#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q4s s LEU 6 N 0.00 4.10 0.35 -4.62 1.43 -1.26 -5.03 118.68 113.66 2q4s s LEU 6 Ca 0.00 -0.30 0.03 0.00 -1.03 0.00 0.00 54.13 52.83 2q4s s LEU 6 Cb 0.00 -2.87 -0.02 0.00 0.03 0.00 0.00 46.19 43.34 2q4s s LEU 6 CO 0.00 -1.20 0.52 -0.76 0.23 0.00 0.00 176.35 175.14 2q4s s LEU 7 N 3.90 3.95 -0.03 1.79 1.43 -1.26 -5.05 118.68 123.42 2q4s s LEU 7 Ca 0.31 0.11 -0.30 0.00 -1.03 0.00 0.00 54.13 53.22 2q4s s LEU 7 Cb -0.12 -2.99 -0.05 0.00 0.03 0.00 0.00 46.19 43.06 2q4s s LEU 7 CO 0.20 -0.42 1.33 -0.75 0.23 0.00 0.00 176.35 176.94 2q4s s LYS 8 N -4.28 4.30 0.12 1.70 2.20 -1.26 -4.95 119.74 117.57 2q4s s LYS 8 Ca 0.43 1.85 -0.31 0.00 -0.36 0.00 0.00 55.97 57.58 2q4s s LYS 8 Cb -0.10 -3.59 -0.09 0.00 -1.51 0.00 0.00 37.83 32.55 2q4s s LYS 8 CO 0.34 -0.54 1.59 -2.14 -0.36 0.00 0.00 175.35 174.23 2q4s s PRO 9 N 2.42 4.22 0.14 4.03 0.02 -1.26 -4.87 135.00 139.70 2q4s s PRO 9 Ca 0.61 2.32 0.05 0.00 0.02 0.00 0.00 61.00 64.00 2q4s s PRO 9 Cb -0.29 -3.36 -0.11 0.00 0.02 0.00 0.00 34.50 30.76 2q4s s PRO 9 CO 0.24 -0.65 1.32 0.00 -0.33 0.00 0.00 177.00 177.59 2q4s h ARG 10 N 7.47 0.06 -4.12 5.54 3.08 -1.92 -3.42 114.38 121.06 2q4s h ARG 10 Ca -0.42 -0.09 -0.15 0.00 0.07 0.00 0.00 59.98 59.39 2q4s h ARG 10 Cb 1.20 0.03 -0.12 0.00 0.08 0.00 0.00 29.97 31.16 2q4s h ARG 10 CO 0.92 0.97 -0.39 0.95 -1.07 0.00 0.00 179.97 181.35 2q4s s THR 11 N -2.90 0.01 0.18 2.04 -4.23 -1.26 -4.95 115.64 104.54 2q4s s THR 11 Ca -0.00 -1.69 -0.12 0.00 -1.18 0.00 0.00 61.69 58.69 2q4s s THR 11 Cb 0.10 -2.28 0.10 0.00 1.34 0.00 0.00 72.50 71.75 2q4s s THR 11 CO 0.82 -0.06 1.83 0.25 -0.54 0.00 0.00 174.62 176.93 2q4s h LEU 12 N 2.48 0.73 -1.34 4.79 5.85 -1.91 -0.39 115.31 125.52 2q4s h LEU 12 Ca -0.31 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.33 2q4s h LEU 12 Cb 1.25 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 42.07 2q4s h LEU 12 CO 0.46 0.57 0.16 0.00 -0.34 0.00 0.00 178.44 179.28 2q4s h ALA 13 N 1.20 1.48 -0.22 1.25 0.00 -1.97 -1.01 119.26 119.99 2q4s h ALA 13 Ca 0.22 -0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.85 2q4s h ALA 13 Cb -0.04 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2q4s h ALA 13 CO -0.04 0.40 -0.51 -0.44 0.00 0.00 0.00 179.25 178.65 2q4s h ASP 14 N 0.61 0.68 -0.53 0.00 3.32 -1.78 -2.33 116.42 116.39 2q4s h ASP 14 Ca 0.15 -0.35 0.03 0.00 0.02 0.00 0.00 57.03 56.88 2q4s h ASP 14 Cb 0.14 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 39.46 2q4s h ASP 14 CO -0.01 1.07 0.31 0.25 -1.72 0.00 0.00 179.24 179.13 2q4s h LEU 15 N 0.48 0.48 -0.81 1.55 5.85 -0.24 -0.92 115.31 121.71 2q4s h LEU 15 Ca 0.02 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 2q4s h LEU 15 Cb 1.06 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.96 2q4s h LEU 15 CO 0.10 0.34 0.50 0.40 -0.34 0.00 0.00 178.44 179.44 2q4s h ILE 16 N 0.61 1.22 -0.39 4.05 2.04 -0.90 0.12 117.51 124.25 2q4s h ILE 16 Ca 0.22 -0.46 -0.00 0.00 1.00 0.00 0.00 64.86 65.61 2q4s h ILE 16 Cb 0.06 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.20 2q4s h ILE 16 CO -0.12 0.23 0.24 -0.09 0.00 0.00 0.00 178.15 178.41 2q4s h ARG 17 N 1.10 0.54 -0.55 2.37 2.43 -1.00 -0.92 114.38 118.36 2q4s h ARG 17 Ca 0.29 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.36 2q4s h ARG 17 Cb -0.06 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.35 2q4s h ARG 17 CO -0.06 0.40 0.15 0.82 -1.51 0.00 0.00 179.97 179.78 2q4s h ILE 18 N 0.52 1.22 -0.54 1.20 2.04 -0.78 -2.31 117.51 118.86 2q4s h ILE 18 Ca 0.14 -0.78 -0.10 0.00 1.00 0.00 0.00 64.86 65.12 2q4s h ILE 18 Cb 0.01 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 2q4s h ILE 18 CO -0.03 0.29 -0.04 -0.07 0.00 0.00 0.00 178.15 178.30 2q4s h LEU 19 N 0.80 0.97 -0.50 1.44 3.38 -0.20 -0.94 115.31 120.26 2q4s h LEU 19 Ca 0.18 -0.33 0.01 0.00 0.09 0.00 0.00 57.88 57.83 2q4s h LEU 19 Cb 0.27 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 2q4s h LEU 19 CO -0.00 1.07 0.32 0.45 0.09 0.00 0.00 178.44 180.37 2q4s h HIS 20 N 0.86 0.61 -0.07 1.13 3.86 -0.80 -1.08 115.15 119.66 2q4s h HIS 20 Ca 0.15 0.02 0.03 0.00 -1.16 0.00 0.00 60.37 59.40 2q4s h HIS 20 Cb 0.59 -0.20 -0.03 0.00 1.06 0.00 0.00 27.41 28.83 2q4s h HIS 20 CO 0.04 0.38 -0.12 0.93 0.86 0.00 0.00 177.93 180.02 2q4s h GLU 21 N 0.66 -0.16 -0.46 2.45 5.08 -1.19 0.22 114.58 121.18 2q4s h GLU 21 Ca 0.19 0.01 0.08 0.00 -1.00 0.00 0.00 59.36 58.64 2q4s h GLU 21 Cb -0.05 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 2q4s h GLU 21 CO -0.05 -0.11 0.31 -0.07 -1.00 0.00 0.00 179.01 178.09 2q4s h LEU 22 N -0.17 0.24 -3.03 1.33 3.38 -0.81 0.68 115.31 116.93 2q4s h LEU 22 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2q4s h LEU 22 Cb 0.26 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2q4s h LEU 22 CO -0.17 0.15 0.00 0.49 0.09 0.00 0.00 178.44 179.00 2q4s n PHE 23 N -4.46 1.35 -0.14 1.13 3.72 -0.44 -4.49 117.46 114.13 2q4s n PHE 23 Ca 0.07 -0.58 0.03 0.00 -0.05 0.00 0.00 57.45 56.92 2q4s n PHE 23 Cb 0.34 -0.17 0.32 0.00 -0.94 0.00 0.00 39.48 39.03 2q4s n PHE 23 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2q4s h ALA 24 N 4.19 1.58 -3.30 4.37 0.00 0.12 -3.43 119.26 122.79 2q4s h ALA 24 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2q4s h ALA 24 Cb 1.33 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2q4s h ALA 24 CO 0.17 0.38 0.00 0.41 0.00 0.00 0.00 179.25 180.20 2q4s n GLY 25 N -1.44 0.37 0.02 0.00 0.00 -1.26 -5.03 105.19 97.84 2q4s n GLY 25 Ca 0.07 -1.86 0.11 0.00 0.00 0.00 0.00 46.02 44.34 2q4s n GLY 25 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2q4s n ASP 26 N -1.94 0.65 -4.77 1.61 8.00 -1.26 -4.94 116.55 113.89 2q4s n ASP 26 Ca 0.00 -0.37 -0.22 0.00 0.71 0.00 0.00 54.79 54.91 2q4s n ASP 26 Cb 0.00 0.81 -0.05 0.00 -0.02 0.00 0.00 41.12 41.85 2q4s n ASP 26 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2q4s s GLU 27 N -3.14 2.48 -0.18 -1.24 0.41 -1.26 -5.12 118.70 110.65 2q4s s GLU 27 Ca 0.05 -1.47 0.01 0.00 -0.41 0.00 0.00 54.97 53.15 2q4s s GLU 27 Cb 0.15 -2.27 0.02 0.00 -1.78 0.00 0.00 34.13 30.25 2q4s s