#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 3.83 0.35 -4.62 1.43 -1.26 -5.02 118.68 113.39 2q4s s LEU 6 Ca 0.00 -0.26 0.04 0.00 -1.03 0.00 0.00 54.13 52.88 2q4s s LEU 6 Cb 0.00 -2.89 -0.01 0.00 0.03 0.00 0.00 46.19 43.32 2q4s s LEU 6 CO 0.00 -1.38 0.52 -0.76 0.23 0.00 0.00 176.35 174.96 2q4s s LEU 7 N 4.44 3.95 0.07 1.79 1.43 -1.26 -5.05 118.68 124.04 2q4s s LEU 7 Ca 0.34 0.06 -0.31 0.00 -1.03 0.00 0.00 54.13 53.20 2q4s s LEU 7 Cb -0.11 -2.95 -0.07 0.00 0.03 0.00 0.00 46.19 43.10 2q4s s LEU 7 CO 0.20 -0.43 1.35 -0.75 0.23 0.00 0.00 176.35 176.95 2q4s s LYS 8 N -4.26 4.33 0.15 1.70 2.20 -1.26 -4.95 119.74 117.66 2q4s s LYS 8 Ca 0.43 1.97 -0.32 0.00 -0.36 0.00 0.00 55.97 57.70 2q4s s LYS 8 Cb -0.10 -3.36 -0.11 0.00 -1.51 0.00 0.00 37.83 32.75 2q4s s LYS 8 CO 0.33 -0.44 1.79 -2.30 -0.36 0.00 0.00 175.35 174.38 2q4s n PRO 9 N 4.36 2.75 0.10 4.03 -0.02 -1.26 -4.87 135.00 140.08 2q4s n PRO 9 Ca 0.11 1.00 -0.00 0.00 -2.02 0.00 0.00 63.50 62.59 2q4s n PRO 9 Cb 0.44 -2.87 -0.03 0.00 -0.02 0.00 0.00 33.50 31.02 2q4s n PRO 9 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2q4s h ARG 10 N 7.87 0.00 -3.22 -0.52 2.47 -1.92 -3.41 114.38 115.64 2q4s h ARG 10 Ca -0.45 0.00 0.02 0.00 -1.26 0.00 0.00 59.98 58.28 2q4s h ARG 10 Cb 1.22 0.00 -0.06 0.00 -1.65 0.00 0.00 29.97 29.48 2q4s h ARG 10 CO 0.95 0.59 0.12 0.95 0.56 0.00 0.00 179.97 183.14 2q4s s THR 11 N -2.89 0.00 0.22 2.04 -4.23 -1.26 -4.98 115.64 104.54 2q4s s THR 11 Ca 0.02 -1.14 -0.08 0.00 -1.18 0.00 0.00 61.69 59.31 2q4s s THR 11 Cb 0.08 -2.15 0.19 0.00 1.34 0.00 0.00 72.50 71.96 2q4s s THR 11 CO 0.77 0.00 1.87 0.25 -0.54 0.00 0.00 174.62 176.98 2q4s h LEU 12 N 2.08 1.01 -1.13 4.79 5.85 -1.92 0.31 115.31 126.30 2q4s h LEU 12 Ca -0.22 -0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.36 2q4s h LEU 12 Cb 1.25 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.01 2q4s h LEU 12 CO 0.29 0.77 -0.19 0.00 -0.34 0.00 0.00 178.44 178.96 2q4s h ALA 13 N 1.28 1.27 -0.29 1.25 0.00 -1.96 -0.15 119.26 120.66 2q4s h ALA 13 Ca 0.30 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 2q4s h ALA 13 Cb -0.06 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2q4s h ALA 13 CO -0.06 0.48 -0.16 0.22 0.00 0.00 0.00 179.25 179.74 2q4s h ASP 14 N 0.35 0.63 -0.58 0.00 3.58 -1.59 -1.61 116.42 117.20 2q4s h ASP 14 Ca 0.06 -0.42 0.08 0.00 0.42 0.00 0.00 57.03 57.17 2q4s h ASP 14 Cb 0.54 -0.18 -0.07 0.00 1.72 0.00 0.00 39.33 41.35 2q4s h ASP 14 CO 0.04 0.91 0.23 0.25 -2.88 0.00 0.00 179.24 177.79 2q4s h LEU 15 N 0.35 0.26 -0.78 2.28 5.85 0.05 -1.49 115.31 121.84 2q4s h LEU 15 Ca 0.06 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.85 2q4s h LEU 15 Cb 0.68 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.71 2q4s h LEU 15 CO 0.05 0.16 0.50 0.40 -0.34 0.00 0.00 178.44 179.21 2q4s h ILE 16 N 0.43 1.21 -0.55 4.05 2.04 -0.69 -0.89 117.51 123.11 2q4s h ILE 16 Ca 0.29 -0.42 0.04 0.00 1.00 0.00 0.00 64.86 65.76 2q4s h ILE 16 Cb 0.32 0.09 -0.04 0.00 -0.74 0.00 0.00 36.82 36.44 2q4s h ILE 16 CO -0.27 0.21 0.31 -0.09 0.00 0.00 0.00 178.15 178.31 2q4s h ARG 17 N 1.06 0.59 -0.50 2.37 2.43 -0.53 -1.41 114.38 118.39 2q4s h ARG 17 Ca 0.28 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.35 2q4s h ARG 17 Cb -0.08 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.31 2q4s h ARG 17 CO -0.06 0.39 0.05 0.82 -1.51 0.00 0.00 179.97 179.66 2q4s h ILE 18 N 0.61 1.24 -0.64 1.20 2.04 -0.77 -2.71 117.51 118.48 2q4s h ILE 18 Ca 0.23 -0.93 -0.08 0.00 1.00 0.00 0.00 64.86 65.08 2q4s h ILE 18 Cb 0.08 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 2q4s h ILE 18 CO -0.13 0.34 0.07 -0.07 0.00 0.00 0.00 178.15 178.35 2q4s h LEU 19 N 0.76 1.04 -2.03 1.44 3.38 -0.45 -1.50 115.31 117.95 2q4s h LEU 19 Ca 0.16 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 2q4s h LEU 19 Cb 0.39 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 2q4s h LEU 19 CO 0.01 1.05 -0.07 0.45 0.09 0.00 0.00 178.44 179.97 2q4s h HIS 20 N 1.00 0.00 -0.02 1.13 3.86 -0.97 -1.62 115.15 118.53 2q4s h HIS 20 Ca 0.19 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.26 2q4s h HIS 20 Cb 0.48 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.96 2q4s h HIS 20 CO 0.03 0.07 -0.53 0.93 0.86 0.00 0.00 177.93 179.29 2q4s h GLU 21 N 0.00 0.39 0.00 2.45 5.08 -1.25 -2.92 114.58 118.33 2q4s h GLU 21 Ca -0.00 -0.40 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 2q4s h GLU 21 Cb 0.14 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.50 2q4s h GLU 21 CO 0.01 1.07 0.00 1.28 -1.00 0.00 0.00 179.01 180.36 2q4s n LEU 22 N -4.26 0.20 -0.23 1.33 4.77 -0.62 -2.13 117.00 116.06 2q4s n LEU 22 Ca -0.10 0.56 0.08 0.00 -0.03 0.00 0.00 56.01 56.52 2q4s n LEU 22 Cb 0.64 -0.54 0.13 0.00 -2.33 0.00 0.00 43.42 41.32 2q4s n LEU 22 CO 0.45 -0.41 0.49 0.49 -1.33 0.00 0.00 177.39 177.09 2q4s n PHE 23 N -1.73 0.00 0.22 -1.77 3.72 -0.66 -4.69 117.46 112.55 2q4s n PHE 23 Ca 0.02 -0.96 0.10 0.00 -0.05 0.00 0.00 57.45 56.55 2q4s n PHE 23 Cb 0.15 -0.16 0.46 0.00 -0.94 0.00 0.00 39.48 39.00 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 0.18 1.03 -3.51 4.37 0.00 -1.22 -3.45 119.26 116.66 2q4s h ALA 24 Ca -0.01 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2q4s h ALA 24 Cb 1.06 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2q4s h ALA 24 CO 0.00 0.30 0.00 0.41 0.00 0.00 0.00 179.25 179.96 2q4s n GLY 25 N 0.11 1.36 0.00 0.00 0.00 -1.26 -5.04 105.19 100.36 2q4s n GLY 25 Ca -0.00 -2.01 0.11 0.00 0.00 0.00 0.00 46.02 44.11 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 -1.89 0.81 -4.84 1.61 8.00 -1.26 -4.96 116.55 114.01 2q4s n ASP 26 Ca 0.00 -0.72 -0.30 0.00 0.71 0.00 0.00 54.79 54.48 2q4s n ASP 26 Cb 0.00 0.86 -0.04 0.00 -0.02 0.00 0.00 41.12 41.92 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 -3.04 2.23 -0.04 -1.24 0.41 -1.26 -5.15 118.70 110.62 2q4s s GLU 27 Ca 0.08 -2.26 0.00 0.00 -0.41 0.00 0.00 54.97 52.38 2q4s s GLU 27 Cb 0.16 -1.79 0.03 0.00 -1.78 0.00 0.00 34.13 30.74 2q4s s GLU 27 CO 0.83 -0.53 -0.01 0.08 -0.49 0.00 0.00 175.26 175.14 2q4s s VAL 28 N -2.85 0.25 -0.68 2.63 1.01 -1.26 -4.86 120.40 114.63 2q4s s VAL 28 Ca 0.17 0.06 -0.19 0.00 0.00 0.00 0.00 61.98 62.01 2q4s s VAL 28 Cb -0.01 -0.34 0.11 0.00 0.00 0.00 0.00 36.38 36.14 2q4s s VAL 28 CO 0.10 0.17 0.84 0.21 0.00 0.00 0.00 175.10 176.43 2q4s s ASN 29 N 1.10 6.30 0.22 3.32 3.84 -1.26 -4.91 114.94 123.55 2q4s s ASN 29 Ca -0.09 -1.53 -0.07 0.00 0.21 0.00 0.00 52.86 51.38 2q4s s ASN 29 Cb -0.14 -2.34 0.33 0.00 -0.55 0.00 0.00 41.25 38.56 2q4s s ASN 29 CO -0.02 -1.14 1.76 0.58 -2.79 0.00 0.00 177.10 175.49 2q4s h VAL 30 N 5.84 0.79 -0.64 -5.21 2.07 -1.98 0.36 116.25 117.49 2q4s h VAL 30 Ca -0.18 -0.17 -0.05 0.00 0.82 0.00 0.00 66.70 67.11 2q4s h VAL 30 Cb 1.07 0.24 -0.03 0.00 -1.52 0.00 0.00 31.29 31.05 2q4s h VAL 30 CO 1.10 0.09 0.21 -0.33 0.02 0.00 0.00 177.57 178.66 2q4s h GLU 31 N 0.51 0.96 0.00 1.57 4.39 -1.98 0.32 114.58 120.35 2q4s h GLU 31 Ca 0.34 -0.18 -0.13 0.00 0.34 0.00 0.00 59.36 59.73 2q4s h GLU 31 Cb 0.41 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.89 2q4s h GLU 31 CO -0.30 0.82 -0.64 0.93 -1.16 0.00 0.00 179.01 178.66 2q4s h GLU 32 N 0.93 0.00 -0.04 2.33 5.08 -1.60 0.16 114.58 121.45 2q4s h GLU 32 Ca 0.21 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.42 2q4s h GLU 32 Cb 0.25 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.51 2q4s h GLU 32 CO -0.01 0.64 -0.55 0.28 -1.00 0.00 0.00 179.01 178.37 2q4s h VAL 33 N 0.00 1.41 -0.45 3.13 2.07 0.21 -2.73 116.25 119.89 2q4s h VAL 33 Ca -0.01 -1.96 -0.10 0.00 0.82 0.00 0.00 66.70 65.45 2q4s h VAL 33 Cb 1.41 2.43 -0.02 0.00 -1.52 0.00 0.00 31.29 33.60 2q4s h VAL 33 CO 0.08 0.58 -0.12 -0.61 0.02 0.00 0.00 177.57 177.52 2q4s h GLN 34 N -0.03 0.81 -0.60 1.57 4.15 -0.42 -2.85 115.11 117.75 2q4s h GLN 34 Ca -0.06 -0.28 -0.01 0.00 0.77 0.00 0.00 58.65 59.08 2q4s h GLN 34 Cb 1.23 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 28.83 2q4s h GLN 34 CO 0.11 0.89 0.35 0.00 -1.93 0.00 0.00 178.83 178.25 2q4s h ALA 35 N 1.13 0.76 -0.50 3.38 0.00 -0.98 -1.57 119.26 121.49 2q4s h ALA 35 Ca 0.12 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2q4s h ALA 35 Cb 0.61 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2q4s h ALA 35 CO 0.04 0.26 0.05 -0.24 0.00 0.00 0.00 179.25 179.36 2q4s h VAL 36 N 0.81 1.26 -0.41 0.00 3.04 -1.43 -2.13 116.25 117.39 2q4s h VAL 36 Ca 0.21 -1.00 -0.02 0.00 -1.01 0.00 0.00 66.70 64.89 2q4s h VAL 36 Cb 0.00 0.92 -0.02 0.00 -2.01 0.00 0.00 31.29 30.18 2q4s h VAL 36 CO -0.04 0.35 0.19 -0.07 -1.01 0.00 0.00 177.57 176.99 2q4s h LEU 37 N 0.73 0.54 -1.50 3.16 3.38 -1.34 -1.98 115.31 118.30 2q4s h LEU 37 Ca 0.15 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 2q4s h LEU 37 Cb 0.45 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 2q4s h LEU 37 CO 0.02 0.53 0.11 -0.08 0.09 0.00 0.00 178.44 179.10 2q4s h GLU 38 N 0.51 0.44 0.00 1.13 4.81 -1.19 -2.87 114.58 117.41 2q4s h GLU 38 Ca 0.14 -0.05 -0.08 0.00 -0.13 0.00 0.00 59.36 59.23 2q4s h GLU 38 Cb 0.14 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 2q4s h GLU 38 CO -0.02 0.38 -0.39 0.00 -0.73 0.00 0.00 179.01 178.25 2q4s h ALA 39 N 1.69 1.11 -2.40 2.92 0.00 -0.67 -3.43 119.26 118.48 2q4s h ALA 39 Ca 0.11 -0.36 -0.54 0.00 0.00 0.00 0.00 54.91 54.12 2q4s h ALA 39 Cb 0.12 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2q4s h ALA 39 CO -0.01 0.49 0.87 -0.47 0.00 0.00 0.00 179.25 180.13 2q4s s TYR 40 N -3.81 2.75 -0.32 0.00 5.04 -1.01 -4.48 117.35 115.53 2q4s s TYR 40 Ca -0.01 0.69 -0.23 0.00 -2.44 0.00 0.00 57.07 55.08 2q4s s TYR 40 Cb 0.12 -3.74 0.00 0.00 0.35 0.00 0.00 41.96 38.69 2q4s s TYR 40 CO 0.70 -2.82 0.77 -1.21 -1.34 0.00 0.00 175.55 171.65 2q4s s GLU 41 N 2.43 3.92 -0.01 4.97 2.02 -1.26 -4.98 118.70 125.79 2q4s s GLU 41 Ca 0.66 0.51 -0.37 0.00 0.02 0.00 0.00 54.97 55.79 2q4s s GLU 41 Cb -0.34 -3.74 -0.16 0.00 0.10 0.00 0.00 34.13 29.99 2q4s s GLU 41 CO 0.28 -0.70 1.49 0.45 0.02 0.00 0.00 175.26 176.80 2q4s n SER 42 N 6.21 2.05 -3.93 -0.19 2.88 -1.26 -4.93 113.62 114.46 2q4s n SER 42 Ca 0.03 1.10 -0.30 0.00 -1.33 0.00 0.00 58.87 58.36 2q4s n SER 42 Cb 0.48 -1.21 -0.15 0.00 -0.75 0.00 0.00 64.21 62.58 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 1.49 4.17 0.32 -3.46 3.84 -1.26 -5.02 114.94 115.02 2q4s s ASN 43 Ca 0.88 -1.55 0.10 0.00 0.21 0.00 0.00 52.86 52.50 2q4s s ASN 43 Cb -0.95 -1.26 0.97 0.00 -0.55 0.00 0.00 41.25 39.46 2q4s s ASN 43 CO 0.51 -0.31 1.65 -0.65 -2.79 0.00 0.00 177.10 175.51 2q4s h PRO 44 N 7.88 0.25 0.00 0.43 0.11 -1.92 0.34 132.00 139.08 2q4s h PRO 44 Ca -0.13 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.93 2q4s h PRO 44 Cb 1.04 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.09 2q4s h PRO 44 CO 0.46 0.16 -0.14 0.00 -0.21 0.00 0.00 178.00 178.27 2q4s h ALA 45 N 1.84 1.48 0.00 -0.75 0.00 -2.00 -1.31 119.26 118.52 2q4s h ALA 45 Ca 0.68 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 55.40 2q4s h ALA 45 Cb 1.51 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.27 2q4s h ALA 45 CO -0.65 0.18 -0.28 0.93 0.00 0.00 0.00 179.25 179.43 2q4s h GLU 46 N 0.00 0.00 0.00 0.00 5.08 -1.36 -3.31 114.58 114.99 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 0.