#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y7d n HIS 2 N 0.00 2.52 -3.06 2.03 -0.00 -1.26 -4.95 115.22 110.51 1y7d n HIS 2 Ca 0.00 -2.60 -0.43 0.00 -0.00 0.00 0.00 57.72 54.69 1y7d n HIS 2 Cb 0.00 -1.34 -0.06 0.00 -0.00 0.00 0.00 29.99 28.59 1y7d n HIS 2 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1y7d s LEU 3 N -3.13 4.42 0.59 0.27 1.02 -1.26 -5.03 118.68 115.56 1y7d s LEU 3 Ca 0.37 -0.28 -0.17 0.00 0.02 0.00 0.00 54.13 54.07 1y7d s LEU 3 Cb 0.12 -2.80 -0.04 0.00 0.02 0.00 0.00 46.19 43.49 1y7d s LEU 3 CO -0.01 -0.84 1.08 0.42 0.02 0.00 0.00 176.35 177.02 1y7d s THR 4 N 3.00 3.52 0.29 5.49 -4.23 -1.26 -4.79 115.64 117.66 1y7d s THR 4 Ca 0.25 0.79 -0.02 0.00 -1.18 0.00 0.00 61.69 61.53 1y7d s THR 4 Cb -0.13 -3.30 0.37 0.00 1.34 0.00 0.00 72.50 70.78 1y7d s THR 4 CO 0.20 -0.36 1.59 -0.65 -0.54 0.00 0.00 174.62 174.87 1y7d h PRO 5 N 0.64 0.04 0.00 3.99 0.11 -2.00 0.33 132.00 135.11 1y7d h PRO 5 Ca -0.48 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.57 1y7d h PRO 5 Cb 1.24 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1y7d h PRO 5 CO 0.57 0.03 -0.28 1.05 -0.21 0.00 0.00 178.00 179.16 1y7d h GLU 6 N 0.04 0.00 0.06 1.05 9.09 -2.00 -2.53 114.58 120.29 1y7d h GLU 6 Ca 0.53 0.00 -0.24 0.00 0.05 0.00 0.00 59.36 59.70 1y7d h GLU 6 Cb 1.01 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.11 1y7d h GLU 6 CO -0.85 0.28 -1.06 0.93 0.05 0.00 0.00 179.01 178.35 1y7d h GLU 7 N 0.00 0.24 -0.05 1.06 5.08 -0.74 -2.97 114.58 117.21 1y7d h GLU 7 Ca -0.00 -0.34 -0.14 0.00 -1.00 0.00 0.00 59.36 57.88 1y7d h GLU 7 Cb 0.73 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.08 1y7d h GLU 7 CO 0.04 1.10 -0.58 -0.22 -1.00 0.00 0.00 179.01 178.34 1y7d h LYS 8 N 0.10 0.16 -0.22 2.33 3.64 -1.08 -1.59 116.57 119.92 1y7d h LYS 8 Ca -0.09 -0.11 -0.11 0.00 -1.27 0.00 0.00 60.65 59.07 1y7d h LYS 8 Cb 1.75 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 33.59 1y7d h LYS 8 CO 0.17 0.70 -0.31 1.03 -2.27 0.00 0.00 179.45 178.77 1y7d h SER 9 N 0.12 0.65 -0.61 4.20 0.87 -1.51 -2.68 113.55 114.59 1y7d h SER 9 Ca -0.00 -0.51 -0.07 0.00 -1.23 0.00 0.00 61.79 59.97 1y7d h SER 9 Cb 1.06 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.81 1y7d h SER 9 CO 0.09 1.04 0.11 0.00 -0.53 0.00 0.00 176.83 177.53 1y7d h ALA 10 N 0.64 0.81 0.04 6.23 0.00 -1.45 0.75 119.26 126.27 1y7d h ALA 10 Ca 0.02 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 1y7d h ALA 10 Cb 0.89 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1y7d h ALA 10 CO 0.07 0.56 -0.02 0.28 0.00 0.00 0.00 179.25 180.14 1y7d h VAL 11 N 0.91 1.09 -0.57 0.00 2.07 -1.27 -3.06 116.25 115.42 1y7d h VAL 11 Ca 0.19 -0.41 -0.07 0.00 0.82 0.00 0.00 66.70 67.23 1y7d h VAL 11 Cb 0.42 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.53 1y7d h VAL 11 CO 0.01 0.11 0.10 0.74 0.02 0.00 0.00 177.57 178.55 1y7d h THR 12 N -0.24 1.25 -0.50 2.57 2.02 -1.46 -1.42 112.91 115.13 1y7d h THR 12 Ca -0.01 -0.96 -0.02 0.00 0.77 0.00 0.00 66.41 66.19 1y7d h THR 12 Cb 0.21 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.38 1y7d h THR 12 CO 0.01 0.35 0.23 0.00 0.37 0.00 0.00 175.52 176.48 1y7d h ALA 13 N 1.01 0.65 -0.01 6.16 0.00 -0.88 -2.77 119.26 123.41 1y7d h ALA 13 Ca 0.17 -0.13 -0.26 0.00 0.00 0.00 0.00 54.91 54.70 1y7d h ALA 13 Cb 0.40 -0.20 0.02 0.00 0.00 0.00 0.00 17.79 18.02 1y7d h ALA 13 CO 0.01 0.22 -1.01 1.25 0.00 0.00 0.00 179.25 179.72 1y7d h LEU 14 N 0.66 0.90 -2.45 0.00 5.85 -1.52 -3.06 115.31 115.70 1y7d h LEU 14 Ca 0.17 -0.73 0.00 0.00 0.84 0.00 0.00 57.88 58.16 1y7d h LEU 14 Cb 0.14 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 40.89 1y7d h LEU 14 CO -0.02 1.52 0.05 -0.25 -0.34 0.00 0.00 178.44 179.39 1y7d h TRP 15 N 0.38 0.00 -0.33 1.25 2.91 -1.19 0.23 115.95 119.20 1y7d h TRP 15 Ca -0.12 0.00 -0.04 0.00 1.13 0.00 0.00 58.89 59.85 1y7d h TRP 15 Cb 1.66 0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 30.29 1y7d h TRP 15 CO 0.10 0.00 0.02 0.78 -1.03 0.00 0.00 178.44 178.32 1y7d h GLY 16 N 0.00 0.54 1.27 2.65 0.00 -1.38 -3.08 103.07 103.07 1y7d h GLY 16 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.03 1y7d h GLY 16 CO 0.00 0.29 -0.45 0.28 0.00 0.00 0.00 176.54 176.66 1y7d n LYS 17 N -4.30 0.13 -2.53 4.80 5.02 0.07 -4.94 118.16 116.41 1y7d n LYS 17 Ca 0.02 0.05 -0.41 0.00 -2.02 0.00 0.00 58.31 55.95 1y7d n LYS 17 Cb 0.22 -1.59 -0.04 0.00 -0.02 0.00 0.00 35.03 33.59 1y7d n LYS 17 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1y7d s VAL 18 N -3.07 3.72 -0.80 -0.18 1.01 -1.17 -5.00 120.40 114.90 1y7d s VAL 18 Ca 0.09 1.62 -0.14 0.00 0.00 0.00 0.00 61.98 63.56 1y7d s VAL 18 Cb 0.16 -4.03 0.21 0.00 0.00 0.00 0.00 36.38 32.71 1y7d s VAL 18 CO 0.68 0.34 0.75 0.21 0.00 0.00 0.00 175.10 177.08 1y7d s ASN 19 N -0.60 6.71 0.55 3.32 3.84 -1.26 -4.94 114.94 122.57 1y7d s ASN 19 Ca 0.46 -2.60 0.27 0.00 0.21 0.00 0.00 52.86 51.20 1y7d s ASN 19 Cb -0.30 -2.21 1.46 0.00 -0.55 0.00 0.00 41.25 39.64 1y7d s ASN 19 CO 0.37 -0.61 1.97 -0.37 -2.79 0.00 0.00 177.10 175.68 1y7d h VAL 20 N 4.90 0.60 0.04 -5.21 -1.51 -1.95 -0.84 116.25 112.28 1y7d h VAL 20 Ca 0.07 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.54 1y7d h VAL 20 Cb 1.05 0.70 0.00 0.00 -2.13 0.00 0.00 31.29 30.90 1y7d h VAL 20 CO 0.78 0.00 -0.02 0.44 -1.23 0.00 0.00 177.57 177.54 1y7d h ASP 21 N 0.00 -0.05 0.80 4.19 3.32 -1.92 -1.87 116.42 120.90 1y7d h ASP 21 Ca 0.25 -0.05 -0.04 0.00 0.02 0.00 0.00 57.03 57.21 1y7d h ASP 21 Cb 1.08 0.01 0.01 0.00 0.22 0.00 0.00 39.33 40.65 1y7d h ASP 21 CO -0.00 0.02 -0.38 -0.08 -1.72 0.00 0.00 179.24 177.07 1y7d h GLU 22 N -0.11 -1.03 -0.81 3.56 4.81 -1.65 -2.89 114.58 116.46 1y7d h GLU 22 Ca -0.01 0.07 0.05 0.00 -0.13 0.00 0.00 59.36 59.34 1y7d h GLU 22 Cb 0.09 0.24 -0.05 0.00 0.63 0.00 0.00 28.75 29.66 1y7d h GLU 22 CO 0.01 -0.68 0.53 0.28 -0.73 0.00 0.00 179.01 178.42 1y7d h VAL 23 N -1.24 1.09 -0.11 0.32 2.07 -1.28 -2.33 116.25 114.78 1y7d h VAL 23 Ca -0.11 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.09 1y7d h VAL 23 Cb 0.83 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 1y7d h VAL 23 CO 0.18 0.17 0.07 1.23 0.02 0.00 0.00 177.57 179.24 1y7d h GLY 24 N 0.95 0.15 0.98 2.17 0.00 -1.37 -0.28 103.07 105.66 1y7d h GLY 24 Ca 0.33 -0.05 -0.05 0.00 0.00 0.00 0.00 47.33 47.56 1y7d h GLY 24 CO -0.11 0.05 0.15 -1.33 0.00 0.00 0.00 176.54 175.31 1y7d h GLY 25 N 0.14 0.89 0.85 4.60 0.00 -1.29 -2.34 103.07 105.92 1y7d h GLY 25 Ca 0.04 -0.54 -0.03 0.00 0.00 0.00 0.00 47.33 46.80 1y7d h GLY 25 CO -0.01 0.50 0.03 0.83 0.00 0.00 0.00 176.54 177.89 1y7d h GLU 26 N 0.73 0.40 -0.03 4.80 4.39 -1.33 -1.46 114.58 122.08 1y7d h GLU 26 Ca 0.17 -0.11 -0.00 0.00 0.34 0.00 0.00 59.36 59.75 1y7d h GLU 26 Cb 0.30 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 28.90 1y7d h GLU 26 CO -0.00 0.55 0.00 0.00 -1.16 0.00 0.00 179.01 178.40 1y7d h ALA 27 N 0.84 0.04 -0.41 3.43 0.00 -1.04 -1.33 119.26 120.80 1y7d h ALA 27 Ca 0.07 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 1y7d h ALA 27 Cb 0.35 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1y7d h ALA 27 CO 0.01 -0.31 0.06 1.25 0.00 0.00 0.00 179.25 180.25 1y7d h LEU 28 N -0.21 0.66 0.34 0.00 5.85 -1.47 -1.99 115.31 118.48 1y7d h LEU 28 Ca 0.01 -0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.45 1y7d h LEU 28 Cb 0.29 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.14 1y7d h LEU 28 CO 0.00 0.77 -0.18 1.23 -0.34 0.00 0.00 178.44 179.91 1y7d h GLY 29 N 0.54 -0.50 1.02 3.75 0.00 -1.25 -2.52 103.07 104.11 1y7d h GLY 29 Ca 0.12 0.20 0.06 0.00 0.00 0.00 0.00 47.33 47.72 1y7d h GLY 29 CO 0.01 -0.19 0.49 3.21 0.00 0.00 0.00 176.54 180.07 1y7d h ARG 30 N -0.48 0.78 -0.36 4.80 3.08 -1.24 -1.87 114.38 119.09 1y7d h ARG 30 Ca -0.04 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 59.98 1y7d h ARG 30 Cb 0.39 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 1y7d h ARG 30 CO 0.06 0.52 0.22 1.25 -1.07 0.00 0.00 179.97 180.94 1y7d h LEU 31 N 0.80 0.35 -1.27 3.04 5.85 -1.01 0.17 115.31 123.24 1y7d h LEU 31 Ca 0.32 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.98 1y7d h LEU 31 Cb 0.24 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 1y7d h LEU 31 CO -0.11 0.26 -0.29 -0.07 -0.34 0.00 0.00 178.44 177.89 1y7d h LEU 32 N 0.44 0.00 0.00 2.25 3.38 -0.94 -1.56 115.31 118.88 1y7d h LEU 32 Ca 0.14 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.06 1y7d h LEU 32 Cb -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1y7d h LEU 32 CO -0.06 0.29 -0.38 0.58 0.09 0.00 0.00 178.44 178.96 1y7d h VAL 33 N 0.00 0.58 -0.51 1.22 2.07 -1.16 -3.27 116.25 115.17 1y7d h VAL 33 Ca -0.00 -1.53 -0.11 0.00 0.82 0.00 0.00 66.70 65.88 1y7d h VAL 33 Cb 0.69 1.19 -0.02 0.00 -1.52 0.00 0.00 31.29 31.63 1y7d h VAL 33 CO 0.04 0.20 -0.10 0.58 0.02 0.00 0.00 177.57 178.31 1y7d h VAL 34 N -1.00 1.27 -2.74 2.57 2.07 -0.70 -3.36 116.25 114.36 1y7d h VAL 34 Ca -0.07 -1.24 -0.61 0.00 0.82 0.00 0.00 66.70 65.60 1y7d h VAL 34 Cb 0.61 1.02 -0.41 0.00 -1.52 0.00 0.00 31.29 30.98 1y7d h VAL 34 CO -0.04 0.43 -0.64 -1.22 0.02 0.00 0.00 177.57 176.13 1y7d n TYR 35 N -4.20 2.81 0.27 1.57 4.01 -0.59 -4.96 117.16 116.07 1y7d n TYR 35 Ca 0.01 -4.15 0.17 0.00 -0.16 0.00 0.00 57.90 53.77 1y7d n TYR 35 Cb 0.39 -0.51 0.90 0.00 -0.31 0.00 0.00 39.34 39.81 1y7d n TYR 35 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1y7d h PRO 36 N 5.04 0.00 0.00 -0.72 0.13 -1.72 -1.11 132.00 133.62 1y7d h PRO 36 Ca 0.17 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.26 1y7d h PRO 36 Cb 0.75 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.87 1y7d h PRO 36 CO 0.71 0.00 -0.21 0.11 -0.23 0.00 0.00 178.00 178.38 1y7d h TRP 37 N 0.00 0.00 0.00 1.56 0.09 -1.91 -2.26 115.95 113.43 1y7d h TRP 37 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.98 1y7d h TRP 37 