#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 3.36 0.45 -4.62 1.43 -1.26 -4.97 118.68 113.07 2q4s s LEU 6 Ca 0.00 0.54 0.03 0.00 -1.03 0.00 0.00 54.13 53.67 2q4s s LEU 6 Cb 0.00 -2.87 0.01 0.00 0.03 0.00 0.00 46.19 43.36 2q4s s LEU 6 CO 0.00 -2.08 0.64 -0.76 0.23 0.00 0.00 176.35 174.38 2q4s s LEU 7 N 7.91 3.62 0.01 1.79 1.43 -1.26 -5.05 118.68 127.12 2q4s s LEU 7 Ca 0.67 -0.01 -0.30 0.00 -1.03 0.00 0.00 54.13 53.45 2q4s s LEU 7 Cb -0.14 -2.91 -0.05 0.00 0.03 0.00 0.00 46.19 43.11 2q4s s LEU 7 CO 0.24 -0.78 1.29 -0.75 0.23 0.00 0.00 176.35 176.59 2q4s s LYS 8 N -4.50 4.34 0.18 1.70 2.20 -1.26 -4.95 119.74 117.45 2q4s s LYS 8 Ca 0.51 1.84 -0.32 0.00 -0.36 0.00 0.00 55.97 57.64 2q4s s LYS 8 Cb -0.10 -3.49 -0.11 0.00 -1.51 0.00 0.00 37.83 32.62 2q4s s LYS 8 CO 0.36 -0.45 1.70 -2.14 -0.36 0.00 0.00 175.35 174.46 2q4s s PRO 9 N 1.92 4.15 0.29 4.03 0.02 -1.26 -4.88 135.00 139.27 2q4s s PRO 9 Ca 0.60 2.55 0.16 0.00 0.02 0.00 0.00 61.00 64.33 2q4s s PRO 9 Cb -0.29 -3.17 0.10 0.00 0.02 0.00 0.00 34.50 31.15 2q4s s PRO 9 CO 0.26 -0.73 1.45 0.00 -0.33 0.00 0.00 177.00 177.64 2q4s h ARG 10 N 7.06 0.00 -3.31 5.54 3.08 -1.92 -3.43 114.38 121.40 2q4s h ARG 10 Ca -0.43 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.54 2q4s h ARG 10 Cb 1.20 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.23 2q4s h ARG 10 CO 0.95 0.42 0.14 0.95 -1.07 0.00 0.00 179.97 181.35 2q4s s THR 11 N -3.00 0.00 0.19 2.04 -4.23 -1.26 -5.00 115.64 104.39 2q4s s THR 11 Ca 0.04 -1.17 -0.09 0.00 -1.18 0.00 0.00 61.69 59.30 2q4s s THR 11 Cb 0.07 -2.70 0.10 0.00 1.34 0.00 0.00 72.50 71.31 2q4s s THR 11 CO 0.74 0.00 1.70 0.25 -0.54 0.00 0.00 174.62 176.76 2q4s h LEU 12 N 2.04 1.08 -1.16 4.79 5.85 -1.92 0.20 115.31 126.19 2q4s h LEU 12 Ca -0.30 -0.25 -0.08 0.00 0.84 0.00 0.00 57.88 58.09 2q4s h LEU 12 Cb 1.25 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 41.98 2q4s h LEU 12 CO 0.38 1.06 -0.25 0.00 -0.34 0.00 0.00 178.44 179.29 2q4s h ALA 13 N 1.06 1.30 -0.16 1.25 0.00 -1.97 -0.44 119.26 120.31 2q4s h ALA 13 Ca 0.21 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 2q4s h ALA 13 Cb 0.43 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2q4s h ALA 13 CO 0.01 0.47 -0.29 0.22 0.00 0.00 0.00 179.25 179.67 2q4s h ASP 14 N 0.24 0.52 -0.97 0.00 3.58 -1.83 -0.80 116.42 117.17 2q4s h ASP 14 Ca 0.04 -0.55 0.08 0.00 0.42 0.00 0.00 57.03 57.02 2q4s h ASP 14 Cb 0.58 -0.15 -0.07 0.00 1.72 0.00 0.00 39.33 41.41 2q4s h ASP 14 CO 0.04 0.97 0.63 