GLU 27 CO 0.80 0.11 -0.19 0.08 -0.49 0.00 0.00 175.26 175.57 2q4s s VAL 28 N -2.39 2.13 -0.83 2.63 1.01 -1.26 -4.85 120.40 116.84 2q4s s VAL 28 Ca 0.39 -0.93 -0.22 0.00 0.00 0.00 0.00 61.98 61.22 2q4s s VAL 28 Cb -0.04 -1.90 0.08 0.00 0.00 0.00 0.00 36.38 34.52 2q4s s VAL 28 CO 0.24 0.53 1.17 0.21 0.00 0.00 0.00 175.10 177.24 2q4s s ASN 29 N 1.30 6.38 0.17 3.32 3.84 -1.26 -4.90 114.94 123.79 2q4s s ASN 29 Ca 0.05 -1.32 -0.15 0.00 0.21 0.00 0.00 52.86 51.66 2q4s s ASN 29 Cb -0.13 -2.47 0.11 0.00 -0.55 0.00 0.00 41.25 38.21 2q4s s ASN 29 CO -0.12 -1.41 1.74 0.58 -2.79 0.00 0.00 177.10 175.10 2q4s h VAL 30 N 6.12 0.85 -0.36 -5.21 2.07 -2.00 -1.93 116.25 115.80 2q4s h VAL 30 Ca -0.05 -0.10 -0.07 0.00 0.82 0.00 0.00 66.70 67.30 2q4s h VAL 30 Cb 1.04 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 2q4s h VAL 30 CO 1.23 0.05 -0.07 -0.33 0.02 0.00 0.00 177.57 178.48 2q4s h GLU 31 N 0.30 0.59 -0.07 1.57 4.39 -1.98 -0.36 114.58 119.01 2q4s h GLU 31 Ca 0.20 -0.16 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 2q4s h GLU 31 Cb 0.20 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.78 2q4s h GLU 31 CO -0.22 0.66 0.01 0.93 -1.16 0.00 0.00 179.01 179.23 2q4s h GLU 32 N 0.55 0.11 -0.62 2.33 5.08 -1.85 -0.71 114.58 119.47 2q4s h GLU 32 Ca 0.11 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.42 2q4s h GLU 32 Cb 0.45 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 2q4s h GLU 32 CO 0.02 0.34 0.31 0.28 -1.00 0.00 0.00 179.01 178.96 2q4s h VAL 33 N -0.14 1.21 -0.11 3.13 2.07 -1.17 -0.00 116.25 121.24 2q4s h VAL 33 Ca 0.02 -0.58 -0.04 0.00 0.82 0.00 0.00 66.70 66.92 2q4s h VAL 33 Cb 0.28 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 2q4s h VAL 33 CO 0.00 0.24 -0.13 -0.61 0.02 0.00 0.00 177.57 177.09 2q4s h GLN 34 N 0.85 0.18 0.00 1.57 4.15 -1.03 0.08 115.11 120.91 2q4s h GLN 34 Ca 0.21 -0.04 -0.25 0.00 0.77 0.00 0.00 58.65 59.34 2q4s h GLN 34 Cb 0.10 -0.03 0.02 0.00 0.21 0.00 0.00 27.48 27.78 2q4s h GLN 34 CO -0.03 0.32 -1.02 0.00 -1.93 0.00 0.00 178.83 176.17 2q4s h ALA 35 N 1.70 0.20 0.01 3.38 0.00 -0.43 -2.38 119.26 121.74 2q4s h ALA 35 Ca 0.04 -0.70 -0.21 0.00 0.00 0.00 0.00 54.91 54.03 2q4s h ALA 35 Cb 0.35 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2q4s h ALA 35 CO 0.02 0.73 -0.93 -0.24 0.00 0.00 0.00 179.25 178.83 2q4s h VAL 36 N 0.34 1.49 -0.42 0.00 3.04 -0.70 -1.16 116.25 118.84 2q4s h VAL 36 Ca -0.12 -2.66 -0.04 0.00 -1.01 0.00 0.00 66.70 62.87 2q4s h VAL 36 Cb 1.67 2.52 -0.02 0.00 -2.01 0.00 0.00 31.29 33.45 2q4s h VAL 36 CO 0.19 0.78 0.09 -0.07 -1.01 0.00 0.00 177.57 177.56 2q4s h LEU 37 N 0.12 0.65 -1.20 3.16 3.38 -1.06 -2.40 115.31 117.96 2q4s h LEU 37 Ca -0.06 -0.24 -0.06 0.00 0.09 0.00 0.00 57.88 57.61 2q4s h LEU 37 Cb 1.58 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 42.14 2q4s h LEU 37 CO 0.15 0.72 -0.10 -0.08 0.09 0.00 0.00 178.44 179.22 2q4s h GLU 38 N 0.55 0.44 0.00 1.13 4.81 -1.37 -2.96 114.58 117.18 2q4s h GLU 38 Ca 0.13 -0.11 -0.06 0.00 -0.13 0.00 0.00 59.36 59.19 2q4s h GLU 38 Cb 0.33 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 2q4s h GLU 38 CO 0.00 0.55 -0.28 0.00 -0.73 0.00 0.00 179.01 178.55 2q4s h ALA 39 N 1.49 1.23 -2.30 2.92 0.00 -0.72 -3.42 119.26 118.46 2q4s h ALA 39 Ca 0.08 -0.25 -0.55 0.00 0.00 0.00 0.00 54.91 54.19 2q4s h ALA 39 Cb 0.43 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2q4s h ALA 39 CO 0.02 0.35 0.95 -0.47 0.00 0.00 0.00 179.25 180.10 2q4s s TYR 40 N -4.01 2.51 -0.35 0.00 5.04 -1.02 -4.67 117.35 114.85 2q4s s TYR 40 Ca -0.02 0.59 -0.22 0.00 -2.44 0.00 0.00 57.07 54.98 2q4s s TYR 40 Cb 0.13 -3.75 0.01 0.00 0.35 0.00 0.00 41.96 38.70 2q4s s TYR 40 CO 0.66 -2.92 0.74 -1.21 -1.34 0.00 0.00 175.55 171.49 2q4s s GLU 41 N 3.20 3.78 -0.22 4.97 0.41 -1.26 -4.98 118.70 124.60 2q4s s GLU 41 Ca 0.66 0.31 -0.41 0.00 -0.41 0.00 0.00 54.97 55.12 2q4s s GLU 41 Cb -0.31 -3.79 -0.17 0.00 -1.78 0.00 0.00 34.13 28.08 2q4s s GLU 41 CO 0.26 -0.78 1.56 0.45 -0.49 0.00 0.00 175.26 176.26 2q4s n SER 42 N 6.27 1.71 -3.95 -0.19 2.88 -1.26 -4.95 113.62 114.13 2q4s n SER 42 Ca 0.02 1.12 -0.31 0.00 -1.33 0.00 0.00 58.87 58.37 2q4s n SER 42 Cb 0.48 -1.07 -0.15 0.00 -0.75 0.00 0.00 64.21 62.72 2q4s n SER 42 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 2q4s s ASN 43 N 2.41 4.48 0.45 -3.46 3.84 -1.26 -5.02 114.94 116.38 2q4s s ASN 43 Ca 0.96 -1.87 0.25 0.00 0.21 0.00 0.00 52.86 52.41 2q4s s ASN 43 Cb -1.17 -1.40 1.27 0.00 -0.55 0.00 0.00 41.25 39.40 2q4s s ASN 43 CO 0.65 -0.36 1.79 -0.65 -2.79 0.00 0.00 177.10 175.74 2q4s h PRO 44 N 7.77 0.23 0.00 0.43 0.11 -1.92 -0.43 132.00 138.19 2q4s h PRO 44 Ca -0.09 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.96 2q4s h PRO 44 Cb 1.03 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 2q4s h PRO 44 CO 0.49 0.15 -0.23 0.00 -0.21 0.00 0.00 178.00 178.21 2q4s h ALA 45 N 1.55 1.19 0.00 -0.75 0.00 -2.00 -0.99 119.26 118.25 2q4s h ALA 45 Ca 0.57 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.27 2q4s h ALA 45 Cb 1.75 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.51 2q4s h ALA 45 CO -0.19 0.29 0.00 0.93 0.00 0.00 0.00 179.25 180.28 2q4s h GLU 46 N 0.00 0.00 0.00 0.00 5.08 -1.51 -3.33 114.58 114.82 2q4s h GLU 46 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2q4s h GLU 46 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2q4s h GLU 46 CO 0.03 0.00 0.00 -2.67 -1.00 0.00 0.00 179.01 175.37 2q4s n TRP 47 N -3.09 0.00 -0.29 4.33 4.27 -1.11 -4.78 117.44 116.77 2q4s n TRP 47 Ca 0.03 -0.10 0.20 0.00 -3.89 0.00 0.00 57.50 53.74 2q4s n TRP 47 Cb 0.47 -0.01 0.49 0.00 -1.36 0.00 0.00 31.31 30.90 2q4s n TRP 47 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2q4s h ALA 48 N 0.00 2.16 -0.72 -1.67 0.00 -1.30 0.37 119.26 118.11 2q4s h ALA 48 Ca 0.00 0.04 0.14 0.00 0.00 0.00 0.00 54.91 55.09 2q4s h ALA 48 Cb 0.25 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 2q4s h ALA 48 CO 0.00 -0.51 0.48 1.25 0.00 0.00 0.00 179.25 180.47 2q4s h LEU 49 N 0.44 0.37 0.00 0.00 5.85 -1.86 -2.13 115.31 117.99 2q4s h LEU 49 Ca 0.54 0.02 0.00 0.00 0.84 0.00 