#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 4.15 0.07 -4.62 1.43 -1.26 -5.05 118.68 113.39 2q4s s LEU 6 Ca 0.00 0.64 0.01 0.00 -1.03 0.00 0.00 54.13 53.75 2q4s s LEU 6 Cb 0.00 -2.67 -0.04 0.00 0.03 0.00 0.00 46.19 43.51 2q4s s LEU 6 CO 0.00 -0.16 0.19 -0.76 0.23 0.00 0.00 176.35 175.86 2q4s s LEU 7 N 1.56 4.27 0.10 1.79 1.43 -1.26 -5.06 118.68 121.52 2q4s s LEU 7 Ca 0.23 0.22 -0.31 0.00 -1.03 0.00 0.00 54.13 53.24 2q4s s LEU 7 Cb -0.15 -2.88 -0.08 0.00 0.03 0.00 0.00 46.19 43.10 2q4s s LEU 7 CO 0.09 0.16 1.49 -0.75 0.23 0.00 0.00 176.35 177.58 2q4s s LYS 8 N -2.54 4.26 0.02 1.70 2.20 -1.26 -4.95 119.74 119.17 2q4s s LYS 8 Ca 0.34 2.19 -0.30 0.00 -0.36 0.00 0.00 55.97 57.84 2q4s s LYS 8 Cb -0.13 -3.34 -0.05 0.00 -1.51 0.00 0.00 37.83 32.79 2q4s s LYS 8 CO 0.27 -0.57 1.28 -2.14 -0.36 0.00 0.00 175.35 173.84 2q4s s PRO 9 N 1.63 4.35 0.13 4.03 0.02 -1.26 -4.90 135.00 139.00 2q4s s PRO 9 Ca 0.68 1.85 0.08 0.00 0.02 0.00 0.00 61.00 63.63 2q4s s PRO 9 Cb -0.38 -3.45 -0.19 0.00 0.02 0.00 0.00 34.50 30.50 2q4s s PRO 9 CO 0.30 -0.42 1.28 0.00 -0.33 0.00 0.00 177.00 177.83 2q4s h ARG 10 N 7.25 0.00 -4.08 5.54 3.08 -1.92 -3.41 114.38 120.84 2q4s h ARG 10 Ca -0.39 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.52 2q4s h ARG 10 Cb 1.19 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 31.12 2q4s h ARG 10 CO 0.86 0.94 -0.37 0.95 -1.07 0.00 0.00 179.97 181.28 2q4s s THR 11 N -2.73 0.02 0.20 2.04 -4.23 -1.26 -4.89 115.64 104.79 2q4s s THR 11 Ca 0.01 -1.64 -0.11 0.00 -1.18 0.00 0.00 61.69 58.77 2q4s s THR 11 Cb 0.10 -2.23 0.14 0.00 1.34 0.00 0.00 72.50 71.84 2q4s s THR 11 CO 0.81 -0.08 1.85 0.25 -0.54 0.00 0.00 174.62 176.91 2q4s h LEU 12 N 2.47 0.86 -1.28 4.79 5.85 -1.92 0.06 115.31 126.15 2q4s h LEU 12 Ca -0.31 -0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.32 2q4s h LEU 12 Cb 1.24 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 42.03 2q4s h LEU 12 CO 0.45 0.66 0.16 0.00 -0.34 0.00 0.00 178.44 179.38 2q4s h ALA 13 N 1.24 1.43 -0.26 1.25 0.00 -1.97 -0.89 119.26 120.06 2q4s h ALA 13 Ca 0.26 -0.14 -0.17 0.00 0.00 0.00 0.00 54.91 54.87 2q4s h ALA 13 Cb -0.05 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 2q4s h ALA 13 CO -0.05 0.43 -0.50 -0.44 0.00 0.00 0.00 179.25 178.68 2q4s h ASP 14 N 0.65 0.81 -0.53 0.00 3.32 -1.74 -2.11 116.42 116.83 2q4s h ASP 14 Ca 0.16 -0.41 0.04 0.00 0.02 0.00 0.00 57.03 56.83 2q4s h ASP 14 Cb 0.16 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.44 2q4s h ASP 14 CO -0.01 1.17 0.28 0.25 -1.72 0.00 0.00 179.24 179.21 2q4s h LEU 15 N 0.58 0.42 -0.75 1.55 5.85 -0.30 -1.20 115.31 121.45 2q4s h LEU 15 Ca 0.02 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 2q4s h LEU 15 Cb 1.07 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 42.01 2q4s h LEU 15 CO 0.11 0.29 0.44 0.40 -0.34 0.00 0.00 178.44 179.33 2q4s h ILE 16 N 0.54 1.22 -0.35 4.05 2.04 -0.88 0.31 117.51 124.43 2q4s h ILE 16 Ca 0.23 -0.50 0.01 0.00 1.00 0.00 0.00 64.86 65.59 2q4s h ILE 16 Cb 0.11 0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 36.36 2q4s h ILE 16 CO -0.15 0.23 0.23 -0.09 0.00 0.00 0.00 178.15 178.37 2q4s h ARG 17 N 1.03 0.45 -0.52 2.37 2.43 -0.96 -0.25 114.38 118.94 2q4s h ARG 17 Ca 0.27 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.40 2q4s h ARG 17 Cb -0.01 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.41 2q4s h ARG 17 CO -0.05 0.30 0.27 0.82 -1.51 0.00 0.00 179.97 179.80 2q4s h ILE 18 N 0.46 1.19 -0.61 1.20 2.04 -0.88 -1.78 117.51 119.12 2q4s h ILE 18 Ca 0.13 -0.51 -0.00 0.00 1.00 0.00 0.00 64.86 65.48 2q4s h ILE 18 Cb -0.04 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 36.58 2q4s h ILE 18 CO -0.04 0.21 0.37 -0.07 0.00 0.00 0.00 178.15 178.62 2q4s h LEU 19 N 0.70 0.73 -1.54 1.44 3.38 -0.54 0.19 115.31 119.67 2q4s h LEU 19 Ca 0.18 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 2q4s h LEU 19 Cb 0.09 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2q4s h LEU 19 CO -0.03 0.56 -0.09 0.45 0.09 0.00 0.00 178.44 179.42 2q4s h HIS 20 N 0.84 0.19 0.03 1.13 3.86 -0.23 -0.76 115.15 120.22 2q4s h HIS 20 Ca 0.22 -0.01 -0.11 0.00 -1.16 0.00 0.00 60.37 59.30 2q4s h HIS 20 Cb -0.04 -0.06 0.01 0.00 1.06 0.00 0.00 27.41 28.38 2q4s h HIS 20 CO 0.00 0.28 -0.46 0.93 0.86 0.00 0.00 177.93 179.54 2q4s h GLU 21 N 0.18 0.25 0.00 2.45 5.08 -0.34 -2.97 114.58 119.24 2q4s h GLU 21 Ca 0.04 -0.32 -0.00 0.00 -1.00 0.00 0.00 59.36 58.08 2q4s h GLU 21 Cb 0.28 0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.63 2q4s h GLU 21 CO 0.01 1.06 -0.01 -0.07 -1.00 0.00 0.00 179.01 179.00 2q4s h LEU 22 N -0.41 0.00 -3.34 1.33 3.38 -0.51 -1.82 115.31 113.94 2q4s h LEU 22 Ca -0.07 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.77 2q4s h LEU 22 Cb 1.25 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.92 2q4s h LEU 22 CO 0.09 0.01 -0.02 0.49 0.09 0.00 0.00 178.44 179.10 2q4s n PHE 23 N -3.14 1.11 0.20 1.13 3.72 -0.31 -4.66 117.46 115.51 2q4s n PHE 23 Ca -0.01 -1.35 0.08 0.00 -0.05 0.00 0.00 57.45 56.11 2q4s n PHE 23 Cb 0.18 -0.45 0.36 0.00 -0.94 0.00 0.00 39.48 38.63 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 1.25 0.96 -3.54 4.37 0.00 -1.15 -3.46 119.26 117.70 2q4s h ALA 24 Ca 0.16 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2q4s h ALA 24 Cb 1.63 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.37 2q4s h ALA 24 CO 0.36 0.36 0.00 0.41 0.00 0.00 0.00 179.25 180.38 2q4s n GLY 25 N 0.36 1.54 0.00 0.00 0.00 -1.26 -5.04 105.19 100.78 2q4s n GLY 25 Ca 0.00 -2.04 0.11 0.00 0.00 0.00 0.00 46.02 44.10 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 -1.86 0.77 -4.84 1.61 8.00 -1.26 -4.95 116.55 114.02 2q4s n ASP 26 Ca 0.00 -0.65 -0.31 0.00 0.71 0.00 0.00 54.79 54.54 2q4s n ASP 26 Cb 0.00 0.68 -0.04 0.00 -0.02 0.00 0.00 41.12 41.74 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 -3.01 2.23 -0.05 -1.24 0.41 -1.26 -5.14 118.70 110.64 2q4s s GLU 27 Ca 0.09 -2.28 0.01 0.00 -0.41 0.00 