LYS 8 CO 0.17 0.77 -0.69 1.03 -2.27 0.00 0.00 179.45 178.46 1y7c h SER 9 N 0.38 0.82 -0.41 4.20 0.87 -1.43 -2.61 113.55 115.36 1y7c h SER 9 Ca 0.04 -0.50 -0.14 0.00 -1.23 0.00 0.00 61.79 59.96 1y7c h SER 9 Cb 0.85 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.56 1y7c h SER 9 CO 0.07 1.28 -0.27 0.00 -0.53 0.00 0.00 176.83 177.39 1y7c h ALA 10 N 0.71 0.70 -0.01 6.23 0.00 -1.43 0.14 119.26 125.61 1y7c h ALA 10 Ca -0.03 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 1y7c h ALA 10 Cb 1.30 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 1y7c h ALA 10 CO 0.14 0.67 0.00 0.28 0.00 0.00 0.00 179.25 180.34 1y7c h VAL 11 N 0.80 1.19 -0.44 0.00 2.07 -1.27 -2.73 116.25 115.86 1y7c h VAL 11 Ca 0.09 -0.56 -0.08 0.00 0.82 0.00 0.00 66.70 66.98 1y7c h VAL 11 Cb 0.84 1.55 -0.02 0.00 -1.52 0.00 0.00 31.29 32.14 1y7c h VAL 11 CO 0.07 0.15 -0.03 0.74 0.02 0.00 0.00 177.57 178.52 1y7c h THR 12 N -0.22 1.27 -0.38 2.57 2.02 -1.49 0.65 112.91 117.33 1y7c h THR 12 Ca 0.00 -1.10 -0.00 0.00 0.77 0.00 0.00 66.41 66.08 1y7c h THR 12 Cb 0.24 1.09 -0.02 0.00 -1.74 0.00 0.00 68.15 67.72 1y7c h THR 12 CO 0.00 0.38 0.22 0.00 0.37 0.00 0.00 175.52 176.49 1y7c h ALA 13 N 0.89 0.49 -0.13 6.16 0.00 -0.73 -2.28 119.26 123.67 1y7c h ALA 13 Ca 0.12 -0.06 -0.23 0.00 0.00 0.00 0.00 54.91 54.74 1y7c h ALA 13 Cb 0.54 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.19 1y7c h ALA 13 CO 0.03 -0.01 -0.82 1.25 0.00 0.00 0.00 179.25 179.70 1y7c h LEU 14 N 0.50 0.95 -1.42 0.00 5.85 -1.45 -2.89 115.31 116.85 1y7c h LEU 14 Ca 0.14 -0.64 0.00 0.00 0.84 0.00 0.00 57.88 58.21 1y7c h LEU 14 Cb 0.02 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 40.77 1y7c h LEU 14 CO -0.02 1.45 0.00 -0.25 -0.34 0.00 0.00 178.44 179.27 1y7c h TRP 15 N 0.52 0.00 -0.22 1.25 2.91 -0.70 0.13 115.95 119.84 1y7c h TRP 15 Ca -0.07 0.00 -0.06 0.00 1.13 0.00 0.00 58.89 59.90 1y7c h TRP 15 Cb 1.46 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 30.10 1y7c h TRP 15 CO 0.09 0.00 -0.11 0.78 -1.03 0.00 0.00 178.44 178.17 1y7c h GLY 16 N 0.31 0.38 1.38 2.65 0.00 -1.19 -3.17 103.07 103.44 1y7c h GLY 16 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.09 1y7c h GLY 16 CO 0.00 0.23 -0.42 0.28 0.00 0.00 0.00 176.54 176.62 1y7c n LYS 17 N -4.25 0.21 -2.66 4.80 5.02 0.45 -4.97 118.16 116.75 1y7c n LYS 17 Ca 0.00 0.09 -0.39 0.00 -2.02 0.00 0.00 58.31 55.99 1y7c n LYS 17 Cb 0.28 -1.66 -0.05 0.00 -0.02 0.00 0.00 35.03 33.58 1y7c n LYS 17 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1y7c s VAL 18 N -3.11 3.92 -0.70 -0.18 1.01 -1.20 -5.02 120.40 115.12 1y7c s VAL 18 Ca 0.09 1.78 -0.11 0.00 0.00 0.00 0.00 61.98 63.73 1y7c s VAL 18 Cb 0.14 -4.07 0.18 0.00 0.00 0.00 0.00 36.38 32.63 1y7c s VAL 18 CO 0.67 0.31 0.60 0.21 0.00 0.00 0.00 175.10 176.90 1y7c s ASN 19 N -1.27 6.21 0.54 3.32 3.84 -1.26 -4.94 114.94 121.37 1y7c s ASN 19 Ca 0.46 -2.51 0.25 0.00 0.21 0.00 0.00 52.86 51.28 1y7c s ASN 19 Cb -0.25 -2.10 1.41 0.00 -0.55 0.00 0.00 41.25 39.76 1y7c s ASN 19 CO 0.32 -0.58 2.00 -0.37 -2.79 0.00 0.00 177.10 175.68 1y7c h VAL 20 N 5.21 0.71 0.10 -5.21 -1.51 -1.96 0.16 116.25 113.75 1y7c h VAL 20 Ca -0.02 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.45 1y7c h VAL 20 Cb 1.03 0.74 0.00 0.00 -2.13 0.00 0.00 31.29 30.94 1y7c h VAL 20 CO 0.80 0.00 -0.05 0.44 -1.23 0.00 0.00 177.57 177.53 1y7c h ASP 21 N 0.00 -0.11 0.70 4.19 3.32 -1.92 0.14 116.42 122.74 1y7c h ASP 21 Ca 0.23 -0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.21 1y7c h ASP 21 Cb 0.96 0.03 0.01 0.00 0.22 0.00 0.00 39.33 40.55 1y7c h ASP 21 CO -0.00 -0.03 -0.34 -0.08 -1.72 0.00 0.00 179.24 177.07 1y7c h GLU 22 N -0.18 -0.90 -0.94 3.56 4.81 -1.62 -2.63 114.58 116.67 1y7c h GLU 22 Ca -0.01 0.06 0.07 0.00 -0.13 0.00 0.00 59.36 59.35 1y7c h GLU 22 Cb 0.14 0.21 -0.06 0.00 0.63 0.00 0.00 28.75 29.67 1y7c h GLU 22 CO 0.02 -0.60 0.61 0.28 -0.73 0.00 0.00 179.01 178.59 1y7c h VAL 23 N -1.16 1.07 -0.51 0.32 2.07 -0.79 -1.91 116.25 115.33 1y7c h VAL 23 Ca -0.10 -0.37 0.02 0.00 0.82 0.00 0.00 66.70 67.08 1y7c h VAL 23 Cb 0.72 -0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 1y7c h VAL 23 CO 0.16 0.20 0.31 1.23 0.02 0.00 0.00 177.57 179.49 1y7c h GLY 24 N 1.07 0.73 1.10 2.17 0.00 -0.73 -1.44 103.07 105.97 1y7c h GLY 24 Ca 0.41 -0.24 -0.13 0.00 0.00 0.00 0.00 47.33 47.37 1y7c h GLY 24 CO -0.16 0.20 -0.24 -1.33 0.00 0.00 0.00 176.54 175.02 1y7c h GLY 25 N 0.62 1.05 1.01 4.60 0.00 -1.04 -2.83 103.07 106.48 1y7c h GLY 25 Ca 0.20 -0.96 -0.12 0.00 0.00 0.00 0.00 47.33 46.46 1y7c h GLY 25 CO -0.09 0.87 -0.24 0.83 0.00 0.00 0.00 176.54 177.92 1y7c h GLU 26 N 0.82 0.78 -0.18 4.80 4.39 -1.19 -2.01 114.58 