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.56 2q4s h GLU 46 CO 0.02 0.28 0.00 -2.67 -1.00 0.00 0.00 179.01 175.64 2q4s n TRP 47 N -3.25 0.00 -0.26 4.33 4.27 -1.04 -4.74 117.44 116.75 2q4s n TRP 47 Ca 0.02 -0.40 0.05 0.00 -3.89 0.00 0.00 57.50 53.28 2q4s n TRP 47 Cb 0.57 -0.04 0.19 0.00 -1.36 0.00 0.00 31.31 30.67 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 1.10 -1.07 -1.67 0.00 -1.34 -0.01 119.26 116.26 2q4s h ALA 48 Ca 0.00 0.11 0.29 0.00 0.00 0.00 0.00 54.91 55.31 2q4s h ALA 48 Cb 0.43 0.07 -0.10 0.00 0.00 0.00 0.00 17.79 18.19 2q4s h ALA 48 CO 0.00 -0.19 0.68 1.25 0.00 0.00 0.00 179.25 180.99 2q4s h LEU 49 N 0.47 0.44 -1.98 0.00 5.85 -1.85 0.24 115.31 118.48 2q4s h LEU 49 Ca 0.42 0.10 0.00 0.00 0.84 0.00 0.00 57.88 59.24 2q4s h LEU 49 Cb 0.63 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.69 2q4s h LEU 49 CO -0.39 0.05 0.00 -1.22 -0.34 0.00 0.00 178.44 176.53 2q4s n TYR 50 N -4.66 0.66 -1.83 1.25 4.01 -0.03 -4.64 117.16 111.92 2q4s n TYR 50 Ca 0.27 -0.33 -0.36 0.00 -0.16 0.00 0.00 57.90 57.32 2q4s n TYR 50 Cb 0.94 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.95 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 1.09 6.77 -2.78 -0.72 0.00 0.84 -4.88 120.51 120.82 2q4s n ALA 51 Ca 0.18 -3.78 -0.35 0.00 0.00 0.00 0.00 53.44 49.49 2q4s n ALA 51 Cb 0.47 -2.65 -0.10 0.00 0.00 0.00 0.00 19.45 17.17 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 -1.07 4.01 0.53 0.00 1.02 -1.26 -5.07 119.74 117.91 2q4s s LYS 52 Ca 0.56 -0.31 0.03 0.00 0.02 0.00 0.00 55.97 56.27 2q4s s LYS 52 Cb 0.23 -3.36 0.02 0.00 -0.52 0.00 0.00 37.83 34.20 2q4s s LYS 52 CO -0.12 0.17 0.21 -0.06 -0.92 0.00 0.00 175.35 174.63 2q4s s PHE 53 N 0.69 1.72 -0.03 3.18 0.08 -1.26 -4.65 117.98 117.70 2q4s s PHE 53 Ca 0.05 -0.91 0.00 0.00 0.12 0.00 0.00 56.93 56.20 2q4s s PHE 53 Cb -0.13 -1.76 0.03 0.00 -0.57 0.00 0.00 43.02 40.59 2q4s s PHE 53 CO 0.01 -0.14 -0.00 0.34 -0.10 0.00 0.00 175.22 175.33 2q4s s ASP 54 N -4.09 0.57 0.47 1.36 2.15 -1.25 -4.99 116.67 110.89 2q4s s ASP 54 Ca 0.19 -0.04 0.15 0.00 0.43 0.00 0.00 52.55 53.29 2q4s s ASP 54 Cb -0.01 -0.25 1.08 0.00 -0.30 0.00 0.00 42.92 43.44 2q4s s ASP 54 CO 0.12 -0.11 2.03 -0.61 -0.17 0.00 0.00 175.17 176.43 2q4s h GLN 55 N 7.36 0.00 0.00 4.34 4.15 -2.00 -3.24 115.11 125.72 2q4s h GLN 55 Ca -0.39 0.00 -0.31 0.00 0.77 0.00 0.00 58.65 58.72 2q4s h GLN 55 Cb 1.13 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.77 2q4s h GLN 55 CO 0.45 0.14 -2.05 0.66 -1.93 0.00 0.00 178.83 176.10 2q4s n TYR 56 N -4.33 0.43 -3.96 3.99 4.01 -1.26 -4.94 117.16 111.11 2q4s n TYR 56 Ca -0.03 0.16 -0.10 0.00 -0.16 0.00 0.00 57.90 57.77 2q4s n TYR 56 Cb 0.21 -1.05 -0.06 0.00 -0.31 0.00 0.00 39.34 38.13 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 -2.61 1.31 0.51 -0.72 1.70 -1.22 -5.00 118.95 112.92 2q4s s ARG 57 Ca -0.07 -1.19 -0.19 0.00 -0.47 0.00 0.00 55.73 53.81 2q4s s ARG 57 Cb 0.07 0.42 -0.07 0.00 -0.57 0.00 0.00 34.95 34.80 2q4s s ARG 57 CO 0.83 -0.51 1.04 1.52 -1.08 0.00 0.00 175.30 177.10 2q4s s TYR 58 N -3.98 3.02 0.21 5.89 -0.85 -1.26 -3.84 117.35 116.53 2q4s s TYR 58 Ca 0.19 1.56 0.09 0.00 -0.52 0.00 0.00 57.07 58.39 2q4s s TYR 58 Cb 0.02 -3.04 -0.04 0.00 0.38 0.00 0.00 41.96 39.28 2q4s s TYR 58 CO 0.03 -0.85 -0.08 0.95 -1.52 0.00 0.00 175.55 174.08 2q4s s THR 59 N -2.12 3.19 -0.19 -3.49 -4.23 -0.89 -4.95 115.64 102.96 2q4s s THR 59 Ca 0.66 -1.79 -0.02 0.00 -1.18 0.00 0.00 61.69 59.36 2q4s s THR 59 Cb -0.16 -2.62 0.00 0.00 1.34 0.00 0.00 72.50 71.06 2q4s s THR 59 CO 0.24 -0.20 -0.11 -0.13 -0.54 0.00 0.00 174.62 173.87 2q4s s ARG 60 N -3.10 3.23 -0.30 3.99 0.52 -1.26 -2.39 118.95 119.63 2q4s s ARG 60 Ca 0.27 -0.71 0.02 0.00 -0.52 0.00 0.00 55.73 54.79 2q4s s ARG 60 Cb -0.08 -2.80 0.09 0.00 0.52 0.00 0.00 34.95 32.68 2q4s s ARG 60 CO 0.16 -0.15 0.03 -0.80 0.02 0.00 0.00 175.30 174.56 2q4s s ASN 61 N 1.27 4.37 0.20 0.23 0.01 -0.53 0.42 114.94 120.92 2q4s s ASN 61 Ca 0.03 -1.76 -0.31 0.00 -0.71 0.00 0.00 52.86 50.11 2q4s s ASN 61 Cb -0.14 -1.34 -0.10 0.00 0.41 0.00 0.00 41.25 40.08 2q4s s ASN 61 CO -0.06 -0.34 1.50 -0.22 -1.51 0.00 0.00 177.10 176.47 2q4s s LEU 62 N 1.20 4.38 -0.18 0.60 2.96 -0.28 -0.46 118.68 126.90 2q4s s LEU 62 Ca 0.05 2.63 -0.05 0.00 -0.22 0.00 0.00 54.13 56.54 2q4s s LEU 62 Cb -0.19 -3.61 -0.09 0.00 0.50 0.00 0.00 46.19 42.81 2q4s s LEU 62 CO -0.12 -0.76 -0.20 0.52 -1.32 0.00 0.00 176.35 174.47 2q4s n VAL 63 N 3.23 0.99 -3.72 1.68 0.31 0.24 -1.30 118.33 119.76 2q4s n VAL 63 Ca 0.11 -0.29 -0.14 0.00 -0.01 0.00 0.00 64.34 64.00 2q4s n VAL 63 Cb 0.39 -1.52 -0.09 0.00 -0.91 0.00 0.00 33.84 31.72 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 -6.28 -0.30 -0.15 4.52 2.15 -0.61 -4.65 116.67 111.34 2q4s s ASP 64 Ca -0.24 0.33 0.17 0.00 0.43 0.00 0.00 52.55 53.23 2q4s s ASP 64 Cb 0.08 0.45 0.72 0.00 -0.30 0.00 0.00 42.92 43.88 2q4s s ASP 64 CO 0.34 -0.40 1.64 0.00 -0.17 0.00 0.00 175.17 176.58 2q4s n GLN 65 N 1.57 4.01 -3.90 4.34 6.02 -1.26 -0.74 117.38 127.41 2q4s n GLN 65 Ca -0.19 -2.95 -0.30 0.00 -0.01 0.00 0.00 57.00 53.55 2q4s n GLN 65 Cb 0.56 -1.99 -0.04 0.00 1.02 0.00 0.00 30.24 29.79 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 0.79 -0.44 3.95 1.08 0.00 -1.06 -0.21 105.19 109.29 2q4s n GLY 66 Ca 0.26 0.07 -0.31 0.00 0.00 0.00 0.00 46.02 46.04 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 -2.27 -4.58 0.00 1.61 4.13 -1.26 -0.59 115.26 112.29 2q4s n ASN 67 Ca 0.07 -0.81 0.00 0.00 1.68 0.00 0.00 54.58 55.52 2q4s n ASN 67 Cb 0.48 -3.76 0.00 0.00 -1.54 0.00 0.00 39.78 34.96 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 -1.66 1.93 0.08 7.41 0.00 0.71 -4.87 105.19 108.79 2q4s n GLY 68 Ca 0.04 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 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 2.32 0.00 -3.38 1.61 1.79 -0.94 -3.42 116.57 114.55 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 0.56 -0.04 -0.59 -1.08 0.00 0.00 179.45 178.31 2q4s s PHE 70 N -2.73 -0.13 -0.19 -1.35 -0.12 -1.25 -4.18 117.98 108.03 2q4s s PHE 70 Ca -0.02 -0.20 -0.04 0.00 -0.05 0.00 0.00 56.93 56.62 2q4s s PHE 70 Cb 0.09 0.30 -0.02 0.00 -0.63 0.00 0.00 43.02 42.76 2q4s s PHE 70 CO 0.81 -0.80 -0.02 -0.80 -0.05 0.00 0.00 175.22 174.36 2q4s s ASN 71 N -2.85 4.76 -0.01 1.98 0.01 0.36 -2.56 114.94 116.64 2q4s s ASN 71 Ca 0.07 -0.20 0.07 0.00 -0.71 0.00 0.00 52.86 52.09 2q4s s ASN 71 Cb 0.01 -1.80 -0.02 0.00 0.41 0.00 0.00 41.25 39.84 2q4s s ASN 71 CO -0.07 0.09 -0.22 -0.22 -1.51 0.00 0.00 177.10 175.17 2q4s s LEU 72 N 0.85 2.33 -0.16 0.60 2.96 0.08 0.89 118.68 126.23 2q4s s LEU 72 Ca 0.00 -0.41 -0.07 