0.00 54.97 52.38 2q4s s GLU 27 Cb 0.17 -1.76 0.02 0.00 -1.78 0.00 0.00 34.13 30.77 2q4s s GLU 27 CO 0.80 -0.52 -0.05 0.08 -0.49 0.00 0.00 175.26 175.07 2q4s s VAL 28 N -2.86 0.64 -1.02 2.63 1.01 -1.26 -4.89 120.40 114.65 2q4s s VAL 28 Ca 0.15 -0.16 -0.15 0.00 0.00 0.00 0.00 61.98 61.81 2q4s s VAL 28 Cb -0.01 -0.66 0.17 0.00 0.00 0.00 0.00 36.38 35.88 2q4s s VAL 28 CO 0.09 0.26 1.17 0.21 0.00 0.00 0.00 175.10 176.83 2q4s s ASN 29 N 1.04 6.86 0.51 3.32 3.84 -1.26 -4.83 114.94 124.42 2q4s s ASN 29 Ca -0.09 -2.60 0.25 0.00 0.21 0.00 0.00 52.86 50.63 2q4s s ASN 29 Cb -0.14 -2.35 1.36 0.00 -0.55 0.00 0.00 41.25 39.56 2q4s s ASN 29 CO -0.00 -0.81 1.95 0.58 -2.79 0.00 0.00 177.10 176.02 2q4s h VAL 30 N 5.09 0.69 0.37 -5.21 2.07 -1.99 -1.14 116.25 116.13 2q4s h VAL 30 Ca 0.20 -0.03 -0.02 0.00 0.82 0.00 0.00 66.70 67.68 2q4s h VAL 30 Cb 0.96 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 31.34 2q4s h VAL 30 CO 1.09 0.01 -0.18 -0.33 0.02 0.00 0.00 177.57 178.19 2q4s h GLU 31 N 0.08 -0.48 0.00 1.57 4.39 -2.00 -1.87 114.58 116.27 2q4s h GLU 31 Ca 0.33 0.03 -0.13 0.00 0.34 0.00 0.00 59.36 59.93 2q4s h GLU 31 Cb 1.19 0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.93 2q4s h GLU 31 CO -0.03 -0.31 -0.62 0.93 -1.16 0.00 0.00 179.01 177.82 2q4s h GLU 32 N -0.52 0.00 -0.21 2.33 5.08 -1.66 -2.63 114.58 116.96 2q4s h GLU 32 Ca -0.05 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 2q4s h GLU 32 Cb 0.40 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 2q4s h GLU 32 CO 0.08 0.62 -0.04 0.28 -1.00 0.00 0.00 179.01 178.95 2q4s h VAL 33 N 0.00 1.28 -0.44 3.13 2.07 -1.28 -0.45 116.25 120.57 2q4s h VAL 33 Ca -0.01 -1.02 -0.01 0.00 0.82 0.00 0.00 66.70 66.49 2q4s h VAL 33 Cb 1.19 1.52 -0.02 0.00 -1.52 0.00 0.00 31.29 32.46 2q4s h VAL 33 CO 0.08 0.31 0.22 -0.61 0.02 0.00 0.00 177.57 177.59 2q4s h GLN 34 N 0.13 0.63 -0.64 1.57 4.15 -1.34 -0.58 115.11 119.03 2q4s h GLN 34 Ca 0.05 -0.09 -0.04 0.00 0.77 0.00 0.00 58.65 59.35 2q4s h GLN 34 Cb 0.49 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 28.03 2q4s h GLN 34 CO 0.02 0.52 0.23 0.00 -1.93 0.00 0.00 178.83 177.67 2q4s h ALA 35 N 1.07 1.19 0.00 3.38 0.00 -1.40 -0.37 119.26 123.13 2q4s h ALA 35 Ca 0.15 -0.19 -0.18 0.00 0.00 0.00 0.00 54.91 54.69 2q4s h ALA 35 Cb 0.09 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2q4s h ALA 35 CO -0.02 0.58 -0.87 -0.24 0.00 0.00 0.00 179.25 178.69 2q4s h VAL 36 N 0.94 1.62 -0.31 0.00 3.04 -0.87 -1.57 116.25 119.09 2q4s h VAL 36 Ca 0.21 -2.96 -0.10 0.00 -1.01 0.00 0.00 66.70 62.84 2q4s h VAL 36 Cb 0.23 2.60 -0.01 0.00 -2.01 0.00 0.00 31.29 32.10 2q4s h VAL 36 CO -0.01 0.85 -0.21 -0.07 -1.01 0.00 0.00 177.57 177.11 2q4s h LEU 37 N 0.01 0.72 -1.06 3.16 3.38 -0.83 -2.78 115.31 117.91 2q4s h LEU 37 Ca -0.01 -0.44 -0.06 0.00 0.09 0.00 0.00 57.88 57.46 2q4s h LEU 37 Cb 1.54 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 42.08 2q4s h LEU 37 CO 0.11 1.00 -0.31 -0.08 0.09 0.00 0.00 178.44 179.26 2q4s h GLU 38 N 0.44 0.00 0.00 1.13 4.81 -1.04 -2.97 114.58 116.95 2q4s h GLU 38 Ca 0.06 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 2q4s h GLU 38 Cb 0.76 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.14 2q4s h GLU 38 CO 0.06 0.31 0.00 0.00 -0.73 0.00 0.00 179.01 178.65 2q4s h ALA 39 N 1.69 1.00 -2.49 2.92 0.00 -1.01 -3.44 119.26 117.93 2q4s h ALA 39 Ca -0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.37 2q4s h ALA 39 Cb 0.81 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.61 2q4s h ALA 39 CO 0.04 0.00 0.69 -0.47 0.00 0.00 0.00 179.25 179.51 2q4s s TYR 40 N -3.61 3.24 -0.43 0.00 5.04 -1.12 -4.60 117.35 115.87 2q4s s TYR 40 Ca 0.02 1.05 -0.24 0.00 -2.44 0.00 0.00 57.07 55.46 2q4s s TYR 40 Cb 0.09 -3.59 0.02 0.00 0.35 0.00 0.00 41.96 38.83 2q4s s TYR 40 CO 0.54 -2.00 0.81 -1.21 -1.34 0.00 0.00 175.55 172.35 2q4s s GLU 41 N 1.33 3.52 -0.24 4.97 0.41 -1.26 -4.97 118.70 122.46 2q4s s GLU 41 Ca 0.62 0.06 -0.39 0.00 -0.41 0.00 0.00 54.97 54.85 2q4s s GLU 41 Cb -0.33 -3.90 -0.15 0.00 -1.78 0.00 0.00 34.13 27.97 2q4s s GLU 41 CO 0.29 -1.06 1.78 0.45 -0.49 0.00 0.00 175.26 176.23 2q4s n SER 42 N 6.72 2.63 -4.02 -0.19 2.88 -1.26 -4.92 113.62 115.45 2q4s n SER 42 Ca 0.03 1.05 -0.31 0.00 -1.33 0.00 0.00 58.87 58.31 2q4s n SER 42 Cb 0.48 -1.19 -0.15 0.00 -0.75 0.00 0.00 64.21 62.60 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 3.68 4.62 0.46 -3.46 3.84 -1.26 -5.01 114.94 117.81 2q4s s ASN 43 Ca 0.97 -1.88 0.24 0.00 0.21 0.00 0.00 52.86 52.41 2q4s s ASN 43 Cb -0.99 -1.57 1.27 0.00 -0.55 0.00 0.00 41.25 39.41 2q4s s ASN 43 CO 0.63 -0.32 1.83 -0.65 -2.79 0.00 0.00 177.10 175.80 2q4s h PRO 44 N 7.69 0.23 0.00 0.43 0.11 -1.91 0.25 132.00 138.79 2q4s h PRO 44 Ca -0.09 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.95 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 0.50 0.15 -0.27 0.00 -0.21 0.00 0.00 178.00 178.17 2q4s h ALA 45 N 1.57 1.25 0.00 -0.75 0.00 -2.00 -0.30 119.26 119.02 2q4s h ALA 45 Ca 0.51 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 2q4s h ALA 45 Cb 1.59 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.33 2q4s h ALA 45 CO -0.14 0.33 -0.21 0.93 0.00 0.00 0.00 179.25 180.16 2q4s h GLU 46 N 0.00 0.00 0.00 0.00 5.08 -1.37 -3.33 114.58 114.96 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 0.