121.99 1y7c h GLU 26 Ca 0.10 -0.37 -0.06 0.00 0.34 0.00 0.00 59.36 59.37 1y7c h GLU 26 Cb 0.82 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.46 1y7c h GLU 26 CO 0.07 1.00 -0.13 0.00 -1.16 0.00 0.00 179.01 178.79 1y7c h ALA 27 N 0.77 0.25 -0.35 3.43 0.00 -1.33 -1.14 119.26 120.90 1y7c h ALA 27 Ca 0.07 -0.31 -0.10 0.00 0.00 0.00 0.00 54.91 54.57 1y7c h ALA 27 Cb 0.80 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1y7c h ALA 27 CO 0.07 0.12 -0.19 1.25 0.00 0.00 0.00 179.25 180.50 1y7c h LEU 28 N 0.06 0.77 0.24 0.00 5.85 -1.57 -1.65 115.31 119.01 1y7c h LEU 28 Ca 0.03 -0.41 -0.01 0.00 0.84 0.00 0.00 57.88 58.33 1y7c h LEU 28 Cb 0.64 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.46 1y7c h LEU 28 CO 0.03 1.01 -0.11 1.23 -0.34 0.00 0.00 178.44 180.26 1y7c h GLY 29 N 0.52 -0.33 0.75 3.75 0.00 -1.38 -2.34 103.07 104.05 1y7c h GLY 29 Ca 0.08 0.12 0.13 0.00 0.00 0.00 0.00 47.33 47.66 1y7c h GLY 29 CO 0.05 -0.12 0.50 3.21 0.00 0.00 0.00 176.54 180.18 1y7c h ARG 30 N -0.43 0.49 -0.30 4.80 3.08 -1.21 0.18 114.38 121.00 1y7c h ARG 30 Ca -0.03 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 1y7c h ARG 30 Cb 0.32 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 1y7c h ARG 30 CO 0.05 0.32 0.14 1.25 -1.07 0.00 0.00 179.97 180.67 1y7c h LEU 31 N 0.50 0.40 -1.71 3.04 5.85 -0.97 0.44 115.31 122.86 1y7c h LEU 31 Ca 0.36 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.93 1y7c h LEU 31 Cb 0.71 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.63 1y7c h LEU 31 CO -0.13 0.42 -0.08 -0.07 -0.34 0.00 0.00 178.44 178.24 1y7c h LEU 32 N 0.35 0.00 0.00 2.25 3.38 -0.45 -2.03 115.31 118.81 1y7c h LEU 32 Ca 0.10 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.02 1y7c h LEU 32 Cb 0.13 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1y7c h LEU 32 CO -0.01 0.08 -0.55 0.58 0.09 0.00 0.00 178.44 178.63 1y7c h VAL 33 N 0.00 0.37 -0.60 1.22 2.07 -1.12 -3.28 116.25 114.91 1y7c h VAL 33 Ca -0.00 -1.39 -0.08 0.00 0.82 0.00 0.00 66.70 66.05 1y7c h VAL 33 Cb 0.45 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 1y7c h VAL 33 CO 0.01 0.12 0.07 0.58 0.02 0.00 0.00 177.57 178.37 1y7c h VAL 34 N -1.00 1.26 -2.36 2.57 2.07 -0.95 -3.35 116.25 114.49 1y7c h VAL 34 Ca -0.08 -1.03 -0.60 0.00 0.82 0.00 0.00 66.70 65.81 1y7c h VAL 34 Cb 0.64 0.72 -0.41 0.00 -1.52 0.00 0.00 31.29 30.72 1y7c h VAL 34 CO -0.05 0.38 -0.71 -1.22 0.02 0.00 0.00 177.57 175.98 1y7c n TYR 35 N -4.21 2.46 0.32 1.57 4.01 -0.76 -4.94 117.16 115.61 1y7c n TYR 35 Ca 0.04 -4.01 0.15 0.00 -0.16 0.00 0.00 57.90 53.91 1y7c n TYR 35 Cb 0.30 -0.47 0.78 0.00 -0.31 0.00 0.00 39.34 39.63 1y7c n TYR 35 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1y7c h PRO 36 N 4.51 0.00 0.00 -0.72 0.13 -1.70 0.25 132.00 134.47 1y7c h PRO 36 Ca 0.17 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.25 1y7c h PRO 36 Cb 0.74 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.86 1y7c h PRO 36 CO 0.71 0.00 -0.26 0.11 -0.23 0.00 0.00 178.00 178.33 1y7c h TRP 37 N 0.00 0.00 0.00 1.56 0.09 -1.91 -1.41 115.95 114.28 1y7c h TRP 37 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.99 1y7c h TRP 37 Cb 0.76 0.00 0.00 0.00 0.08 0.00 0.00 29.16 30.00 1y7c h TRP 37 CO 0.00 0.26 0.00 0.25 0.09 0.00 0.00 178.44 179.04 1y7c n THR 38 N -3.69 1.24 0.51 0.12 -2.24 0.88 -1.78 114.28 109.31 1y7c n THR 38 Ca -0.01 0.31 0.06 0.00 -2.27 0.00 0.00 64.05 62.14 1y7c n THR 38 Cb 0.37 -1.13 0.29 0.00 -2.10 0.00 0.00 70.33 67.76 1y7c n THR 38 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1y7c n GLN 39 N -1.48 0.10 0.25 -0.78 6.02 -0.53 -3.33 117.38 117.63 1y7c n GLN 39 Ca 0.03 0.22 0.16 0.00 -0.01 0.00 0.00 57.00 57.40 1y7c n GLN 39 Cb 0.12 -1.50 0.87 0.00 1.02 0.00 0.00 30.24 30.74 1y7c n GLN 39 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.06 176.12 1y7c h ARG 40 N 0.00 0.00 0.00 -1.09 0.11 -1.56 -2.63 114.38 109.21 1y7c h ARG 40 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1y7c h ARG 40 Cb 0.15 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.23 1y7c h ARG 40 CO 0.00 0.00 -0.67 1.19 0.10 0.00 0.00 179.97 180.59 1y7c n PHE 41 N -3.85 0.32 -1.92 4.08 3.01 -1.21 -4.43 117.46 113.46 1y7c n PHE 41 Ca -0.01 0.09 -0.25 0.00 1.01 0.00 0.00 57.45 58.29 1y7c n PHE 41 Cb 0.20 -0.48 0.03 0.00 -0.01 0.00 0.00 39.48 39.22 1y7c n PHE 41 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 1y7c n PHE 42 N -1.88 2.77 0.76 1.38 3.01 -0.99 -4.78 117.46 117.73 1y7c n PHE 42 Ca 0.04 -2.31 0.09 0.00 1.01 0.00 0.00 57.45 56.27 1y7c n PHE 42 Cb 0.41 -0.49 0.43 0.00 -0.01 0.00 0.00 39.48 39.82 1y7c n PHE 42 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92 1y7c n