0.00 -0.22 0.00 0.00 54.13 53.44 2q4s s LEU 72 Cb -0.14 -1.42 0.07 0.00 0.50 0.00 0.00 46.19 45.20 2q4s s LEU 72 CO 0.02 0.31 0.35 -0.63 -1.32 0.00 0.00 176.35 175.08 2q4s s ILE 74 N -0.72 -0.39 -0.13 6.68 1.01 0.39 0.83 121.20 128.87 2q4s s ILE 74 Ca 0.11 0.19 -0.07 0.00 0.00 0.00 0.00 60.65 60.88 2q4s s ILE 74 Cb -0.10 -0.56 -0.04 0.00 0.01 0.00 0.00 42.46 41.77 2q4s s ILE 74 CO 0.01 0.08 0.11 -0.76 0.00 0.00 0.00 174.94 174.37 2q4s s LEU 75 N 2.16 4.17 -0.20 2.97 1.02 0.90 -1.45 118.68 128.25 2q4s s LEU 75 Ca -0.03 0.34 0.00 0.00 0.02 0.00 0.00 54.13 54.46 2q4s s LEU 75 Cb -0.11 -2.02 0.02 0.00 0.02 0.00 0.00 46.19 44.10 2q4s s LEU 75 CO -0.11 0.35 -0.15 0.00 0.02 0.00 0.00 176.35 176.46 2q4s s TRP 77 N 1.30 3.31 1.13 0.00 0.52 0.80 -2.09 118.94 123.91 2q4s s TRP 77 Ca 0.03 -1.87 -0.12 0.00 0.02 0.00 0.00 56.10 54.15 2q4s s TRP 77 Cb -0.14 -2.31 0.26 0.00 -1.15 0.00 0.00 33.47 30.13 2q4s s TRP 77 CO -0.10 -0.81 1.04 0.20 0.02 0.00 0.00 176.95 177.30 2q4s s GLY 78 N 1.36 1.56 0.37 0.98 0.00 -1.26 0.26 107.32 110.59 2q4s s GLY 78 Ca -0.03 -0.10 -0.27 0.00 0.00 0.00 0.00 44.72 44.33 2q4s s GLY 78 CO -0.01 0.58 1.23 1.18 0.00 0.00 0.00 173.10 176.08 2q4s n GLU 79 N -4.78 1.91 0.00 2.90 4.71 -1.26 -0.76 120.64 123.36 2q4s n GLU 79 Ca 0.04 0.67 0.00 0.00 -0.01 0.00 0.00 57.16 57.86 2q4s n GLU 79 Cb 0.54 -2.27 0.00 0.00 -1.01 0.00 0.00 31.44 28.70 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 0.87 2.59 3.79 0.62 0.00 -0.06 -4.98 105.19 108.02 2q4s n GLY 80 Ca 0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.11 3.05 0.08 1.61 3.76 0.06 -4.73 115.29 117.01 2q4s s HIS 81 Ca 0.00 1.59 -0.06 0.00 -0.15 0.00 0.00 55.06 56.44 2q4s s HIS 81 Cb 0.00 -3.09 0.02 0.00 1.11 0.00 0.00 32.58 30.62 2q4s s HIS 81 CO 0.00 -0.81 0.27 0.41 -0.85 0.00 0.00 174.74 173.76 2q4s n GLY 82 N -0.10 1.34 3.16 -2.22 0.00 -1.26 0.18 105.19 106.29 2q4s n GLY 82 Ca 0.08 -1.03 -0.28 0.00 0.00 0.00 0.00 46.02 44.80 2q4s n GLY 82 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2q4s n SER 83 N -0.94 2.87 -4.95 1.61 2.88 -0.44 -4.71 113.62 109.94 2q4s n SER 83 Ca -0.01 -2.95 -0.24 0.00 -1.33 0.00 0.00 58.87 54.34 2q4s n SER 83 Cb 0.17 0.42 0.05 0.00 -0.75 0.00 0.00 64.21 64.11 2q4s n SER 83 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2q4s s SER 84 N -3.41 5.05 0.31 -3.46 1.04 -1.26 -4.62 113.70 107.33 2q4s s SER 84 Ca 0.03 0.26 -0.29 0.00 0.48 0.00 0.00 55.95 56.44 2q4s s SER 84 Cb 0.00 -1.03 -0.10 0.00 0.10 0.00 0.00 66.02 64.99 2q4s s SER 84 CO 0.02 -1.38 1.18 -0.63 0.98 0.00 0.00 173.24 173.42 2q4s s ILE 85 N -3.02 3.16 0.23 -1.02 1.01 -1.26 -4.52 121.20 115.79 2q4s s ILE 85 Ca 0.59 1.16 -0.14 0.00 0.00 0.00 0.00 60.65 62.26 2q4s s ILE 85 Cb -0.11 -3.74 0.00 0.00 0.01 0.00 0.00 42.46 38.63 2q4s s ILE 85 CO 0.42 0.27 0.48 -1.38 0.00 0.00 0.00 174.94 174.73 2q4s s HIS 86 N -1.17 0.27 0.53 3.97 -3.43 0.51 -0.92 115.29 115.04 2q4s s HIS 86 Ca 0.47 -0.63 0.06 0.00 -0.80 0.00 0.00 55.06 54.15 2q4s s HIS 86 Cb -0.35 0.23 0.06 0.00 -1.43 0.00 0.00 32.58 31.09 2q4s s HIS 86 CO 0.46 -0.98 0.48 -0.40 -2.00 0.00 0.00 174.74 172.30 2q4s n ASP 87 N -0.37 2.50 -0.28 7.38 5.75 -1.19 -2.41 116.55 127.94 2q4s n ASP 87 Ca -0.03 -2.71 0.06 0.00 -0.01 0.00 0.00 54.79 52.10 2q4s n ASP 87 Cb 0.62 -0.13 0.09 0.00 -1.03 0.00 0.00 41.12 40.68 2q4s n ASP 87 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 2q4s n HIS 88 N -1.83 0.00 -3.60 2.11 8.25 -1.26 -4.64 115.22 114.24 2q4s n HIS 88 Ca 0.02 -0.67 -0.20 0.00 -0.26 0.00 0.00 57.72 56.61 2q4s n HIS 88 Cb 0.59 -0.12 0.06 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 -0.89 -4.89 -3.20 1.59 -1.04 -1.26 -2.36 114.28 102.23 2q4s n THR 89 Ca 0.11 -0.46 -0.23 0.00 -2.04 0.00 0.00 64.05 61.43 2q4s n THR 89 Cb 0.68 -4.22 0.04 0.00 -1.82 0.00 0.00 70.33 65.01 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 -3.07 -5.79 -4.30 8.00 8.00 -1.26 -4.98 116.55 113.15 2q4s n ASP 90 Ca -0.27 -0.36 -0.18 0.00 0.71 0.00 0.00 54.79 54.69 2q4s n ASP 90 Cb 0.66 -4.66 -0.11 0.00 -0.02 0.00 0.00 41.12 37.00 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 -2.83 2.32 0.28 -2.24 0.01 -0.99 -4.70 113.70 105.55 2q4s s SER 91 Ca 0.38 -0.93 -0.29 0.00 1.31 0.00 0.00 55.95 56.42 2q4s s SER 91 Cb -0.17 -0.10 -0.09 0.00 0.21 0.00 0.00 66.02 65.86 2q4s s SER 91 CO 0.47 -0.16 1.04 -1.00 0.41 0.00 0.00 173.24 174.00 2q4s s HIS 92 N -2.61 3.69 -0.08 2.43 3.76 -0.55 -4.51 115.29 117.42 2q4s s HIS 92 Ca 0.17 1.77 0.01 0.00 -0.15 0.00 0.00 55.06 56.85 2q4s s HIS 92 Cb -0.02 -3.17 0.02 0.00 1.11 0.00 0.00 32.58 30.52 2q4s s HIS 92 CO 0.05 -0.21 -0.08 0.00 -0.85 0.00 0.00 174.74 173.65 2q4s s PHE 94 N 1.28 2.42 -0.14 0.00 0.08 -1.08 -1.25 117.98 119.29 2q4s s PHE 94 Ca -0.04 -0.78 -0.00 0.00 0.12 0.00 0.00 56.93 56.23 2q4s s PHE 94 Cb -0.14 -1.59 0.03 0.00 -0.57 0.00 0.00 43.02 40.75 2q4s s PHE 94 CO -0.03 -0.26 -0.09 -1.17 -0.10 0.00 0.00 175.22 173.58 2q4s s LEU 95 N -0.04 1.48 -0.10 -0.37 0.20 -0.05 -1.83 118.68 117.98 2q4s s LEU 95 Ca -0.07 -0.48 0.02 0.00 0.69 0.00 0.00 54.13 54.29 2q4s s LEU 95 Cb -0.15 -0.96 -0.02 0.00 -0.43 0.00 0.00 46.19 44.64 2q4s s LEU 95 CO 0.05 -0.12 -0.15 -0.75 -0.29 0.00 0.00 176.35 175.09 2q4s s LYS 96 N 1.62 3.03 -0.10 1.98 2.20 0.17 0.48 119.74 129.12 2q4s s LYS 96 Ca 0.03 -0.71 -0.28 0.00 -0.36 0.00 0.00 55.97 54.65 2q4s s LYS 96 Cb -0.14 -2.51 -0.02 0.00 -1.51 0.00 0.00 37.83 33.66 2q4s s LYS 96 CO -0.09 0.36 0.95 -0.51 -0.36 0.00 0.00 175.35 175.70 2q4s s LEU 97 N -0.04 4.26 -0.17 5.43 2.01 -0.55 0.28 118.68 129.89 2q4s s LEU 97 Ca -0.03 1.46 0.18 0.00 0.01 0.00 0.00 54.13 55.74 2q4s s LEU 97 Cb -0.14 -3.46 -0.25 0.00 0.01 0.00 0.00 46.19 42.34 2q4s s LEU 97 CO 0.04 -0.39 0.11 0.18 1.01 0.00 0.00 176.35 177.31 2q4s n LEU 98 N 4.80 0.00 -3.64 1.79 4.77 0.78 -0.86 117.00 124.65 2q4s n LEU 98 Ca 0.07 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.95 2q4s n LEU 98 Cb 0.49 0.42 -0.07 0.00 -2.33 0.00 