0.00 57.88 59.28 2q4s h LEU 49 Cb 1.29 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.26 2q4s h LEU 49 CO -0.25 0.20 -0.89 -1.22 -0.34 0.00 0.00 178.44 175.94 2q4s n TYR 50 N -4.47 0.34 -2.40 1.25 4.01 0.11 -4.68 117.16 111.31 2q4s n TYR 50 Ca 0.13 0.10 -0.43 0.00 -0.16 0.00 0.00 57.90 57.54 2q4s n TYR 50 Cb 0.50 -0.49 0.00 0.00 -0.31 0.00 0.00 39.34 39.04 2q4s n TYR 50 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2q4s n ALA 51 N -1.81 4.28 -2.99 -0.72 0.00 -0.80 -4.78 120.51 113.69 2q4s n ALA 51 Ca 0.02 -3.97 -0.43 0.00 0.00 0.00 0.00 53.44 49.07 2q4s n ALA 51 Cb 0.43 -3.44 -0.08 0.00 0.00 0.00 0.00 19.45 16.35 2q4s n ALA 51 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2q4s s LYS 52 N 3.18 2.86 0.31 0.00 1.02 -1.26 -5.02 119.74 120.83 2q4s s LYS 52 Ca 0.49 -1.37 -0.08 0.00 0.02 0.00 0.00 55.97 55.03 2q4s s LYS 52 Cb 0.06 -4.01 -0.06 0.00 -0.52 0.00 0.00 37.83 33.30 2q4s s LYS 52 CO 0.02 -0.99 0.63 -0.06 -0.92 0.00 0.00 175.35 174.03 2q4s s PHE 53 N 1.57 3.46 0.04 3.18 0.08 -1.26 -4.72 117.98 120.32 2q4s s PHE 53 Ca 0.04 0.85 0.07 0.00 0.12 0.00 0.00 56.93 58.00 2q4s s PHE 53 Cb -0.24 -2.27 -0.02 0.00 -0.57 0.00 0.00 43.02 39.92 2q4s s PHE 53 CO 0.05 0.10 -0.19 0.34 -0.10 0.00 0.00 175.22 175.43 2q4s s ASP 54 N -2.93 2.25 0.54 1.36 2.15 -1.26 -5.06 116.67 113.71 2q4s s ASP 54 Ca 0.48 -0.50 0.32 0.00 0.43 0.00 0.00 52.55 53.28 2q4s s ASP 54 Cb -0.11 -0.18 1.32 0.00 -0.30 0.00 0.00 42.92 43.66 2q4s s ASP 54 CO 0.28 0.13 1.97 -0.61 -0.17 0.00 0.00 175.17 176.77 2q4s h GLN 55 N 4.91 0.00 0.00 4.34 4.15 -2.00 -3.36 115.11 123.14 2q4s h GLN 55 Ca -0.41 0.00 -0.37 0.00 0.77 0.00 0.00 58.65 58.63 2q4s h GLN 55 Cb 1.16 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 28.79 2q4s h GLN 55 CO 0.44 0.03 -2.41 0.66 -1.93 0.00 0.00 178.83 175.62 2q4s n TYR 56 N -3.15 0.00 -4.02 3.99 4.01 -1.26 -5.01 117.16 111.73 2q4s n TYR 56 Ca 0.00 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.61 2q4s n TYR 56 Cb 0.32 -0.99 -0.02 0.00 -0.31 0.00 0.00 39.34 38.33 2q4s n TYR 56 CO 0.00 0.00 0.00 -0.98 -0.46 0.00 0.00 176.86 175.42 2q4s s ARG 57 N -2.50 2.04 0.57 -0.72 1.70 -1.26 -4.97 118.95 113.82 2q4s s ARG 57 Ca -0.19 -1.71 -0.15 0.00 -0.47 0.00 0.00 55.73 53.21 2q4s s ARG 57 Cb 0.07 0.50 -0.05 0.00 -0.57 0.00 0.00 34.95 34.89 2q4s s ARG 57 CO 0.74 -0.88 1.02 1.52 -1.08 0.00 0.00 175.30 176.62 2q4s s TYR 58 N -2.75 3.31 0.18 5.89 -0.85 -1.26 -4.34 117.35 117.52 2q4s s TYR 58 Ca 0.27 1.45 0.10 0.00 -0.52 0.00 0.00 57.07 58.36 2q4s s TYR 58 Cb -0.02 -2.85 -0.04 0.00 0.38 0.00 0.00 41.96 39.43 2q4s s TYR 58 CO 0.19 -0.72 -0.15 0.95 -1.52 0.00 0.00 175.55 174.30 2q4s s THR 59 N -2.69 2.90 -0.18 -3.49 -4.23 -0.29 -4.93 115.64 102.72 2q4s s THR 59 Ca 0.60 -1.75 -0.02 0.00 -1.18 0.00 0.00 61.69 59.34 2q4s s THR 59 Cb -0.12 -2.41 -0.00 0.00 1.34 0.00 0.00 72.50 71.30 2q4s s THR 59 CO 0.38 -0.08 -0.10 -0.13 -0.54 0.00 0.00 174.62 174.14 2q4s s ARG 60 N -2.69 3.29 -0.24 3.99 0.52 -1.26 -1.64 118.95 120.91 2q4s s ARG 60 Ca 0.23 -0.69 0.01 0.00 -0.52 0.00 0.00 55.73 54.76 2q4s s ARG 60 Cb -0.09 -2.80 0.06 0.00 0.52 0.00 0.00 34.95 32.65 2q4s s ARG 60 CO 0.13 -0.07 -0.07 -0.80 0.02 0.00 0.00 175.30 174.51 2q4s s ASN 61 N 1.09 4.05 0.11 0.23 0.01 -0.63 0.37 114.94 120.17 2q4s s ASN 61 Ca 0.00 -1.26 -0.31 0.00 -0.71 0.00 0.00 52.86 50.58 2q4s s ASN 61 Cb -0.15 -1.29 -0.07 0.00 0.41 0.00 0.00 41.25 40.15 2q4s s ASN 61 CO -0.03 -0.23 1.35 -0.22 -1.51 0.00 0.00 177.10 176.46 2q4s s LEU 62 N 1.30 4.37 -0.21 0.60 2.96 -0.23 -0.74 118.68 126.73 2q4s s LEU 62 Ca -0.06 2.26 0.01 0.00 -0.22 0.00 0.00 54.13 56.11 2q4s s LEU 62 Cb -0.19 -3.59 -0.14 0.00 0.50 0.00 0.00 46.19 42.78 2q4s s LEU 62 CO -0.06 -0.61 -0.19 0.52 -1.32 0.00 0.00 176.35 174.69 2q4s n VAL 63 N 3.90 1.21 -3.59 1.68 0.31 0.14 -0.99 118.33 120.99 2q4s n VAL 63 Ca 0.11 -0.45 -0.14 0.00 -0.01 0.00 0.00 64.34 63.84 2q4s n VAL 63 Cb 0.43 -1.28 -0.06 0.00 -0.91 0.00 0.00 33.84 32.01 2q4s n VAL 63 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2q4s s ASP 64 N -6.11 -0.63 -0.04 4.52 2.15 -0.86 -4.68 116.67 111.02 2q4s s ASP 64 Ca -0.29 1.02 0.16 0.00 0.43 0.00 0.00 52.55 53.88 2q4s s ASP 64 Cb 0.08 0.97 0.55 0.00 -0.30 0.00 0.00 42.92 44.21 2q4s s ASP 64 CO 0.48 -0.35 1.44 0.00 -0.17 0.00 0.00 175.17 176.57 2q4s n GLN 65 N 1.86 2.76 -4.17 4.34 6.02 -1.26 -1.19 117.38 125.74 2q4s n GLN 65 Ca -0.15 -2.20 -0.35 0.00 -0.01 0.00 0.00 57.00 54.29 2q4s n GLN 65 Cb 0.56 -1.61 -0.06 0.00 1.02 0.00 0.00 30.24 30.16 2q4s n GLN 65 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2q4s n GLY 66 N 1.21 -0.42 2.84 1.08 0.00 -1.17 0.42 105.19 109.14 2q4s n GLY 66 Ca 0.20 0.07 -0.20 0.00 0.00 0.00 0.00 46.02 46.09 2q4s n GLY 66 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2q4s n ASN 67 N -2.34 -5.60 0.00 1.61 4.13 -1.26 -1.50 115.26 110.30 2q4s n ASN 67 Ca 0.09 -0.24 0.00 0.00 1.68 0.00 0.00 54.58 56.11 2q4s n ASN 67 Cb 0.47 -4.45 0.00 0.00 -1.54 0.00 0.00 39.78 34.26 2q4s n ASN 67 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2q4s n GLY 68 N -1.42 0.64 0.11 7.41 0.00 0.17 -4.80 105.19 107.30 2q4s n GLY 68 Ca -0.11 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.91 2q4s n GLY 68 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2q4s h LYS 69 N 1.27 0.00 -3.26 1.61 1.79 -1.36 -3.41 116.57 113.21 2q4s h LYS 69 Ca 0.00 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.43 2q4s h LYS 69 Cb 0.00 0.00 -0.12 0.00 -1.58 0.00 0.00 32.23 30.53 2q4s h LYS 69 CO 0.00 0.55 0.03 -0.59 -1.08 0.00 0.00 179.45 178.37 2q4s s PHE 70 N -2.89 -0.29 -0.18 -1.35 -0.12 -1.25 -4.19 117.98 107.71 2q4s s PHE 70 Ca 0.02 -0.00 -0.04 0.00 -0.05 0.00 0.00 56.93 56.85 2q4s s PHE 70 Cb 0.08 0.38 -0.03 0.00 -0.63 0.00 0.00 43.02 42.82 2q4s s PHE 70 CO 0.78 -0.79 -0.02 -0.80 -0.05 0.00 0.00 175.22 174.34 2q4s s ASN 71 N -2.80 4.81 0.00 1.98 0.01 0.18 -3.07 114.94 116.05 2q4s s ASN 71 Ca 0.04 -0.17 0.07 0.00 -0.71 0.00 0.00 52.86 52.09 2q4s s ASN 71 Cb 0.00 -1.80 -0.03 0.00 0.41 0.00 0.00 41.25 39.83 2q4s s ASN 71 CO -0.10 0.11 -0.23 -0.22 -1.51 