GLU 43 N -0.74 0.16 0.00 -1.08 0.28 -1.26 -2.03 120.64 115.97 1y7c n GLU 43 Ca 0.46 0.15 0.12 0.00 -0.16 0.00 0.00 57.16 57.73 1y7c n GLU 43 Cb 0.93 -1.50 0.19 0.00 1.43 0.00 0.00 31.44 32.48 1y7c n GLU 43 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 1y7c n SER 44 N -1.37 2.21 -0.12 -1.84 3.41 -1.26 -4.11 113.62 110.54 1y7c n SER 44 Ca 0.07 -1.64 0.14 0.00 -0.26 0.00 0.00 58.87 57.19 1y7c n SER 44 Cb 0.17 0.15 0.61 0.00 -0.26 0.00 0.00 64.21 64.88 1y7c n SER 44 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1y7c n PHE 45 N 0.50 0.00 -1.85 7.33 0.99 -0.86 -5.04 117.46 118.53 1y7c n PHE 45 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.58 1y7c n PHE 45 Cb 0.49 -0.18 0.00 0.00 -1.00 0.00 0.00 39.48 38.79 1y7c n PHE 45 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1y7c n GLY 46 N 1.27 0.32 3.63 1.37 0.00 -1.26 -4.85 105.19 105.68 1y7c n GLY 46 Ca 0.15 -1.40 -0.43 0.00 0.00 0.00 0.00 46.02 44.34 1y7c n GLY 46 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1y7c s ASP 47 N -4.00 6.44 -0.04 1.61 3.68 -1.26 -4.84 116.67 118.27 1y7c s ASP 47 Ca 0.00 1.53 0.05 0.00 2.13 0.00 0.00 52.55 56.27 1y7c s ASP 47 Cb 0.00 -2.53 0.08 0.00 -1.45 0.00 0.00 42.92 39.02 1y7c s ASP 47 CO 0.00 -1.22 0.94 0.18 0.13 0.00 0.00 175.17 175.20 1y7c n LEU 48 N 8.26 1.36 0.16 -1.34 4.77 -1.26 -4.29 117.00 124.66 1y7c n LEU 48 Ca 0.18 -1.73 0.18 0.00 -0.03 0.00 0.00 56.01 54.61 1y7c n LEU 48 Cb 0.45 -0.12 0.79 0.00 -2.33 0.00 0.00 43.42 42.22 1y7c n LEU 48 CO 0.64 0.42 1.16 0.77 -1.33 0.00 0.00 177.39 179.05 1y7c h SER 49 N 0.00 0.00 -5.55 -1.43 4.64 -1.89 -3.44 113.55 105.87 1y7c h SER 49 Ca 0.00 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.09 1y7c h SER 49 Cb 0.89 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 62.85 1y7c h SER 49 CO 0.00 0.00 -0.48 0.42 -0.87 0.00 0.00 176.83 175.90 1y7c s THR 50 N -4.67 0.00 0.15 2.95 -4.23 -1.26 -5.03 115.64 103.55 1y7c s THR 50 Ca -0.05 -1.86 -0.17 0.00 -1.18 0.00 0.00 61.69 58.43 1y7c s THR 50 Cb 0.16 -2.45 0.02 0.00 1.34 0.00 0.00 72.50 71.56 1y7c s THR 50 CO 0.56 0.00 1.73 -0.65 -0.54 0.00 0.00 174.62 175.72 1y7c h PRO 51 N 2.46 0.16 -0.51 3.99 0.11 -1.99 -2.31 132.00 133.90 1y7c h PRO 51 Ca -0.32 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.75 1y7c h PRO 51 Cb 1.25 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 1y7c h PRO 51 CO 0.47 0.10 0.20 -0.44 -0.21 0.00 0.00 178.00 178.12 1y7c h ASP 52 N 0.16 0.72 -0.02 -2.05 3.32 -1.97 -1.79 116.42 114.79 1y7c h ASP 52 Ca 0.15 -0.17 0.01 0.00 0.02 0.00 0.00 57.03 57.03 1y7c h ASP 52 Cb 0.17 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 39.53 1y7c h ASP 52 CO -0.21 0.70 0.04 0.00 -1.72 0.00 0.00 179.24 178.05 1y7c h ALA 53 N 1.05 1.37 0.00 3.45 0.00 -1.79 -1.54 119.26 121.79 1y7c h ALA 53 Ca 0.17 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.92 1y7c h ALA 53 Cb 0.21 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1y7c h ALA 53 CO -0.01 -0.05 -1.12 0.28 0.00 0.00 0.00 179.25 178.35 1y7c n VAL 54 N -3.53 1.49 0.14 0.00 0.31 -0.83 -3.10 118.33 112.80 1y7c n VAL 54 Ca -0.02 0.03 0.14 0.00 -0.01 0.00 0.00 64.34 64.48 1y7c n VAL 54 Cb 0.12 -2.16 0.67 0.00 -0.91 0.00 0.00 33.84 31.56 1y7c n VAL 54 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 1y7c h MET 55 N -1.00 0.00 0.00 5.55 2.07 -1.34 -2.57 114.93 117.64 1y7c h MET 55 Ca -0.25 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.38 1y7c h MET 55 Cb 1.05 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.78 1y7c h MET 55 CO -0.15 0.00 -1.17 0.41 1.07 0.00 0.00 176.91 177.07 1y7c n GLY 56 N -1.58 -1.01 3.64 8.32 0.00 -0.58 -4.86 105.19 109.11 1y7c n GLY 56 Ca 0.03 -0.57 -0.44 0.00 0.00 0.00 0.00 46.02 45.04 1y7c n GLY 56 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1y7c n ASN 57 N -1.66 3.77 -0.07 1.61 2.85 -0.97 -4.86 115.26 115.93 1y7c n ASN 57 Ca 0.02 0.72 0.14 0.00 -0.11 0.00 0.00 54.58 55.35 1y7c n ASN 57 Cb 0.38 -1.50 0.54 0.00 1.24 0.00 0.00 39.78 40.44 1y7c n ASN 57 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1y7c h PRO 58 N 11.60 0.31 -0.50 1.20 0.13 -1.91 -1.37 132.00 141.46 1y7c h PRO 58 Ca -0.47 -0.02 -0.11 0.00 -0.87 0.00 0.00 66.00 64.53 1y7c h PRO 58 Cb 1.25 -0.07 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 1y7c h PRO 58 CO 0.95 0.21 -0.13 0.87 -0.23 0.00 0.00 178.00 179.66 1y7c h LYS 59 N 0.32 0.97 -0.26 0.86 1.57 -1.89 -2.18 116.57 115.96 1y7c h LYS 59 Ca 0.28 -0.38 -0.16 0.00 -1.87 0.00 0.00 60.65 58.53 1y7c h LYS 59 Cb 0.67 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.93 1y7c h LYS 59 CO -0.07 1.05 -0.47 0.28 -0.57 0.00 0.00 179.45 179.66 1y7c h VAL 60 N 0.82 1.30 -0.46 0.50 2.07 -1.59 -0.81 116.25 118.08 1y7c h VAL 60 Ca 0.12 -1.67 -0.09 0.00 0.82 0.00 0.00 66.70 65.88 1y7c h VAL 60 Cb 0.70 1.61 -0.02 0.00 -1.52 0.00 0.00 31.29 32.06 1y7c h VAL 60 CO 0.05 0.53 -0.04 0.11 0.02 0.00 0.00 177.57 178.24 1y7c h LYS 61 N 0.54 0.84 -0.28 1.57 1.57 -1.19 0.73 116.57 120.36 1y7c h LYS 61 Ca 0.03 -0.29 -0.10 0.00 -1.87 0.00 0.00 60.65 58.42 1y7c h LYS 61 Cb 1.03 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.27 1y7c h LYS 61 CO 0.10 0.92 -0.21 0.00 -0.57 0.00 0.00 179.45 179.69 1y7c h ALA 62 N 0.90 0.40 -0.22 3.86 0.00 -1.35 -2.70 119.26 120.14 1y7c h ALA 62 Ca 0.13 -0.36 -0.10 0.00 0.00 0.00 0.00 54.91 54.58 1y7c h ALA 62 Cb 0.57 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 1y7c h ALA 62 CO 0.03 0.35 -0.24 1.25 0.00 0.00 0.00 179.25 180.64 1y7c h HIS 63 N 0.37 0.67 -0.96 0.00 -0.00 -1.07 -2.95 115.15 111.21 1y7c h HIS 63 Ca 0.05 -0.21 0.12 0.00 -0.00 0.00 0.00 60.37 60.34 1y7c h HIS 63 Cb 0.76 -0.14 -0.08 0.00 -0.00 0.00 0.00 27.41 27.95 1y7c h HIS 63 CO 0.07 0.91 0.61 0.78 -0.00 0.00 0.00 177.93 180.30 1y7c h GLY 64 N 0.25 1.50 1.40 5.26 0.00 -0.81 -0.13 103.07 110.53 1y7c h GLY 64 Ca 0.03 -0.39 -0.13 0.00 0.00 0.00 0.00 47.33 46.85 1y7c h GLY 64 CO 0.06 0.15 -0.32 1.70 0.00 0.00 0.00 176.54 178.13 1y7c h LYS 65 N 0.91 0.68 0.80 4.80 3.64 -1.44 -1.62 116.57 124.34 1y7c h LYS 65 Ca 0.48 -0.31 -0.04 0.00 -1.27 0.00 0.00 60.65 59.51 1y7c h LYS 65 Cb 0.54 -0.01 0.01 0.00 -0.41 0.00 0.00 32.23 32.35 1y7c h LYS 65 CO -0.24 0.91 -0.39 -0.22 -2.27 0.00 0.00 179.45 177.24 1y7c h LYS 66 N 0.58 -1.04 -0.45 1.90 3.64 -1.16 -1.49 116.57 118.54 1y7c h LYS 66 Ca 0.07 0.07 0.09 0.00 -1.27 0.00 0.00 60.65 59.61 1y7c h LYS 66 Cb 0.82 0.24 -0.09 0.00 -0.41 0.00 0.00 32.23 32.79 1y7c h LYS 66 CO 0.07 -0.69 -0.15 0.28 -2.27 0.00 0.00 179.45 176.69 1y7c h VAL 67 N -1.28 0.49 0.00 2.00 2.07 -1.01 -0.32 116.25 118.20 1y7c h VAL 67 Ca -0.11 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.39 1y7c h VAL 67 Cb 0.83 0.49 -0.00 0.00 -1.52 0.00 0.00 31.29 31.08 1y7c h VAL 67 CO 0.18 0.00 -0.11 -0.07 0.02 0.00 0.00 177.57 177.60 1y7c h LEU 68 N -0.04 0.00 0.02 2.57 3.38 -1.35 -2.02 115.31 117.87 1y7c h LEU 68 Ca 0.22 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.19 1y7c h LEU 68 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1y7c h LEU 68 CO -0.49 0.11 -0.01 1.23 0.09 0.00 0.00 178.44 179.37 1y7c h GLY 69 N 2.36 -0.03 0.91 0.83 0.00 0.03 0.25 103.07 107.43 1y7c h GLY 69 Ca -0.00 0.01 0.02 0.00 0.00 0.00 0.00 47.33 47.36 1y7c h GLY 69 CO 0.01 -0.01 0.49 0.00 0.00 0.00 0.00 176.54 177.04 1y7c h ALA 70 N 0.54 1.00 -0.48 3.60 0.00 -1.25 -2.18 119.26 120.49 1y7c h ALA 70 Ca -0.00 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1y7c h ALA 70 Cb 0.41 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1y7c h ALA 70 CO 0.00 0.32 0.10 0.35 0.00 0.00 0.00 179.25 180.03 1y7c h PHE 71 N 0.98 0.82 -0.55 0.00 3.57 -1.18 -1.48 116.94 119.09 1y7c h PHE 71 Ca 0.30 -0.10 -0.06 0.00 3.53 0.00 0.00 57.97 61.64 1y7c h PHE 71 Cb -0.02 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 38.46 1y7c h PHE 71 CO -0.03 0.75 0.11 0.77 -2.23 0.00 0.00 178.31 177.68 1y7c h SER 72 N 0.66 0.81 -0.81 0.41 0.02 0.05 -1.11 113.55 113.57 1y7c h SER 72 Ca 0.15 -0.16 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1y7c h SER 72 Cb 0.35 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 62.64 1y7c h SER 72 CO 0.00 0.80 0.48 0.44 -1.14 0.00 0.00 176.83 177.42 1y7c h ASP 73 N 0.82 0.99 -0.80 3.07 5.19 -1.20 -1.54 116.42 122.96 1y7c h ASP 73 Ca 0.18 -0.07 0.06 0.00 -0.62 0.00 0.00 57.03 56.58 1y7c h ASP 73 Cb 0.33 -0.25 -0.05 0.00 0.18 0.00 0.00 39.33 39.54 1y7c h ASP 73 CO 0.00 0.77 0.52 1.23 -3.12 0.00 0.00 179.24 178.65 1y7c h GLY 74 N 1.16 1.11 2.00 2.75 0.00 -0.14 -1.91 103.07 108.03 1y7c h GLY 74 Ca 0.29 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 47.27 1y7c h GLY 74 CO -0.05 0.27 0.00 1.04 0.00 0.00 0.00 176.54 177.80 1y7c n LEU 75 N -4.48 0.08 -0.60 3.11 4.77 -0.58 -2.12 117.00 117.18 1y7c n LEU 75 Ca 0.12 0.52 0.11 0.00 -0.03 0.00 0.00 56.01 56.73 1y7c n LEU 75 Cb 0.20 -0.52 0.02 0.00 -2.33 0.00 0.00 43.42 40.80 1y7c n LEU 75 CO 0.34 -0.34 0.39 0.00 -1.33 0.00 0.00 177.39 176.45 1y7c n ALA 76 N -1.53 3.18 -2.54 -1.18 0.00 -0.72 -4.39 120.51 113.33 1y7c n ALA 76 Ca 0.03 -0.64 -0.11 0.00 0.00 0.00 0.00 53.44 52.72 1y7c n ALA 76 Cb 0.15 -0.75 0.03 0.00 0.00 0.00 0.00 19.45 18.88 1y7c n ALA 76 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1y7c n HIS 77 N 0.35 1.88 0.25 0.00 8.25 -0.90 -4.90 115.22 120.15 1y7c n HIS 77 Ca 0.10 -2.35 0.14 0.00 -0.26 0.00 0.00 57.72 55.36 1y7c