0.25 -2.88 0.00 0.00 179.24 178.25 2q4s h LEU 15 N 0.09 0.97 -0.71 2.28 5.85 -0.67 0.11 115.31 123.23 2q4s h LEU 15 Ca 0.01 0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.68 2q4s h LEU 15 Cb 0.88 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.69 2q4s h LEU 15 CO 0.07 0.60 0.18 0.40 -0.34 0.00 0.00 178.44 179.34 2q4s h ILE 16 N 1.08 1.26 -0.50 4.05 2.04 -0.76 0.48 117.51 125.16 2q4s h ILE 16 Ca 0.43 -0.97 0.00 0.00 1.00 0.00 0.00 64.86 65.33 2q4s h ILE 16 Cb 0.25 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 36.83 2q4s h ILE 16 CO -0.18 0.37 0.33 -0.09 0.00 0.00 0.00 178.15 178.59 2q4s h ARG 17 N 1.08 0.67 -0.55 2.37 2.43 0.35 -1.25 114.38 119.47 2q4s h ARG 17 Ca 0.22 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.30 2q4s h ARG 17 Cb 0.37 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.74 2q4s h ARG 17 CO 0.00 0.44 0.11 0.82 -1.51 0.00 0.00 179.97 179.83 2q4s h ILE 18 N 0.68 1.23 -0.30 1.20 2.04 -0.27 -2.78 117.51 119.32 2q4s h ILE 18 Ca 0.18 -0.87 -0.03 0.00 1.00 0.00 0.00 64.86 65.14 2q4s h ILE 18 Cb -0.08 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 2q4s h ILE 18 CO -0.04 0.32 0.07 -0.07 0.00 0.00 0.00 178.15 178.43 2q4s h LEU 19 N 0.82 0.46 -2.00 1.44 3.38 -0.29 -2.28 115.31 116.84 2q4s h LEU 19 Ca 0.18 -0.24 0.06 0.00 0.09 0.00 0.00 57.88 57.97 2q4s h LEU 19 Cb 0.34 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2q4s h LEU 19 CO 0.00 0.58 0.16 0.45 0.09 0.00 0.00 178.44 179.73 2q4s h HIS 20 N 0.32 0.00 -0.32 1.13 3.86 -0.99 -1.11 115.15 118.04 2q4s h HIS 20 Ca 0.09 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.19 2q4s h HIS 20 Cb 0.31 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.77 2q4s h HIS 20 CO 0.02 0.00 -0.24 0.93 0.86 0.00 0.00 177.93 179.49 2q4s h GLU 21 N 0.00 0.74 -0.82 2.45 5.08 -1.17 -2.86 114.58 118.00 2q4s h GLU 21 Ca 0.10 -0.36 -0.03 0.00 -1.00 0.00 0.00 59.36 58.07 2q4s h GLU 21 Cb 0.42 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.63 2q4s h GLU 21 CO -0.00 0.98 0.38 -0.07 -1.00 0.00 0.00 179.01 179.29 2q4s h LEU 22 N 0.50 1.09 -1.79 1.33 3.38 -0.69 -2.53 115.31 116.60 2q4s h LEU 22 Ca 0.06 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2q4s h LEU 22 Cb 0.80 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.27 2q4s h LEU 22 CO 0.06 0.93 0.00 0.49 0.09 0.00 0.00 178.44 180.01 2q4s n PHE 23 N -4.32 0.74 -0.07 1.13 3.72 -0.80 -4.35 117.46 113.52 2q4s n PHE 23 Ca 0.08 -0.31 0.07 0.00 -0.05 0.00 0.00 57.45 