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.84 2q4s h GLU 46 CO 0.03 0.21 0.00 -2.67 -1.00 0.00 0.00 179.01 175.59 2q4s n TRP 47 N -3.23 0.00 -0.31 4.33 4.27 -1.10 -4.76 117.44 116.64 2q4s n TRP 47 Ca 0.02 -0.09 0.20 0.00 -3.89 0.00 0.00 57.50 53.74 2q4s n TRP 47 Cb 0.52 -0.01 0.46 0.00 -1.36 0.00 0.00 31.31 30.93 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 2.08 -0.93 -1.67 0.00 -1.16 0.52 119.26 118.10 2q4s h ALA 48 Ca 0.00 0.06 0.19 0.00 0.00 0.00 0.00 54.91 55.16 2q4s h ALA 48 Cb 0.17 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.87 2q4s h ALA 48 CO 0.00 -0.46 0.60 1.25 0.00 0.00 0.00 179.25 180.64 2q4s h LEU 49 N 0.49 0.56 0.00 0.00 5.85 -1.85 -0.31 115.31 120.04 2q4s h LEU 49 Ca 0.57 0.06 0.00 0.00 0.84 0.00 0.00 57.88 59.35 2q4s h LEU 49 Cb 1.29 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.27 2q4s h LEU 49 CO -0.30 0.23 -0.55 -1.22 -0.34 0.00 0.00 178.44 176.26 2q4s n TYR 50 N -4.59 0.22 -2.40 1.25 4.01 0.16 -4.68 117.16 111.13 2q4s n TYR 50 Ca 0.20 0.07 -0.37 0.00 -0.16 0.00 0.00 57.90 57.63 2q4s n TYR 50 Cb 0.62 -0.43 -0.04 0.00 -0.31 0.00 0.00 39.34 39.19 2q4s n TYR 50 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2q4s s ALA 51 N -3.07 2.42 -0.32 -0.72 0.00 -0.13 -4.83 121.76 115.11 2q4s s ALA 51 Ca 0.09 -1.87 0.01 0.00 0.00 0.00 0.00 51.96 50.19 2q4s s ALA 51 Cb 0.16 -4.49 0.10 0.00 0.00 0.00 0.00 23.12 18.89 2q4s s ALA 51 CO 0.70 -3.89 0.08 0.15 0.00 0.00 0.00 175.76 172.80 2q4s s LYS 52 N 5.70 0.99 0.33 0.00 1.02 -1.26 -4.99 119.74 121.53 2q4s s LYS 52 Ca 0.52 -1.36 -0.06 0.00 0.02 0.00 0.00 55.97 55.08 2q4s s LYS 52 Cb -0.03 -2.43 -0.05 0.00 -0.52 0.00 0.00 37.83 34.80 2q4s s LYS 52 CO -0.03 -0.97 0.63 -0.06 -0.92 0.00 0.00 175.35 174.00 2q4s s PHE 53 N 1.36 3.48 0.07 3.18 0.08 -1.26 -4.74 117.98 120.14 2q4s s PHE 53 Ca 0.10 0.76 0.09 0.00 0.12 0.00 0.00 56.93 58.00 2q4s s PHE 53 Cb -0.18 -2.20 -0.03 0.00 -0.57 0.00 0.00 43.02 40.04 2q4s s PHE 53 CO -0.19 0.07 -0.24 0.34 -0.10 0.00 0.00 175.22 175.10 2q4s s ASP 54 N -3.23 2.88 0.34 1.36 2.15 -1.26 -5.06 116.67 113.86 2q4s s ASP 54 Ca 0.46 -0.61 0.17 0.00 0.43 0.00 0.00 52.55 53.00 2q4s s ASP 54 Cb -0.11 -0.23 0.56 0.00 -0.30 0.00 0.00 42.92 42.84 2q4s s ASP 54 CO 0.31 0.19 1.68 -0.61 -0.17 0.00 0.00 175.17 176.57 2q4s h GLN 55 N 4.58 0.00 0.04 4.34 4.15 -2.00 -3.37 115.11 122.85 2q4s h GLN 55 Ca -0.46 0.00 -0.35 0.00 0.77 0.00 0.00 58.65 58.61 2q4s h GLN 55 Cb 1.16 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 28.80 2q4s h GLN 55 CO 0.42 0.45 -2.11 0.66 -1.93 0.00 0.00 178.83 176.32 2q4s n TYR 56 N -3.57 0.63 -4.07 3.99 4.01 -1.26 -4.98 117.16 111.91 2q4s n TYR 56 Ca -0.00 0.18 -0.12 0.00 -0.16 0.00 0.00 57.90 57.80 2q4s n TYR 56 Cb 0.55 -1.10 -0.06 0.00 -0.31 0.00 0.00 39.34 38.43 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 -2.55 1.63 0.58 -0.72 1.70 -1.26 -5.00 118.95 113.33 2q4s s ARG 57 Ca -0.17 -1.51 -0.16 0.00 -0.47 0.00 0.00 55.73 53.41 2q4s s ARG 57 Cb 0.07 0.42 -0.04 0.00 -0.57 0.00 0.00 34.95 34.83 2q4s s ARG 57 CO 0.76 -0.66 1.05 1.52 -1.08 0.00 0.00 175.30 176.89 2q4s s TYR 58 N -3.67 3.06 0.17 5.89 -0.85 -1.26 -4.26 117.35 116.42 2q4s s TYR 58 Ca 0.29 1.51 0.09 0.00 -0.52 0.00 0.00 57.07 58.43 2q4s s TYR 58 Cb 0.01 -2.98 -0.04 0.00 0.38 0.00 0.00 41.96 39.33 2q4s s TYR 58 CO 0.14 -1.00 -0.12 0.95 -1.52 0.00 0.00 175.55 174.00 2q4s s THR 59 N -2.46 3.05 -0.19 -3.49 -4.23 -0.83 -4.94 115.64 102.55 2q4s s THR 59 Ca 0.63 -1.67 -0.02 0.00 -1.18 0.00 0.00 61.69 59.45 2q4s s THR 59 Cb -0.15 -2.49 -0.00 0.00 1.34 0.00 0.00 72.50 71.19 2q4s s THR 59 CO 0.36 -0.08 -0.10 -0.13 -0.54 0.00 0.00 174.62 174.13 2q4s s ARG 60 N -2.71 3.29 -0.29 3.99 0.52 -1.26 -1.81 118.95 120.68 2q4s s ARG 60 Ca 0.23 -0.68 0.02 0.00 -0.52 0.00 0.00 55.73 54.78 2q4s s ARG 60 Cb -0.09 -2.83 0.08 0.00 0.52 0.00 0.00 34.95 32.63 2q4s s ARG 60 CO 0.14 -0.11 0.01 -0.80 0.02 0.00 0.00 175.30 174.55 2q4s s ASN 61 N 1.20 4.30 0.21 0.23 0.01 -0.19 0.42 114.94 121.11 2q4s s ASN 61 Ca 0.02 -1.66 -0.30 0.00 -0.71 0.00 0.00 52.86 50.21 2q4s s ASN 61 Cb -0.14 -1.33 -0.10 0.00 0.41 0.00 0.00 41.25 40.09 2q4s s ASN 61 CO -0.04 -0.32 1.42 -0.22 -1.51 0.00 0.00 177.10 176.44 2q4s s LEU 62 N 1.22 4.39 -0.11 0.60 2.96 -0.48 -1.18 118.68 126.07 2q4s s LEU 62 Ca 0.03 2.57 -0.02 0.00 -0.22 0.00 0.00 54.13 56.49 2q4s s LEU 62 Cb -0.19 -3.61 -0.06 0.00 0.50 0.00 0.00 46.19 42.83 2q4s s LEU 62 CO -0.10 -0.67 -0.12 0.52 -1.32 0.00 0.00 176.35 174.65 2q4s n VAL 63 N 2.79 0.64 -3.79 1.68 0.31 0.12 -1.20 118.33 118.87 2q4s n VAL 63 Ca 0.08 -0.21 -0.13 0.00 -0.01 0.00 0.00 64.34 64.07 2q4s n VAL 63 Cb 0.41 -1.17 -0.10 0.00 -0.91 0.00 0.00 33.84 32.06 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 -5.43 -0.21 -0.18 4.52 2.15 -0.74 -4.64 116.67 112.14 2q4s s ASP 64 Ca -0.15 0.29 0.16 0.00 0.43 0.00 0.00 52.55 53.27 2q4s s ASP 64 Cb 0.05 0.43 0.77 0.00 -0.30 0.00 0.00 42.92 43.86 2q4s s ASP 64 CO 0.24 -0.25 1.69 0.00 -0.17 0.00 0.00 175.17 176.68 2q4s n GLN 65 N 2.19 4.32 -3.02 4.34 6.02 -1.26 0.10 117.38 130.08 2q4s n GLN 65 Ca -0.17 -3.04 -0.15 0.00 -0.01 0.00 0.00 57.00 53.64 2q4s n GLN 65 Cb 0.57 -2.09 -0.01 0.00 1.02 0.00 0.00 30.24 29.73 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 0.78 -0.48 3.44 1.08 0.00 0.30 -0.75 105.19 109.57 2q4s n GLY 66 Ca 0.27 0.03 -0.25 0.00 0.00 0.00 0.00 46.02 46.07 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 -1.90 -4.85 0.00 1.61 4.13 -1.26 -1.06 115.26 111.93 2q4s n ASN 67 Ca -0.01 -0.48 0.00 0.00 1.68 0.00 0.00 54.58 55.76 2q4s n ASN 67 Cb 0.52 -3.92 0.00 0.00 -1.54 0.00 0.00 39.78 34.84 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 -1.46 2.28 0.10 7.41 0.00 0.08 -4.88 105.19 108.72 2q4s n GLY 68 Ca -0.02 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.02 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 2.47 0.00 -2.53 1.61 1.79 -1.23 -3.43 116.57 115.25 2q4s h LYS 69 Ca 0.00 0.00 0.03 0.00 -2.18 0.00 0.00 60.65 58.50 2q4s h LYS 69 Cb 0.00 0.00 -0.15 0.00 -1.58 0.00 0.00 32.23 30.50 2q4s h LYS 69 CO 0.00 0.23 0.33 -0.59 -1.08 0.00 0.00 179.45 178.34 2q4s s PHE 70 N -3.03 -0.47 -0.04 -1.35 -0.12 -1.24 -4.16 117.98 107.57 2q4s s PHE 70 Ca -0.02 0.40 0.02 0.00 -0.05 0.00 0.00 56.93 57.28 2q4s s PHE 70 Cb 0.09 0.53 -0.03 0.00 -0.63 0.00 0.00 43.02 42.98 2q4s s PHE 70 CO 0.80 -0.68 -0.09 -0.80 -0.05 0.00 0.00 175.22 174.41 2q4s s ASN 71 N -2.37 4.49 0.14 1.98 0.01 -1.03 -0.54 114.94 117.62 2q4s s ASN 71 Ca 0.01 -0.11 0.11 0.00 -0.71 0.00 0.00 52.86 52.16 2q4s s ASN 71 Cb -0.01 -1.06 -0.04 0.00 0.41 0.00 0.00 41.25 40.56 