0.00 0.00 177.10 175.15 2q4s s LEU 72 N 0.70 2.28 -0.13 0.60 2.96 -0.33 -0.87 118.68 123.89 2q4s s LEU 72 Ca -0.01 -0.45 -0.06 0.00 -0.22 0.00 0.00 54.13 53.39 2q4s s LEU 72 Cb -0.14 -1.39 0.06 0.00 0.50 0.00 0.00 46.19 45.22 2q4s s LEU 72 CO 0.02 0.30 0.29 -0.63 -1.32 0.00 0.00 176.35 175.01 2q4s s ILE 74 N -0.73 -0.23 -0.10 6.68 1.01 0.08 0.29 121.20 128.19 2q4s s ILE 74 Ca 0.11 0.19 -0.06 0.00 0.00 0.00 0.00 60.65 60.90 2q4s s ILE 74 Cb -0.10 -0.46 -0.04 0.00 0.01 0.00 0.00 42.46 41.87 2q4s s ILE 74 CO 0.01 0.08 0.13 -0.76 0.00 0.00 0.00 174.94 174.40 2q4s s LEU 75 N 1.84 4.32 -0.20 2.97 1.02 0.48 -1.60 118.68 127.50 2q4s s LEU 75 Ca -0.05 0.42 0.00 0.00 0.02 0.00 0.00 54.13 54.53 2q4s s LEU 75 Cb -0.11 -2.14 0.02 0.00 0.02 0.00 0.00 46.19 43.98 2q4s s LEU 75 CO -0.09 0.38 -0.16 0.00 0.02 0.00 0.00 176.35 176.49 2q4s s TRP 77 N 1.30 3.53 1.30 0.00 0.52 -0.14 -1.14 118.94 124.32 2q4s s TRP 77 Ca 0.04 -2.34 -0.18 0.00 0.02 0.00 0.00 56.10 53.63 2q4s s TRP 77 Cb -0.14 -2.94 0.32 0.00 -1.15 0.00 0.00 33.47 29.56 2q4s s TRP 77 CO -0.11 -0.93 0.83 0.41 0.02 0.00 0.00 176.95 177.18 2q4s n GLY 78 N 4.57 -2.94 3.69 0.98 0.00 -1.26 -0.98 105.19 109.25 2q4s n GLY 78 Ca -0.04 -1.36 -0.43 0.00 0.00 0.00 0.00 46.02 44.19 2q4s n GLY 78 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2q4s n GLU 79 N -4.95 2.77 -0.99 1.61 4.71 -1.26 -1.96 120.64 120.56 2q4s n GLU 79 Ca 0.07 1.00 0.00 0.00 -0.01 0.00 0.00 57.16 58.22 2q4s n GLU 79 Cb 0.56 -2.89 0.00 0.00 -1.01 0.00 0.00 31.44 28.10 2q4s n GLU 79 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2q4s n GLY 80 N 4.17 0.52 3.75 0.62 0.00 -0.41 -4.98 105.19 108.86 2q4s n GLY 80 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 2q4s n GLY 80 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2q4s s HIS 81 N -2.16 3.73 0.30 1.61 3.76 -0.83 -4.83 115.29 116.87 2q4s s HIS 81 Ca 0.00 1.38 0.03 0.00 -0.15 0.00 0.00 55.06 56.32 2q4s s HIS 81 Cb 0.00 -2.73 -0.04 0.00 1.11 0.00 0.00 32.58 30.92 2q4s s HIS 81 CO 0.00 0.32 0.14 0.20 -0.85 0.00 0.00 174.74 174.56 2q4s s GLY 82 N -0.19 2.02 0.54 -2.22 0.00 -1.26 -0.64 107.32 105.58 2q4s s GLY 82 Ca 0.35 -1.76 0.06 0.00 0.00 0.00 0.00 44.72 43.37 2q4s s GLY 82 CO 0.21 -1.60 0.43 -1.35 0.00 0.00 0.00 173.10 170.79 2q4s s SER 83 N -3.37 4.67 0.97 1.64 1.04 -0.80 -4.74 113.70 113.10 2q4s s SER 83 Ca 0.36 -1.21 -0.16 0.00 0.48 0.00 0.00 55.95 55.42 2q4s s SER 83 Cb 0.05 0.39 0.21 0.00 0.10 0.00 0.00 66.02 66.78 2q4s s SER 83 CO 0.17 -1.12 1.32 -0.44 0.98 0.00 0.00 173.24 174.15 2q4s s SER 84 N -4.31 3.03 -0.14 7.02 0.01 -1.26 -4.67 113.70 113.37 2q4s s SER 84 Ca 0.36 0.17 -0.24 0.00 1.31 0.00 0.00 55.95 57.55 2q4s s SER 84 Cb -0.02 -0.17 -0.02 0.00 0.21 0.00 0.00 66.02 66.01 2q4s s SER 84 CO 0.23 -2.78 0.76 -0.63 0.41 0.00 0.00 173.24 171.22 2q4s s ILE 85 N -3.88 4.96 0.25 1.44 1.01 -1.26 -4.23 121.20 119.49 2q4s s ILE 85 Ca 0.75 1.50 -0.07 0.00 0.00 0.00 0.00 60.65 62.82 2q4s s ILE 85 Cb -0.03 -4.07 -0.01 0.00 0.01 0.00 0.00 42.46 38.35 2q4s s ILE 85 CO 0.53 0.11 0.37 -1.38 0.00 0.00 0.00 174.94 174.57 2q4s s HIS 86 N 1.70 0.73 0.00 3.97 -3.43 0.61 0.24 115.29 119.11 2q4s s HIS 86 Ca 0.36 -1.02 0.00 0.00 -0.80 0.00 0.00 55.06 53.60 2q4s s HIS 86 Cb -0.17 -0.09 0.00 0.00 -1.43 0.00 0.00 32.58 30.89 2q4s s HIS 86 CO 0.14 -0.91 0.00 -0.40 -2.00 0.00 0.00 174.74 171.57 2q4s n ASP 87 N -0.52 0.38 -1.85 7.38 5.68 -1.13 -2.13 116.55 124.36 2q4s n ASP 87 Ca 0.00 0.00 -0.02 0.00 -0.50 0.00 0.00 54.79 54.27 2q4s n ASP 87 Cb 0.63 0.00 0.02 0.00 -1.14 0.00 0.00 41.12 40.63 2q4s n ASP 87 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 2q4s n HIS 88 N 0.00 -0.34 -3.26 2.11 8.25 -1.26 -4.81 115.22 115.91 2q4s n HIS 88 Ca 0.00 -1.08 -0.23 0.00 -0.26 0.00 0.00 57.72 56.15 2q4s n HIS 88 Cb 0.00 0.51 0.01 0.00 1.12 0.00 0.00 29.99 31.63 2q4s n HIS 88 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 2q4s n THR 89 N -0.39 -1.32 -2.15 1.59 -1.04 -1.26 -1.23 114.28 108.47 2q4s n THR 89 Ca -0.12 0.00 -0.17 0.00 -2.04 0.00 0.00 64.05 61.72 2q4s n THR 89 Cb 0.86 -2.34 -0.03 0.00 -1.82 0.00 0.00 70.33 67.01 2q4s n THR 89 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2q4s n ASP 90 N -2.36 -4.95 -4.39 8.00 8.00 -1.26 -4.93 116.55 114.66 2q4s n ASP 90 Ca -0.05 0.18 -0.24 0.00 0.71 0.00 0.00 54.79 55.39 2q4s n ASP 90 Cb 0.57 -4.23 -0.11 0.00 -0.02 0.00 0.00 41.12 37.32 2q4s n ASP 90 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2q4s s SER 91 N -2.17 3.16 0.63 -2.24 0.01 -0.37 -4.84 113.70 107.89 2q4s s SER 91 Ca 0.00 -0.89 -0.16 0.00 1.31 0.00 0.00 55.95 56.21 2q4s s SER 91 Cb 0.00 -0.22 -0.01 0.00 0.21 0.00 0.00 66.02 65.99 2q4s s SER 91 CO 0.00 0.05 1.12 -1.00 0.41 0.00 0.00 173.24 173.82 2q4s s HIS 92 N -1.95 2.59 -0.25 2.43 3.76 0.28 -4.56 115.29 117.60 2q4s s HIS 92 Ca 0.20 1.55 -0.02 0.00 -0.15 0.00 0.00 55.06 56.64 2q4s s HIS 92 Cb -0.07 -3.23 0.12 0.00 1.11 0.00 0.00 32.58 30.52 2q4s s HIS 92 CO 0.09 -1.73 0.29 0.00 -0.85 0.00 0.00 174.74 172.54 2q4s s PHE 94 N 2.40 3.18 -0.10 0.00 0.08 0.02 -0.56 117.98 123.01 2q4s s PHE 94 Ca 0.09 0.13 -0.05 0.00 0.12 0.00 0.00 56.93 57.23 2q4s s PHE 94 Cb -0.15 -1.69 0.05 0.00 -0.57 0.00 0.00 43.02 40.66 2q4s s PHE 94 CO -0.21 0.51 0.22 -1.17 -0.10 0.00 0.00 175.22 174.48 2q4s s LEU 95 N -1.78 0.35 0.03 -0.37 0.20 -0.36 -1.07 118.68 115.68 2q4s s LEU 95 Ca 0.23 0.48 0.07 0.00 0.69 0.00 0.00 54.13 55.59 2q4s s LEU 95 Cb -0.12 0.63 -0.02 0.00 -0.43 0.00 0.00 46.19 46.25 2q4s s LEU 95 CO 0.14 -0.18 -0.19 -0.75 -0.29 0.00 0.00 176.35 175.08 2q4s s LYS 96 N 1.45 1.32 -0.16 1.98 2.20 -0.14 0.25 119.74 126.65 2q4s s LYS 96 Ca -0.07 -0.86 -0.22 0.00 -0.36 0.00 0.00 55.97 54.46 2q4s s LYS 96 Cb -0.11 -1.39 -0.03 0.00 -1.51 0.00 0.00 37.83 34.79 2q4s s LYS 96 CO -0.08 0.36 0.65 -0.51 -0.36 0.00 0.00 175.35 175.41 2q4s s LEU 97 N -1.05 4.19 -0.05 5.43 2.01 0.59 -1.01 118.68 128.81 2q4s s LEU 97 Ca 0.06 0.94 0.19 0.00 0.01 0.00 0.00 54.13 55.33 2q4s s LEU 97 Cb -0.08 -2.95 -0.23 0.00 0.01 0.00 0.00 46.19 42.94 2q4s s LEU 97 CO 0.01 -0.23 0.48 0.18 1.01 0.00 0.00 