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.39 1y7d h TRP 37 CO 0.00 0.21 0.00 0.25 0.09 0.00 0.00 178.44 178.99 1y7d n THR 38 N -3.85 1.29 0.53 0.12 -2.24 -0.42 -2.12 114.28 107.59 1y7d n THR 38 Ca -0.02 0.46 0.08 0.00 -2.27 0.00 0.00 64.05 62.31 1y7d n THR 38 Cb 0.30 -1.40 0.35 0.00 -2.10 0.00 0.00 70.33 67.49 1y7d n THR 38 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1y7d n GLN 39 N -1.86 0.02 0.20 -0.78 6.02 -0.85 -3.27 117.38 116.87 1y7d n GLN 39 Ca 0.01 0.25 0.15 0.00 -0.01 0.00 0.00 57.00 57.39 1y7d n GLN 39 Cb 0.09 -1.54 0.77 0.00 1.02 0.00 0.00 30.24 30.58 1y7d n GLN 39 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.06 176.12 1y7d h ARG 40 N 0.00 0.00 0.00 -1.09 0.11 -1.65 -1.94 114.38 109.81 1y7d h ARG 40 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1y7d h ARG 40 Cb 0.29 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.37 1y7d h ARG 40 CO 0.00 0.00 -0.45 1.19 0.10 0.00 0.00 179.97 180.81 1y7d n PHE 41 N -4.11 0.03 -2.00 4.08 3.01 -1.20 -4.40 117.46 112.87 1y7d n PHE 41 Ca 0.01 0.01 -0.25 0.00 1.01 0.00 0.00 57.45 58.23 1y7d n PHE 41 Cb 0.26 -0.30 0.02 0.00 -0.01 0.00 0.00 39.48 39.45 1y7d n PHE 41 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 1y7d n PHE 42 N -1.54 2.83 0.78 1.38 3.01 -0.73 -4.78 117.46 118.41 1y7d n PHE 42 Ca 0.06 -2.34 0.09 0.00 1.01 0.00 0.00 57.45 56.27 1y7d n PHE 42 Cb 0.34 -0.40 0.44 0.00 -0.01 0.00 0.00 39.48 39.85 1y7d n PHE 42 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92 1y7d n GLU 43 N -0.71 0.15 -0.05 -1.08 0.28 -1.26 -2.21 120.64 115.76 1y7d n GLU 43 Ca 0.45 0.14 0.12 0.00 -0.16 0.00 0.00 57.16 57.71 1y7d n GLU 43 Cb 0.92 -1.50 0.28 0.00 1.43 0.00 0.00 31.44 32.57 1y7d n GLU 43 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 1y7d n SER 44 N -1.38 2.51 -0.07 -1.84 3.41 -1.26 -4.06 113.62 110.92 1y7d n SER 44 Ca 0.07 -1.83 0.13 0.00 -0.26 0.00 0.00 58.87 56.99 1y7d n SER 44 Cb 0.18 -0.07 0.49 0.00 -0.26 0.00 0.00 64.21 64.56 1y7d n SER 44 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1y7d n PHE 45 N 0.92 0.00 -1.98 7.33 0.99 -0.94 -5.04 117.46 118.74 1y7d n PHE 45 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.62 1y7d n PHE 45 Cb 0.50 -0.26 0.00 0.00 -1.00 0.00 0.00 39.48 38.71 1y7d n PHE 45 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1y7d n GLY 46 N 1.39 0.48 3.65 1.37 0.00 -1.26 -4.82 105.19 106.00 1y7d n GLY 46 Ca 0.10 -1.34 -0.43 0.00 0.00 0.00 0.00 46.02 44.36 1y7d n GLY 46 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1y7d s ASP 47 N -4.00 6.63 -0.05 1.61 3.68 -1.26 -4.86 116.67 118.43 1y7d s ASP 47 Ca 0.00 1.80 0.07 0.00 2.13 0.00 0.00 52.55 56.55 1y7d s ASP 47 Cb 0.00 -2.53 0.11 0.00 -1.45 0.00 0.00 42.92 39.04 1y7d s ASP 47 CO 0.00 -1.02 0.98 0.18 0.13 0.00 0.00 175.17 175.45 1y7d n LEU 48 N 7.51 1.21 0.26 -1.34 4.77 -1.26 -4.26 117.00 123.89 1y7d n LEU 48 Ca 0.17 -1.79 0.10 0.00 -0.03 0.00 0.00 56.01 54.45 1y7d n LEU 48 Cb 0.44 -0.16 0.69 0.00 -2.33 0.00 0.00 43.42 42.06 1y7d n LEU 48 CO 0.62 0.43 1.04 0.77 -1.33 0.00 0.00 177.39 178.91 1y7d h SER 49 N 0.00 0.00 -5.51 -1.43 4.64 -1.90 -3.44 113.55 105.92 1y7d h SER 49 Ca 0.00 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.11 1y7d h SER 49 Cb 1.04 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 62.98 1y7d h SER 49 CO 0.00 0.05 -0.63 0.42 -0.87 0.00 0.00 176.83 175.80 1y7d s THR 50 N -4.81 0.05 0.20 2.95 -4.23 -1.26 -5.03 115.64 103.51 1y7d s THR 50 Ca -0.05 -1.95 -0.10 0.00 -1.18 0.00 0.00 61.69 58.41 1y7d s THR 50 Cb 0.16 -2.27 0.13 0.00 1.34 0.00 0.00 72.50 71.86 1y7d s THR 50 CO 0.64 -0.23 1.75 -0.65 -0.54 0.00 0.00 174.62 175.59 1y7d h PRO 51 N 2.74 0.42 -0.58 3.99 0.11 -1.99 -1.32 132.00 135.36 1y7d h PRO 51 Ca -0.35 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 65.63 1y7d h PRO 51 Cb 1.22 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 1y7d h PRO 51 CO 0.56 0.28 -0.03 -0.44 -0.21 0.00 0.00 178.00 178.15 1y7d h ASP 52 N 0.43 1.01 0.10 -2.05 3.32 -1.97 -1.45 116.42 115.81 1y7d h ASP 52 Ca 0.29 -0.30 -0.02 0.00 0.02 0.00 0.00 57.03 57.02 1y7d h ASP 52 Cb 0.32 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.59 1y7d h ASP 52 CO -0.27 1.08 -0.09 0.00 -1.72 0.00 0.00 179.24 178.24 1y7d h ALA 53 N 1.01 1.80 0.00 3.45 0.00 -1.67 -2.16 119.26 121.69 1y7d h ALA 53 Ca 0.16 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1y7d h ALA 53 Cb 0.58 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1y7d h ALA 53 CO 0.03 0.11 -0.21 0.28 0.00 0.00 0.00 179.25 179.47 1y7d h VAL 54 N 0.00 0.28 -0.41 0.00 2.07 -0.82 -3.19 116.25 114.18 1y7d h VAL 54 Ca -0.00 -1.24 0.04 0.00 0.82 0.00 0.00 66.70 66.32 1y7d h VAL 54 Cb 0.16 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1y7d h VAL 54 CO 0.01 0.10 0.28 0.24 0.02 0.00 0.00 177.57 178.22 1y7d h MET 55 N -1.00 0.38 0.00 1.57 2.07 -1.32 -2.85 114.93 113.78 1y7d h MET 55 Ca -0.02 -0.02 0.00 0.00 -2.07 0.00 0.00 59.70 57.59 1y7d h MET 55 Cb 0.34 -0.09 0.00 0.00 -1.87 0.00 0.00 31.60 29.98 1y7d h MET 55 CO -0.01 0.25 -0.80 0.41 1.07 0.00 0.00 176.91 177.82 1y7d n GLY 56 N -1.51 -1.17 3.62 8.32 0.00 -0.81 -4.84 105.19 108.80 1y7d n GLY 56 Ca 0.05 -0.44 -0.44 0.00 0.00 0.00 0.00 46.02 45.19 1y7d n GLY 56 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1y7d n ASN 57 N -1.65 3.55 0.17 1.61 2.85 -1.08 -4.87 115.26 115.84 1y7d n ASN 57 Ca 0.04 0.61 0.08 0.00 -0.11 0.00 0.00 54.58 55.21 1y7d n ASN 57 Cb 0.37 -1.49 0.59 0.00 1.24 0.00 0.00 39.78 40.49 1y7d n ASN 57 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1y7d h PRO 58 N 12.19 0.13 -0.36 1.20 0.13 -1.92 -1.19 132.00 142.18 1y7d h PRO 58 Ca -0.45 -0.01 -0.12 0.00 -0.87 0.00 0.00 66.00 64.56 1y7d h PRO 58 Cb 1.25 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 1y7d h PRO 58 CO 0.96 0.08 -0.26 0.87 -0.23 0.00 0.00 178.00 179.42 1y7d h LYS 59 N 0.13 0.74 -0.17 0.86 1.57 -1.89 -2.00 116.57 115.81 1y7d h LYS 59 Ca 0.07 -0.31 -0.21 0.00 -1.87 0.00 0.00 60.65 58.32 1y7d h LYS 59 Cb 0.10 -0.03 0.01 0.00 0.08 0.00 0.00 32.23 32.39 1y7d h LYS 59 CO -0.01 0.92 -0.73 0.28 -0.57 0.00 0.00 179.45 179.34 1y7d h VAL 60 N 0.64 1.29 -0.44 0.50 2.07 -1.69 -1.38 116.25 117.24 1y7d h VAL 60 Ca 0.08 -1.94 -0.02 0.00 0.82 0.00 0.00 66.70 65.64 1y7d h VAL 60 Cb 0.77 1.92 -0.02 0.00 -1.52 0.00 0.00 31.29 32.44 1y7d h VAL 60 CO 0.06 0.62 0.18 0.11 0.02 0.00 0.00 177.57 178.55 1y7d h LYS 61 N 0.54 0.65 -0.26 1.57 1.57 -1.14 0.10 116.57 119.60 1y7d h LYS 61 Ca -0.04 -0.12 -0.05 0.00 -1.87 0.00 0.00 60.65 58.58 1y7d h LYS 61 Cb 1.35 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.54 1y7d h LYS 61 CO 0.15 0.60 -0.02 0.00 -0.57 0.00 0.00 179.45 179.61 1y7d h ALA 62 N 1.02 0.36 -0.34 3.86 0.00 -1.35 -2.67 119.26 120.14 1y7d h ALA 62 Ca 0.15 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 1y7d h ALA 62 Cb 0.19 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1y7d h ALA 62 CO -0.01 0.11 0.02 1.25 0.00 0.00 0.00 179.25 180.62 1y7d h HIS 63 N 0.25 0.63 -0.86 0.00 -0.00 -1.18 -2.83 115.15 111.16 1y7d h HIS 63 Ca 0.07 -0.10 0.12 0.00 -0.00 0.00 0.00 60.37 60.46 1y7d h HIS 63 Cb 0.45 -0.17 -0.08 0.00 -0.00 0.00 0.00 27.41 27.61 1y7d h HIS 63 CO 0.04 0.68 0.47 0.78 -0.00 0.00 0.00 177.93 179.90 1y7d h GLY 64 N 0.40 1.37 1.16 5.26 0.00 -0.74 -0.00 103.07 110.51 1y7d h GLY 64 Ca 0.10 -0.30 -0.07 0.00 0.00 0.00 0.00 47.33 47.06 1y7d h GLY 64 CO 0.01 0.05 0.14 1.70 0.00 0.00 0.00 176.54 178.45 1y7d h LYS 65 N 0.74 1.04 0.51 4.80 3.64 -1.36 -0.95 116.57 124.99 1y7d h LYS 65 Ca 0.44 -0.25 -0.02 0.00 -1.27 0.00 0.00 60.65 59.54 1y7d h LYS 65 Cb 0.52 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1y7d h LYS 65 CO -0.30 0.94 -0.24 -0.22 -2.27 0.00 0.00 179.45 177.35 1y7d h LYS 66 N 0.99 -0.66 -0.44 1.90 3.64 -1.12 -0.49 116.57 120.40 1y7d h LYS 66 Ca 0.20 0.04 0.06 0.00 -1.27 0.00 0.00 60.65 59.69 1y7d h LYS 66 Cb 0.38 0.15 -0.05 0.00 -0.41 0.00 0.00 32.23 32.29 1y7d h LYS 66 CO 0.00 -0.36 0.13 0.28 -2.27 0.00 0.00 179.45 177.23 1y7d h VAL 67 N -0.90 0.82 0.00 2.00 2.07 -0.93 -0.74 116.25 118.57 1y7d h VAL 67 Ca -0.07 -0.09 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 1y7d h VAL 67 Cb 0.60 0.52 -0.00 0.00 -1.52 0.00 0.00 31.29 30.89 1y7d h VAL 67 CO 0.11 0.05 -0.07 -0.07 0.02 0.00 0.00 177.57 177.61 1y7d h LEU 68 N 0.28 0.00 -0.06 2.57 -0.00 -1.14 -2.20 115.31 114.74 1y7d h LEU 68 Ca 0.21 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 58.07 1y7d h LEU 68 Cb 0.23 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.89 1y7d h LEU 68 CO -0.24 0.07 -0.04 1.23 -0.00 0.00 0.00 178.44 179.46 1y7d h GLY 69 N 2.67 0.15 1.07 0.83 0.00 0.37 -0.82 103.07 107.35 1y7d h GLY 69 Ca -0.00 -0.15 0.01 0.00 0.00 0.00 0.00 47.33 47.20 1y7d h GLY 69 CO 0.01 0.13 0.61 0.00 0.00 0.00 0.00 176.54 177.29 1y7d h ALA 70 N 0.59 1.36 -0.31 3.60 0.00 -1.21 -2.19 119.26 121.10 1y7d h ALA 70 Ca 0.01 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1y7d h ALA 70 Cb 0.51 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1y7d h ALA 70 CO 0.01 0.59 0.03 0.35 0.00 0.00 0.00 179.25 180.23 1y7d h PHE 71 N 1.23 0.57 -0.41 0.00 3.57 -1.27 -2.36 116.94 118.27 1y7d h PHE 71 Ca 0.34 -0.09 0.05 0.00 3.53 0.00 0.00 57.97 61.80 1y7d h PHE 71 Cb -0.11 -0.15 -0.05 0.00 2.79 0.00 0.00 35.95 38.43 1y7d h PHE 71 CO -0.00 0.64 0.14 1.03 -2.23 0.00 0.00 178.31 177.88 1y7d h SER 72 N 0.34 0.13 -0.48 0.41 0.87 -0.75 -1.23 113.55 112.85 1y7d h SER 72 Ca 0.09 0.05 -0.00 0.00 -1.23 0.00 0.00 61.79 60.70 1y7d h SER 72 Cb 0.39 0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.37 1y7d h SER 72 CO 0.01 0.11 0.29 0.44 -0.53 0.00 0.00 176.83 177.16 1y7d h ASP 73 N 0.29 0.59 -0.39 6.23 5.19 -1.28 -1.34 116.42 125.70 1y7d h ASP 73 Ca 0.19 -0.03 -0.04 0.00 -0.62 0.00 0.00 57.03 56.53 1y7d h ASP 73 Cb 0.18 