2q4s s ASN 71 CO -0.08 0.33 -0.25 -0.22 -1.51 0.00 0.00 177.10 175.37 2q4s s LEU 72 N -1.02 2.35 -0.05 0.60 2.96 0.12 -1.86 118.68 121.78 2q4s s LEU 72 Ca 0.14 -0.77 -0.02 0.00 -0.22 0.00 0.00 54.13 53.25 2q4s s LEU 72 Cb -0.11 -1.16 0.03 0.00 0.50 0.00 0.00 46.19 45.46 2q4s s LEU 72 CO 0.03 0.15 0.11 -0.63 -1.32 0.00 0.00 176.35 174.69 2q4s s ILE 74 N -1.24 -0.04 -0.14 6.68 1.01 -0.32 0.12 121.20 127.26 2q4s s ILE 74 Ca 0.15 0.16 -0.04 0.00 0.00 0.00 0.00 60.65 60.92 2q4s s ILE 74 Cb -0.09 -0.18 -0.03 0.00 0.01 0.00 0.00 42.46 42.16 2q4s s ILE 74 CO 0.07 0.07 -0.01 -0.76 0.00 0.00 0.00 174.94 174.30 2q4s s LEU 75 N 0.99 3.43 -0.23 2.97 1.02 0.94 -1.03 118.68 126.76 2q4s s LEU 75 Ca -0.08 -0.02 -0.05 0.00 0.02 0.00 0.00 54.13 54.00 2q4s s LEU 75 Cb -0.10 -1.82 -0.01 0.00 0.02 0.00 0.00 46.19 44.27 2q4s s LEU 75 CO -0.04 0.23 -0.01 0.00 0.02 0.00 0.00 176.35 176.55 2q4s s TRP 77 N 1.51 3.35 1.20 0.00 0.52 0.13 -1.96 118.94 123.69 2q4s s TRP 77 Ca 0.06 -1.94 -0.15 0.00 0.02 0.00 0.00 56.10 54.09 2q4s s TRP 77 Cb -0.15 -2.45 0.29 0.00 -1.15 0.00 0.00 33.47 30.01 2q4s s TRP 77 CO -0.01 -0.84 1.03 0.20 0.02 0.00 0.00 176.95 177.35 2q4s s GLY 78 N 1.44 1.52 0.27 0.98 0.00 -1.26 -0.06 107.32 110.20 2q4s s GLY 78 Ca -0.01 -0.40 -0.30 0.00 0.00 0.00 0.00 44.72 44.01 2q4s s GLY 78 CO -0.01 0.38 1.46 1.18 0.00 0.00 0.00 173.10 176.11 2q4s n GLU 79 N -4.93 2.28 0.00 2.90 4.71 -1.26 -1.31 120.64 123.03 2q4s n GLU 79 Ca 0.06 0.81 0.00 0.00 -0.01 0.00 0.00 57.16 58.02 2q4s n GLU 79 Cb 0.56 -2.50 0.00 0.00 -1.01 0.00 0.00 31.44 28.49 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 2.00 2.96 3.77 0.62 0.00 0.04 -4.97 105.19 109.62 2q4s n GLY 80 Ca 0.10 0.00 -0.38 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 -2.86 3.23 0.31 1.61 3.76 -0.43 -4.71 115.29 116.20 2q4s s HIS 81 Ca 0.00 1.62 -0.16 0.00 -0.15 0.00 0.00 55.06 56.37 2q4s s HIS 81 Cb 0.00 -3.24 0.02 0.00 1.11 0.00 0.00 32.58 30.47 2q4s s HIS 81 CO 0.00 -0.86 0.66 0.20 -0.85 0.00 0.00 174.74 173.90 2q4s s GLY 82 N -1.33 0.30 0.59 -2.22 0.00 -1.26 0.59 107.32 103.99 2q4s s GLY 82 Ca 0.56 -0.65 0.08 0.00 0.00 0.00 0.00 44.72 44.71 2q4s s GLY 82 CO 0.33 -0.34 0.82 -1.35 0.00 0.00 0.00 173.10 172.56 2q4s s SER 83 N -3.01 5.00 0.64 1.64 1.04 0.18 -4.81 113.70 114.38 2q4s s SER 83 Ca 0.16 -0.80 -0.06 0.00 0.48 0.00 0.00 55.95 55.73 2q4s s SER 83 Cb -0.04 0.28 0.03 0.00 0.10 0.00 0.00 66.02 66.39 2q4s s SER 83 CO 0.10 -1.41 0.95 -0.94 0.98 0.00 0.00 173.24 172.91 2q4s s SER 84 N -4.68 5.24 0.08 7.02 1.04 -1.26 -4.60 113.70 116.54 2q4s s SER 84 Ca 0.63 0.57 -0.31 0.00 0.48 0.00 0.00 55.95 57.32 2q4s s SER 84 Cb -0.06 -1.41 -0.06 0.00 0.10 0.00 0.00 66.02 64.59 2q4s s SER 84 CO 0.40 -1.30 1.20 -0.63 0.98 0.00 0.00 173.24 173.88 2q4s s ILE 85 N -3.10 3.98 0.17 -1.02 1.01 -1.26 -4.34 121.20 116.65 2q4s s ILE 85 Ca 0.57 1.45 -0.12 0.00 0.00 0.00 0.00 60.65 62.55 2q4s s ILE 85 Cb -0.11 -3.93 0.00 0.00 0.01 0.00 0.00 42.46 38.44 2q4s s ILE 85 CO 0.45 0.13 0.36 -1.38 0.00 0.00 0.00 174.94 174.49 2q4s s HIS 86 N 0.91 0.23 0.50 3.97 -3.43 0.25 -1.15 115.29 116.56 2q4s s HIS 86 Ca 0.58 -0.59 0.06 0.00 -0.80 0.00 0.00 55.06 54.31 2q4s s HIS 86 Cb -0.30 0.09 0.06 0.00 -1.43 0.00 0.00 32.58 31.00 2q4s s HIS 86 CO 0.30 -0.78 0.49 -0.40 -2.00 0.00 0.00 174.74 172.35 2q4s n ASP 87 N -0.25 2.30 -0.45 7.38 5.75 -1.13 -2.26 116.55 127.89 2q4s n ASP 87 Ca -0.08 -2.56 0.06 0.00 -0.01 0.00 0.00 54.79 52.20 2q4s n ASP 87 Cb 0.63 -0.16 0.11 0.00 -1.03 0.00 0.00 41.12 40.66 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 -1.82 0.00 -3.65 2.11 8.25 -1.26 -4.56 115.22 114.30 2q4s n HIS 88 Ca 0.04 -0.79 -0.21 0.00 -0.26 0.00 0.00 57.72 56.50 2q4s n HIS 88 Cb 0.54 -0.15 0.04 0.00 1.12 0.00 0.00 29.99 31.55 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 -0.79 -4.74 -3.71 1.59 -1.04 -1.26 -2.32 114.28 102.01 2q4s n THR 89 Ca 0.11 -0.49 -0.28 0.00 -2.04 0.00 0.00 64.05 61.36 2q4s n THR 89 Cb 0.72 -4.02 0.03 0.00 -1.82 0.00 0.00 70.33 65.25 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 -5.04 -4.21 8.00 8.00 -1.26 -4.98 116.55 114.00 2q4s n ASP 90 Ca -0.29 -0.65 -0.14 0.00 0.71 0.00 0.00 54.79 54.42 2q4s n ASP 90 Cb 0.67 -4.03 -0.10 0.00 -0.02 0.00 0.00 41.12 37.64 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 -3.16 1.58 0.44 -2.24 0.01 -0.98 -4.72 113.70 104.63 2q4s s SER 91 Ca 0.59 -0.90 -0.23 0.00 1.31 0.00 0.00 55.95 56.71 2q4s s SER 91 Cb -0.29 0.01 -0.08 0.00 0.21 0.00 0.00 66.02 65.86 2q4s s SER 91 CO 0.73 -0.30 1.10 -1.00 0.41 0.00 0.00 173.24 174.18 2q4s s HIS 92 N -2.86 3.05 -0.07 2.43 3.76 0.36 -4.56 115.29 117.40 2q4s s HIS 92 Ca 0.10 1.59 -0.03 0.00 -0.15 0.00 0.00 55.06 56.57 2q4s s HIS 92 Cb -0.00 -3.23 0.04 0.00 1.11 0.00 0.00 32.58 30.49 2q4s s HIS 92 CO -0.00 -1.05 0.13 0.00 -0.85 0.00 0.00 174.74 172.96 2q4s s PHE 94 N 2.24 2.66 -0.09 0.00 0.08 -0.63 -1.14 117.98 121.11 2q4s s PHE 94 Ca 0.04 -0.19 -0.02 0.00 0.12 0.00 0.00 56.93 56.88 2q4s s PHE 94 Cb -0.12 -1.55 0.04 0.00 -0.57 0.00 0.00 43.02 40.82 2q4s s PHE 94 CO -0.05 0.25 0.03 -1.17 -0.10 0.00 0.00 175.22 174.18 2q4s s LEU 95 N -1.19 0.50 -0.08 -0.37 0.20 -0.24 -1.92 118.68 115.59 2q4s s LEU 95 Ca 0.14 -0.18 0.04 0.00 0.69 0.00 0.00 54.13 54.82 2q4s s LEU 95 Cb -0.11 -0.35 -0.02 0.00 -0.43 0.00 0.00 46.19 45.29 2q4s s LEU 95 CO 0.04 -0.24 -0.19 -0.75 -0.29 0.00 0.00 176.35 174.92 2q4s s LYS 96 N 2.03 2.79 0.08 1.98 2.20 0.03 -0.07 119.74 128.78 2q4s s LYS 96 Ca 0.04 -0.79 -0.30 0.00 -0.36 0.00 0.00 55.97 54.56 2q4s s LYS 96 Cb -0.13 -2.35 -0.05 0.00 -1.51 0.00 0.00 37.83 33.79 2q4s s LYS 96 CO -0.05 0.39 0.99 -0.51 -0.36 0.00 0.00 175.35 175.81 2q4s s LEU 97 N -0.14 4.45 -0.11 5.43 2.01 -0.20 -0.57 118.68 129.55 2q4s s LEU 97 Ca -0.03 1.80 0.15 0.00 0.01 0.00 0.00 54.13 56.06 2q4s s LEU 97 Cb -0.14 -3.58 -0.22 0.00 0.01 0.00 0.00 46.19 42.26 2q4s s LEU 97 CO 0.04 -0.16 0.17 0.18 1.01 0.00 0.00 176.35 177.59 2q4s n LEU 98 N 3.12 