n HIS 77 Cb 0.48 -0.27 0.77 0.00 1.12 0.00 0.00 29.99 32.09 1y7c n HIS 77 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1y7c h LEU 78 N 2.54 0.00 -0.22 2.41 4.07 -1.75 0.22 115.31 122.57 1y7c h LEU 78 Ca 0.06 0.00 -0.15 0.00 0.08 0.00 0.00 57.88 57.87 1y7c h LEU 78 Cb 1.30 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.05 1y7c h LEU 78 CO 0.46 0.00 -0.43 -0.78 -1.08 0.00 0.00 178.44 176.61 1y7c h ASP 79 N 0.00 0.76 -2.00 -0.43 -0.00 -1.90 -3.39 116.42 109.46 1y7c h ASP 79 Ca 0.00 -0.54 -0.54 0.00 -0.00 0.00 0.00 57.03 55.95 1y7c h ASP 79 Cb 0.28 -0.22 -0.39 0.00 -0.00 0.00 0.00 39.33 39.00 1y7c h ASP 79 CO 0.00 1.16 -1.13 -3.20 -0.00 0.00 0.00 179.24 176.07 1y7c n ASN 80 N -4.19 0.34 -0.14 2.28 5.15 0.76 -4.94 115.26 114.51 1y7c n ASN 80 Ca -0.05 -2.77 -0.12 0.00 -0.60 0.00 0.00 54.58 51.03 1y7c n ASN 80 Cb 0.56 -0.64 -0.01 0.00 -0.53 0.00 0.00 39.78 39.16 1y7c n ASN 80 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1y7c h LEU 81 N 3.76 1.00 -0.55 1.20 3.38 -1.74 -0.75 115.31 121.60 1y7c h LEU 81 Ca 0.08 -0.43 0.06 0.00 0.09 0.00 0.00 57.88 57.68 1y7c h LEU 81 Cb 0.90 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 41.32 1y7c h LEU 81 CO 0.47 1.22 0.26 0.11 0.09 0.00 0.00 178.44 180.59 1y7c h LYS 82 N 0.79 0.48 -0.11 1.13 1.57 -1.90 0.47 116.57 119.00 1y7c h LYS 82 Ca 0.08 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.78 1y7c h LYS 82 Cb 0.88 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 33.08 1y7c h LYS 82 CO 0.08 0.32 -0.15 0.78 -0.57 0.00 0.00 179.45 179.91 1y7c h GLY 83 N 0.50 0.33 -0.13 3.86 0.00 -1.93 -2.36 103.07 103.34 1y7c h GLY 83 Ca 0.25 -0.35 0.12 0.00 0.00 0.00 0.00 47.33 47.35 1y7c h GLY 83 CO -0.20 0.32 -0.09 -0.84 0.00 0.00 0.00 176.54 175.73 1y7c h THR 84 N -0.12 0.44 -0.14 4.70 2.02 -0.69 -2.74 112.91 116.38 1y7c h THR 84 Ca 0.01 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1y7c h THR 84 Cb 0.70 0.40 0.00 0.00 -1.74 0.00 0.00 68.15 67.51 1y7c h THR 84 CO 0.04 0.01 0.00 0.49 0.37 0.00 0.00 175.52 176.42 1y7c n PHE 85 N -5.36 0.18 -0.25 3.16 3.01 0.16 -4.63 117.46 113.73 1y7c n PHE 85 Ca 0.07 -0.09 -0.06 0.00 1.01 0.00 0.00 57.45 58.38 1y7c n PHE 85 Cb 0.32 0.00 0.05 0.00 -0.01 0.00 0.00 39.48 39.84 1y7c n PHE 85 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1y7c h ALA 86 N 4.08 0.90 0.00 4.37 0.00 -1.10 -0.77 119.26 126.74 1y7c h ALA 86 Ca 0.00 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 1y7c h ALA 86 Cb 0.48 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1y7c h ALA 86 CO 0.00 0.49 -0.41 1.79 0.00 0.00 0.00 179.25 181.12 1y7c h THR 87 N 0.98 1.14 -0.13 0.00 1.35 -1.82 -2.68 112.91 111.74 1y7c h THR 87 Ca 0.24 -1.46 -0.08 0.00 -0.55 0.00 0.00 66.41 64.55 1y7c h THR 87 Cb 0.16 1.82 -0.00 0.00 -1.73 0.00 0.00 68.15 68.40 1y7c h THR 87 CO -0.03 0.40 -0.22 0.25 -0.25 0.00 0.00 175.52 175.67 1y7c h LEU 88 N 0.00 0.42 -0.69 3.87 5.85 -1.83 -1.50 115.31 121.43 1y7c h LEU 88 Ca -0.00 -0.54 0.08 0.00 0.84 0.00 0.00 57.88 58.26 1y7c h LEU 88 Cb 0.79 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.64 1y7c h LEU 88 CO 0.05 0.88 0.37 -1.28 -0.34 0.00 0.00 178.44 178.12 1y7c h SER 89 N -0.02 0.51 -0.55 1.25 0.87 -1.09 0.51 113.55 115.04 1y7c h SER 89 Ca 0.01 0.04 -0.07 0.00 -1.23 0.00 0.00 61.79 60.54 1y7c h SER 89 Cb 0.79 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 62.68 1y7c h SER 89 CO 0.05 0.31 0.07 -0.33 -0.53 0.00 0.00 176.83 176.41 1y7c h GLU 90 N 0.65 0.96 -0.05 2.24 5.08 -1.36 -1.59 114.58 120.51 1y7c h GLU 90 Ca 0.32 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 1y7c h GLU 90 Cb 0.27 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 1y7c h GLU 90 CO -0.22 0.90 0.01 1.25 -1.00 0.00 0.00 179.01 179.95 1y7c h LEU 91 N 0.90 0.08 -1.17 1.33 5.85 -0.28 0.17 115.31 122.20 1y7c h LEU 91 Ca 0.18 -0.27 0.03 0.00 0.84 0.00 0.00 57.88 58.65 1y7c h LEU 91 Cb 0.43 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.39 1y7c h LEU 91 CO 0.01 0.33 0.57 0.45 -0.34 0.00 0.00 178.44 179.46 1y7c h HIS 92 N -0.18 1.05 0.01 1.25 3.86 -0.83 0.32 115.15 120.62 1y7c h HIS 92 Ca 0.01 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.25 1y7c h HIS 92 Cb 0.29 -0.35 0.00 0.00 1.06 0.00 0.00 27.41 28.41 1y7c h HIS 92 CO 0.02 0.62 -0.00 0.00 0.86 0.00 0.00 177.93 179.43 1y7c h ASP 94 N -0.01 0.40 0.00 0.00 3.32 -0.99 -3.12 116.42 116.02 1y7c h ASP 94 Ca -0.00 -0.18 -0.32 0.00 0.02 0.00 0.00 57.03 56.54 1y7c h ASP 94 Cb 0.01 -0.11 -0.05 0.00 0.22 0.00 0.00 39.33 39.39 1y7c h ASP 94 CO 0.00 0.80 -2.09 0.29 -1.72 0.00 0.00 179.24 176.52 1y7c n LYS 95 N -3.99 0.43 0.06 3.56 4.01 0.99 -4.73 118.16 118.48 1y7c n LYS 95 Ca -0.02 0.17 -0.06 0.00 -0.51 0.00 0.00 58.31 57.89 1y7c n LYS 95 Cb 0.53 -1.24 -0.11 0.00 -0.51 0.00 0.00 35.03 33.70 1y7c n LYS 95 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 1y7c h LEU 96 N -0.55 0.00 -1.55 -0.35 3.38 -1.21 -3.49 115.31 111.54 1y7c h LEU 96 Ca -0.48 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.15 1y7c h LEU 96 Cb 1.48 0.00 0.16 0.00 0.09 0.00 0.00 40.66 42.39 1y7c h LEU 96 CO -0.25 0.96 -0.75 1.41 0.09 0.00 0.00 178.44 179.90 1y7c n HIS 97 N -3.30 -2.25 -3.40 1.13 8.25 0.73 -4.98 115.22 111.41 1y7c n HIS 97 Ca -0.02 0.93 -0.41 0.00 -0.26 0.00 0.00 57.72 57.96 1y7c n HIS 97 Cb 0.94 -5.03 -0.09 0.00 1.12 0.00 0.00 29.99 26.92 1y7c n HIS 97 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1y7c s VAL 98 N -3.35 5.17 0.02 1.59 1.01 -0.70 -5.03 120.40 119.12 1y7c s VAL 98 Ca 0.08 -0.13 -0.35 0.00 0.00 0.00 0.00 61.98 61.58 1y7c s VAL 98 Cb -0.03 -3.87 -0.14 0.00 0.00 0.00 0.00 36.38 32.34 1y7c s VAL 98 CO 0.72 -0.18 1.66 -0.67 0.00 0.00 0.00 175.10 176.63 1y7c n ASP 99 N 5.38 2.91 0.24 3.32 4.64 -1.26 -4.71 116.55 127.07 1y7c n ASP 99 Ca -0.09 1.05 0.18 0.00 -1.38 0.00 0.00 54.79 54.55 1y7c n ASP 99 Cb 0.49 -1.34 0.88 0.00 -1.04 0.00 0.00 41.12 40.10 1y7c n ASP 99 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1y7c h ALA 100 N 6.92 1.63 -0.07 -1.67 0.00 -1.97 0.34 119.26 124.45 1y7c h ALA 100 Ca -0.47 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.46 1y7c h ALA 100 Cb 1.28 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 1y7c h ALA 100 CO 0.90 -0.29 0.07 1.49 0.00 0.00 0.00 179.25 181.42 1y7c h GLU 101 N 0.00 0.00 -0.71 0.00 4.57 -1.99 -1.32 114.58 115.13 1y7c h GLU 101 Ca 0.07 0.00 0.03 0.00 -1.18 0.00 0.00 59.36 58.28 1y7c h GLU 101 Cb 0.49 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.04 1y7c h GLU 101 CO -0.00 0.00 0.47 -0.91 -1.18 0.00 0.00 179.01 177.38 1y7c h ASN 102 N 0.00 0.73 0.29 1.04 -0.26 -1.27 -1.06 115.58 115.05 1y7c h ASN 102 Ca 0.03 -0.01 -0.05 0.00 -0.56 0.00 0.00 56.30 55.72 1y7c h ASN 102 Cb 0.17 -0.17 -0.01 0.00 -1.06 0.00 0.00 38.32 37.25 1y7c h ASN 102 CO -0.00 0.50 -0.22 -0.26 -1.06 0.00 0.00 177.43 176.39 1y7c h PHE 103 N 0.85 0.00 0.04 1.19 0.04 -1.42 -1.79 116.94 115.85 1y7c h PHE 103 Ca 0.28 0.00 -0.26 0.00 2.80 0.00 0.00 57.97 60.80 1y7c h PHE 103 Cb 0.07 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.19 1y7c h PHE 103 CO -0.00 0.22 -1.30 0.00 -0.60 0.00 0.00 178.31 176.63 1y7c h ARG 104 N 0.00 0.09 0.15 1.51 3.08 -1.27 -3.02 114.38 114.92 1y7c h ARG 104 Ca -0.00 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 59.89 1y7c h ARG 104 Cb 0.42 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.53 1y7c h ARG 104 CO 0.03 0.95 -0.07 -0.07 -1.07 0.00 0.00 179.97 179.73 1y7c h LEU 105 N 0.02 -0.17 -1.29 3.04 3.38 -1.19 -2.50 115.31 116.61 1y7c h LEU 105 Ca -0.13 -0.04 0.07 0.00 0.09 0.00 0.00 57.88 57.86 1y7c h LEU 105 Cb 1.90 0.04 -0.05 0.00 0.09 0.00 0.00 40.66 42.64 1y7c h LEU 105 CO 0.14 -0.07 0.52 0.25 0.09 0.00 0.00 178.44 179.37 1y7c h LEU 106 N -0.26 0.75 -0.74 1.67 5.85 -1.44 -2.07 115.31 119.07 1y7c h LEU 106 Ca -0.02 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 1y7c h LEU 106 Cb 0.20 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 1y7c h LEU 106 CO 0.03 0.48 0.44 1.23 -0.34 0.00 0.00 178.44 180.29 1y7c h GLY 107 N 0.85 1.08 1.01 3.75 0.00 -1.32 0.48 103.07 108.92 1y7c h GLY 107 Ca 0.35 -0.46 -0.08 0.00 0.00 0.00 0.00 47.33 47.14 1y7c h GLY 107 CO -0.13 0.44 -0.02 3.43 0.00 0.00 0.00 176.54 180.27 1y7c h ASN 108 N 1.02 0.85 -0.22 0.19 2.35 -0.99 -0.44 115.58 118.33 1y7c h ASN 108 Ca 0.27 -0.32 -0.01 0.00 -0.55 0.00 0.00 56.30 55.69 1y7c h ASN 108 Cb -0.03 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.11 1y7c h ASN 108 CO -0.05 0.96 0.11 0.58 -1.65 0.00 0.00 177.43 177.38 1y7c h VAL 109 N 0.72 1.13 -1.00 2.81 2.07 -1.14 -0.92 116.25 119.92 1y7c h VAL 109 Ca 0.13 -0.37 0.08 0.00 0.82 0.00 0.00 66.70 67.37 1y7c h VAL 109 Cb 0.53 0.97 -0.07 0.00 -1.52 0.00 0.00 31.29 31.19 1y7c h VAL 109 CO 0.03 0.13 0.64 0.25 0.02 0.00 0.00 177.57 178.63 1y7c h LEU 110 N 0.24 0.99 -0.89 2.57 5.85 0.25 0.28 115.31 124.59 1y7c h LEU 110 Ca 0.08 0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.76 1y7c h LEU 110 Cb 0.10 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 1y7c h LEU 110 CO -0.01 0.59 0.09 0.58 -0.34 0.00 0.00 178.44 179.35 1y7c h VAL 111 N 1.10 1.24 -0.44 1.05 2.07 -0.50 0.11 116.25 120.90 1y7c h VAL 111 Ca 0.45 -0.94 -0.13 0.00 0.82 0.00 0.00 66.70 66.90 1y7c h VAL 111 Cb 0.28 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 1y7c h VAL 111 CO -0.21 0.35 -0.24 0.00 0.02 0.00 