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 39.52 1y7d h ASP 73 CO -0.20 0.46 0.13 1.23 -3.12 0.00 0.00 179.24 177.74 1y7d h GLY 74 N 0.72 0.73 2.00 2.75 0.00 -0.70 -2.30 103.07 106.27 1y7d h GLY 74 Ca 0.18 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 47.13 1y7d h GLY 74 CO -0.03 0.36 0.00 1.41 0.00 0.00 0.00 176.54 178.28 1y7d h LEU 75 N 0.66 0.00 -0.09 3.11 3.38 -0.58 -2.00 115.31 119.79 1y7d h LEU 75 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1y7d h LEU 75 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1y7d h LEU 75 CO -0.01 0.00 -0.55 0.00 0.09 0.00 0.00 178.44 177.98 1y7d n ALA 76 N -1.81 3.68 -2.56 1.53 0.00 -0.87 -4.34 120.51 116.15 1y7d n ALA 76 Ca 0.01 -0.41 -0.11 0.00 0.00 0.00 0.00 53.44 52.94 1y7d n ALA 76 Cb 0.19 -1.06 0.03 0.00 0.00 0.00 0.00 19.45 18.62 1y7d n ALA 76 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1y7d n HIS 77 N -1.34 1.85 0.33 0.00 8.25 -0.76 -4.91 115.22 118.64 1y7d n HIS 77 Ca 0.06 -2.40 0.18 0.00 -0.26 0.00 0.00 57.72 55.30 1y7d n HIS 77 Cb 0.34 -0.27 0.93 0.00 1.12 0.00 0.00 29.99 32.11 1y7d n HIS 77 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1y7d h LEU 78 N 2.58 0.00 -0.28 2.41 4.07 -1.74 0.37 115.31 122.71 1y7d h LEU 78 Ca 0.04 0.00 -0.20 0.00 0.08 0.00 0.00 57.88 57.80 1y7d h LEU 78 Cb 1.28 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 43.02 1y7d h LEU 78 CO 0.46 0.00 -0.86 -0.78 -1.08 0.00 0.00 178.44 176.18 1y7d h ASP 79 N 0.00 0.39 -1.82 -0.43 -0.00 -1.91 -3.39 116.42 109.25 1y7d h ASP 79 Ca 0.01 -0.30 -0.50 0.00 -0.00 0.00 0.00 57.03 56.24 1y7d h ASP 79 Cb 0.49 -0.12 -0.37 0.00 -0.00 0.00 0.00 39.33 39.33 1y7d h ASP 79 CO -0.00 1.08 -1.08 -3.20 -0.00 0.00 0.00 179.24 176.04 1y7d n ASN 80 N -3.73 0.14 -0.08 2.28 5.15 0.11 -4.96 115.26 114.17 1y7d n ASN 80 Ca -0.05 -2.87 -0.14 0.00 -0.60 0.00 0.00 54.58 50.92 1y7d n ASN 80 Cb 0.79 -0.41 -0.02 0.00 -0.53 0.00 0.00 39.78 39.61 1y7d n ASN 80 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1y7d h LEU 81 N 3.62 0.95 -0.64 1.20 3.38 -1.75 -0.85 115.31 121.23 1y7d h LEU 81 Ca 0.06 -0.49 0.03 0.00 0.09 0.00 0.00 57.88 57.57 1y7d h LEU 81 Cb 0.93 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.36 1y7d h LEU 81 CO 0.46 1.28 0.39 0.11 0.09 0.00 0.00 178.44 180.77 1y7d h LYS 82 N 0.68 0.75 0.12 1.13 1.57 -1.91 0.57 116.57 119.48 1y7d h LYS 82 Ca 0.03 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1y7d h LYS 82 Cb 1.10 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.24 1y7d h LYS 82 CO 0.11 0.50 -0.06 0.78 -0.57 0.00 0.00 179.45 180.21 1y7d h GLY 83 N 0.77 -0.17 -0.03 3.86 0.00 -1.94 -1.63 103.07 103.93 1y7d h GLY 83 Ca 0.25 0.06 0.14 0.00 0.00 0.00 0.00 47.33 47.79 1y7d h GLY 83 CO -0.10 -0.06 0.13 -0.84 0.00 0.00 0.00 176.54 175.66 1y7d h THR 84 N -0.50 0.53 -0.36 4.70 2.02 -0.77 -2.88 112.91 115.65 1y7d h THR 84 Ca -0.02 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 67.08 1y7d h THR 84 Cb 0.40 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 67.09 1y7d h THR 84 CO 0.03 0.04 0.00 0.49 0.37 0.00 0.00 175.52 176.45 1y7d n PHE 85 N -5.18 0.47 -0.35 3.16 3.01 0.19 -4.68 117.46 114.07 1y7d n PHE 85 Ca 0.12 -0.23 -0.03 0.00 1.01 0.00 0.00 57.45 58.32 1y7d n PHE 85 Cb 0.41 0.00 0.10 0.00 -0.01 0.00 0.00 39.48 39.98 1y7d n PHE 85 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1y7d h ALA 86 N 4.19 1.20 -0.20 4.37 0.00 -1.06 -0.17 119.26 127.58 1y7d h ALA 86 Ca 0.00 -0.07 -0.13 0.00 0.00 0.00 0.00 54.91 54.71 1y7d h ALA 86 Cb 0.73 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1y7d h ALA 86 CO 0.00 0.60 -0.43 1.79 0.00 0.00 0.00 179.25 181.21 1y7d h THR 87 N 1.28 1.31 -0.36 0.00 1.35 -1.83 -2.61 112.91 112.05 1y7d h THR 87 Ca 0.34 -1.61 -0.13 0.00 -0.55 0.00 0.00 66.41 64.47 1y7d h THR 87 Cb -0.13 1.62 -0.01 0.00 -1.73 0.00 0.00 68.15 67.90 1y7d h THR 87 CO -0.07 0.50 -0.28 0.25 -0.25 0.00 0.00 175.52 175.67 1y7d h LEU 88 N 0.40 0.87 -0.05 3.87 5.85 -1.83 -1.88 115.31 122.54 1y7d h LEU 88 Ca 0.03 -0.44 0.03 0.00 0.84 0.00 0.00 57.88 58.34 1y7d h LEU 88 Cb 0.92 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.67 1y7d h LEU 88 CO 0.08 1.13 -0.12 -1.28 -0.34 0.00 0.00 178.44 177.91 1y7d h SER 89 N 0.62 -0.36 -0.64 1.25 0.87 -0.98 -0.01 113.55 114.30 1y7d h SER 89 Ca 0.07 0.06 -0.04 0.00 -1.23 0.00 0.00 61.79 60.65 1y7d h SER 89 Cb 0.85 0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.94 1y7d h SER 89 CO 0.07 -0.17 0.27 -0.33 -0.53 0.00 0.00 176.83 176.15 1y7d h GLU 90 N -0.18 0.98 -0.09 2.24 5.08 -1.33 -2.28 114.58 119.00 1y7d h GLU 90 Ca 0.06 -0.16 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 1y7d h GLU 90 Cb 0.26 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 1y7d h GLU 90 CO -0.16 0.79 0.03 1.25 -1.00 0.00 0.00 179.01 179.92 1y7d h LEU 91 N 0.96 0.13 -1.28 1.33 5.85 -0.94 0.42 115.31 121.79 1y7d h LEU 91 Ca 0.23 