57.24 2q4s n PHE 23 Cb 0.15 -0.12 0.44 0.00 -0.94 0.00 0.00 39.48 39.01 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 3.48 1.82 -3.10 4.37 0.00 -1.21 -3.43 119.26 121.20 2q4s h ALA 24 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2q4s h ALA 24 Cb 0.81 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.46 2q4s h ALA 24 CO 0.10 0.10 0.00 0.41 0.00 0.00 0.00 179.25 179.86 2q4s n GLY 25 N -1.49 1.44 0.98 0.00 0.00 -1.26 -5.02 105.19 99.84 2q4s n GLY 25 Ca 0.07 -1.98 0.10 0.00 0.00 0.00 0.00 46.02 44.21 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 -0.36 3.19 -4.58 1.61 8.00 -1.26 -4.94 116.55 118.21 2q4s n ASP 26 Ca 0.00 -1.92 -0.31 0.00 0.71 0.00 0.00 54.79 53.27 2q4s n ASP 26 Cb 0.00 -0.22 -0.10 0.00 -0.02 0.00 0.00 41.12 40.78 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 -1.30 2.29 -0.30 -1.24 0.41 -1.26 -5.10 118.70 112.20 2q4s s GLU 27 Ca 0.33 -0.91 -0.03 0.00 -0.41 0.00 0.00 54.97 53.95 2q4s s GLU 27 Cb 0.19 -2.38 0.04 0.00 -1.78 0.00 0.00 34.13 30.21 2q4s s GLU 27 CO 0.27 0.54 0.02 0.08 -0.49 0.00 0.00 175.26 175.67 2q4s s VAL 28 N -1.14 3.15 -0.75 2.63 1.01 -1.26 -4.80 120.40 119.24 2q4s s VAL 28 Ca 0.20 -1.29 -0.22 0.00 0.00 0.00 0.00 61.98 60.67 2q4s s VAL 28 Cb -0.11 -2.79 0.09 0.00 0.00 0.00 0.00 36.38 33.57 2q4s s VAL 28 CO 0.12 -0.09 1.04 0.21 0.00 0.00 0.00 175.10 176.37 2q4s s ASN 29 N 1.29 6.32 0.58 3.32 3.84 -1.26 -4.88 114.94 124.15 2q4s s ASN 29 Ca -0.04 -1.30 0.28 0.00 0.21 0.00 0.00 52.86 52.01 2q4s s ASN 29 Cb -0.19 -2.42 1.53 0.00 -0.55 0.00 0.00 41.25 39.62 2q4s s ASN 29 CO -0.00 -1.34 1.99 0.58 -2.79 0.00 0.00 177.10 175.53 2q4s h VAL 30 N 5.98 0.47 0.06 -5.21 2.07 -2.00 -1.41 116.25 116.21 2q4s h VAL 30 Ca -0.14 0.00 -0.24 0.00 0.82 0.00 0.00 66.70 67.14 2q4s h VAL 30 Cb 1.05 0.72 -0.00 0.00 -1.52 0.00 0.00 31.29 31.54 2q4s h VAL 30 CO 1.18 0.00 -1.07 -0.33 0.02 0.00 0.00 177.57 177.37 2q4s h GLU 31 N 0.00 0.24 0.00 1.57 4.39 -1.99 -2.06 114.58 116.73 2q4s h GLU 31 Ca 0.17 -0.34 0.00 0.00 0.34 0.00 0.00 59.36 59.53 2q4s h GLU 31 Cb 0.88 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.65 2q4s h GLU 31 CO -0.00 1.11 -0.32 0.39 -1.16 0.00 0.00 179.01 179.02 2q4s n GLU 32 N -3.58 0.13 -0.06 2.33 1.02 -0.58 -2.20 120.64 117.71 2q4s n GLU 32 Ca -0.06 0.06 -0.20 0.00 -0.02 0.00 0.00 57.16 56.94 2q4s n GLU 32 Cb 0.93 -1.61 -0.13 0.00 -0.02 0.00 0.00 31.44 30.61 2q4s n GLU 32 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2q4s h VAL 33 N 0.00 1.09 -0.27 2.62 2.07 -1.45 -3.18 116.25 117.14 2q4s h VAL 33 Ca 0.00 -2.28 -0.07 0.00 0.82 0.00 0.00 66.70 65.17 2q4s h VAL 33 Cb 0.62 2.59 -0.02 0.00 -1.52 0.00 0.00 31.29 32.96 2q4s h VAL 33 CO 0.00 0.51 -0.14 -0.61 0.02 0.00 0.00 177.57 177.34 2q4s h GLN 34 N -0.75 0.46 -0.28 1.57 4.15 -1.46 -0.66 115.11 118.14 2q4s h GLN 34 Ca -0.28 -0.14 -0.19 0.00 0.77 0.00 0.00 58.65 58.82 2q4s h GLN 34 Cb 1.41 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 29.06 2q4s h GLN 34 CO -0.08 0.60 -0.56 0.00 -1.93 0.00 0.00 178.83 176.86 2q4s h ALA 35 N 1.43 0.46 0.04 3.38 0.00 -1.61 -1.68 119.26 121.28 2q4s h ALA 35 Ca 0.08 -0.52 -0.23 0.00 0.00 0.00 0.00 54.91 54.24 2q4s h ALA 35 Cb 0.51 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2q4s h ALA 35 CO 0.03 0.68 -1.01 -0.24 0.00 0.00 0.00 179.25 178.71 2q4s h VAL 36 N 0.66 1.47 -0.46 0.00 3.04 -1.50 -0.47 116.25 119.00 2q4s h VAL 36 Ca 0.01 -2.72 -0.03 0.00 -1.01 0.00 0.00 66.70 62.95 2q4s h VAL 36 Cb 1.17 2.61 -0.02 0.00 -2.01 0.00 0.00 31.29 33.04 2q4s h VAL 36 CO 0.12 0.80 0.16 -0.07 -1.01 0.00 0.00 177.57 177.57 2q4s h LEU 37 N 0.14 0.65 -1.13 3.16 3.38 -1.16 -2.28 115.31 118.07 2q4s h LEU 37 Ca -0.08 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 57.61 2q4s h LEU 37 Cb 1.68 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 42.25 2q4s h LEU 37 CO 0.16 0.66 -0.38 -0.08 0.09 0.00 0.00 178.44 178.90 2q4s h GLU 38 N 0.60 0.10 0.00 1.13 4.81 -1.24 -2.98 114.58 116.99 2q4s h GLU 38 Ca 0.15 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.29 2q4s h GLU 38 Cb 0.24 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 2q4s h GLU 38 CO -0.01 0.47 -0.24 0.00 -0.73 0.00 0.00 179.01 178.50 2q4s h ALA 39 N 1.53 1.22 -2.30 2.92 0.00 -0.51 -3.42 119.26 118.70 2q4s h ALA 39 Ca 0.01 -0.21 -0.55 0.00 0.00 0.00 0.00 54.91 54.15 2q4s h ALA 39 Cb 0.72 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2q4s h ALA 39 CO 0.05 0.29 0.92 -0.47 0.00 0.00 0.00 179.25 180.05 2q4s s TYR 40 N -4.02 2.59 -0.35 0.00 5.04 -1.01 -4.66 117.35 114.94 2q4s s TYR 40 Ca -0.02 0.66 -0.22 0.00 -2.44 0.00 0.00 57.07 55.04 2q4s s TYR 40 Cb 0.13 -3.72 0.01 0.00 0.35 0.00 0.00 41.96 38.72 2q4s s TYR 40 CO 0.64 -2.76 0.74 -1.21 -1.34 0.00 0.00 175.55 171.63 2q4s s GLU 41 N 3.07 3.77 -0.27 4.97 0.41 -1.26 -4.98 118.70 124.42 2q4s s GLU 41 Ca 0.65 0.29 -0.40 0.00 -0.41 0.00 0.00 54.97 55.10 2q4s s GLU 41 Cb -0.30 -3.79 -0.16 0.00 -1.78 0.00 0.00 34.13 28.09 2q4s s GLU 41 CO 0.25 -0.78 1.73 0.45 -0.49 0.00 0.00 175.26 176.41 2q4s n SER 42 N 6.28 2.32 -3.97 -0.19 2.88 -1.26 -4.95 113.62 114.72 2q4s n SER 42 Ca 0.02 1.08 -0.31 0.00 -1.33 0.00 0.00 58.87 58.33 2q4s n SER 42 Cb 0.48 -1.13 -0.15 0.00 -0.75 0.00 0.00 64.21 62.66 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 3.42 4.62 0.46 -3.46 3.84 -1.26 -5.00 114.94 117.55 2q4s s ASN 43 Ca 0.98 -2.03 0.30 0.00 0.21 0.00 0.00 52.86 52.32 2q4s s ASN 43 Cb -1.08 -1.49 1.38 0.00 -0.55 0.00 0.00 41.25 39.51 2q4s s ASN 43 CO 0.66 -0.38 1.69 -0.65 -2.79 0.00 0.00 177.10 175.64 2q4s h PRO 44 N 7.70 0.15 0.00 0.43 0.11 -1.92 0.64 132.00 139.11 2q4s h PRO 44 Ca -0.06 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.02 2q4s h PRO 44 Cb 1.02 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.09 2q4s h PRO 44 CO 0.51 0.10 -0.09 0.00 -0.21 0.00 0.00 178.00 178.30 2q4s h ALA 45 N 1.51 1.43 0.00 -0.75 0.00 -2.01 -1.30 119.26 118.14 2q4s h ALA 45 Ca 0.72 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.54 2q4s h ALA 45 Cb 2.32 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 20.10 2q4s h ALA 45 CO -0.27 0.12 -0.32 0.93 0.00 0.00 0.00 179.25 179.71 2q4s h GLU 46 N 0.00 0.00 0.00 0.00 5.08 -1.30 -3.35 114.58 115.01 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 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2q4s h GLU 46 CO 0.01 0.00 0.00 -2.67 -1.00 0.00 0.00 179.01 175.35 2q4s n TRP 47 N -2.40 0.00 -0.35 4.33 4.27 -1.04 -4.77 117.44 117.48 2q4s n TRP 47 Ca 0.04 -0.20 0.15 0.00 -3.89 0.00 0.00 57.50 53.60 2q4s n TRP 47 Cb 0.46 -0.02 0.36 0.00 -1.36 0.00 0.00 31.31 30.75 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 1.76 -1.02 -1.67 0.00 -1.39 0.55 119.26 117.50 2q4s h ALA 48 Ca 0.00 0.09 0.24 0.00 0.00 0.00 0.00 54.91 55.24 2q4s h ALA 48 Cb 0.37 -0.04 -0.10 0.00 0.00 0.00 0.00 17.79 18.01 2q4s h ALA 48 CO 0.00 -0.17 0.64 1.25 0.00 0.00 0.00 179.25 180.97 2q4s h LEU 49 N 0.67 0.53 -0.81 0.00 5.85 -1.86 0.15 115.31 119.85 2q4s h LEU 49 Ca 0.60 0.09 0.00 0.00 0.84 0.00 0.00 57.88 59.41 2q4s h LEU 49 Cb 1.05 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.08 2q4s h LEU 49 CO -0.40 0.13 -0.15 -1.22 -0.34 0.00 0.00 178.44 176.46 2q4s n TYR 50 N -4.68 0.00 -1.21 1.25 4.01 0.17 -4.63 117.16 112.08 2q4s n TYR 50 Ca 0.25 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.63 2q4s n TYR 50 Cb 0.79 -0.06 -0.03 0.00 -0.31 0.00 0.00 39.34 39.73 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 -0.14 7.08 -2.66 -0.72 0.00 0.54 -4.85 120.51 119.75 2q4s n ALA 51 Ca 0.15 -3.23 -0.41 0.00 0.00 0.00 0.00 53.44 49.96 2q4s n ALA 51 Cb 0.37 -3.29 -0.11 0.00 0.00 0.00 0.00 19.45 16.43 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 2.34 3.19 0.40 0.00 1.02 -1.26 -5.05 119.74 120.38 2q4s s LYS 52 Ca 0.65 -0.84 0.08 0.00 0.02 0.00 0.00 55.97 55.87 2q4s s LYS 52 Cb 0.17 -3.77 0.00 0.00 -0.52 0.00 0.00 37.83 33.71 2q4s s LYS 52 CO -0.05 -0.56 0.52 -0.06 -0.92 0.00 0.00 175.35 174.27 2q4s s PHE 53 N 1.65 2.86 -0.08 3.18 0.08 -1.26 -4.72 117.98 119.69 2q4s s PHE 53 Ca 0.05 -0.37 0.00 0.00 0.12 0.00 0.00 56.93 56.72 2q4s s PHE 53 Cb -0.18 -2.26 0.02 0.00 -0.57 0.00 0.00 43.02 40.03 2q4s s PHE 53 CO 0.08 -0.28 -0.05 0.34 -0.10 0.00 0.00 175.22 175.21 2q4s s ASP 54 N -4.28 1.67 0.55 1.36 2.15 -1.26 -5.02 116.67 111.84 2q4s s ASP 54 Ca 0.52 -0.20 0.26 0.00 0.43 0.00 0.00 52.55 53.55 2q4s s ASP 54 Cb -0.09 -0.64 1.46 0.00 -0.30 0.00 0.00 42.92 43.35 2q4s s ASP 54 CO 0.32 -0.10 2.03 -0.61 -0.17 0.00 0.00 175.17 176.63 2q4s h GLN 55 N 7.81 0.00 0.07 4.34 4.15 -1.99 -3.25 115.11 126.24 2q4s h GLN 55 Ca -0.29 0.00 -0.37 0.00 0.77 0.00 0.00 58.65 58.75 2q4s h GLN 55 Cb 1.14 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.79 2q4s h GLN 55 CO 0.39 0.00 -2.21 0.66 -1.93 0.00 0.00 178.83 175.74 2q4s n TYR 56 N -4.18 0.68 -4.21 3.99 4.01 -1.26 -4.90 117.16 111.28 2q4s n TYR 56 Ca 0.06 0.15 -0.15 0.00 -0.16 0.00 0.00 57.90 57.80 2q4s n TYR 56 Cb 0.49 -1.09 -0.09 0.00 -0.31 0.00 0.00 39.34 38.35 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 -2.54 1.50 0.54 -0.72 1.70 -1.23 -4.95 118.95 113.25 2q4s s ARG 57 Ca -0.27 -1.78 -0.18 0.00 -0.47 0.00 0.00 55.73 53.03 2q4s s ARG 57 Cb 0.08 0.32 -0.06 0.00 -0.57 0.00 0.00 34.95 34.71 2q4s s ARG 57 CO 0.70 -0.54 1.04 1.52 -1.08 0.00 0.00 175.30 176.93 2q4s s TYR 58 N -3.77 3.08 0.05 5.89 -0.85 -1.26 -4.08 117.35 116.40 2q4s s TYR 58 Ca 0.38 1.53 0.08 0.00 -0.52 0.00 0.00 57.07 58.54 2q4s s TYR 58 Cb 0.04 -2.99 -0.03 0.00 0.38 0.00 0.00 41.96 39.36 2q4s s TYR 58 CO 0.19 -0.86 -0.22 0.95 -1.52 0.00 0.00 175.55 174.08 2q4s s THR 59 N -2.31 2.46 -0.18 -3.49 -4.23 -0.39 -4.95 115.64 102.55 2q4s s THR 59 Ca 0.64 -1.31 -0.04 0.00 -1.18 0.00 0.00 61.69 59.80 2q4s s THR 59 Cb -0.15 -2.01 -0.02 0.00 1.34 0.00 0.00 72.50 71.67 2q4s s THR 59 CO 0.29 0.34 -0.03 -0.13 -0.54 0.00 0.00 174.62 174.55 2q4s s ARG 60 N -1.38 3.56 -0.28 3.99 0.52 -1.26 -1.39 118.95 122.72 2q4s s ARG 60 Ca 0.13 -0.56 -0.00 0.00 -0.52 0.00 