0.00 -3.63 1.79 4.77 0.20 -0.54 117.00 122.72 2q4s n LEU 98 Ca 0.04 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.92 2q4s n LEU 98 Cb 0.49 0.26 -0.07 0.00 -2.33 0.00 0.00 43.42 41.78 2q4s n LEU 98 CO 0.52 0.26 0.74 -1.58 -1.33 0.00 0.00 177.39 176.00 2q4s s GLN 99 N -2.67 0.52 1.43 3.23 0.74 -0.85 -4.82 119.66 117.25 2q4s s GLN 99 Ca -0.07 0.55 0.00 0.00 0.05 0.00 0.00 55.36 55.88 2q4s s GLN 99 Cb 0.07 0.25 0.00 0.00 1.10 0.00 0.00 33.01 34.43 2q4s s GLN 99 CO 0.68 -0.08 0.00 0.41 -0.55 0.00 0.00 175.29 175.75 2q4s n GLY 100 N 2.04 -1.66 2.94 2.59 0.00 -1.26 -0.17 105.19 109.66 2q4s n GLY 100 Ca -0.12 -1.48 -0.14 0.00 0.00 0.00 0.00 46.02 44.28 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 0.42 -0.03 1.61 0.01 -1.26 -3.67 114.94 108.02 2q4s s ASN 101 Ca 0.00 -0.11 0.05 0.00 -0.71 0.00 0.00 52.86 52.08 2q4s s ASN 101 Cb 0.00 -0.03 -0.01 0.00 0.41 0.00 0.00 41.25 41.62 2q4s s ASN 101 CO 0.00 0.01 -0.16 -0.76 -1.51 0.00 0.00 177.10 174.68 2q4s s LEU 102 N -0.24 1.96 -0.09 0.60 1.43 -0.84 -4.54 118.68 116.97 2q4s s LEU 102 Ca -0.00 -0.31 -0.11 0.00 -1.03 0.00 0.00 54.13 52.67 2q4s s LEU 102 Cb -0.02 -0.88 -0.05 0.00 0.03 0.00 0.00 46.19 45.27 2q4s s LEU 102 CO -0.00 0.17 0.27 -0.75 0.23 0.00 0.00 176.35 176.27 2q4s s LYS 103 N -0.17 3.84 -0.14 1.70 2.20 0.17 0.37 119.74 127.71 2q4s s LYS 103 Ca 0.02 0.10 0.01 0.00 -0.36 0.00 0.00 55.97 55.73 2q4s s LYS 103 Cb -0.09 -3.27 -0.00 0.00 -1.51 0.00 0.00 37.83 32.96 2q4s s LYS 103 CO 0.01 0.59 -0.17 -2.00 -0.36 0.00 0.00 175.35 173.42 2q4s s GLU 104 N -0.60 3.21 -0.18 4.03 2.12 0.12 -0.61 118.70 126.80 2q4s s GLU 104 Ca 0.18 -0.76 -0.03 0.00 0.36 0.00 0.00 54.97 54.72 2q4s s GLU 104 Cb -0.14 -2.57 -0.02 0.00 0.26 0.00 0.00 34.13 31.67 2q4s s GLU 104 CO 0.07 0.08 -0.06 0.99 -0.54 0.00 0.00 175.26 175.80 2q4s s THR 105 N 0.65 3.50 -0.08 -1.70 2.01 0.16 -1.87 115.64 118.31 2q4s s THR 105 Ca -0.09 -0.48 -0.10 0.00 0.31 0.00 0.00 61.69 61.34 2q4s s THR 105 Cb -0.16 -2.54 -0.05 0.00 0.01 0.00 0.00 72.50 69.76 2q4s s THR 105 CO 0.02 0.47 0.24 -0.76 -0.69 0.00 0.00 174.62 173.90 2q4s s LEU 106 N 0.84 4.42 0.12 4.42 1.43 0.47 -0.99 118.68 129.39 2q4s s LEU 106 Ca -0.02 0.65 0.03 0.00 -1.03 0.00 0.00 54.13 53.77 2q4s s LEU 106 Cb -0.15 -2.27 -0.04 0.00 0.03 0.00 0.00 46.19 43.76 2q4s s LEU 106 CO 0.01 0.37 -0.09 -0.36 0.23 0.00 0.00 176.35 176.52 2q4s s PHE 107 N -1.02 1.11 0.26 0.29 0.08 -0.84 0.21 117.98 118.07 2q4s s PHE 107 Ca 0.18 -0.79 -0.06 0.00 0.12 0.00 0.00 56.93 56.38 2q4s s PHE 107 Cb -0.14 -0.59 -0.06 0.00 -0.57 0.00 0.00 43.02 41.66 2q4s s PHE 107 CO 0.07 -0.00 0.52 -0.51 -0.10 0.00 0.00 175.22 175.20 2q4s s ASP 108 N -3.01 6.48 0.48 1.36 1.01 -1.26 -1.43 116.67 120.30 2q4s s ASP 108 Ca 0.13 0.73 -0.24 0.00 0.71 0.00 0.00 52.55 53.88 2q4s s ASP 108 Cb 0.03 -2.15 -0.07 0.00 1.01 0.00 0.00 42.92 41.73 2q4s s ASP 108 CO -0.01 -0.14 1.35 0.79 0.21 0.00 0.00 175.17 177.38 2q4s n TRP 109 N -0.65 2.37 -1.71 4.23 7.02 -1.26 -4.81 117.44 122.63 2q4s n TRP 109 Ca -0.01 0.45 -0.37 0.00 -1.02 0.00 0.00 57.50 56.54 2q4s n TRP 109 Cb 0.53 -2.40 0.06 0.00 -2.42 0.00 0.00 31.31 27.09 2q4s n TRP 109 CO 0.00 0.00 0.00 -2.30 -2.02 0.00 0.00 177.69 173.37 2q4s n PRO 110 N -0.43 1.15 0.00 -0.99 -0.02 -1.26 -5.03 135.00 128.42 2q4s n PRO 110 Ca 0.07 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 2q4s n PRO 110 Cb 0.42 -2.48 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 2q4s n PRO 110 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2q4s n ASP 111 N -1.59 0.00 0.00 2.55 8.00 -1.26 -5.11 116.55 119.14 2q4s n ASP 111 Ca 0.15 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.65 2q4s n ASP 111 Cb 0.47 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.57 2q4s n ASP 111 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2q4s n LYS 112 N 0.00 0.00 -1.47 -1.24 4.76 -1.26 -4.81 118.16 114.14 2q4s n LYS 112 Ca 0.00 0.00 -0.54 0.00 -2.87 0.00 0.00 58.31 54.90 2q4s n LYS 112 Cb 0.00 -0.23 -0.06 0.00 -1.84 0.00 0.00 35.03 32.90 2q4s n LYS 112 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2q4s n LYS 113 N 0.00 0.09 -1.64 1.97 4.76 -1.26 -4.72 118.16 117.35 2q4s n LYS 113 Ca 0.00 0.03 -0.42 0.00 -2.87 0.00 0.00 58.31 55.05 2q4s n LYS 113 Cb 0.00 -1.35 -0.02 0.00 -1.84 0.00 0.00 35.03 31.83 2q4s n LYS 113 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2q4s n SER 114 N 1.73 3.58 -4.92 4.39 2.88 -1.26 -4.90 113.62 115.13 2q4s n SER 114 Ca 0.19 -2.80 -0.20 0.00 -1.33 0.00 0.00 58.87 54.73 2q4s n SER 114 Cb 0.16 -1.53 0.06 0.00 -0.75 0.00 0.00 64.21 62.14 2q4s n SER 114 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2q4s n ASN 115 N 6.73 2.16 0.00 -3.46 3.02 -1.21 -4.67 115.26 117.84 2q4s n ASN 115 Ca 0.51 -2.57 0.00 0.00 -0.03 0.00 0.00 54.58 52.50 2q4s n ASN 115 Cb 0.40 -0.39 0.00 0.00 -0.61 0.00 0.00 39.78 39.18 2q4s n ASN 115 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 2q4s n GLU 116 N -2.21 2.80 -3.64 3.52 2.13 -1.06 -3.22 120.64 118.95 2q4s n GLU 116 Ca 0.15 0.00 -0.09 0.00 0.66 0.00 0.00 57.16 57.88 2q4s n GLU 116 Cb 0.60 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 32.24 2q4s n GLU 116 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 2q4s s ILE 118 N 0.00 0.00 0.42 6.31 -1.09 -1.26 -4.91 121.20 120.66 2q4s s ILE 118 Ca 0.00 0.00 -0.26 0.00 -2.23 0.00 0.00 60.65 58.16 2q4s s ILE 118 Cb 0.00 -1.00 -0.09 0.00 -1.58 0.00 0.00 42.46 39.79 2q4s s ILE 118 CO 0.00 0.00 1.39 -1.59 -1.23 0.00 0.00 174.94 173.51 2q4s s LYS 119 N 1.15 3.86 -0.06 2.79 -2.85 -1.26 -4.56 119.74 118.81 2q4s s LYS 119 Ca -0.06 2.35 0.02 0.00 -1.00 0.00 0.00 55.97 57.28 2q4s s LYS 119 Cb -0.05 -2.75 -0.25 0.00 -2.06 0.00 0.00 37.83 32.72 2q4s s LYS 119 CO -0.12 -0.65 0.60 1.57 0.10 0.00 0.00 175.35 176.84 2q4s h LYS 120 N 2.57 0.15 -1.77 1.78 2.10 -0.60 -3.49 116.57 117.32 2q4s h LYS 120 Ca -0.50 -0.26 0.26 0.00 -2.00 0.00 0.00 60.65 58.14 2q4s h LYS 120 Cb 1.25 0.10 -0.12 0.00 -0.90 