0.00 177.57 177.49 1y7c h VAL 113 N 0.78 1.07 -0.71 0.00 2.07 0.03 0.18 116.25 119.66 1y7c h VAL 113 Ca 0.10 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.46 1y7c h VAL 113 Cb 0.79 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.18 1y7c h VAL 113 CO 0.07 0.07 0.35 -0.07 0.02 0.00 0.00 177.57 178.01 1y7c h LEU 114 N 0.39 0.91 -0.45 2.57 3.38 -0.72 -0.96 115.31 120.43 1y7c h LEU 114 Ca 0.11 -0.09 -0.15 0.00 0.09 0.00 0.00 57.88 57.83 1y7c h LEU 114 Cb -0.04 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 1y7c h LEU 114 CO -0.02 0.76 -0.36 0.00 0.09 0.00 0.00 178.44 178.91 1y7c h ALA 115 N 1.38 0.63 -0.46 1.53 0.00 -0.98 -0.24 119.26 121.13 1y7c h ALA 115 Ca 0.25 -0.44 0.06 0.00 0.00 0.00 0.00 54.91 54.78 1y7c h ALA 115 Cb 0.09 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.70 1y7c h ALA 115 CO -0.03 0.67 0.14 1.25 0.00 0.00 0.00 179.25 181.28 1y7c h HIS 116 N 0.75 0.24 0.04 0.00 -0.00 0.16 -1.66 115.15 114.67 1y7c h HIS 116 Ca 0.07 0.02 -0.11 0.00 -0.00 0.00 0.00 60.37 60.35 1y7c h HIS 116 Cb 0.94 -0.04 0.01 0.00 -0.00 0.00 0.00 27.41 28.32 1y7c h HIS 116 CO 0.06 0.07 -0.46 0.45 -0.00 0.00 0.00 177.93 178.05 1y7c h HIS 117 N 0.30 0.38 -0.00 5.26 3.86 -1.10 -3.36 115.15 120.47 1y7c h HIS 117 Ca 0.22 -0.24 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1y7c h HIS 117 Cb 0.24 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 28.68 1y7c h HIS 117 CO -0.18 1.11 -0.31 1.19 0.86 0.00 0.00 177.93 180.60 1y7c n PHE 118 N -4.34 0.00 -1.33 2.45 3.01 -0.11 -4.99 117.46 112.14 1y7c n PHE 118 Ca -0.11 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.35 1y7c n PHE 118 Cb 0.63 -0.26 0.00 0.00 -0.01 0.00 0.00 39.48 39.85 1y7c n PHE 118 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1y7c n GLY 119 N 1.44 3.06 0.21 1.37 0.00 -0.63 -1.24 105.19 109.40 1y7c n GLY 119 Ca 0.08 -0.17 0.11 0.00 0.00 0.00 0.00 46.02 46.05 1y7c n GLY 119 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1y7c h LYS 120 N 0.00 0.00 0.00 1.61 -0.00 -1.94 -1.66 116.57 114.58 1y7c h LYS 120 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 60.65 60.58 1y7c h LYS 120 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 32.23 32.22 1y7c h LYS 120 CO 0.00 0.00 -0.32 1.49 -0.00 0.00 0.00 179.45 180.62 1y7c h GLU 121 N 0.00 0.00 -3.71 0.07 4.81 -1.56 -3.33 114.58 110.86 1y7c h GLU 121 Ca 0.00 0.00 -0.74 0.00 -0.13 0.00 0.00 59.36 58.49 1y7c h GLU 121 Cb 0.36 0.00 -0.12 0.00 0.63 0.00 0.00 28.75 29.62 1y7c h GLU 121 CO 0.00 0.32 2.36 0.34 -0.73 0.00 0.00 179.01 181.30 1y7c n PHE 122 N -3.44 3.18 -1.04 0.92 7.35 -0.63 -4.93 117.46 118.87 1y7c n PHE 122 Ca 0.00 -2.86 -0.31 0.00 -0.76 0.00 0.00 57.45 53.52 1y7c n PHE 122 Cb 0.49 -2.15 0.12 0.00 0.35 0.00 0.00 39.48 38.30 1y7c n PHE 122 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1y7c s THR 123 N 1.31 2.63 0.18 -2.13 -4.23 -1.25 -4.72 115.64 107.44 1y7c s THR 123 Ca 0.42 0.22 -0.19 0.00 -1.18 0.00 0.00 61.69 60.97 1y7c s THR 123 Cb 0.11 -2.50 0.13 0.00 1.34 0.00 0.00 72.50 71.58 1y7c s THR 123 CO -0.02 -0.26 1.62 -0.65 -0.54 0.00 0.00 174.62 174.77 1y7c h PRO 124 N -1.33 -0.12 0.00 3.99 0.11 -1.93 0.20 132.00 132.92 1y7c h PRO 124 Ca -0.44 0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.66 1y7c h PRO 124 Cb 1.26 0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.39 1y7c h PRO 124 CO 0.47 -0.08 -0.10 -1.35 -0.21 0.00 0.00 178.00 176.73 1y7c h PRO 125 N -0.12 0.00 0.06 1.05 0.11 -1.99 -2.19 132.00 128.92 1y7c h PRO 125 Ca 0.23 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 66.10 1y7c h PRO 125 Cb 0.48 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.58 1y7c h PRO 125 CO -0.57 0.10 -1.12 0.28 -0.21 0.00 0.00 178.00 176.48 1y7c h VAL 126 N 0.00 1.61 -0.30 3.15 2.07 -1.08 -3.18 116.25 118.52 1y7c h VAL 126 Ca -0.00 -3.24 -0.03 0.00 0.82 0.00 0.00 66.70 64.25 1y7c h VAL 126 Cb 0.26 2.89 -0.01 0.00 -1.52 0.00 0.00 31.29 32.91 1y7c h VAL 126 CO 0.01 0.94 0.08 -0.61 0.02 0.00 0.00 177.57 178.01 1y7c h GLN 127 N 0.04 0.48 -0.75 1.57 4.15 -0.25 -2.06 115.11 118.29 1y7c h GLN 127 Ca -0.07 -0.11 0.07 0.00 0.77 0.00 0.00 58.65 59.30 1y7c h GLN 127 Cb 1.87 -0.07 -0.05 0.00 0.21 0.00 0.00 27.48 29.44 1y7c h GLN 127 CO 0.17 0.54 0.49 0.00 -1.93 0.00 0.00 178.83 178.10 1y7c h ALA 128 N 0.91 1.68 0.24 3.38 0.00 -1.50 0.59 119.26 124.57 1y7c h ALA 128 Ca 0.10 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1y7c h ALA 128 Cb 0.27 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1y7c h ALA 128 CO -0.00 0.20 -0.12 0.00 0.00 0.00 0.00 179.25 179.33 1y7c h ALA 129 N 1.60 -0.32 -0.35 0.00 0.00 -1.51 -2.38 119.26 116.29 1y7c h ALA 129 Ca 0.32 