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 1y7d h LEU 91 Cb 0.18 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.14 1y7d h LEU 91 CO -0.02 0.32 0.32 0.45 -0.34 0.00 0.00 178.44 179.17 1y7d h HIS 92 N -0.05 0.80 0.18 1.25 3.86 -0.79 0.42 115.15 120.81 1y7d h HIS 92 Ca 0.03 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.22 1y7d h HIS 92 Cb 0.23 -0.26 0.00 0.00 1.06 0.00 0.00 27.41 28.44 1y7d h HIS 92 CO 0.00 0.56 -0.09 0.00 0.86 0.00 0.00 177.93 179.27 1y7d h ASP 94 N -0.50 0.57 0.00 0.00 3.32 -0.95 -3.06 116.42 115.79 1y7d h ASP 94 Ca -0.02 -0.37 -0.39 0.00 0.02 0.00 0.00 57.03 56.26 1y7d h ASP 94 Cb 0.18 -0.17 -0.06 0.00 0.22 0.00 0.00 39.33 39.50 1y7d h ASP 94 CO 0.04 1.12 -2.31 0.29 -1.72 0.00 0.00 179.24 176.66 1y7d n LYS 95 N -3.86 0.50 0.06 3.56 4.01 0.01 -4.72 118.16 117.73 1y7d n LYS 95 Ca -0.05 0.21 -0.05 0.00 -0.51 0.00 0.00 58.31 57.91 1y7d n LYS 95 Cb 0.71 -1.34 -0.09 0.00 -0.51 0.00 0.00 35.03 33.80 1y7d n LYS 95 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 1y7d h LEU 96 N -0.78 0.00 -2.05 -0.35 3.38 -1.28 -3.49 115.31 110.74 1y7d h LEU 96 Ca -0.59 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.01 1y7d h LEU 96 Cb 1.54 0.00 0.11 0.00 0.09 0.00 0.00 40.66 42.40 1y7d h LEU 96 CO -0.34 0.88 -0.84 1.41 0.09 0.00 0.00 178.44 179.64 1y7d n HIS 97 N -3.26 -2.06 -3.35 1.13 8.25 0.65 -4.97 115.22 111.61 1y7d n HIS 97 Ca -0.02 0.81 -0.42 0.00 -0.26 0.00 0.00 57.72 57.83 1y7d n HIS 97 Cb 0.91 -4.37 -0.09 0.00 1.12 0.00 0.00 29.99 27.56 1y7d n HIS 97 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1y7d s VAL 98 N -3.54 5.12 0.17 1.59 1.01 -0.50 -5.01 120.40 119.24 1y7d s VAL 98 Ca 0.14 -0.14 -0.34 0.00 0.00 0.00 0.00 61.98 61.64 1y7d s VAL 98 Cb -0.03 -3.94 -0.14 0.00 0.00 0.00 0.00 36.38 32.27 1y7d s VAL 98 CO 0.79 -0.26 1.49 -0.67 0.00 0.00 0.00 175.10 176.45 1y7d n ASP 99 N 5.50 2.74 -0.06 3.32 4.64 -1.26 -4.70 116.55 126.73 1y7d n ASP 99 Ca -0.08 1.10 0.23 0.00 -1.38 0.00 0.00 54.79 54.66 1y7d n ASP 99 Cb 0.48 -1.38 0.69 0.00 -1.04 0.00 0.00 41.12 39.87 1y7d n ASP 99 CO 0.00 0.00 0.00 1.23 -0.82 0.00 0.00 177.20 177.61 1y7d h GLY 100 N 5.26 0.03 1.73 0.27 0.00 -1.97 -1.78 103.07 106.61 1y7d h GLY 100 Ca -0.45 -0.01 0.03 0.00 0.00 0.00 0.00 47.33 46.90 1y7d h GLY 100 CO 0.84 0.00 0.10 -2.09 0.00 0.00 0.00 176.54 175.39 1y7d h GLU 101 N 0.02 0.00 -0.91 4.80 4.57 -1.98 -2.04 114.58 119.04 1y7d h GLU 101 Ca 0.31 0.00 0.07 0.00 -1.18 0.00 0.00 59.36 58.56 1y7d h GLU 101 Cb 1.23 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 29.76 1y7d h GLU 101 CO -0.01 0.00 0.59 -0.91 -1.18 0.00 0.00 179.01 177.50 1y7d h ASN 102 N 0.00 0.89 -0.35 1.04 -0.26 -1.68 -1.26 115.58 113.95 1y7d h ASN 102 Ca 0.05 0.01 -0.02 0.00 -0.56 0.00 0.00 56.30 55.79 1y7d h ASN 102 Cb 0.26 -0.18 -0.02 0.00 -1.06 0.00 0.00 38.32 37.32 1y7d h ASN 102 CO -0.00 0.56 0.18 -0.26 -1.06 0.00 0.00 177.43 176.85 1y7d h PHE 103 N 1.01 0.54 0.05 1.19 0.04 -1.56 0.05 116.94 118.26 1y7d h PHE 103 Ca 0.40 -0.01 -0.25 0.00 2.80 0.00 0.00 57.97 60.90 1y7d h PHE 103 Cb 0.24 -0.17 0.01 0.00 2.20 0.00 0.00 35.95 38.22 1y7d h PHE 103 CO -0.00 0.41 -1.07 0.07 -0.60 0.00 0.00 178.31 177.12 1y7d h ARG 104 N 0.55 0.42 -0.01 1.51 0.11 -1.34 -2.34 114.38 113.28 1y7d h ARG 104 Ca 0.14 -0.52 0.00 0.00 0.10 0.00 0.00 59.98 59.70 1y7d h ARG 104 Cb 0.08 0.16 -0.00 0.00 1.11 0.00 0.00 29.97 31.32 1y7d h ARG 104 CO -0.02 1.18 -0.01 -0.07 0.10 0.00 0.00 179.97 181.15 1y7d h LEU 105 N 0.20 -0.04 -0.92 0.08 3.38 -0.91 -2.27 115.31 114.83 1y7d h LEU 105 Ca -0.11 0.01 0.06 0.00 0.09 0.00 0.00 57.88 57.93 1y7d h LEU 105 Cb 1.73 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 42.44 1y7d h LEU 105 CO 0.19 -0.02 0.58 0.25 0.09 0.00 0.00 178.44 179.53 1y7d h LEU 106 N -0.02 0.92 -0.66 1.67 5.85 -1.02 -2.36 115.31 119.70 1y7d h LEU 106 Ca 0.01 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.80 1y7d h LEU 106 Cb 0.04 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.83 1y7d h LEU 106 CO -0.02 0.58 0.37 1.23 -0.34 0.00 0.00 178.44 180.26 1y7d h GLY 107 N 1.05 0.96 0.98 3.75 0.00 -0.87 0.17 103.07 109.11 1y7d h GLY 107 Ca 0.40 -0.26 -0.08 0.00 0.00 0.00 0.00 47.33 47.39 1y7d h GLY 107 CO -0.18 0.17 -0.06 3.43 0.00 0.00 0.00 176.54 179.90 1y7d h ASN 108 N 0.69 0.78 -0.34 0.19 2.35 -0.97 -1.86 115.58 116.42 1y7d h ASN 108 Ca 0.29 -0.34 0.01 0.00 -0.55 0.00 0.00 56.30 55.70 1y7d h ASN 108 Cb 0.16 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 1y7d h ASN 108 CO -0.17 0.94 0.22 0.58 -1.65 0.00 0.00 177.43 177.35 1y7d h VAL 109 N 0.61 1.08 -0.78 2.81 2.07 -1.20 -1.50 116.25 119.34 1y7d h VAL 109 Ca 0.11 -0.15 0.05 0.00 0.82 0.00 0.00 66.70 67.53 1y7d h VAL 109 Cb 0.58 0.59 -0.06 0.00 -1.52 0.00 0.00 31.29 30.88 1y7d h VAL 109 CO 0.03 0.08 0.48 0.25 0.02 0.00 0.00 177.57 178.43 1y7d h LEU 110 N 0.45 0.75 -0.89 2.57 5.85 -0.39 -0.55 115.31 123.11 1y7d h LEU 110 