0.00 0.00 32.23 32.56 2q4s h LYS 120 CO 0.62 0.90 0.70 -1.54 -2.00 0.00 0.00 179.45 178.13 2q4s s SER 121 N -6.64 -0.13 0.25 7.07 1.04 -1.20 -5.01 113.70 109.08 2q4s s SER 121 Ca -0.12 -0.18 -0.03 0.00 0.48 0.00 0.00 55.95 56.09 2q4s s SER 121 Cb 0.07 0.27 -0.02 0.00 0.10 0.00 0.00 66.02 66.44 2q4s s SER 121 CO 0.81 -0.49 0.30 -1.83 0.98 0.00 0.00 173.24 173.01 2q4s s GLU 122 N -2.73 1.48 -0.10 4.02 -1.05 -1.26 -0.40 118.70 118.66 2q4s s GLU 122 Ca 0.12 -1.60 -0.32 0.00 -0.15 0.00 0.00 54.97 53.02 2q4s s GLU 122 Cb 0.02 0.36 0.12 0.00 -0.44 0.00 0.00 34.13 34.19 2q4s s GLU 122 CO -0.03 -0.56 1.13 -0.98 0.95 0.00 0.00 175.26 175.78 2q4s s ARG 123 N -3.85 0.49 -0.18 -4.83 1.70 -0.78 -4.99 118.95 106.51 2q4s s ARG 123 Ca 0.33 -0.20 -0.03 0.00 -0.47 0.00 0.00 55.73 55.36 2q4s s ARG 123 Cb 0.03 0.21 -0.01 0.00 -0.57 0.00 0.00 34.95 34.61 2q4s s ARG 123 CO 0.14 -0.22 -0.06 0.99 -1.08 0.00 0.00 175.30 175.07 2q4s s THR 124 N -2.63 3.43 -0.15 4.99 2.01 -1.26 0.13 115.64 122.15 2q4s s THR 124 Ca 0.09 -0.50 -0.11 0.00 0.31 0.00 0.00 61.69 61.49 2q4s s THR 124 Cb -0.00 -2.52 -0.05 0.00 0.01 0.00 0.00 72.50 69.94 2q4s s THR 124 CO -0.05 0.47 0.20 -0.76 -0.69 0.00 0.00 174.62 173.78 2q4s s LEU 125 N 0.91 4.28 0.48 4.42 1.43 0.16 -4.97 118.68 125.38 2q4s s LEU 125 Ca -0.01 0.42 0.06 0.00 -1.03 0.00 0.00 54.13 53.57 2q4s s LEU 125 Cb -0.15 -2.20 -0.01 0.00 0.03 0.00 0.00 46.19 43.87 2q4s s LEU 125 CO 0.01 0.23 0.28 -0.13 0.23 0.00 0.00 176.35 176.97 2q4s s ARG 126 N -0.07 2.28 0.22 1.70 0.52 -1.26 -1.98 118.95 120.35 2q4s s ARG 126 Ca 0.13 -1.93 -0.31 0.00 -0.52 0.00 0.00 55.73 53.10 2q4s s ARG 126 Cb -0.12 -2.04 -0.15 0.00 0.52 0.00 0.00 34.95 33.16 2q4s s ARG 126 CO 0.02 -0.36 1.10 0.39 0.02 0.00 0.00 175.30 176.47 2q4s n GLU 127 N -1.50 1.22 -0.04 3.54 1.02 -1.24 -1.95 120.64 121.68 2q4s n GLU 127 Ca -0.02 0.43 0.00 0.00 -0.02 0.00 0.00 57.16 57.55 2q4s n GLU 127 Cb 0.64 -1.87 0.00 0.00 -0.02 0.00 0.00 31.44 30.19 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 1.75 0.00 -4.77 1.62 3.02 0.30 -4.94 115.26 112.25 2q4s n ASN 128 Ca 0.13 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.30 2q4s n ASN 128 Cb 0.27 -0.64 -0.02 0.00 -0.61 0.00 0.00 39.78 38.78 2q4s n ASN 128 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 2q4s s GLN 129 N -0.02 4.15 -0.15 3.52 0.74 -0.82 -4.54 119.66 122.54 2q4s s GLN 129 Ca 0.00 1.84 0.01 0.00 0.05 0.00 0.00 55.36 57.26 2q4s s GLN 129 Cb 0.00 -2.75 0.02 0.00 1.10 0.00 0.00 33.01 31.37 2q4s s GLN 129 CO 0.00 -0.23 -0.16 0.00 -0.55 0.00 0.00 175.29 174.35 2q4s s ALA 131 N 1.34 4.19 0.00 0.00 0.00 0.90 -4.92 121.76 123.27 2q4s s ALA 131 Ca 0.03 -1.42 -0.00 0.00 0.00 0.00 0.00 51.96 50.57 2q4s s ALA 131 Cb -0.13 -1.71 -0.01 0.00 0.00 0.00 0.00 23.12 21.27 2q4s s ALA 131 CO -0.09 -0.03 -0.00 -0.47 0.00 0.00 0.00 175.76 175.16 2q4s s TYR 132 N -2.18 0.07 0.02 0.00 6.14 -1.26 -1.08 117.35 119.06 2q4s s TYR 132 Ca 0.44 -0.14 -0.14 0.00 0.64 0.00 0.00 57.07 57.87 2q4s s TYR 132 Cb -0.10 -0.05 0.02 0.00 0.42 0.00 0.00 41.96 42.26 2q4s s TYR 132 CO 0.31 -0.05 0.31 -1.50 0.64 0.00 0.00 175.55 175.26 2q4s s ILE 133 N -0.40 0.07 0.23 3.14 2.07 -0.29 -5.03 121.20 120.99 2q4s s ILE 133 Ca -0.04 -0.60 -0.10 0.00 -1.41 0.00 0.00 60.65 58.49 2q4s s ILE 133 Cb -0.03 -0.84 -0.01 0.00 0.13 0.00 0.00 42.46 41.71 2q4s s ILE 133 CO -0.00 -0.33 0.39 0.54 -1.91 0.00 0.00 174.94 173.62 2q4s s ASN 134 N -1.82 -0.03 0.60 4.50 2.20 -1.26 -2.03 114.94 117.09 2q4s s ASN 134 Ca -0.08 -1.00 0.33 0.00 -0.94 0.00 0.00 52.86 51.18 2q4s s ASN 134 Cb -0.02 0.53 1.92 0.00 -2.00 0.00 0.00 41.25 41.67 2q4s s ASN 134 CO -0.01 -1.05 2.25 0.44 -2.94 0.00 0.00 177.10 175.79 2q4s h ASP 135 N 2.36 0.00 -0.41 3.54 3.32 -1.80 -1.95 116.42 121.47 2q4s h ASP 135 Ca -0.29 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.76 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 0.24 -1.28 -1.72 0.00 0.00 179.24 176.90 2q4s h SER 136 N 0.00 0.50 -0.53 6.45 0.87 -1.97 -2.96 113.55 115.91 2q4s h SER 136 Ca -0.00 -0.07 -0.07 0.00 -1.23 0.00 0.00 61.79 60.43 2q4s h SER 136 Cb 0.07 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 61.88 2q4s h SER 136 CO 0.00 0.42 0.06 0.40 -0.53 0.00 0.00 176.83 177.18 2q4s h ILE 137 N 0.54 1.26 0.00 2.23 2.04 -1.77 -3.50 117.51 118.31 2q4s h ILE 137 Ca 0.15 -0.99 0.00 0.00 1.00 0.00 0.00 64.86 65.01 2q4s h ILE 137 Cb 0.02 0.87 0.00 0.00 -0.74 0.00 0.00 36.82 36.97 2q4s h ILE 137 CO -0.03 0.36 0.00 0.61 0.00 0.00 0.00 178.15 179.09 2q4s n GLY 138 N -0.49 0.45 3.69 5.37 0.00 -1.10 -4.96 105.19 108.14 2q4s n GLY 138 Ca 0.02 -1.34 -0.27 0.00 0.00 0.00 0.00 46.02 44.43 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 2.95 0.05 0.99 1.43 -0.51 -4.36 118.68 119.23 2q4s s LEU 139 Ca 0.00 -1.25 -0.27 0.00 -1.03 0.00 0.00 54.13 51.58 2q4s s LEU 139 Cb 0.00 -1.15 0.07 0.00 0.03 0.00 0.00 46.19 45.14 2q4s s LEU 139 CO 0.00 -0.53 0.65 -1.38 0.23 0.00 0.00 176.35 175.32 2q4s s HIS 140 N -2.67 -0.59 -0.00 0.29 -3.43 -0.96 -1.99 115.29 105.94 2q4s s HIS 140 Ca 0.36 0.72 0.05 0.00 -0.80 0.00 0.00 55.06 55.39 2q4s s HIS 140 Cb 0.06 0.49 -0.03 0.00 -1.43 0.00 0.00 32.58 31.67 2q4s s HIS 140 CO 0.19 -0.72 -0.15 0.50 -2.00 0.00 0.00 174.74 172.57 2q4s s ARG 141 N -2.46 2.33 0.00 -0.38 3.52 -0.16 -0.58 118.95 121.23 2q4s s ARG 141 Ca -0.05 -0.82 0.06 0.00 -0.13 0.00 0.00 55.73 54.80 2q4s s ARG 141 Cb -0.01 -2.32 -0.03 0.00 -1.56 0.00 0.00 34.95 31.04 2q4s s ARG 141 CO -0.02 0.59 -0.19 0.08 -0.81 0.00 0.00 175.30 174.95 2q4s s VAL 142 N -0.85 2.69 -0.15 7.11 1.01 -1.26 -0.66 120.40 128.28 2q4s s VAL 142 Ca 0.14 -1.04 -0.13 0.00 0.00 0.00 0.00 61.98 60.95 2q4s s VAL 142 Cb -0.11 -2.06 0.04 0.00 0.00 0.00 0.00 36.38 34.25 2q4s s VAL 142 CO 0.04 0.47 0.39 -1.61 0.00 0.00 0.00 175.10 174.38 2q4s s GLU 143 N -1.03 0.44 -0.93 2.72 2.02 0.22 0.47 118.70 122.60 2q4s s GLU 143 Ca 0.13 0.57 -0.10 0.00 0.02 0.00 0.00 54.97 55.58 2q4s s GLU 143 Cb -0.10 0.19 0.24 