0.00 43.42 41.94 2q4s n LEU 98 CO 0.51 0.42 0.71 -1.58 -1.33 0.00 0.00 177.39 176.12 2q4s s GLN 99 N -2.59 0.54 1.36 3.23 0.74 -0.55 -4.86 119.66 117.54 2q4s s GLN 99 Ca -0.09 0.62 0.00 0.00 0.05 0.00 0.00 55.36 55.94 2q4s s GLN 99 Cb 0.07 0.26 0.00 0.00 1.10 0.00 0.00 33.01 34.44 2q4s s GLN 99 CO 0.81 -0.07 0.00 0.41 -0.55 0.00 0.00 175.29 175.89 2q4s n GLY 100 N 2.22 -1.66 2.84 2.59 0.00 -1.26 0.27 105.19 110.19 2q4s n GLY 100 Ca -0.13 -1.52 -0.15 0.00 0.00 0.00 0.00 46.02 44.23 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 0.21 -0.00 1.61 0.01 -1.26 -3.82 114.94 107.69 2q4s s ASN 101 Ca 0.00 -0.01 0.08 0.00 -0.71 0.00 0.00 52.86 52.22 2q4s s ASN 101 Cb 0.00 -0.08 -0.02 0.00 0.41 0.00 0.00 41.25 41.55 2q4s s ASN 101 CO 0.00 -0.05 -0.25 -0.76 -1.51 0.00 0.00 177.10 174.53 2q4s s LEU 102 N 0.52 2.14 -0.30 0.60 1.43 -1.13 -4.24 118.68 117.70 2q4s s LEU 102 Ca -0.05 -0.48 -0.12 0.00 -1.03 0.00 0.00 54.13 52.46 2q4s s LEU 102 Cb -0.07 -1.35 -0.04 0.00 0.03 0.00 0.00 46.19 44.77 2q4s s LEU 102 CO -0.01 0.30 0.20 -0.75 0.23 0.00 0.00 176.35 176.33 2q4s s LYS 103 N -0.80 3.77 -0.22 1.70 2.20 0.37 -1.33 119.74 125.43 2q4s s LYS 103 Ca 0.11 -0.45 -0.11 0.00 -0.36 0.00 0.00 55.97 55.16 2q4s s LYS 103 Cb -0.10 -3.70 -0.05 0.00 -1.51 0.00 0.00 37.83 32.47 2q4s s LYS 103 CO 0.00 -0.28 0.19 -2.00 -0.36 0.00 0.00 175.35 172.90 2q4s s GLU 104 N 1.74 4.14 -0.14 4.03 2.12 0.12 -2.08 118.70 128.62 2q4s s GLU 104 Ca 0.07 -0.17 -0.01 0.00 0.36 0.00 0.00 54.97 55.21 2q4s s GLU 104 Cb -0.16 -3.49 -0.02 0.00 0.26 0.00 0.00 34.13 30.72 2q4s s GLU 104 CO 0.11 0.14 -0.11 0.99 -0.54 0.00 0.00 175.26 175.85 2q4s s THR 105 N 0.81 3.21 -0.04 -1.70 2.01 -0.60 -0.21 115.64 119.13 2q4s s THR 105 Ca 0.10 -0.60 -0.01 0.00 0.31 0.00 0.00 61.69 61.49 2q4s s THR 105 Cb -0.13 -2.37 -0.04 0.00 0.01 0.00 0.00 72.50 69.98 2q4s s THR 105 CO 0.03 0.51 0.04 -0.76 -0.69 0.00 0.00 174.62 173.75 2q4s s LEU 106 N 0.41 3.75 0.07 4.42 1.43 0.12 -1.66 118.68 127.22 2q4s s LEU 106 Ca -0.09 0.13 0.03 0.00 -1.03 0.00 0.00 54.13 53.17 2q4s s LEU 106 Cb -0.15 -2.06 -0.03 0.00 0.03 0.00 0.00 46.19 43.97 2q4s s LEU 106 CO 0.05 0.32 -0.08 -0.36 0.23 0.00 0.00 176.35 176.50 2q4s s PHE 107 N -1.07 0.84 0.49 0.29 0.08 -0.97 0.80 117.98 118.43 2q4s s PHE 107 Ca 0.19 -0.64 -0.01 0.00 0.12 0.00 0.00 56.93 56.58 2q4s s PHE 107 Cb -0.12 -0.48 0.00 0.00 -0.57 0.00 0.00 43.02 41.85 2q4s s PHE 107 CO 0.09 -0.08 0.73 -0.51 -0.10 0.00 0.00 175.22 175.35 2q4s s ASP 108 N -2.16 5.76 0.44 1.36 1.01 -1.26 -1.24 116.67 120.58 2q4s s ASP 108 Ca -0.01 0.36 -0.26 0.00 0.71 0.00 0.00 52.55 53.36 2q4s s ASP 108 Cb -0.04 -1.54 -0.09 0.00 1.01 0.00 0.00 42.92 42.26 2q4s s ASP 108 CO -0.01 -0.80 1.44 0.26 0.21 0.00 0.00 175.17 176.26 2q4s s TRP 109 N -2.66 2.47 0.29 4.23 0.52 -1.26 -4.73 118.94 117.79 2q4s s TRP 109 Ca 0.50 1.25 -0.24 0.00 0.02 0.00 0.00 56.10 57.63 2q4s s TRP 109 Cb -0.10 -3.94 -0.09 0.00 -1.15 0.00 0.00 33.47 28.19 2q4s s TRP 109 CO 0.39 -2.96 0.86 -2.14 0.02 0.00 0.00 176.95 173.13 2q4s s PRO 110 N -2.41 4.46 1.07 4.98 0.02 -1.26 -5.08 135.00 136.78 2q4s s PRO 110 Ca 0.60 1.15 -0.17 0.00 0.02 0.00 0.00 61.00 62.60 2q4s s PRO 110 Cb -0.44 -2.82 0.24 0.00 0.02 0.00 0.00 34.50 31.49 2q4s s PRO 110 CO 0.57 0.32 1.21 -0.51 -0.33 0.00 0.00 177.00 178.26 2q4s s ASP 111 N -1.63 2.09 0.30 2.53 1.01 -1.26 -4.97 116.67 114.74 2q4s s ASP 111 Ca 0.48 0.47 0.11 0.00 0.71 0.00 0.00 52.55 54.32 2q4s s ASP 111 Cb -0.18 -0.63 0.45 0.00 1.01 0.00 0.00 42.92 43.57 2q4s s ASP 111 CO 0.23 -3.39 1.67 0.11 0.21 0.00 0.00 175.17 173.99 2q4s h LYS 112 N -2.08 0.00 -6.71 8.23 1.79 -1.98 -3.44 116.57 112.39 2q4s h LYS 112 Ca -0.45 0.00 -0.52 0.00 -2.18 0.00 0.00 60.65 57.51 2q4s h LYS 112 Cb 1.27 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 31.94 2q4s h LYS 112 CO 0.37 0.56 0.53 0.15 -1.08 0.00 0.00 179.45 179.98 2q4s s LYS 113 N -3.75 4.53 0.02 3.15 -0.14 -1.26 -4.96 119.74 117.33 2q4s s LYS 113 Ca -0.02 1.85 -0.30 0.00 -1.36 0.00 0.00 55.97 56.14 2q4s s LYS 113 Cb 0.13 -3.22 -0.06 0.00 -1.68 0.00 0.00 37.83 32.99 2q4s s LYS 113 CO 0.75 0.00 1.50 0.45 -0.76 0.00 0.00 175.35 177.29 2q4s s SER 114 N -0.18 6.76 0.11 2.83 0.15 -1.26 -4.95 113.70 117.16 2q4s s SER 114 Ca 0.50 2.24 -0.22 0.00 0.70 0.00 0.00 55.95 59.18 2q4s s SER 114 Cb -0.32 -2.56 0.06 0.00 -1.71 0.00 0.00 66.02 61.48 2q4s s SER 114 CO 0.38 -0.79 0.54 0.20 1.20 0.00 0.00 173.24 174.77 2q4s s ASN 115 N 2.13 -0.46 0.00 5.45 0.01 -0.43 -5.01 114.94 116.63 2q4s s ASN 115 Ca 0.68 -0.00 0.00 0.00 -0.71 0.00 0.00 52.86 52.82 2q4s s ASN 115 Cb -0.34 0.54 0.00 0.00 0.41 0.00 0.00 41.25 41.86 2q4s s ASN 115 CO 0.28 -0.86 0.00 1.21 -1.51 0.00 0.00 177.10 176.22 2q4s n GLU 116 N -0.09 3.28 -3.64 -0.60 4.07 -0.90 -3.32 120.64 119.44 2q4s n GLU 116 Ca -0.17 0.00 -0.07 0.00 -0.06 0.00 0.00 57.16 56.86 2q4s n GLU 116 Cb 0.63 0.00 -0.07 0.00 -0.06 0.00 0.00 31.44 31.94 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 0.16 6.31 -1.09 -1.26 -4.95 121.20 120.38 2q4s s ILE 118 Ca 0.00 0.00 -0.34 0.00 -2.23 0.00 0.00 60.65 58.08 2q4s s ILE 118 Cb 0.00 -1.00 -0.14 0.00 -1.58 0.00 0.00 42.46 39.74 2q4s s ILE 118 CO 0.00 0.00 1.50 2.29 -1.23 0.00 0.00 174.94 177.50 2q4s n LYS 119 N 3.66 1.95 0.17 2.79 2.85 -1.26 -4.81 118.16 123.51 2q4s n LYS 119 Ca -0.18 0.70 0.05 0.00 -1.05 0.00 0.00 58.31 57.83 2q4s n LYS 119 Cb 0.58 -2.43 0.17 0.00 -0.65 0.00 0.00 35.03 32.70 2q4s n LYS 119 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 177.40 178.92 2q4s h LYS 120 N 5.35 0.00 0.00 -1.58 2.10 0.02 -3.48 116.57 118.98 2q4s h LYS 120 Ca -0.45 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.20 2q4s h LYS 120 Cb 1.27 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.60 2q4s h LYS 120 CO 0.84 0.40 0.00 -1.13 -2.00 0.00 0.00 179.45 177.56 2q4s n SER 121 N -3.29 0.00 -3.73 7.07 3.41 -1.02 -5.00 113.62 111.06 2q4s n SER 121 Ca 0.01 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.49 