176.35 177.80 2q4s n LEU 98 N 4.70 0.33 -3.56 1.79 4.77 0.17 0.39 117.00 125.59 2q4s n LEU 98 Ca -0.01 0.14 -0.17 0.00 -0.03 0.00 0.00 56.01 55.94 2q4s n LEU 98 Cb 0.50 0.19 -0.06 0.00 -2.33 0.00 0.00 43.42 41.71 2q4s n LEU 98 CO 0.45 0.21 0.41 -1.58 -1.33 0.00 0.00 177.39 175.54 2q4s s GLN 99 N -2.97 0.98 2.98 3.23 0.74 -0.85 -4.74 119.66 119.03 2q4s s GLN 99 Ca -0.07 0.40 0.00 0.00 0.05 0.00 0.00 55.36 55.74 2q4s s GLN 99 Cb 0.09 0.47 0.00 0.00 1.10 0.00 0.00 33.01 34.67 2q4s s GLN 99 CO 0.85 -0.27 0.00 0.41 -0.55 0.00 0.00 175.29 175.73 2q4s n GLY 100 N 1.34 0.35 3.33 2.59 0.00 -1.26 -1.87 105.19 109.67 2q4s n GLY 100 Ca -0.18 -0.91 -0.17 0.00 0.00 0.00 0.00 46.02 44.76 2q4s n GLY 100 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2q4s s ASN 101 N -4.00 2.18 -0.08 1.61 0.01 -1.26 -2.79 114.94 110.62 2q4s s ASN 101 Ca 0.00 -1.10 -0.05 0.00 -0.71 0.00 0.00 52.86 51.00 2q4s s ASN 101 Cb 0.00 -0.07 0.03 0.00 0.41 0.00 0.00 41.25 41.62 2q4s s ASN 101 CO 0.00 -0.34 0.19 -0.76 -1.51 0.00 0.00 177.10 174.68 2q4s s LEU 102 N -3.29 0.91 0.03 0.60 1.43 -0.95 -4.68 118.68 112.73 2q4s s LEU 102 Ca 0.24 0.40 -0.04 0.00 -1.03 0.00 0.00 54.13 53.69 2q4s s LEU 102 Cb 0.03 0.59 -0.05 0.00 0.03 0.00 0.00 46.19 46.80 2q4s s LEU 102 CO 0.06 -0.11 0.25 -0.75 0.23 0.00 0.00 176.35 176.03 2q4s s LYS 103 N 0.68 3.52 -0.14 1.70 2.20 -0.27 -0.77 119.74 126.66 2q4s s LYS 103 Ca -0.05 -0.20 0.01 0.00 -0.36 0.00 0.00 55.97 55.37 2q4s s LYS 103 Cb -0.06 -3.04 0.02 0.00 -1.51 0.00 0.00 37.83 33.23 2q4s s LYS 103 CO -0.04 0.62 -0.15 -2.00 -0.36 0.00 0.00 175.35 173.43 2q4s s GLU 104 N -2.07 2.32 -0.23 4.03 2.12 0.28 -1.28 118.70 123.87 2q4s s GLU 104 Ca 0.31 -0.57 -0.09 0.00 0.36 0.00 0.00 54.97 54.97 2q4s s GLU 104 Cb -0.13 -2.08 -0.04 0.00 0.26 0.00 0.00 34.13 32.14 2q4s s GLU 104 CO 0.20 -0.19 0.12 0.99 -0.54 0.00 0.00 175.26 175.84 2q4s s THR 105 N 1.35 5.05 -0.12 -1.70 2.01 0.26 -2.74 115.64 119.75 2q4s s THR 105 Ca 0.02 0.07 -0.12 0.00 0.31 0.00 0.00 61.69 61.97 2q4s s THR 105 Cb -0.13 -3.34 -0.05 0.00 0.01 0.00 0.00 72.50 68.99 2q4s s THR 105 CO -0.09 0.36 0.27 -0.76 -0.69 0.00 0.00 174.62 173.72 2q4s s LEU 106 N 1.04 4.32 0.01 4.42 1.43 0.23 -1.24 118.68 128.90 2q4s s LEU 106 Ca 0.06 0.57 0.04 0.00 -1.03 0.00 0.00 54.13 53.77 2q4s s LEU 106 Cb -0.14 -2.33 -0.01 0.00 0.03 0.00 0.00 46.19 43.74 2q4s s LEU 106 CO 0.04 0.22 -0.12 -0.36 0.23 0.00 0.00 176.35 176.36 2q4s s PHE 107 N -0.20 1.07 0.59 0.29 0.08 -0.63 0.35 117.98 119.53 2q4s s PHE 107 Ca 0.17 -0.27 -0.11 0.00 0.12 0.00 0.00 56.93 56.85 2q4s s PHE 107 Cb -0.13 -0.67 -0.04 0.00 -0.57 0.00 0.00 43.02 41.61 2q4s s PHE 107 CO 0.05 -0.00 0.99 -0.51 -0.10 0.00 0.00 175.22 175.65 2q4s s ASP 108 N -0.65 6.27 0.31 1.36 1.01 -1.26 -0.93 116.67 122.77 2q4s s ASP 108 Ca 0.03 1.36 -0.30 0.00 0.71 0.00 0.00 52.55 54.35 2q4s s ASP 108 Cb -0.06 -2.44 -0.11 0.00 1.01 0.00 0.00 42.92 41.32 2q4s s ASP 108 CO 0.00 -0.80 1.58 0.26 0.21 0.00 0.00 175.17 176.43 2q4s s TRP 109 N -3.06 2.72 0.57 4.23 0.52 -1.26 -4.80 118.94 117.87 2q4s s TRP 109 Ca 0.54 0.83 -0.20 0.00 0.02 0.00 0.00 56.10 57.29 2q4s s TRP 109 Cb -0.11 -4.07 -0.04 0.00 -1.15 0.00 0.00 33.47 28.10 2q4s s TRP 109 CO 0.50 -3.53 1.23 -2.14 0.02 0.00 0.00 176.95 173.03 2q4s s PRO 110 N -0.73 3.06 0.66 4.98 0.02 -1.26 -5.04 135.00 136.69 2q4s s PRO 110 Ca 0.62 1.91 -0.07 0.00 0.02 0.00 0.00 61.00 63.48 2q4s s PRO 110 Cb -0.48 -2.03 0.14 0.00 0.02 0.00 0.00 34.50 32.15 2q4s s PRO 110 CO 0.50 -1.16 0.90 -0.25 -0.33 0.00 0.00 177.00 176.66 2q4s n ASP 111 N -1.39 0.54 0.06 2.53 8.00 -1.26 -5.01 116.55 120.02 2q4s n ASP 111 Ca 0.13 -1.61 -0.13 0.00 0.71 0.00 0.00 54.79 53.89 2q4s n ASP 111 Cb 0.49 -0.64 -0.07 0.00 -0.02 0.00 0.00 41.12 40.87 2q4s n ASP 111 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2q4s h LYS 112 N 0.00 -0.06 -7.00 -1.24 1.79 -1.99 -3.44 116.57 104.63 2q4s h LYS 112 Ca -0.29 0.00 -0.54 0.00 -2.18 0.00 0.00 60.65 57.64 2q4s h LYS 112 Cb 0.92 0.01 0.11 0.00 -1.58 0.00 0.00 32.23 31.70 2q4s h LYS 112 CO 0.25 0.01 0.66 0.15 -1.08 0.00 0.00 179.45 179.44 2q4s s LYS 113 N -5.95 3.61 -0.35 3.15 -0.14 -1.26 -4.92 119.74 113.89 2q4s s LYS 113 Ca -0.14 2.31 -0.29 0.00 -1.36 0.00 0.00 55.97 56.49 2q4s s LYS 113 Cb 0.05 -2.57 0.00 0.00 -1.68 0.00 0.00 37.83 33.63 2q4s s LYS 113 CO 0.66 -0.84 1.41 0.45 -0.76 0.00 0.00 175.35 176.27 2q4s s SER 114 N -0.68 6.44 0.06 2.83 0.15 -1.26 -4.97 113.70 116.28 2q4s s SER 114 Ca 0.63 1.08 -0.01 0.00 0.70 0.00 0.00 55.95 58.34 2q4s s SER 114 Cb -0.41 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.32 2q4s s SER 114 CO 0.52 -1.30 -0.02 0.20 1.20 0.00 0.00 173.24 173.85 2q4s s ASN 115 N 3.64 0.46 0.00 5.45 0.01 -0.93 -4.99 114.94 118.59 2q4s s ASN 115 Ca 0.61 -1.03 0.00 0.00 -0.71 0.00 0.00 52.86 51.73 2q4s s ASN 115 Cb -0.16 0.21 0.00 0.00 0.41 0.00 0.00 41.25 41.71 2q4s s ASN 115 CO 0.29 -0.62 0.00 1.21 -1.51 0.00 0.00 177.10 176.47 2q4s n GLU 116 N 0.08 2.84 -3.64 -0.60 4.07 -1.17 -3.45 120.64 118.77 2q4s n GLU 116 Ca -0.13 0.00 -0.07 0.00 -0.06 0.00 0.00 57.16 56.91 2q4s n GLU 116 Cb 0.61 0.00 -0.07 0.00 -0.06 0.00 0.00 31.44 31.93 2q4s n GLU 116 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 2q4s s ILE 118 N 0.00 0.00 0.39 6.31 -1.09 -1.26 -4.97 121.20 120.57 2q4s s ILE 118 Ca 0.00 0.00 -0.28 0.00 -2.23 0.00 0.00 60.65 58.14 2q4s s ILE 118 Cb 0.00 -1.00 -0.11 0.00 -1.58 0.00 0.00 42.46 39.77 2q4s s ILE 118 CO 0.00 0.00 1.48 -1.59 -1.23 0.00 0.00 174.94 173.60 2q4s s LYS 119 N 0.63 4.05 -0.01 2.79 -2.85 -1.26 -4.61 119.74 118.48 2q4s s LYS 119 Ca -0.01 2.55 0.11 0.00 -1.00 0.00 0.00 55.97 57.62 2q4s s LYS 119 Cb -0.05 -2.93 -0.23 0.00 -2.06 0.00 0.00 37.83 32.57 2q4s s LYS 119 CO -0.10 -0.57 0.79 1.57 0.10 0.00 0.00 175.35 177.15 2q4s h LYS 120 N 2.91 0.01 -1.33 1.78 2.10 -0.47 -3.49 116.57 118.08 2q4s h LYS 120 Ca -0.51 -0.02 0.31 0.00 -2.00 0.00 0.00 60.65 58.43 2q4s h LYS 120 Cb 1.24 0.01 -0.16 0.00 -0.90 0.00 0.00 32.23 32.42 2q4s h LYS 120 CO 0.64 0.63 0.87 -1.54 -2.00 0.00 0.00 179.45 178.05 2q4s s SER 121 N -6.27 -0.07 0.27 7.07 