0.00 0.10 0.00 0.00 34.13 34.55 2q4s s GLU 143 CO 0.02 -0.07 0.88 1.21 0.02 0.00 0.00 175.26 177.33 2q4s s ASN 144 N 0.36 6.82 0.00 -0.19 2.47 0.20 0.44 114.94 125.04 2q4s s ASN 144 Ca -0.01 -3.16 0.16 0.00 0.42 0.00 0.00 52.86 50.27 2q4s s ASN 144 Cb -0.03 -2.16 0.94 0.00 -1.45 0.00 0.00 41.25 38.54 2q4s s ASN 144 CO -0.01 -0.41 1.39 1.33 -3.72 0.00 0.00 177.10 175.68 2q4s n VAL 145 N 3.29 0.00 -1.82 -5.21 0.24 -1.26 -0.95 118.33 112.62 2q4s n VAL 145 Ca 0.18 0.00 -0.38 0.00 -2.04 0.00 0.00 64.34 62.10 2q4s n VAL 145 Cb 0.42 -0.55 0.04 0.00 -1.47 0.00 0.00 33.84 32.28 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 -1.84 5.32 -0.00 -1.34 0.15 -1.26 -4.59 113.70 110.14 2q4s s SER 146 Ca 0.24 2.72 0.22 0.00 0.70 0.00 0.00 55.95 59.82 2q4s s SER 146 Cb 0.11 -2.63 -0.19 0.00 -1.71 0.00 0.00 66.02 61.60 2q4s s SER 146 CO 0.18 -1.54 0.87 1.41 1.20 0.00 0.00 173.24 175.37 2q4s n HIS 147 N -1.02 0.02 0.00 3.44 8.25 -1.26 -0.78 115.22 123.87 2q4s n HIS 147 Ca 0.10 0.01 0.00 0.00 -0.26 0.00 0.00 57.72 57.57 2q4s n HIS 147 Cb 0.45 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 31.44 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 -1.65 0.00 -3.94 1.59 -2.24 -1.26 -4.92 114.28 101.86 2q4s n THR 148 Ca 0.03 -0.23 -0.29 0.00 -2.27 0.00 0.00 64.05 61.28 2q4s n THR 148 Cb 0.38 0.78 -0.16 0.00 -2.10 0.00 0.00 70.33 69.22 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 -0.92 1.70 0.73 -0.78 0.41 -1.26 -5.01 118.70 113.56 2q4s s GLU 149 Ca 0.00 -0.71 -0.15 0.00 -0.41 0.00 0.00 54.97 53.70 2q4s s GLU 149 Cb 0.00 -2.26 0.04 0.00 -1.78 0.00 0.00 34.13 30.13 2q4s s GLU 149 CO 0.00 -0.45 1.20 -2.14 -0.49 0.00 0.00 175.26 173.37 2q4s s PRO 150 N 1.51 2.17 0.23 0.39 0.01 -1.26 -4.57 135.00 133.48 2q4s s PRO 150 Ca -0.01 1.73 0.10 0.00 0.01 0.00 0.00 61.00 62.83 2q4s s PRO 150 Cb -0.16 -1.84 -0.04 0.00 0.01 0.00 0.00 34.50 32.46 2q4s s PRO 150 CO -0.08 -1.80 -0.10 0.00 0.01 0.00 0.00 177.00 175.03 2q4s s ALA 151 N -2.02 2.94 -0.03 -1.55 0.00 0.91 -4.21 121.76 117.79 2q4s s ALA 151 Ca 0.74 -1.64 -0.01 0.00 0.00 0.00 0.00 51.96 51.04 2q4s s ALA 151 Cb -0.28 -0.60 0.03 0.00 0.00 0.00 0.00 23.12 22.26 2q4s s ALA 151 CO 0.45 0.35 0.04 0.08 0.00 0.00 0.00 175.76 176.69 2q4s s VAL 152 N -2.09 -0.06 0.12 0.00 1.01 0.76 -0.70 120.40 119.44 2q4s s VAL 152 Ca 0.28 0.32 0.07 0.00 0.00 0.00 0.00 61.98 62.65 2q4s s VAL 152 Cb -0.07 -0.14 -0.04 0.00 0.00 0.00 0.00 36.38 36.13 2q4s s VAL 152 CO 0.16 0.15 -0.17 -0.94 0.00 0.00 0.00 175.10 174.30 2q4s s SER 153 N 1.68 2.29 -0.27 3.32 1.04 -0.44 0.61 113.70 121.94 2q4s s SER 153 Ca -0.01 -0.77 -0.04 0.00 0.48 0.00 0.00 55.95 55.61 2q4s s SER 153 Cb -0.12 -0.11 0.01 0.00 0.10 0.00 0.00 66.02 65.90 2q4s s SER 153 CO -0.03 -0.05 0.01 -0.22 0.98 0.00 0.00 173.24 173.93 2q4s s LEU 154 N -2.27 3.45 -0.11 2.42 2.96 0.27 -0.04 118.68 125.36 2q4s s LEU 154 Ca 0.09 -0.72 0.01 0.00 -0.22 0.00 0.00 54.13 53.28 2q4s s LEU 154 Cb -0.07 -1.78 -0.02 0.00 0.50 0.00 0.00 46.19 44.82 2q4s s LEU 154 CO 0.04 -0.14 -0.12 -1.00 -1.32 0.00 0.00 176.35 173.81 2q4s s HIS 155 N 1.43 2.81 -0.16 5.38 3.76 -1.26 -0.79 115.29 126.46 2q4s s HIS 155 Ca 0.02 -0.43 0.00 0.00 -0.15 0.00 0.00 55.06 54.50 2q4s s HIS 155 Cb -0.17 -1.79 0.03 0.00 1.11 0.00 0.00 32.58 31.77 2q4s s HIS 155 CO -0.01 -0.05 -0.11 -1.17 -0.85 0.00 0.00 174.74 172.55 2q4s s LEU 156 N -0.03 1.76 -0.01 0.89 0.20 -0.81 -4.22 118.68 116.46 2q4s s LEU 156 Ca -0.03 -0.59 0.03 0.00 0.69 0.00 0.00 54.13 54.23 2q4s s LEU 156 Cb -0.14 -1.11 -0.03 0.00 -0.43 0.00 0.00 46.19 44.48 2q4s s LEU 156 CO 0.04 -0.11 -0.06 -0.31 -0.29 0.00 0.00 176.35 175.62 2q4s s TYR 157 N 1.52 2.91 -0.18 5.38 2.02 -0.78 -1.60 117.35 126.62 2q4s s TYR 157 Ca 0.03 -0.02 -0.06 0.00 -0.37 0.00 0.00 57.07 56.65 2q4s s TYR 157 Cb -0.14 -1.63 0.09 0.00 -0.40 0.00 0.00 41.96 39.88 2q4s s TYR 157 CO -0.09 0.37 0.35 0.45 -1.57 0.00 0.00 175.55 175.06 2q4s s SER 158 N -1.32 0.08 0.90 2.29 0.15 -0.33 -2.47 113.70 113.01 2q4s s SER 158 Ca 0.16 0.72 -0.12 0.00 0.70 0.00 0.00 55.95 57.42 2q4s s SER 158 Cb -0.11 1.05 0.13 0.00 -1.71 0.00 0.00 66.02 65.38 2q4s s SER 158 CO 0.07 -0.25 1.09 -2.84 1.20 0.00 0.00 173.24 172.52 2q4s s PRO 159 N 2.53 1.21 0.56 5.44 0.02 -1.26 0.13 135.00 143.63 2q4s s PRO 159 Ca 0.01 0.73 -0.20 0.00 0.02 0.00 0.00 61.00 61.55 2q4s s PRO 159 Cb -0.13 -1.81 -0.04 0.00 0.02 0.00 0.00 34.50 32.54 2q4s s PRO 159 CO -0.11 -2.25 1.27 -2.14 -0.33 0.00 0.00 177.00 173.43 2q4s s PRO 160 N -4.98 3.10 -0.05 5.54 0.02 -1.26 -4.74 135.00 132.63 2q4s s PRO 160 Ca 0.63 2.00 -0.12 0.00 0.02 0.00 0.00 61.00 63.53 2q4s s PRO 160 Cb -0.17 -2.11 0.02 0.00 0.02 0.00 0.00 34.50 32.26 2q4s s PRO 160 CO 0.57 -1.15 0.28 -0.59 -0.33 0.00 0.00 177.00 175.77 2q4s s PHE 161 N -1.45 -0.20 0.00 6.54 -0.12 -1.26 -5.04 117.98 116.44 2q4s s PHE 161 Ca 0.74 0.41 0.00 0.00 -0.05 0.00 0.00 56.93 58.03 2q4s s PHE 161 Cb -0.35 0.08 0.00 0.00 -0.63 0.00 0.00 43.02 42.12 2q4s s PHE 161 CO 0.39 -0.28 0.74 -0.40 -0.05 0.00 0.00 175.22 175.63 2q4s n ASP 162 N 1.97 1.46 -4.15 1.98 5.68 -1.26 -5.02 116.55 117.22 2q4s n ASP 162 Ca -0.18 -1.51 -0.16 0.00 -0.50 0.00 0.00 54.79 52.44 2q4s n ASP 162 Cb 0.57 0.00 -0.11 0.00 -1.14 0.00 0.00 41.12 40.43 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 -0.51 0.93 0.05 2.12 -4.23 -1.26 -4.62 115.64 108.12 2q4s s THR 163 Ca 0.00 -1.35 -0.02 0.00 -1.18 0.00 0.00 61.69 59.14 2q4s s THR 163 Cb 0.00 -1.04 0.01 0.00 1.34 0.00 0.00 72.50 72.80 2q4s s THR 163 CO 0.00 -0.36 0.10 0.00 -0.54 0.00 0.00 174.62 173.82 2q4s s HIS 165 N -7.77 1.92 -0.03 0.00 3.76 -1.26 0.18 115.29 112.09 2q4s s HIS 165 Ca 0.02 -0.38 -0.01 0.00 -0.15 0.00 0.00 55.06 54.55 2q4s s HIS 165 Cb -0.01 -1.17 -0.04 0.00 1.11 0.00 0.00 32.58 32.48 2q4s s HIS 165 CO 0.02 0.07 0.05 0.00 -0.85 0.00 0.00 174.74 174.02 2q4s s ALA 166 N -0.72 3.46 -0.10 -1.40 0.00 -0.74 -2.85 121.76 119.41 2q4s s ALA 166 Ca 0.08 -0.86 0.04 0.00 0.00 0.00 0.00 51.96 