2q4s n SER 121 Cb 0.63 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.49 2q4s n SER 121 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 2q4s s GLU 122 N -2.00 0.57 0.04 4.33 -1.05 -1.26 0.14 118.70 119.47 2q4s s GLU 122 Ca 0.00 0.26 -0.01 0.00 -0.15 0.00 0.00 54.97 55.07 2q4s s GLU 122 Cb 0.00 0.27 -0.03 0.00 -0.44 0.00 0.00 34.13 33.92 2q4s s GLU 122 CO 0.00 -0.12 -0.03 -0.98 0.95 0.00 0.00 175.26 175.08 2q4s s ARG 123 N -0.44 0.51 -0.38 -4.83 1.70 0.71 -5.00 118.95 111.23 2q4s s ARG 123 Ca -0.06 -1.02 -0.17 0.00 -0.47 0.00 0.00 55.73 54.02 2q4s s ARG 123 Cb -0.04 0.18 0.00 0.00 -0.57 0.00 0.00 34.95 34.53 2q4s s ARG 123 CO 0.02 -0.09 0.45 0.99 -1.08 0.00 0.00 175.30 175.59 2q4s s THR 124 N -3.11 5.08 -0.29 4.99 2.01 -1.26 -0.71 115.64 122.35 2q4s s THR 124 Ca -0.01 0.00 -0.23 0.00 0.31 0.00 0.00 61.69 61.76 2q4s s THR 124 Cb 0.02 -3.96 -0.00 0.00 0.01 0.00 0.00 72.50 68.57 2q4s s THR 124 CO -0.07 -0.27 0.77 -0.76 -0.69 0.00 0.00 174.62 173.60 2q4s s LEU 125 N 2.21 4.09 0.33 4.42 1.43 -0.44 -4.98 118.68 125.74 2q4s s LEU 125 Ca 0.14 0.71 0.07 0.00 -1.03 0.00 0.00 54.13 54.02 2q4s s LEU 125 Cb -0.16 -3.05 -0.01 0.00 0.03 0.00 0.00 46.19 42.99 2q4s s LEU 125 CO 0.13 -0.56 0.44 -0.13 0.23 0.00 0.00 176.35 176.46 2q4s s ARG 126 N 2.87 3.07 -0.04 1.70 0.52 -1.26 -2.86 118.95 122.94 2q4s s ARG 126 Ca 0.32 -1.04 -0.37 0.00 -0.52 0.00 0.00 55.73 54.11 2q4s s ARG 126 Cb -0.14 -2.77 -0.15 0.00 0.52 0.00 0.00 34.95 32.40 2q4s s ARG 126 CO 0.11 0.09 1.59 0.39 0.02 0.00 0.00 175.30 177.50 2q4s n GLU 127 N -1.59 1.49 0.00 3.54 1.02 -1.25 -1.98 120.64 121.87 2q4s n GLU 127 Ca -0.01 0.54 0.00 0.00 -0.02 0.00 0.00 57.16 57.67 2q4s n GLU 127 Cb 0.58 -2.25 0.00 0.00 -0.02 0.00 0.00 31.44 29.75 2q4s n GLU 127 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2q4s n ASN 128 N 4.23 0.00 -4.76 1.62 2.85 -0.04 -4.97 115.26 114.19 2q4s n ASN 128 Ca 0.21 0.00 -0.30 0.00 -0.11 0.00 0.00 54.58 54.38 2q4s n ASN 128 Cb 0.20 0.00 0.11 0.00 1.24 0.00 0.00 39.78 41.33 2q4s n ASN 128 CO 0.00 0.00 0.00 -1.58 -2.11 0.00 0.00 177.26 173.57 2q4s s GLN 129 N -0.14 1.91 -0.46 1.20 0.74 -0.84 -4.60 119.66 117.46 2q4s s GLN 129 Ca 0.00 0.93 0.03 0.00 0.05 0.00 0.00 55.36 56.38 2q4s s GLN 129 Cb 0.00 -1.87 0.13 0.00 1.10 0.00 0.00 33.01 32.36 2q4s s GLN 129 CO 0.00 -1.82 0.22 0.00 -0.55 0.00 0.00 175.29 173.13 2q4s s ALA 131 N 0.15 1.40 -0.12 0.00 0.00 0.18 -4.76 121.76 118.61 2q4s s ALA 131 Ca 0.16 -0.11 -0.11 0.00 0.00 0.00 0.00 51.96 51.90 2q4s s ALA 131 Cb -0.24 -3.18 0.03 0.00 0.00 0.00 0.00 23.12 19.73 2q4s s ALA 131 CO -0.02 -2.47 0.33 -0.47 0.00 0.00 0.00 175.76 173.12 2q4s s TYR 132 N -2.93 -0.36 0.07 0.00 6.14 -1.26 -0.87 117.35 118.14 2q4s s TYR 132 Ca 0.64 0.88 -0.11 0.00 0.64 0.00 0.00 57.07 59.12 2q4s s TYR 132 Cb -0.18 0.12 0.01 0.00 0.42 0.00 0.00 41.96 42.33 2q4s s TYR 132 CO 0.57 -0.18 0.25 -1.50 0.64 0.00 0.00 175.55 175.34 2q4s s ILE 133 N 0.21 0.11 0.23 3.14 2.07 -0.38 -5.03 121.20 121.55 2q4s s ILE 133 Ca -0.00 -0.89 -0.10 0.00 -1.41 0.00 0.00 60.65 58.25 2q4s s ILE 133 Cb -0.02 -1.10 -0.01 0.00 0.13 0.00 0.00 42.46 41.45 2q4s s ILE 133 CO 0.00 -0.49 0.38 0.54 -1.91 0.00 0.00 174.94 173.46 2q4s s ASN 134 N -2.44 -0.03 0.61 4.50 2.20 -1.26 -1.72 114.94 116.79 2q4s s ASN 134 Ca -0.00 -1.03 0.35 0.00 -0.94 0.00 0.00 52.86 51.24 2q4s s ASN 134 Cb 0.01 0.53 1.96 0.00 -2.00 0.00 0.00 41.25 41.75 2q4s s ASN 134 CO -0.07 -1.05 2.25 0.44 -2.94 0.00 0.00 177.10 175.73 2q4s h ASP 135 N 2.36 0.00 -0.44 3.54 3.32 -1.79 -1.98 116.42 121.42 2q4s h ASP 135 Ca -0.29 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.74 2q4s h ASP 135 Cb 1.25 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.78 2q4s h ASP 135 CO 0.40 0.02 0.21 -1.28 -1.72 0.00 0.00 179.24 176.87 2q4s h SER 136 N 0.00 0.59 -0.55 6.45 0.87 -1.96 -2.96 113.55 115.99 2q4s h SER 136 Ca -0.00 -0.14 -0.10 0.00 -1.23 0.00 0.00 61.79 60.33 2q4s h SER 136 Cb 0.09 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 61.88 2q4s h SER 136 CO 0.00 0.56 -0.03 0.40 -0.53 0.00 0.00 176.83 177.24 2q4s h ILE 137 N 0.57 1.26 0.00 2.23 2.04 -1.77 -3.50 117.51 118.35 2q4s h ILE 137 Ca 0.15 -1.16 0.00 0.00 1.00 0.00 0.00 64.86 64.85 2q4s h ILE 137 Cb 0.14 0.85 0.00 0.00 -0.74 0.00 0.00 36.82 37.07 2q4s h ILE 137 CO -0.02 0.42 0.00 0.61 0.00 0.00 0.00 178.15 179.16 2q4s n GLY 138 N -0.43 0.60 3.69 5.37 0.00 -1.10 -4.88 105.19 108.45 2q4s n GLY 138 Ca 0.03 -1.45 -0.27 0.00 0.00 0.00 0.00 46.02 44.32 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 2.87 0.13 0.99 1.43 -0.37 -4.35 118.68 119.38 2q4s s LEU 139 Ca 0.00 -1.30 -0.24 0.00 -1.03 0.00 0.00 54.13 51.56 2q4s s LEU 139 Cb 0.00 -1.07 0.07 0.00 0.03 0.00 0.00 46.19 45.21 2q4s s LEU 139 CO 0.00 -0.57 0.60 -1.38 0.23 0.00 0.00 176.35 175.24 2q4s s HIS 140 N -2.70 -0.55 0.02 0.29 -3.43 -1.01 -2.30 115.29 105.60 2q4s s HIS 140 Ca 0.33 0.42 0.07 0.00 -0.80 0.00 0.00 55.06 55.09 2q4s s HIS 140 Cb 0.06 0.53 -0.03 0.00 -1.43 0.00 0.00 32.58 31.72 2q4s s HIS 140 CO 0.18 -0.81 -0.22 0.50 -2.00 0.00 0.00 174.74 172.38 2q4s s ARG 141 N -3.41 2.06 -0.08 -0.38 3.52 -0.66 -0.37 118.95 119.63 2q4s s ARG 141 Ca -0.01 -0.97 0.03 0.00 -0.13 0.00 0.00 55.73 54.65 2q4s s ARG 141 Cb -0.01 -2.12 0.01 0.00 -1.56 0.00 0.00 34.95 31.27 2q4s s ARG 141 CO -0.10 0.55 -0.16 0.08 -0.81 0.00 0.00 175.30 174.86 2q4s s VAL 142 N -0.79 1.44 -0.07 7.11 1.01 -1.26 -1.55 120.40 126.28 2q4s s VAL 142 Ca 0.12 -0.65 -0.08 0.00 0.00 0.00 0.00 61.98 61.37 2q4s s VAL 142 Cb -0.10 -1.29 0.02 0.00 0.00 0.00 0.00 36.38 35.01 2q4s s VAL 142 CO 0.02 0.42 0.22 -1.83 0.00 0.00 0.00 175.10 173.93 2q4s s GLU 143 N 0.60 0.28 -0.59 2.72 -1.05 -0.89 -1.33 118.70 118.45 2q4s s GLU 143 Ca -0.15 0.25 -0.24 0.00 -0.15 0.00 0.00 54.97 54.68 2q4s s GLU 143 Cb -0.16 0.13 0.05 0.00 -0.44 0.00 0.00 34.13 33.71 2q4s s GLU 143 CO 0.05 -0.04 0.95 1.21 0.95 0.00 0.00 175.26 178.38 2q4s s ASN 144 N -0.01 6.28 