1.04 -1.20 -5.01 113.70 109.53 2q4s s SER 121 Ca -0.04 -0.05 0.02 0.00 0.48 0.00 0.00 55.95 56.35 2q4s s SER 121 Cb 0.08 0.11 -0.03 0.00 0.10 0.00 0.00 66.02 66.29 2q4s s SER 121 CO 0.82 -0.20 0.26 -1.83 0.98 0.00 0.00 173.24 173.27 2q4s s GLU 122 N -2.31 1.54 -0.18 4.02 -1.05 -1.26 -0.60 118.70 118.87 2q4s s GLU 122 Ca 0.12 -1.78 -0.35 0.00 -0.15 0.00 0.00 54.97 52.81 2q4s s GLU 122 Cb 0.03 0.33 0.14 0.00 -0.44 0.00 0.00 34.13 34.18 2q4s s GLU 122 CO -0.04 -0.56 1.20 -0.98 0.95 0.00 0.00 175.26 175.82 2q4s s ARG 123 N -3.72 0.33 -0.10 -4.83 1.70 -1.11 -4.99 118.95 106.24 2q4s s ARG 123 Ca 0.38 -0.12 0.00 0.00 -0.47 0.00 0.00 55.73 55.51 2q4s s ARG 123 Cb 0.04 0.15 -0.03 0.00 -0.57 0.00 0.00 34.95 34.54 2q4s s ARG 123 CO 0.19 -0.15 -0.09 0.99 -1.08 0.00 0.00 175.30 175.17 2q4s s THR 124 N -2.45 3.51 -0.26 4.99 2.01 -1.26 -0.56 115.64 121.62 2q4s s THR 124 Ca 0.09 -0.53 -0.01 0.00 0.31 0.00 0.00 61.69 61.56 2q4s s THR 124 Cb -0.01 -2.46 0.04 0.00 0.01 0.00 0.00 72.50 70.08 2q4s s THR 124 CO -0.05 0.56 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.62 2q4s s LEU 125 N -0.30 3.33 0.61 4.42 1.43 0.05 -5.00 118.68 123.21 2q4s s LEU 125 Ca 0.04 -1.04 0.03 0.00 -1.03 0.00 0.00 54.13 52.12 2q4s s LEU 125 Cb -0.13 -1.64 0.08 0.00 0.03 0.00 0.00 46.19 44.53 2q4s s LEU 125 CO 0.02 -0.16 0.85 -0.13 0.23 0.00 0.00 176.35 177.16 2q4s s ARG 126 N 1.27 2.17 0.02 1.70 0.52 -1.26 -2.23 118.95 121.14 2q4s s ARG 126 Ca -0.02 -1.12 -0.39 0.00 -0.52 0.00 0.00 55.73 53.68 2q4s s ARG 126 Cb -0.18 -2.48 -0.19 0.00 0.52 0.00 0.00 34.95 32.62 2q4s s ARG 126 CO -0.04 -1.00 1.10 0.39 0.02 0.00 0.00 175.30 175.76 2q4s n GLU 127 N -2.48 0.20 -0.57 3.54 1.02 -1.12 -0.90 120.64 120.33 2q4s n GLU 127 Ca 0.12 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.33 2q4s n GLU 127 Cb 0.60 -1.58 0.00 0.00 -0.02 0.00 0.00 31.44 30.44 2q4s n GLU 127 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2q4s n ASN 128 N 1.68 0.00 -4.84 1.62 3.02 0.16 -4.97 115.26 111.93 2q4s n ASN 128 Ca 0.20 0.00 -0.33 0.00 -0.03 0.00 0.00 54.58 54.42 2q4s n ASN 128 Cb 0.10 -0.47 -0.06 0.00 -0.61 0.00 0.00 39.78 38.74 2q4s n ASN 128 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2q4s s GLN 129 N -0.14 4.08 0.46 3.52 -0.21 -0.08 -4.60 119.66 122.70 2q4s s GLN 129 Ca 0.00 0.86 0.06 0.00 0.02 0.00 0.00 55.36 56.30 2q4s s GLN 129 Cb 0.00 -2.31 -0.02 0.00 1.00 0.00 0.00 33.01 31.68 2q4s s GLN 129 CO 0.00 0.05 0.22 0.00 -2.12 0.00 0.00 175.29 173.44 2q4s s ALA 131 N -2.69 -0.57 -0.06 0.00 0.00 0.14 -4.96 121.76 113.62 2q4s s ALA 131 Ca 0.34 -0.37 -0.04 0.00 0.00 0.00 0.00 51.96 51.89 2q4s s ALA 131 Cb 0.02 0.68 0.02 0.00 0.00 0.00 0.00 23.12 23.84 2q4s s ALA 131 CO 0.19 -0.62 0.14 -0.47 0.00 0.00 0.00 175.76 175.00 2q4s s TYR 132 N -3.86 -0.16 0.03 0.00 6.14 -1.26 -1.23 117.35 117.02 2q4s s TYR 132 Ca 0.07 0.42 -0.10 0.00 0.64 0.00 0.00 57.07 58.09 2q4s s TYR 132 Cb 0.03 -0.01 0.01 0.00 0.42 0.00 0.00 41.96 42.41 2q4s s TYR 132 CO -0.09 -0.11 0.22 -1.50 0.64 0.00 0.00 175.55 174.71 2q4s s ILE 133 N 0.56 0.10 0.23 3.14 2.07 0.28 -5.02 121.20 122.56 2q4s s ILE 133 Ca -0.04 -0.80 -0.08 0.00 -1.41 0.00 0.00 60.65 58.32 2q4s s ILE 133 Cb -0.06 -0.84 -0.02 0.00 0.13 0.00 0.00 42.46 41.68 2q4s s ILE 133 CO -0.03 -0.44 0.35 0.54 -1.91 0.00 0.00 174.94 173.45 2q4s s ASN 134 N -1.94 -0.00 0.17 4.50 2.20 -1.26 -1.86 114.94 116.74 2q4s s ASN 134 Ca -0.07 -1.10 -0.12 0.00 -0.94 0.00 0.00 52.86 50.63 2q4s s ASN 134 Cb -0.02 0.51 0.06 0.00 -2.00 0.00 0.00 41.25 39.80 2q4s s ASN 134 CO -0.02 -1.03 1.71 0.44 -2.94 0.00 0.00 177.10 175.26 2q4s h ASP 135 N 2.39 0.80 0.10 3.54 5.19 -1.80 -2.39 116.42 124.25 2q4s h ASP 135 Ca -0.30 -0.19 -0.01 0.00 -0.62 0.00 0.00 57.03 55.91 2q4s h ASP 135 Cb 1.25 -0.21 -0.00 0.00 0.18 0.00 0.00 39.33 40.55 2q4s h ASP 135 CO 0.42 0.77 -0.06 0.28 -3.12 0.00 0.00 179.24 177.54 2q4s h SER 136 N 0.78 0.00 0.00 6.45 0.02 -1.97 -3.29 113.55 115.53 2q4s h SER 136 Ca 0.19 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 2q4s h SER 136 Cb 0.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.78 2q4s h SER 136 CO -0.01 0.06 0.00 -0.38 -1.14 0.00 0.00 176.83 175.36 2q4s n ILE 137 N -4.07 0.00 -3.47 3.27 5.41 -0.92 -5.06 119.36 114.53 2q4s n ILE 137 Ca -0.03 0.53 -0.02 0.00 1.00 0.00 0.00 62.75 64.23 2q4s n ILE 137 Cb 0.14 -1.06 0.01 0.00 -0.71 0.00 0.00 39.64 38.02 2q4s n ILE 137 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2q4s n GLY 138 N 0.97 1.30 3.93 7.39 0.00 -1.10 -4.91 105.19 112.77 2q4s n GLY 138 Ca 0.00 -1.05 -0.20 0.00 0.00 0.00 0.00 46.02 44.77 2q4s n GLY 138 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2q4s s LEU 139 N 0.00 3.81 0.19 0.99 1.43 -0.11 -4.54 118.68 120.45 2q4s s LEU 139 Ca 0.07 -0.33 -0.19 0.00 -1.03 0.00 0.00 54.13 52.66 2q4s s LEU 139 Cb -0.01 -2.52 0.04 0.00 0.03 0.00 0.00 46.19 43.72 2q4s s LEU 139 CO 0.03 -0.41 0.54 -1.38 0.23 0.00 0.00 176.35 175.36 2q4s s HIS 140 N -2.24 -0.20 -0.04 0.29 -3.43 -0.91 -1.61 115.29 107.15 2q4s s HIS 140 Ca 0.44 -0.12 0.04 0.00 -0.80 0.00 0.00 55.06 54.61 2q4s s HIS 140 Cb -0.08 0.43 -0.00 0.00 -1.43 0.00 0.00 32.58 31.50 2q4s s HIS 140 CO 0.29 -0.91 -0.16 0.50 -2.00 0.00 0.00 174.74 172.47 2q4s s ARG 141 N -3.85 1.69 -0.06 -0.38 3.52 -0.37 -0.28 118.95 119.22 2q4s s ARG 141 Ca 0.07 -0.57 0.05 0.00 -0.13 0.00 0.00 55.73 55.15 2q4s s ARG 141 Cb -0.01 -1.47 -0.00 0.00 -1.56 0.00 0.00 34.95 31.90 2q4s s ARG 141 CO -0.05 0.22 -0.20 0.08 -0.81 0.00 0.00 175.30 174.54 2q4s s VAL 142 N 0.08 1.67 0.02 7.11 1.01 -1.26 0.90 120.40 129.94 2q4s s VAL 142 Ca -0.04 -0.84 -0.05 0.00 0.00 0.00 0.00 61.98 61.05 2q4s s VAL 142 Cb -0.11 -1.43 -0.01 0.00 0.00 0.00 0.00 36.38 34.82 2q4s s VAL 142 CO 0.02 0.47 0.09 -1.83 0.00 0.00 0.00 175.10 173.86 2q4s s GLU 143 N 0.09 0.51 -0.55 2.72 -1.05 -0.41 -1.91 118.70 118.09 2q4s s GLU 143 Ca -0.07 -0.60 -0.18 0.00 -0.15 0.00 0.00 54.97 53.97 2q4s s GLU 143 Cb -0.13 0.20 0.09 0.00 -0.44 0.00 0.00 34.13 33.85 2q4s s GLU 143 CO 0.04 -0.12 0.62 1.21 0.95 0.00 0.00 175.26 177.96 2q4s s ASN 144 N -1.75 6.19 0.00 0.83 