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1y7c h ALA 129 Cb 0.26 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1y7c h ALA 129 CO -0.11 -0.53 0.19 1.88 0.00 0.00 0.00 179.25 180.68 1y7c h TYR 130 N -0.63 0.47 -0.58 0.00 0.05 -0.74 -0.84 116.97 114.70 1y7c h TYR 130 Ca -0.03 -0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.72 1y7c h TYR 130 Cb 0.45 -0.15 -0.03 0.00 1.01 0.00 0.00 36.73 38.01 1y7c h TYR 130 CO 0.02 0.33 0.26 1.96 -1.05 0.00 0.00 178.16 179.68 1y7c h GLN 131 N 0.49 0.84 -0.83 4.88 1.08 0.30 0.17 115.11 122.04 1y7c h GLN 131 Ca 0.13 -0.14 -0.02 0.00 -1.45 0.00 0.00 58.65 57.17 1y7c h GLN 131 Cb 0.02 -0.15 -0.04 0.00 -0.05 0.00 0.00 27.48 27.27 1y7c h GLN 131 CO -0.02 0.70 0.44 0.87 -0.95 0.00 0.00 178.83 179.87 1y7c h LYS 132 N 0.79 1.17 -0.22 1.46 1.57 -0.84 -2.74 116.57 117.76 1y7c h LYS 132 Ca 0.20 -0.15 -0.04 0.00 -1.87 0.00 0.00 60.65 58.79 1y7c h LYS 132 Cb 0.15 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 1y7c h LYS 132 CO -0.02 0.88 -0.01 0.28 -0.57 0.00 0.00 179.45 180.00 1y7c h VAL 133 N 1.17 1.26 -0.04 0.50 2.07 -0.55 -0.77 116.25 119.90 1y7c h VAL 133 Ca 0.29 -0.93 -0.09 0.00 0.82 0.00 0.00 66.70 66.79 1y7c h VAL 133 Cb 0.06 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 31.25 1y7c h VAL 133 CO -0.04 0.29 -0.41 -0.37 0.02 0.00 0.00 177.57 177.05 1y7c h VAL 134 N 0.15 1.30 -0.27 2.57 -1.51 -0.62 -1.98 116.25 115.90 1y7c h VAL 134 Ca 0.06 -1.46 -0.10 0.00 -1.23 0.00 0.00 66.70 63.97 1y7c h VAL 134 Cb 0.43 1.74 -0.00 0.00 -2.13 0.00 0.00 31.29 31.32 1y7c h VAL 134 CO 0.01 0.42 -0.23 0.00 -1.23 0.00 0.00 177.57 176.54 1y7c h ALA 135 N 1.52 0.40 -0.88 5.19 0.00 -1.39 -0.61 119.26 123.48 1y7c h ALA 135 Ca 0.00 -0.37 0.09 0.00 0.00 0.00 0.00 54.91 54.63 1y7c h ALA 135 Cb 0.76 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.39 1y7c h ALA 135 CO 0.06 0.37 0.53 0.78 0.00 0.00 0.00 179.25 180.98 1y7c h GLY 136 N 0.37 1.37 0.93 0.00 0.00 -0.85 0.26 103.07 105.15 1y7c h GLY 136 Ca 0.05 -0.37 -0.15 0.00 0.00 0.00 0.00 47.33 46.86 1y7c h GLY 136 CO 0.06 0.18 -0.49 -2.08 0.00 0.00 0.00 176.54 174.21 1y7c h VAL 137 N 0.90 1.34 -0.71 4.60 2.07 -1.27 0.13 116.25 123.32 1y7c h VAL 137 Ca 0.41 -1.77 0.03 0.00 0.82 0.00 0.00 66.70 66.19 1y7c h VAL 137 Cb 0.32 2.07 -0.05 0.00 -1.52 0.00 0.00 31.29 32.11 1y7c h VAL 137 CO -0.23 0.54 0.44 0.00 0.02 0.00 0.00 177.57 178.35 1y7c h ALA 138 N 0.52 0.93 -0.27 1.67 0.00 -0.34 0.50 119.26 122.27 1y7c h ALA 138 Ca -0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1y7c h ALA 138 Cb 1.12 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 1y7c h ALA 138 CO 0.10 0.22 0.13 -0.91 0.00 0.00 0.00 179.25 178.79 1y7c h ASN 139 N 0.87 0.36 -0.95 0.00 -0.26 -0.39 -1.61 115.58 113.60 1y7c h ASN 139 Ca 0.29 -0.13 0.00 0.00 -0.56 0.00 0.00 56.30 55.90 1y7c h ASN 139 Cb 0.03 -0.09 -0.05 0.00 -1.06 0.00 0.00 38.32 37.15 1y7c h ASN 139 CO -0.11 0.39 0.61 0.00 -1.06 0.00 0.00 177.43 177.26 1y7c h ALA 140 N 0.98 1.29 0.00 -0.83 0.00 -0.14 -0.88 119.26 119.69 1y7c h ALA 140 Ca 0.09 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1y7c h ALA 140 Cb 0.13 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.54 1y7c h ALA 140 CO -0.01 0.64 0.00 -0.07 0.00 0.00 0.00 179.25 179.81 1y7c h LEU 141 N 1.29 0.00 -0.17 0.00 3.38 0.50 -3.06 115.31 117.25 1y7c h LEU 141 Ca 0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.31 1y7c h LEU 141 Cb -0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1y7c h LEU 141 CO -0.07 0.00 -0.83 0.00 0.09 0.00 0.00 178.44 177.62 1y7c n ALA 142 N -1.89 4.35 -0.32 1.53 0.00 -0.52 -4.37 120.51 119.30 1y7c n ALA 142 Ca 0.02 -0.56 0.20 0.00 0.00 0.00 0.00 53.44 53.10 1y7c n ALA 142 Cb 0.29 -0.71 0.46 0.00 0.00 0.00 0.00 19.45 19.49 1y7c n ALA 142 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 1y7c h HIS 143 N 0.41 0.77 -0.49 0.00 2.07 -1.10 -1.22 115.15 115.58 1y7c h HIS 143 Ca 0.00 0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.55 1y7c h HIS 143 Cb 0.50 -0.23 0.00 0.00 2.57 0.00 0.00 27.41 30.26 1y7c h HIS 143 CO 0.00 0.10 0.00 1.63 -3.07 0.00 0.00 177.93 176.59 1y7c n LYS 144 N -4.67 2.40 -2.65 5.12 4.76 -1.26 -4.93 118.16 116.92 1y7c n LYS 144 Ca 0.24 -1.87 -0.37 0.00 -2.87 0.00 0.00 58.31 53.44 1y7c n LYS 144 Cb 0.78 -1.49 -0.05 0.00 -1.84 0.00 0.00 35.03 32.43 1y7c n LYS 144 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1y7c s TYR 145 N -1.46 3.46 0.00 2.13 2.02 -0.46 -4.77 117.35 118.27 1y7c s TYR 145 Ca 0.34 1.70 0.00 0.00 -0.37 0.00 0.00 57.07 58.75 1y7c s TYR 145 Cb 0.19 -3.04 0.00 0.00 -0.40 0.00 0.00 41.96 38.71 1y7c s TYR 145 CO 0.21 -0.26 0.00 -2.39 -1.57 0.00 0.00 175.55 171.54