Ca 0.13 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 1y7d h LEU 110 Cb -0.04 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 40.80 1y7d h LEU 110 CO -0.03 0.49 0.46 0.58 -0.34 0.00 0.00 178.44 179.60 1y7d h VAL 111 N 0.89 1.26 -0.53 1.05 2.07 -1.01 0.06 116.25 120.03 1y7d h VAL 111 Ca 0.33 -0.69 -0.09 0.00 0.82 0.00 0.00 66.70 67.08 1y7d h VAL 111 Cb 0.13 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 29.97 1y7d h VAL 111 CO -0.16 0.30 -0.03 0.00 0.02 0.00 0.00 177.57 177.71 1y7d h VAL 113 N 0.85 1.19 -0.89 0.00 2.07 -0.56 -0.18 116.25 118.74 1y7d h VAL 113 Ca 0.15 -0.59 0.01 0.00 0.82 0.00 0.00 66.70 67.09 1y7d h VAL 113 Cb 0.54 1.04 -0.04 0.00 -1.52 0.00 0.00 31.29 31.31 1y7d h VAL 113 CO 0.03 0.20 0.58 -0.07 0.02 0.00 0.00 177.57 178.33 1y7d h LEU 114 N 0.31 1.02 -0.51 2.57 3.38 -0.95 -0.36 115.31 120.77 1y7d h LEU 114 Ca 0.09 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1y7d h LEU 114 Cb 0.21 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1y7d h LEU 114 CO -0.01 0.74 0.03 0.00 0.09 0.00 0.00 178.44 179.30 1y7d h ALA 115 N 1.32 0.69 -0.43 1.53 0.00 -1.13 0.11 119.26 121.35 1y7d h ALA 115 Ca 0.32 -0.27 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1y7d h ALA 115 Cb -0.14 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 1y7d h ALA 115 CO -0.07 0.47 0.26 1.25 0.00 0.00 0.00 179.25 181.16 1y7d h HIS 116 N 0.76 0.48 -0.02 0.00 -0.00 -0.47 -0.74 115.15 115.16 1y7d h HIS 116 Ca 0.15 0.01 -0.07 0.00 -0.00 0.00 0.00 60.37 60.46 1y7d h HIS 116 Cb 0.48 -0.16 0.00 0.00 -0.00 0.00 0.00 27.41 27.74 1y7d h HIS 116 CO 0.04 0.28 -0.27 0.45 -0.00 0.00 0.00 177.93 178.43 1y7d h HIS 117 N 0.52 0.31 -0.00 5.26 -0.00 -0.95 -3.36 115.15 116.92 1y7d h HIS 117 Ca 0.17 -0.16 0.00 0.00 -0.00 0.00 0.00 60.37 60.38 1y7d h HIS 117 Cb -0.00 -0.04 0.00 0.00 -0.00 0.00 0.00 27.41 27.37 1y7d h HIS 117 CO -0.07 0.92 -0.38 1.19 -0.00 0.00 0.00 177.93 179.60 1y7d n PHE 118 N -4.49 0.00 0.00 2.45 3.01 0.02 -5.00 117.46 113.44 1y7d n PHE 118 Ca -0.09 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.37 1y7d n PHE 118 Cb 0.50 -0.26 0.00 0.00 -0.01 0.00 0.00 39.48 39.71 1y7d n PHE 118 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1y7d n GLY 119 N 1.47 3.22 0.34 1.37 0.00 -0.29 -1.65 105.19 109.65 1y7d n GLY 119 Ca 0.07 -0.05 0.18 0.00 0.00 0.00 0.00 46.02 46.22 1y7d n GLY 119 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1y7d h LYS 120 N 0.00 0.00 0.00 1.61 3.11 -1.95 -1.95 116.57 117.40 1y7d h LYS 120 Ca 0.00 0.00 -0.07 0.00 -2.81 0.00 0.00 60.65 57.77 1y7d h LYS 120 Cb 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.22 1y7d h LYS 120 CO 0.00 0.00 -0.31 1.49 -2.81 0.00 0.00 179.45 177.82 1y7d h GLU 121 N 0.00 0.00 -4.02 1.90 4.81 -1.71 -3.32 114.58 112.24 1y7d h GLU 121 Ca 0.06 0.00 -0.73 0.00 -0.13 0.00 0.00 59.36 58.56 1y7d h GLU 121 Cb 0.48 0.00 -0.11 0.00 0.63 0.00 0.00 28.75 29.75 1y7d h GLU 121 CO -0.00 0.31 2.40 0.34 -0.73 0.00 0.00 179.01 181.33 1y7d n PHE 122 N -3.59 3.51 -1.35 0.92 7.35 -0.73 -4.93 117.46 118.64 1y7d n PHE 122 Ca -0.01 -2.92 -0.31 0.00 -0.76 0.00 0.00 57.45 53.46 1y7d n PHE 122 Cb 0.44 -2.26 0.08 0.00 0.35 0.00 0.00 39.48 38.09 1y7d n PHE 122 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1y7d s THR 123 N 1.90 3.51 0.20 -2.13 -4.23 -1.25 -4.75 115.64 108.89 1y7d s THR 123 Ca 0.44 0.49 -0.20 0.00 -1.18 0.00 0.00 61.69 61.25 1y7d s THR 123 Cb 0.10 -3.05 0.17 0.00 1.34 0.00 0.00 72.50 71.05 1y7d s THR 123 CO -0.02 -0.64 1.57 -0.65 -0.54 0.00 0.00 174.62 174.34 1y7d h PRO 124 N -1.02 -0.10 0.00 3.99 0.11 -1.93 0.10 132.00 133.15 1y7d h PRO 124 Ca -0.44 0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.63 1y7d h PRO 124 Cb 1.23 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1y7d h PRO 124 CO 0.53 -0.07 -0.25 -1.35 -0.21 0.00 0.00 178.00 176.65 1y7d h PRO 125 N -0.10 0.00 -0.29 1.05 0.11 -1.99 -1.95 132.00 128.82 1y7d h PRO 125 Ca 0.27 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 66.21 1y7d h PRO 125 Cb 0.57 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.68 1y7d h PRO 125 CO -0.79 0.25 -0.52 0.28 -0.21 0.00 0.00 178.00 177.01 1y7d h VAL 126 N 0.00 1.28 -0.38 3.15 2.07 -1.46 -2.69 116.25 118.23 1y7d h VAL 126 Ca -0.00 -1.70 -0.01 0.00 0.82 0.00 0.00 66.70 65.80 1y7d h VAL 126 Cb 0.45 1.