2.47 0.19 -1.12 114.94 121.76 2q4s s ASN 144 Ca -0.10 -1.35 0.27 0.00 0.42 0.00 0.00 52.86 52.10 2q4s s ASN 144 Cb -0.05 -2.27 0.85 0.00 -1.45 0.00 0.00 41.25 38.33 2q4s s ASN 144 CO -0.02 -0.97 1.62 1.33 -3.72 0.00 0.00 177.10 175.34 2q4s n VAL 145 N 5.48 0.00 -1.80 -5.21 0.24 -1.26 -1.29 118.33 114.49 2q4s n VAL 145 Ca -0.10 -0.16 -0.37 0.00 -2.04 0.00 0.00 64.34 61.67 2q4s n VAL 145 Cb 0.43 0.42 0.06 0.00 -1.47 0.00 0.00 33.84 33.28 2q4s n VAL 145 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2q4s s SER 146 N -2.36 4.72 -0.01 -1.34 0.15 -1.26 -4.67 113.70 108.94 2q4s s SER 146 Ca 0.28 2.57 0.19 0.00 0.70 0.00 0.00 55.95 59.70 2q4s s SER 146 Cb 0.20 -2.61 -0.23 0.00 -1.71 0.00 0.00 66.02 61.66 2q4s s SER 146 CO 0.47 -1.92 0.72 1.41 1.20 0.00 0.00 173.24 175.11 2q4s n HIS 147 N -1.84 0.00 0.00 3.44 8.25 -1.26 -2.15 115.22 121.66 2q4s n HIS 147 Ca 0.15 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.61 2q4s n HIS 147 Cb 0.48 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 31.48 2q4s n HIS 147 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2q4s n THR 148 N -1.64 0.00 -5.25 1.59 -2.24 -1.26 -4.95 114.28 100.53 2q4s n THR 148 Ca 0.02 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.48 2q4s n THR 148 Cb 0.35 0.27 -0.16 0.00 -2.10 0.00 0.00 70.33 68.69 2q4s n THR 148 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2q4s s GLU 149 N -1.62 2.56 0.95 -0.78 0.41 -1.26 -5.03 118.70 113.92 2q4s s GLU 149 Ca 0.00 -0.90 -0.12 0.00 -0.41 0.00 0.00 54.97 53.54 2q4s s GLU 149 Cb 0.00 -2.17 0.16 0.00 -1.78 0.00 0.00 34.13 30.33 2q4s s GLU 149 CO 0.00 0.39 1.11 -1.25 -0.49 0.00 0.00 175.26 175.02 2q4s s PRO 150 N -0.18 0.83 0.07 0.39 0.04 -1.26 -4.50 135.00 130.39 2q4s s PRO 150 Ca -0.03 0.47 0.08 0.00 0.04 0.00 0.00 61.00 61.56 2q4s s PRO 150 Cb -0.14 -1.79 -0.03 0.00 0.04 0.00 0.00 34.50 32.59 2q4s s PRO 150 CO 0.04 -2.45 -0.22 0.00 0.04 0.00 0.00 177.00 174.41 2q4s s ALA 151 N -3.08 1.92 -0.07 8.56 0.00 -0.16 -3.98 121.76 124.95 2q4s s ALA 151 Ca 0.64 -1.20 -0.03 0.00 0.00 0.00 0.00 51.96 51.37 2q4s s ALA 151 Cb -0.17 -0.33 0.04 0.00 0.00 0.00 0.00 23.12 22.66 2q4s s ALA 151 CO 0.56 0.42 0.14 0.08 0.00 0.00 0.00 175.76 176.96 2q4s s VAL 152 N -0.95 -0.20 0.19 0.00 1.01 -0.78 -0.97 120.40 118.70 2q4s s VAL 152 Ca 0.09 0.34 0.08 0.00 0.00 0.00 0.00 61.98 62.48 2q4s s VAL 152 Cb -0.09 -0.25 -0.04 0.00 0.00 0.00 0.00 36.38 35.99 2q4s s VAL 152 CO 0.03 0.14 -0.16 -0.94 0.00 0.00 0.00 175.10 174.18 2q4s s SER 153 N 2.07 2.57 -0.23 3.32 1.04 -0.24 0.43 113.70 122.66 2q4s s SER 153 Ca 0.01 -0.95 -0.01 0.00 0.48 0.00 0.00 55.95 55.48 2q4s s SER 153 Cb -0.12 -0.14 0.02 0.00 0.10 0.00 0.00 66.02 65.88 2q4s s SER 153 CO -0.05 -0.12 -0.09 -0.22 0.98 0.00 0.00 173.24 173.74 2q4s s LEU 154 N -3.05 2.98 -0.07 2.42 2.96 -0.18 -0.39 118.68 123.36 2q4s s LEU 154 Ca 0.19 -0.81 0.01 0.00 -0.22 0.00 0.00 54.13 53.31 2q4s s LEU 154 Cb -0.03 -1.63 -0.03 0.00 0.50 0.00 0.00 46.19 45.00 2q4s s LEU 154 CO 0.07 -0.10 -0.08 -1.00 -1.32 0.00 0.00 176.35 173.92 2q4s s HIS 155 N 1.32 2.92 -0.11 5.38 3.76 -1.26 -0.97 115.29 126.33 2q4s s HIS 155 Ca 0.01 0.01 0.02 0.00 -0.15 0.00 0.00 55.06 54.95 2q4s s HIS 155 Cb -0.16 -1.70 0.01 0.00 1.11 0.00 0.00 32.58 31.84 2q4s s HIS 155 CO -0.06 0.32 -0.15 -1.17 -0.85 0.00 0.00 174.74 172.83 2q4s s LEU 156 N -0.81 1.74 -0.05 0.89 0.20 -0.23 -4.26 118.68 116.16 2q4s s LEU 156 Ca 0.12 -0.44 0.05 0.00 0.69 0.00 0.00 54.13 54.56 2q4s s LEU 156 Cb -0.11 -1.11 -0.01 0.00 -0.43 0.00 0.00 46.19 44.54 2q4s s LEU 156 CO 0.01 0.02 -0.21 -0.31 -0.29 0.00 0.00 176.35 175.57 2q4s s TYR 157 N 1.00 2.07 -0.16 5.38 2.02 -0.05 -0.80 117.35 126.81 2q4s s TYR 157 Ca -0.06 -0.61 -0.06 0.00 -0.37 0.00 0.00 57.07 55.97 2q4s s TYR 157 Cb -0.15 -1.37 0.07 0.00 -0.40 0.00 0.00 41.96 40.11 2q4s s TYR 157 CO -0.02 -0.19 0.32 0.45 -1.57 0.00 0.00 175.55 174.54 2q4s s SER 158 N -0.06 0.12 0.94 2.29 0.15 -0.94 -0.65 113.70 115.55 2q4s s SER 158 Ca -0.04 0.75 -0.12 0.00 0.70 0.00 0.00 55.95 57.24 2q4s s SER 158 Cb -0.13 0.95 0.15 0.00 -1.71 0.00 0.00 66.02 65.29 2q4s s SER 158 CO 0.03 -0.24 1.09 -2.84 1.20 0.00 0.00 173.24 172.48 2q4s s PRO 159 N 2.49 0.93 0.57 5.44 0.02 -1.26 0.10 135.00 143.29 2q4s s PRO 159 Ca 0.00 0.77 -0.20 0.00 0.02 0.00 0.00 61.00 61.59 2q4s s PRO 159 Cb -0.12 -1.78 -0.04 0.00 0.02 0.00 0.00 34.50 32.58 2q4s s PRO 159 CO -0.10 -2.45 1.25 -2.14 -0.33 0.00 0.00 177.00 173.23 2q4s s PRO 160 N -4.91 3.06 -0.10 5.54 0.02 -1.25 -4.76 135.00 132.60 2q4s s PRO 160 Ca 0.64 1.95 -0.12 0.00 0.02 0.00 0.00 61.00 63.48 2q4s s PRO 160 Cb -0.19 -2.06 0.03 0.00 0.02 0.00 0.00 34.50 32.31 2q4s s PRO 160 CO 0.57 -1.16 0.33 -0.59 -0.33 0.00 0.00 177.00 175.82 2q4s s PHE 161 N -1.49 -0.33 -0.04 6.54 -0.12 -1.26 -5.01 117.98 116.27 2q4s s PHE 161 Ca 0.75 0.76 0.06 0.00 -0.05 0.00 0.00 56.93 58.44 2q4s s PHE 161 Cb -0.33 0.12 0.09 0.00 -0.63 0.00 0.00 43.02 42.26 2q4s s PHE 161 CO 0.37 -0.23 1.03 -0.40 -0.05 0.00 0.00 175.22 175.94 2q4s n ASP 162 N 2.52 2.00 -4.02 1.98 5.68 -1.26 -5.01 116.55 118.44 2q4s n ASP 162 Ca -0.15 -2.30 -0.12 0.00 -0.50 0.00 0.00 54.79 51.73 2q4s n ASP 162 Cb 0.57 -0.13 -0.12 0.00 -1.14 0.00 0.00 41.12 40.30 2q4s n ASP 162 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 2q4s s THR 163 N -1.52 0.36 0.22 2.12 -4.23 -1.26 -4.66 115.64 106.67 2q4s s THR 163 Ca 0.10 -0.90 -0.08 0.00 -1.18 0.00 0.00 61.69 59.63 2q4s s THR 163 Cb 0.09 -0.44 0.03 0.00 1.34 0.00 0.00 72.50 73.52 2q4s s THR 163 CO 0.01 -0.36 0.44 0.00 -0.54 0.00 0.00 174.62 174.17 2q4s s HIS 165 N -5.08 2.52 -0.04 0.00 3.76 -1.26 0.01 115.29 115.20 2q4s s HIS 165 Ca 0.09 -0.28 0.00 0.00 -0.15 0.00 0.00 55.06 54.73 2q4s s HIS 165 Cb -0.03 -1.42 -0.03 0.00 1.11 0.00 0.00 32.58 32.21 2q4s s HIS 165 CO 0.07 0.27 -0.01 0.00 -0.85 0.00 0.00 174.74 174.22 2q4s s ALA 166 N -0.96 3.24 -0.10 -1.40 0.00 -0.79 -2.83 121.76 118.91 2q4s s ALA 166 Ca 0.15 -0.89 0.03 0.00 0.00 0.00 0.00 51.96 51.25 2q4s s ALA 166 Cb -0.10 -1.37 -0.01 0.00 0.00 0.00 0.00 23.12 21.64 2q4s s ALA 166 CO 0.06 0.62 -0.20 -0.06 