51.22 2q4s s ALA 166 Cb -0.09 -1.52 -0.01 0.00 0.00 0.00 0.00 23.12 21.50 2q4s s ALA 166 CO 0.01 0.65 -0.22 -0.06 0.00 0.00 0.00 175.76 176.14 2q4s s PHE 167 N -1.08 2.59 -0.21 0.00 0.08 -0.30 -1.52 117.98 117.54 2q4s s PHE 167 Ca 0.19 -0.89 -0.29 0.00 0.12 0.00 0.00 56.93 56.06 2q4s s PHE 167 Cb -0.12 -1.71 -0.00 0.00 -0.57 0.00 0.00 43.02 40.62 2q4s s PHE 167 CO 0.09 -0.32 1.21 0.34 -0.10 0.00 0.00 175.22 176.44 2q4s s ASP 168 N 0.21 6.93 0.45 1.36 2.15 -0.64 -4.25 116.67 122.88 2q4s s ASP 168 Ca -0.14 1.52 0.30 0.00 0.43 0.00 0.00 52.55 54.66 2q4s s ASP 168 Cb -0.17 -2.54 1.61 0.00 -0.30 0.00 0.00 42.92 41.53 2q4s s ASP 168 CO 0.07 -0.80 1.90 -0.61 -0.17 0.00 0.00 175.17 175.57 2q4s h GLN 169 N 8.21 0.00 0.00 4.34 4.15 -1.96 0.68 115.11 130.52 2q4s h GLN 169 Ca -0.24 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.18 2q4s h GLN 169 Cb 1.09 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.78 2q4s h GLN 169 CO 0.99 0.00 -1.28 0.54 -1.93 0.00 0.00 178.83 177.14 2q4s n ARG 170 N -2.55 0.49 0.00 1.69 5.12 -1.26 -4.59 116.66 115.56 2q4s n ARG 170 Ca -0.02 -0.01 0.00 0.00 -1.93 0.00 0.00 57.85 55.89 2q4s n ARG 170 Cb 0.07 -1.65 0.00 0.00 -1.16 0.00 0.00 32.46 29.72 2q4s n ARG 170 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 2q4s n THR 171 N -2.27 0.00 -0.56 0.55 -2.24 -0.84 -2.56 114.28 106.36 2q4s n THR 171 Ca -0.00 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 2q4s n THR 171 Cb 0.51 0.31 0.00 0.00 -2.10 0.00 0.00 70.33 69.05 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 0.74 1.44 3.76 3.38 0.00 0.17 -3.31 105.19 111.37 2q4s n GLY 172 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 -3.39 3.18 0.29 1.61 5.04 -1.26 -4.68 115.29 116.07 2q4s s HIS 173 Ca 0.00 1.35 0.09 0.00 -1.54 0.00 0.00 55.06 54.96 2q4s s HIS 173 Cb 0.00 -3.62 -0.04 0.00 0.04 0.00 0.00 32.58 28.96 2q4s s HIS 173 CO 0.00 -1.78 0.06 -1.59 -2.34 0.00 0.00 174.74 169.09 2q4s s LYS 174 N -1.10 2.35 -0.02 2.88 -2.85 -1.26 -1.63 119.74 118.11 2q4s s LYS 174 Ca 0.52 -1.46 -0.02 0.00 -1.00 0.00 0.00 55.97 54.01 2q4s s LYS 174 Cb -0.38 -2.18 0.00 0.00 -2.06 0.00 0.00 37.83 33.22 2q4s s LYS 174 CO 0.46 0.27 0.05 0.54 0.10 0.00 0.00 175.35 176.77 2q4s s ASN 175 N -3.74 -0.05 0.47 0.03 4.22 -0.58 -4.96 114.94 110.33 2q4s s ASN 175 Ca 0.34 0.08 -0.24 0.00 -2.14 0.00 0.00 52.86 50.90 2q4s s ASN 175 Cb -0.05 0.11 -0.07 0.00 1.28 0.00 0.00 41.25 42.52 2q4s s ASN 175 CO 0.21 -0.03 1.33 -0.75 -2.04 0.00 0.00 177.10 175.82 2q4s s LYS 176 N -0.04 3.58 0.02 3.55 2.47 -1.26 -1.79 119.74 126.26 2q4s s LYS 176 Ca -0.01 2.19 0.07 0.00 -1.56 0.00 0.00 55.97 56.66 2q4s s LYS 176 Cb -0.01 -2.50 -0.02 0.00 -1.46 0.00 0.00 37.83 33.84 2q4s s LYS 176 CO 0.00 -0.83 -0.22 0.08 0.16 0.00 0.00 175.35 174.55 2q4s s VAL 177 N -1.31 1.74 0.00 4.02 1.01 0.13 -4.85 120.40 121.14 2q4s s VAL 177 Ca 0.64 -1.11 0.00 0.00 0.00 0.00 0.00 61.98 61.51 2q4s s VAL 177 Cb -0.39 -1.48 0.00 0.00 0.00 0.00 0.00 36.38 34.51 2q4s s VAL 177 CO 0.48 0.33 0.00 0.41 0.00 0.00 0.00 175.10 176.32 2q4s n THR 178 N 2.11 0.00 -3.65 3.92 -1.04 -1.26 -2.58 114.28 111.78 2q4s n THR 178 Ca -0.16 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.83 2q4s n THR 178 Cb 0.53 -0.48 -0.07 0.00 -1.82 0.00 0.00 70.33 68.49 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 0.24 0.00 -0.05 12.58 -4.23 -1.26 -5.03 115.64 117.89 2q4s s THR 180 Ca 0.00 0.00 -0.19 0.00 -1.18 0.00 0.00 61.69 60.32 2q4s s THR 180 Cb 0.00 -1.00 -0.05 0.00 1.34 0.00 0.00 72.50 72.79 2q4s s THR 180 CO 0.00 0.00 0.52 -0.36 -0.54 0.00 0.00 174.62 174.24 2q4s s PHE 181 N -0.16 3.61 0.12 3.99 0.08 -1.26 -4.49 117.98 119.88 2q4s s PHE 181 Ca 0.08 1.03 -0.00 0.00 0.12 0.00 0.00 56.93 58.17 2q4s s PHE 181 Cb -0.04 -2.54 -0.14 0.00 -0.57 0.00 0.00 43.02 39.73 2q4s s PHE 181 CO -0.16 0.31 1.27 1.25 -0.10 0.00 0.00 175.22 177.80 2q4s h HIS 182 N 5.98 0.36 -3.43 0.36 -0.00 -0.32 -3.43 115.15 114.67 2q4s h HIS 182 Ca -0.44 -0.23 -0.05 0.00 -0.00 0.00 0.00 60.37 59.65 2q4s h HIS 182 Cb 1.19 -0.03 -0.12 0.00 -0.00 0.00 0.00 27.41 28.46 2q4s h HIS 182 CO 0.65 1.11 -0.07 -1.54 -0.00 0.00 0.00 177.93 178.07 2q4s s SER 183 N -6.99 -0.21 -0.02 3.26 1.04 -1.20 -1.36 113.70 108.22 2q4s s SER 183 Ca -0.03 -0.44 -0.00 0.00 0.48 0.00 0.00 55.95 55.96 2q4s s SER 183 Cb 0.09 0.50 0.03 0.00 0.10 0.00 0.00 66.02 66.74 2q4s s SER 183 CO 0.85 -0.92 0.04 -0.54 0.98 0.00 0.00 173.24 173.65 2q4s s LYS 184 N -3.85 -0.05 -1.52 4.02 1.02 0.56 -1.39 119.74 118.54 2q4s s LYS 184 Ca 0.07 0.23 -0.12 0.00 0.02 0.00 0.00 55.97 56.17 2q4s s LYS 184 Cb 0.01 -0.30 0.08 0.00 -0.52 0.00 0.00 37.83 37.10 2q4s s LYS 184 CO -0.08 -0.20 0.89 1.19 -0.92 0.00 0.00 175.35 176.23 2q4s n PHE 185 N 4.42 -2.15 -0.18 3.18 3.72 -0.34 -0.99 117.46 125.11 2q4s n PHE 185 Ca -0.23 0.88 0.00 0.00 -0.05 0.00 0.00 57.45 58.05 2q4s n PHE 185 Cb 0.50 -3.89 0.00 0.00 -0.94 0.00 0.00 39.48 35.15 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 -1.66 2.19 3.57 1.37 0.00 -1.26 -5.02 105.19 104.39 2q4s n GLY 186 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 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 -3.03 5.07 0.25 -0.61 -1.09 -0.16 -4.96 121.20 116.67 2q4s s ILE 187 Ca 0.00 0.09 -0.30 0.00 -2.23 0.00 0.00 60.65 58.20 2q4s s ILE 187 Cb 0.00 -3.40 -0.11 0.00 -1.58 0.00 0.00 42.46 37.37 2q4s s ILE 187 CO 0.00 0.29 1.58 -0.60 -1.23 0.00 0.00 174.94 174.98 2q4s s ARG 188 N 1.59 4.17 -0.54 2.79 6.06 -1.26 -0.33 118.95 131.42 2q4s s ARG 188 Ca 0.07 2.49 0.04 0.00 -2.50 0.00 0.00 55.73 55.83 2q4s s ARG 188 Cb -0.15 -3.07 0.15 0.00 0.06 0.00 0.00 34.95 31.94 2q4s s ARG 188 CO 0.08 -0.60 0.34 0.95 -2.50 0.00 0.00 175.30 173.57 2q4s s THR 189 N 0.33 2.10 -2.00 4.11 -4.23 -0.46 -4.89 115.64 110.60 2q4s s THR 189 Ca 0.65 -3.33 0.02 0.00 -1.18 0.00 0.00 61.69 57.84 2q4s s THR 189 Cb -0.46 -2.43 0.05 0.00 1.34 0.00 0.00 72.50 71.00 2q4s s THR 189 CO 0.42 -0.94 0.59 -2.65 -0.54 0.00 0.00 174.62 171.50