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.80 1y7d h VAL 126 CO 0.03 0.56 0.18 -0.61 0.02 0.00 0.00 177.57 177.75 1y7d h GLN 127 N 0.66 0.54 -0.74 1.57 4.15 -0.44 -1.14 115.11 119.71 1y7d h GLN 127 Ca 0.02 -0.08 0.03 0.00 0.77 0.00 0.00 58.65 59.39 1y7d h GLN 127 Cb 1.11 -0.10 -0.04 0.00 0.21 0.00 0.00 27.48 28.67 1y7d h GLN 127 CO 0.11 0.48 0.49 0.00 -1.93 0.00 0.00 178.83 177.99 1y7d h ALA 128 N 1.03 1.54 -0.01 3.38 0.00 -1.28 0.48 119.26 124.41 1y7d h ALA 128 Ca 0.13 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1y7d h ALA 128 Cb 0.12 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1y7d h ALA 128 CO -0.02 0.39 -0.00 0.00 0.00 0.00 0.00 179.25 179.62 1y7d h ALA 129 N 1.56 0.01 -0.04 0.00 0.00 -1.26 -2.72 119.26 116.81 1y7d h ALA 129 Ca 0.29 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1y7d h ALA 129 Cb 0.01 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1y7d h ALA 129 CO -0.08 -0.29 -0.13 1.88 0.00 0.00 0.00 179.25 180.64 1y7d h TYR 130 N -0.36 0.06 -0.58 0.00 0.05 -0.49 -2.41 116.97 113.24 1y7d h TYR 130 Ca 0.00 -0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.71 1y7d h TYR 130 Cb 0.39 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.09 1y7d h TYR 130 CO 0.06 0.19 0.10 1.96 -1.05 0.00 0.00 178.16 179.42 1y7d h GLN 131 N 0.06 0.95 -0.54 4.88 1.08 0.10 -1.09 115.11 120.55 1y7d h GLN 131 Ca 0.01 -0.25 0.00 0.00 -1.45 0.00 0.00 58.65 56.97 1y7d h GLN 131 Cb 0.27 -0.11 -0.03 0.00 -0.05 0.00 0.00 27.48 27.56 1y7d h GLN 131 CO 0.02 0.90 0.35 0.87 -0.95 0.00 0.00 178.83 180.02 1y7d h LYS 132 N 0.85 0.72 0.11 1.46 1.57 -1.16 -2.72 116.57 117.39 1y7d h LYS 132 Ca 0.18 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 1y7d h LYS 132 Cb 0.40 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1y7d h LYS 132 CO 0.01 0.49 -0.05 0.28 -0.57 0.00 0.00 179.45 179.61 1y7d h VAL 133 N 0.73 0.98 0.00 0.50 2.07 -1.10 -0.78 116.25 118.65 1y7d h VAL 133 Ca 0.20 -0.30 -0.06 0.00 0.82 0.00 0.00 66.70 67.35 1y7d h VAL 133 Cb -0.07 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1y7d h VAL 133 CO -0.04 0.07 -0.30 -0.37 0.02 0.00 0.00 177.57 176.96 1y7d h VAL 134 N -0.28 1.01 -0.16 2.57 -1.51 -1.21 0.04 116.25 116.71 1y7d h VAL 134 Ca -0.01 -1.09 -0.10 0.00 -1.23 0.00 0.00 66.70 64.26 1y7d h VAL 134 Cb 0.23 1.62 -0.00 0.00 -2.13 0.00 0.00 31.29 31.01 1y7d h VAL 134 CO 0.02 0.29 -0.28 0.00 -1.23 0.00 0.00 177.57 176.37 1y7d h ALA 135 N 1.70 0.26 -0.48 5.19 0.00 -1.37 -0.18 119.26 124.38 1y7d h ALA 135 Ca -0.00 -0.40 0.06 0.00 0.00 0.00 0.00 54.91 54.57 1y7d h ALA 135 Cb 0.60 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.29 1y7d h ALA 135 CO 0.04 0.26 0.16 0.78 0.00 0.00 0.00 179.25 180.49 1y7d h GLY 136 N 0.12 0.63 0.98 0.00 0.00 -0.65 0.72 103.07 104.86 1y7d h GLY 136 Ca 0.01 -0.09 -0.09 0.00 0.00 0.00 0.00 47.33 47.16 1y7d h GLY 136 CO 0.06 0.01 -0.13 -2.08 0.00 0.00 0.00 176.54 174.40 1y7d h VAL 137 N 0.33 1.28 -0.49 4.60 2.07 -0.98 -0.80 116.25 122.26 1y7d h VAL 137 Ca 0.23 -1.24 0.01 0.00 0.82 0.00 0.00 66.70 66.52 1y7d h VAL 137 Cb 0.24 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 31.27 1y7d h VAL 137 CO -0.24 0.41 0.32 0.00 0.02 0.00 0.00 177.57 178.08 1y7d h ALA 138 N 0.82 0.62 -0.24 1.67 0.00 -0.45 0.26 119.26 121.94 1y7d h ALA 138 Ca 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1y7d h ALA 138 Cb 0.66 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1y7d h ALA 138 CO 0.05 0.05 0.15 -0.91 0.00 0.00 0.00 179.25 178.59 1y7d h ASN 139 N 0.65 0.26 -0.89 0.00 -0.26 -0.73 -2.37 115.58 112.24 1y7d h ASN 139 Ca 0.18 -0.00 0.01 0.00 -0.56 0.00 0.00 56.30 55.93 1y7d h ASN 139 Cb -0.05 -0.06 -0.05 0.00 -1.06 0.00 0.00 38.32 37.10 1y7d h ASN 139 CO -0.05 0.19 0.59 0.00 -1.06 0.00 0.00 177.43 177.10 1y7d h ALA 140 N 1.10 1.13 0.00 -0.83 0.00 -0.81 -1.59 119.26 118.26 1y7d h ALA 140 Ca 0.09 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1y7d h ALA 140 Cb -0.03 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.41 1y7d h ALA 140 CO -0.03 0.51 -0.01 -0.07 0.00 0.00 0.00 179.25 179.66 1y7d h LEU 141 N 1.19 0.00 -1.37 0.00 3.38 -0.66 -2.95 115.31 114.89 1y7d h LEU 141 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 1y7d h LEU 141 Cb -0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1y7d h LEU 141 CO -0.08 0.01 -0.20 0.00 0.09 0.00 0.00 178.44 178.26 1y7d n ALA 142 N -2.10 2.91 -0.12 1.53 0.00 -0.77 -4.37 120.51 117.60 1y7d n ALA 142 Ca 0.00 -0.63 0.09 0.00 0.00 0.00 0.00 53.44 52.90 1y7d n ALA 142 Cb 0.28 -0.68 0.43 0.00 0.00 0.00 0.00 19.45 19.48 1y7d n ALA 142 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 1y7d h HIS 143 N 3.07 0.59 -0.44 0.00 2.07 -1.14 -2.37 115.15 116.93 1y7d h HIS 143 Ca 0.00 0.02 0.00 0.00 -2.85 0.00 0.00 60.37 57.54 1y7d h HIS 143 Cb 0.75 -0.19 0.00 0.00 2.57 0.00 0.00 27.41 30.54 1y7d h HIS 143 CO 0.00 0.30 0.00 1.63 -3.07 0.00 0.00 177.93 176.79 1y7d n LYS 144 N -4.48 2.08 -2.46 5.12 4.76 -1.26 -4.94 118.16 116.97 1y7d n LYS 144 Ca 0.10 -1.67 -0.36 0.00 -2.87 0.00 0.00 58.31 53.51 1y7d n LYS 144 Cb 0.28 -1.37 -0.03 0.00 -1.84 0.00 0.00 35.03 32.07 1y7d n LYS 144 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1y7d s TYR 145 N -1.41 3.11 0.00 2.13 2.02 -0.89 -4.77 117.35 117.54 1y7d s TYR 145 Ca 0.32 1.60 0.00 0.00 -0.37 0.00 0.00 57.07 58.62 1y7d s TYR 145 Cb 0.17 -3.18 0.00 0.00 -0.40 0.00 0.00 41.96 38.54 1y7d s TYR 145 CO 0.22 -0.91 0.00 -2.39 -1.57 0.00 0.00 175.55 170.90