0.00 0.83 2.47 0.48 -0.48 114.94 124.51 2q4s s ASN 144 Ca -0.01 -0.55 0.31 0.00 0.42 0.00 0.00 52.86 53.02 2q4s s ASN 144 Cb -0.02 -2.43 1.82 0.00 -1.45 0.00 0.00 41.25 39.17 2q4s s ASN 144 CO 0.00 -1.30 2.17 1.33 -3.72 0.00 0.00 177.10 175.59 2q4s n VAL 145 N 6.11 0.00 -2.06 -5.21 0.24 -1.26 -2.19 118.33 113.96 2q4s n VAL 145 Ca -0.00 -0.00 -0.38 0.00 -2.04 0.00 0.00 64.34 61.92 2q4s n VAL 145 Cb 0.47 -0.48 0.01 0.00 -1.47 0.00 0.00 33.84 32.37 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 -1.95 5.86 -0.01 -1.34 0.15 -1.26 -4.66 113.70 110.49 2q4s s SER 146 Ca 0.46 2.52 0.22 0.00 0.70 0.00 0.00 55.95 59.84 2q4s s SER 146 Cb 0.21 -2.62 -0.24 0.00 -1.71 0.00 0.00 66.02 61.66 2q4s s SER 146 CO 0.35 -1.14 0.74 1.41 1.20 0.00 0.00 173.24 175.80 2q4s n HIS 147 N -0.60 0.03 -0.76 3.44 8.25 -1.26 -0.88 115.22 123.43 2q4s n HIS 147 Ca 0.08 0.01 0.00 0.00 -0.26 0.00 0.00 57.72 57.55 2q4s n HIS 147 Cb 0.46 -0.26 0.00 0.00 1.12 0.00 0.00 29.99 31.31 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 -1.87 0.00 -3.95 1.59 -2.24 -1.26 -4.92 114.28 101.63 2q4s n THR 148 Ca 0.00 -0.08 -0.31 0.00 -2.27 0.00 0.00 64.05 61.40 2q4s n THR 148 Cb 0.44 1.76 -0.15 0.00 -2.10 0.00 0.00 70.33 70.28 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 -0.01 1.60 0.53 -0.78 0.41 -1.26 -5.00 118.70 114.18 2q4s s GLU 149 Ca 0.00 -1.18 -0.21 0.00 -0.41 0.00 0.00 54.97 53.17 2q4s s GLU 149 Cb 0.00 -2.67 -0.05 0.00 -1.78 0.00 0.00 34.13 29.63 2q4s s GLU 149 CO 0.00 -0.68 1.22 -1.25 -0.49 0.00 0.00 175.26 174.05 2q4s s PRO 150 N 1.30 3.30 0.19 0.39 0.04 -1.26 -4.43 135.00 134.54 2q4s s PRO 150 Ca -0.02 1.87 0.08 0.00 0.04 0.00 0.00 61.00 62.97 2q4s s PRO 150 Cb -0.19 -2.16 -0.04 0.00 0.04 0.00 0.00 34.50 32.15 2q4s s PRO 150 CO -0.08 -0.95 -0.02 0.00 0.04 0.00 0.00 177.00 175.99 2q4s s ALA 151 N -1.54 3.14 -0.03 8.56 0.00 0.14 -4.34 121.76 127.68 2q4s s ALA 151 Ca 0.71 -1.45 0.01 0.00 0.00 0.00 0.00 51.96 51.23 2q4s s ALA 151 Cb -0.31 -0.89 0.02 0.00 0.00 0.00 0.00 23.12 21.94 2q4s s ALA 151 CO 0.36 0.43 -0.02 0.08 0.00 0.00 0.00 175.76 176.61 2q4s s VAL 152 N -1.85 0.30 0.03 0.00 1.01 0.14 -0.14 120.40 119.90 2q4s s VAL 152 Ca 0.28 0.01 0.03 0.00 0.00 0.00 0.00 61.98 62.30 2q4s s VAL 152 Cb -0.09 -0.37 -0.02 0.00 0.00 0.00 0.00 36.38 35.91 2q4s s VAL 152 CO 0.18 0.17 -0.09 -0.94 0.00 0.00 0.00 175.10 174.43 2q4s s SER 153 N 0.97 0.97 -0.24 3.32 1.04 0.01 -0.16 113.70 119.62 2q4s s SER 153 Ca -0.10 -0.45 -0.09 0.00 0.48 0.00 0.00 55.95 55.78 2q4s s SER 153 Cb -0.14 -0.01 -0.04 0.00 0.10 0.00 0.00 66.02 65.93 2q4s s SER 153 CO -0.01 -0.11 0.13 -0.22 0.98 0.00 0.00 173.24 174.01 2q4s s LEU 154 N -1.23 3.93 -0.06 2.42 2.96 0.14 -0.07 118.68 126.77 2q4s s LEU 154 Ca -0.05 0.03 0.05 0.00 -0.22 0.00 0.00 54.13 53.94 2q4s s LEU 154 Cb -0.08 -2.05 -0.01 0.00 0.50 0.00 0.00 46.19 44.55 2q4s s LEU 154 CO 0.01 0.05 -0.22 -1.00 -1.32 0.00 0.00 176.35 173.87 2q4s s HIS 155 N 1.15 2.16 -0.17 5.38 3.76 -1.26 0.46 115.29 126.77 2q4s s HIS 155 Ca 0.06 -0.66 0.00 0.00 -0.15 0.00 0.00 55.06 54.31 2q4s s HIS 155 Cb -0.14 -1.44 0.03 0.00 1.11 0.00 0.00 32.58 32.15 2q4s s HIS 155 CO 0.05 -0.22 -0.11 -1.17 -0.85 0.00 0.00 174.74 172.44 2q4s s LEU 156 N -0.03 1.95 -0.12 0.89 0.20 -0.76 -4.12 118.68 116.69 2q4s s LEU 156 Ca -0.05 -0.69 0.03 0.00 0.69 0.00 0.00 54.13 54.11 2q4s s LEU 156 Cb -0.13 -1.17 -0.00 0.00 -0.43 0.00 0.00 46.19 44.45 2q4s s LEU 156 CO 0.04 -0.11 -0.21 -0.31 -0.29 0.00 0.00 176.35 175.46 2q4s s TYR 157 N 1.46 2.64 -0.11 5.38 2.02 0.26 -2.63 117.35 126.37 2q4s s TYR 157 Ca 0.02 -1.03 -0.04 0.00 -0.37 0.00 0.00 57.07 55.65 2q4s s TYR 157 Cb -0.15 -1.76 0.05 0.00 -0.40 0.00 0.00 41.96 39.71 2q4s s TYR 157 CO -0.09 -0.42 0.22 0.45 -1.57 0.00 0.00 175.55 174.13 2q4s s SER 158 N 0.45 0.43 0.33 2.29 0.15 -1.13 0.13 113.70 116.37 2q4s s SER 158 Ca -0.15 0.47 -0.29 0.00 0.70 0.00 0.00 55.95 56.69 2q4s s SER 158 Cb -0.17 0.49 -0.11 0.00 -1.71 0.00 0.00 66.02 64.52 2q4s s SER 158 CO 0.06 -0.23 1.41 -2.84 1.20 0.00 0.00 173.24 172.84 2q4s s PRO 159 N 2.21 4.24 -0.25 5.44 0.02 -1.26 -1.48 135.00 143.92 2q4s s PRO 159 Ca 0.01 2.38 -0.33 0.00 0.02 0.00 0.00 61.00 63.07 2q4s s PRO 159 Cb -0.12 -3.04 -0.10 0.00 0.02 0.00 0.00 34.50 31.27 2q4s s PRO 159 CO -0.07 -0.37 2.11 -2.30 -0.33 0.00 0.00 177.00 176.03 2q4s n PRO 160 N 0.96 1.56 -4.38 5.54 -0.02 -1.14 -4.87 135.00 132.65 2q4s n PRO 160 Ca 0.02 0.48 -0.24 0.00 -2.02 0.00 0.00 63.50 61.74 2q4s n PRO 160 Cb 0.40 -2.68 -0.09 0.00 -0.02 0.00 0.00 33.50 31.11 2q4s n PRO 160 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 2q4s s PHE 161 N 6.66 2.50 0.00 6.00 -0.12 -1.26 -4.96 117.98 126.80 2q4s s PHE 161 Ca 1.03 -0.31 0.00 0.00 -0.05 0.00 0.00 56.93 57.60 2q4s s PHE 161 Cb -0.70 -1.16 0.00 0.00 -0.63 0.00 0.00 43.02 40.53 2q4s s PHE 161 CO 0.47 0.64 0.24 -0.40 -0.05 0.00 0.00 175.22 176.12 2q4s n ASP 162 N -0.79 0.49 -4.34 1.98 5.75 -1.26 -5.05 116.55 113.32 2q4s n ASP 162 Ca -0.05 -0.98 -0.25 0.00 -0.01 0.00 0.00 54.79 53.49 2q4s n ASP 162 Cb 0.60 0.01 -0.12 0.00 -1.03 0.00 0.00 41.12 40.58 2q4s n ASP 162 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 2q4s s THR 163 N -0.01 1.97 0.03 2.12 -4.23 -1.26 -4.46 115.64 109.79 2q4s s THR 163 Ca 0.00 -1.74 -0.28 0.00 -1.18 0.00 0.00 61.69 58.48 2q4s s THR 163 Cb 0.00 -1.81 0.10 0.00 1.34 0.00 0.00 72.50 72.13 2q4s s THR 163 CO 0.00 -0.08 0.98 0.00 -0.54 0.00 0.00 174.62 174.98 2q4s s HIS 165 N -3.04 3.46 0.05 0.00 3.76 -1.26 0.09 115.29 118.35 2q4s s HIS 165 Ca 0.09 0.04 0.06 0.00 -0.15 0.00 0.00 55.06 55.10 2q4s s HIS 165 Cb -0.01 -1.61 -0.03 0.00 1.11 0.00 0.00 32.58 32.04 2q4s s HIS 165 CO -0.05 0.46 -0.14 0.00 -0.85 0.00 0.00 174.74 174.17 2q4s s ALA 166 N -1.90 2.76 -0.14 -1.40 0.00 -0.87 -3.15 121.76 117.07 2q4s s ALA 166 Ca 0.34 -1.18 -0.01 0.00 0.00 0.00 0.00 51.96 51.12 2q4s s ALA 166 Cb -0.10 -0.85 -0.01 0.00 0.00 0.00 0.00 23.12 22.16 2q4s s ALA 166 CO 0.29 0.60 -0.11 -0.06 0.00 0.00 0.00 175.76 176.47 2q4s s PHE 167 N -1.01 2.85 -0.35 0.00 0.08 -0.10 -2.65 117.98 116.81 2q4s s PHE 167 Ca 0.17 -0.66 -0.29 0.00 0.12 0.00 0.00 56.93 56.27 2q4s s PHE 167 Cb -0.11 -1.89 0.01 0.00 -0.57 0.00 0.00 43.02 40.46 2q4s s PHE 167 CO 0.08 -0.24 1.27 0.34 -0.10 0.00 0.00 175.22 176.57 2q4s s ASP 168 N 0.50 6.63 0.56 1.36 2.15 -0.20 -4.23 116.67 123.44 2q4s s ASP 168 Ca -0.08 1.00 0.24 0.00 0.43 0.00 0.00 52.55 54.14 2q4s s ASP 168 Cb -0.15 -2.54 1.56 0.00 -0.30 0.00 0.00 42.92 41.49 2q4s s ASP 168 CO 0.04 -1.16 2.18 -0.61 -0.17 0.00 0.00 175.17 175.45 2q4s h GLN 169 N 9.43 0.00 -0.21 4.34 4.15 -1.95 0.34 115.11 131.21 2q4s h GLN 169 Ca -0.25 0.00 -0.16 0.00 0.77 0.00 0.00 58.65 59.01 2q4s h GLN 169 Cb 1.09 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.77 2q4s h GLN 169 CO 1.06 0.00 -0.53 0.00 -1.93 0.00 0.00 178.83 177.43 2q4s h ARG 170 N 0.00 0.61 0.00 1.69 2.47 -1.90 -3.40 114.38 113.85 2q4s h ARG 170 Ca 0.03 -0.37 0.00 0.00 -1.26 0.00 0.00 59.98 58.38 2q4s h ARG 170 Cb 0.15 0.04 0.00 0.00 -1.65 0.00 0.00 29.97 28.50 2q4s h ARG 170 CO -0.00 0.98 -0.98 0.25 0.56 0.00 0.00 179.97 180.79 2q4s n THR 171 N -3.97 0.00 -0.03 2.04 -2.24 -0.90 -2.12 114.28 107.06 2q4s n THR 171 Ca -0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 2q4s n THR 171 Cb 0.60 -0.94 0.00 0.00 -2.10 0.00 0.00 70.33 67.89 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 2.99 0.41 3.62 3.38 0.00 0.11 -1.31 105.19 114.39 2q4s n GLY 172 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2q4s n GLY 172 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2q4s s HIS 173 N -2.06 1.27 0.26 1.61 3.76 -1.26 -4.67 115.29 114.20 2q4s s HIS 173 Ca 0.00 0.75 -0.19 0.00 -0.15 0.00 0.00 55.06 55.47 2q4s s HIS 173 Cb 0.00 -3.33 0.02 0.00 1.11 0.00 0.00 32.58 30.38 2q4s s HIS 173 CO 0.00 -3.46 0.64 -1.59 -0.85 0.00 0.00 174.74 169.48 2q4s s LYS 174 N -5.14 1.66 0.08 1.40 -2.85 -1.26 -1.03 119.74 112.60 2q4s s LYS 174 Ca 0.68 -0.99 -0.19 0.00 -1.00 0.00 0.00 55.97 54.46 2q4s s LYS 174 Cb -0.15 0.57 0.04 0.00 -2.06 0.00 0.00 37.83 36.24 2q4s s LYS 174 CO 0.57 -0.74 0.46 0.54 0.10 0.00 0.00 175.35 176.29 2q4s s ASN 175 N -2.92 -0.35 0.17 0.03 4.22 -1.08 -4.96 114.94 110.04 2q4s s ASN 175 Ca 0.12 -0.04 -0.30 0.00 -2.14 0.00 0.00 52.86 50.50 2q4s s ASN 175 Cb -0.04 0.48 -0.07 0.00 1.28 0.00 0.00 41.25 42.90 2q4s s ASN 175 CO 0.05 -0.77 1.04 -0.75 -2.04 0.00 0.00 177.10 174.63 2q4s s LYS 176 N -3.01 4.66 -0.02 3.55 2.20 -1.26 -2.04 119.74 123.81 2q4s s LYS 176 Ca -0.02 1.63 0.05 0.00 -0.36 0.00 0.00 55.97 57.26 2q4s s LYS 176 Cb 0.00 -3.30 -0.01 0.00 -1.51 0.00 0.00 37.83 33.01 2q4s s LYS 176 CO -0.06 0.17 -0.16 0.08 -0.36 0.00 0.00 175.35 175.02 2q4s s VAL 177 N -0.35 1.29 0.10 4.02 1.01 0.11 -4.96 120.40 121.61 2q4s s VAL 177 Ca 0.47 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.78 2q4s s VAL 177 Cb -0.28 -1.08 0.01 0.00 0.00 0.00 0.00 36.38 35.04 2q4s s VAL 177 CO 0.34 0.37 0.10 0.41 0.00 0.00 0.00 175.10 176.31 2q4s n THR 178 N 2.80 0.00 -3.51 3.92 -1.04 -1.26 -1.24 114.28 113.95 2q4s n THR 178 Ca -0.15 -0.37 -0.08 0.00 -2.04 0.00 0.00 64.05 61.40 2q4s n THR 178 Cb 0.54 -0.60 -0.02 0.00 -1.82 0.00 0.00 70.33 68.43 2q4s n THR 178 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 2q4s s THR 180 N -0.17 0.00 -0.20 12.58 -4.23 -1.26 -5.00 115.64 117.35 2q4s s THR 180 Ca 0.07 0.00 -0.13 0.00 -1.18 0.00 0.00 61.69 60.46 2q4s s THR 180 Cb -0.01 -1.00 -0.05 0.00 1.34 0.00 0.00 72.50 72.79 2q4s s THR 180 CO 0.05 0.00 0.25 -0.36 -0.54 0.00 0.00 174.62 174.02 2q4s s PHE 181 N -2.99 3.39 0.20 3.99 0.08 -1.26 -4.67 117.98 116.71 2q4s s PHE 181 Ca 0.05 0.44 -0.08 0.00 0.12 0.00 0.00 56.93 57.46 2q4s s PHE 181 Cb -0.01 -2.34 0.11 0.00 -0.57 0.00 0.00 43.02 40.22 2q4s s PHE 181 CO -0.08 0.13 1.71 1.25 -0.10 0.00 0.00 175.22 178.13 2q4s h HIS 182 N 7.10 1.21 -3.75 0.36 -0.00 -0.31 -3.42 115.15 116.34 2q4s h HIS 182 Ca -0.39 -0.15 -0.08 0.00 -0.00 0.00 0.00 60.37 59.75 2q4s h HIS 182 Cb 1.16 -0.34 -0.13 0.00 -0.00 0.00 0.00 27.41 28.10 2q4s h HIS 182 CO 0.64 0.98 -0.31 -1.54 -0.00 0.00 0.00 177.93 177.70 2q4s s SER 183 N -6.47 0.04 -0.03 3.26 1.04 -1.17 -0.68 113.70 109.69 2q4s s SER 183 Ca -0.12 -0.65 -0.00 0.00 0.48 0.00 0.00 55.95 55.66 2q4s s SER 183 Cb 0.15 0.38 0.03 0.00 0.10 0.00 0.00 66.02 66.68 2q4s s SER 183 CO 0.85 -0.79 0.02 -0.54 0.98 0.00 0.00 173.24 173.76 2q4s s LYS 184 N -3.88 0.18 -1.48 4.02 1.02 0.72 -1.12 119.74 119.20 2q4s s LYS 184 Ca 0.07 0.14 -0.12 0.00 0.02 0.00 0.00 55.97 56.09 2q4s s LYS 184 Cb 0.04 -0.44 0.07 0.00 -0.52 0.00 0.00 37.83 36.98 2q4s s LYS 184 CO -0.09 -0.17 0.88 1.19 -0.92 0.00 0.00 175.35 176.24 2q4s n PHE 185 N 4.33 -2.24 -0.21 3.18 3.72 -0.42 -0.82 117.46 125.01 2q4s n PHE 185 Ca -0.24 0.80 0.00 0.00 -0.05 0.00 0.00 57.45 57.96 2q4s n PHE 185 Cb 0.50 -3.97 0.00 0.00 -0.94 0.00 0.00 39.48 35.07 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 -1.62 2.01 3.63 1.37 0.00 -1.26 -5.02 105.19 104.30 2q4s n GLY 186 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 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 -3.00 5.24 0.27 -0.61 -1.09 0.00 -4.96 121.20 117.05 2q4s s ILE 187 Ca 0.00 0.14 -0.30 0.00 -2.23 0.00 0.00 60.65 58.26 2q4s s ILE 187 Cb 0.00 -3.45 -0.11 0.00 -1.58 0.00 0.00 42.46 37.32 2q4s s ILE 187 CO 0.00 0.33 1.51 -0.60 -1.23 0.00 0.00 174.94 174.95 2q4s s ARG 188 N 1.20 4.20 -0.55 2.79 6.06 -1.26 -0.20 118.95 131.19 2q4s s ARG 188 Ca 0.07 2.42 0.04 0.00 -2.50 0.00 0.00 55.73 55.76 2q4s s ARG 188 Cb -0.14 -3.07 0.16 0.00 0.06 0.00 0.00 34.95 31.96 2q4s s ARG 188 CO 0.06 -0.52 0.38 0.95 -2.50 0.00 0.00 175.30 173.66 2q4s s THR 189 N 0.03 1.75 -2.00 4.11 -4.23 0.14 -4.88 115.64 110.57 2q4s s THR 189 Ca 0.61 -3.34 0.05 0.00 -1.18 0.00 0.00 61.69 57.83 2q4s s THR 189 Cb -0.44 -2.18 0.14 0.00 1.34 0.00 0.00 72.50 71.35 2q4s s THR 189 CO 0.45 -1.04 0.76 -2.65 -0.54 0.00 0.00 174.62 171.60