0.00 0.00 0.00 175.76 176.17 2q4s s PHE 167 N -0.98 2.62 -0.23 0.00 0.08 0.14 -1.98 117.98 117.63 2q4s s PHE 167 Ca 0.16 -0.80 -0.29 0.00 0.12 0.00 0.00 56.93 56.13 2q4s s PHE 167 Cb -0.11 -1.72 -0.00 0.00 -0.57 0.00 0.00 43.02 40.61 2q4s s PHE 167 CO 0.06 -0.27 1.22 0.34 -0.10 0.00 0.00 175.22 176.47 2q4s s ASP 168 N 0.16 6.89 0.62 1.36 2.15 -0.37 -4.22 116.67 123.25 2q4s s ASP 168 Ca -0.11 1.43 0.37 0.00 0.43 0.00 0.00 52.55 54.68 2q4s s ASP 168 Cb -0.16 -2.54 2.07 0.00 -0.30 0.00 0.00 42.92 41.99 2q4s s ASP 168 CO 0.06 -0.85 2.28 -0.61 -0.17 0.00 0.00 175.17 175.88 2q4s h GLN 169 N 8.39 0.00 0.00 4.34 4.15 -1.95 0.25 115.11 130.30 2q4s h GLN 169 Ca -0.25 0.00 -0.21 0.00 0.77 0.00 0.00 58.65 58.96 2q4s h GLN 169 Cb 1.09 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.75 2q4s h GLN 169 CO 1.00 0.01 -1.02 0.00 -1.93 0.00 0.00 178.83 176.89 2q4s h ARG 170 N 0.00 0.01 0.00 1.69 2.47 -1.90 -3.41 114.38 113.24 2q4s h ARG 170 Ca -0.00 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.70 2q4s h ARG 170 Cb 0.07 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.39 2q4s h ARG 170 CO 0.00 1.00 -0.76 0.25 0.56 0.00 0.00 179.97 181.02 2q4s n THR 171 N -3.35 0.00 0.00 2.04 -2.24 -0.98 -3.05 114.28 106.70 2q4s n THR 171 Ca -0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 2q4s n THR 171 Cb 0.94 -0.62 0.00 0.00 -2.10 0.00 0.00 70.33 68.55 2q4s n THR 171 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2q4s n GLY 172 N 2.63 0.33 3.77 3.38 0.00 0.84 -2.19 105.19 113.95 2q4s n GLY 172 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 2q4s n GLY 172 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2q4s s HIS 173 N -2.00 2.72 0.18 1.61 5.04 -1.26 -4.64 115.29 116.94 2q4s s HIS 173 Ca 0.00 1.37 0.08 0.00 -1.54 0.00 0.00 55.06 54.97 2q4s s HIS 173 Cb 0.00 -3.73 -0.04 0.00 0.04 0.00 0.00 32.58 28.85 2q4s s HIS 173 CO 0.00 -2.30 -0.15 -1.59 -2.34 0.00 0.00 174.74 168.35 2q4s s LYS 174 N -2.31 1.26 0.02 2.88 -2.85 -1.26 -1.24 119.74 116.23 2q4s s LYS 174 Ca 0.58 -1.47 -0.08 0.00 -1.00 0.00 0.00 55.97 54.00 2q4s s LYS 174 Cb -0.39 -1.14 -0.00 0.00 -2.06 0.00 0.00 37.83 34.23 2q4s s LYS 174 CO 0.50 0.21 0.15 0.54 0.10 0.00 0.00 175.35 176.85 2q4s s ASN 175 N -2.97 0.06 0.64 0.03 4.22 -0.84 -4.96 114.94 111.12 2q4s s ASN 175 Ca 0.18 -0.32 -0.18 0.00 -2.14 0.00 0.00 52.86 50.40 2q4s s ASN 175 Cb -0.03 0.24 -0.01 0.00 1.28 0.00 0.00 41.25 42.72 2q4s s ASN 175 CO 0.06 -0.46 1.25 -0.75 -2.04 0.00 0.00 177.10 175.16 2q4s s LYS 176 N -2.00 2.67 -0.07 3.55 2.20 -1.26 -1.88 119.74 122.94 2q4s s LYS 176 Ca -0.10 1.93 0.02 0.00 -0.36 0.00 0.00 55.97 57.47 2q4s s LYS 176 Cb -0.04 -1.88 0.01 0.00 -1.51 0.00 0.00 37.83 34.41 2q4s s LYS 176 CO -0.01 -1.47 -0.14 0.08 -0.36 0.00 0.00 175.35 173.45 2q4s s VAL 177 N -1.55 1.25 0.20 4.02 1.01 0.10 -4.82 120.40 120.61 2q4s s VAL 177 Ca 0.80 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 62.25 2q4s s VAL 177 Cb -0.34 -1.13 0.04 0.00 0.00 0.00 0.00 36.38 34.95 2q4s s VAL 177 CO 0.38 0.38 0.27 0.41 0.00 0.00 0.00 175.10 176.54 2q4s n THR 178 N 3.77 0.00 0.00 3.92 -1.04 -1.26 -2.34 114.28 117.33 2q4s n THR 178 Ca -0.22 -0.57 0.00 0.00 -2.04 0.00 0.00 64.05 61.22 2q4s n THR 178 Cb 0.52 -0.98 0.00 0.00 -1.82 0.00 0.00 70.33 68.05 2q4s n THR 178 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 2q4s n THR 180 N -1.55 0.00 -3.91 12.58 -2.24 -1.26 -5.02 114.28 112.88 2q4s n THR 180 Ca 0.05 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.48 2q4s n THR 180 Cb 0.19 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.32 2q4s n THR 180 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 2q4s s PHE 181 N -2.00 3.27 0.11 4.78 0.08 -1.26 -4.64 117.98 118.32 2q4s s PHE 181 Ca 0.00 0.09 0.28 0.00 0.12 0.00 0.00 56.93 57.42 2q4s s PHE 181 Cb 0.00 -2.12 1.09 0.00 -0.57 0.00 0.00 43.02 41.42 2q4s s PHE 181 CO 0.00 0.12 1.89 1.25 -0.10 0.00 0.00 175.22 178.38 2q4s h HIS 182 N 6.91 0.00 -2.36 0.36 -0.00 -0.37 -3.42 115.15 116.27 2q4s h HIS 182 Ca -0.38 0.00 0.09 0.00 -0.00 0.00 0.00 60.37 60.08 2q4s h HIS 182 Cb 1.17 0.00 -0.15 0.00 -0.00 0.00 0.00 27.41 28.43 2q4s h HIS 182 CO 0.59 0.12 0.45 0.45 -0.00 0.00 0.00 177.93 179.54 2q4s s SER 183 N -5.99 -0.40 -0.04 3.26 0.15 -1.18 -2.39 113.70 107.11 2q4s s SER 183 Ca 0.01 0.03 -0.01 0.00 0.70 0.00 0.00 55.95 56.67 2q4s s SER 183 Cb 0.10 0.42 0.03 0.00 -1.71 0.00 0.00 66.02 64.86 2q4s s SER 183 CO 0.60 -0.66 0.08 -0.54 1.20 0.00 0.00 173.24 173.91 2q4s s LYS 184 N -3.11 0.00 -1.48 5.44 1.02 0.88 -1.06 119.74 121.43 2q4s s LYS 184 Ca 0.04 0.29 -0.11 0.00 0.02 0.00 0.00 55.97 56.21 2q4s s LYS 184 Cb -0.01 -0.25 0.07 0.00 -0.52 0.00 0.00 37.83 37.12 2q4s s LYS 184 CO -0.09 -0.19 0.92 1.19 -0.92 0.00 0.00 175.35 176.26 2q4s n PHE 185 N 4.35 -2.23 -0.03 3.18 3.72 -0.16 -1.11 117.46 125.17 2q4s n PHE 185 Ca -0.24 0.89 0.00 0.00 -0.05 0.00 0.00 57.45 58.05 2q4s n PHE 185 Cb 0.51 -4.08 0.00 0.00 -0.94 0.00 0.00 39.48 34.96 2q4s n PHE 185 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2q4s n GLY 186 N -1.68 2.45 3.59 1.37 0.00 -1.26 -5.01 105.19 104.65 2q4s n GLY 186 Ca -0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 2q4s n GLY 186 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2q4s s ILE 187 N -2.87 5.23 0.24 -0.61 -1.09 -0.27 -4.96 121.20 116.87 2q4s s ILE 187 Ca 0.00 0.14 -0.31 0.00 -2.23 0.00 0.00 60.65 58.25 2q4s s ILE 187 Cb 0.00 -3.47 -0.11 0.00 -1.58 0.00 0.00 42.46 37.30 2q4s s ILE 187 CO 0.00 0.28 1.58 -0.60 -1.23 0.00 0.00 174.94 174.97 2q4s s ARG 188 N 1.57 4.17 -0.55 2.79 6.06 -1.26 -0.09 118.95 131.64 2q4s s ARG 188 Ca 0.07 2.49 0.04 0.00 -2.50 0.00 0.00 55.73 55.82 2q4s s ARG 188 Cb -0.15 -3.08 0.16 0.00 0.06 0.00 0.00 34.95 31.94 2q4s s ARG 188 CO 0.09 -0.61 0.37 0.95 -2.50 0.00 0.00 175.30 173.60 2q4s s THR 189 N 0.44 1.87 -2.00 4.11 -4.23 -1.00 -4.88 115.64 109.94 2q4s s THR 189 Ca 0.66 -3.37 0.03 0.00 -1.18 0.00 0.00 61.69 57.83 2q4s s THR 189 Cb -0.46 -2.26 0.09 0.00 1.34 0.00 0.00 72.50 71.21 2q4s s THR 189 CO 0.41 -1.02 0.68 -2.65 -0.54 0.00 0.00 174.62 171.50