0.00 55.73 54.78 2q4s s ARG 60 Cb -0.10 -2.97 0.08 0.00 0.52 0.00 0.00 34.95 32.49 2q4s s ARG 60 CO 0.04 0.06 0.05 -0.80 0.02 0.00 0.00 175.30 174.67 2q4s s ASN 61 N 0.83 3.87 0.54 0.23 0.01 -0.01 0.70 114.94 121.12 2q4s s ASN 61 Ca -0.01 -1.45 -0.22 0.00 -0.71 0.00 0.00 52.86 50.47 2q4s s ASN 61 Cb -0.14 -0.97 -0.05 0.00 0.41 0.00 0.00 41.25 40.50 2q4s s ASN 61 CO 0.02 -0.35 1.37 -0.22 -1.51 0.00 0.00 177.10 176.40 2q4s s LEU 62 N 1.54 3.86 0.00 0.60 2.96 -0.18 -0.90 118.68 126.55 2q4s s LEU 62 Ca 0.05 2.78 0.00 0.00 -0.22 0.00 0.00 54.13 56.74 2q4s s LEU 62 Cb -0.18 -4.26 0.00 0.00 0.50 0.00 0.00 46.19 42.25 2q4s s LEU 62 CO -0.16 -1.57 0.00 0.52 -1.32 0.00 0.00 176.35 173.82 2q4s n VAL 63 N -1.01 0.00 -3.68 1.68 0.31 -0.11 -2.18 118.33 113.34 2q4s n VAL 63 Ca 0.10 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.32 2q4s n VAL 63 Cb 0.45 -0.47 -0.09 0.00 -0.91 0.00 0.00 33.84 32.81 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 -3.90 -0.61 0.00 4.52 2.15 -0.98 -4.71 116.67 113.14 2q4s s ASP 64 Ca 0.00 1.09 0.24 0.00 0.43 0.00 0.00 52.55 54.31 2q4s s ASP 64 Cb 0.00 1.05 1.05 0.00 -0.30 0.00 0.00 42.92 44.71 2q4s s ASP 64 CO 0.00 -0.20 1.72 0.00 -0.17 0.00 0.00 175.17 176.52 2q4s n GLN 65 N 3.46 1.50 -3.03 4.34 6.02 -1.26 -0.88 117.38 127.53 2q4s n GLN 65 Ca -0.17 -0.73 -0.20 0.00 -0.01 0.00 0.00 57.00 55.88 2q4s n GLN 65 Cb 0.56 -1.42 0.01 0.00 1.02 0.00 0.00 30.24 30.41 2q4s n GLN 65 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2q4s n GLY 66 N 1.07 -0.50 3.13 1.08 0.00 -0.88 -1.47 105.19 107.61 2q4s n GLY 66 Ca 0.18 0.08 -0.21 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.23 -4.14 0.00 1.61 4.13 -1.26 -1.04 115.26 112.33 2q4s n ASN 67 Ca -0.08 -0.26 0.00 0.00 1.68 0.00 0.00 54.58 55.92 2q4s n ASN 67 Cb 0.58 -3.43 0.00 0.00 -1.54 0.00 0.00 39.78 35.40 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 -1.16 2.61 0.13 7.41 0.00 -0.54 -4.85 105.19 108.79 2q4s n GLY 68 Ca -0.06 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.00 2q4s n GLY 68 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2q4s h LYS 69 N 1.99 0.00 -2.38 1.61 1.79 -1.26 -3.43 116.57 114.90 2q4s h LYS 69 Ca 0.00 0.00 0.04 0.00 -2.18 0.00 0.00 60.65 58.51 2q4s h LYS 69 Cb 0.00 0.00 -0.16 0.00 -1.58 0.00 0.00 32.23 30.49 2q4s h LYS 69 CO 0.00 0.33 0.36 -0.59 -1.08 0.00 0.00 179.45 178.47 2q4s s PHE 70 N -3.02 -0.46 -0.01 -1.35 -0.12 -1.24 -4.31 117.98 107.46 2q4s s PHE 70 Ca 0.02 0.45 0.02 0.00 -0.05 0.00 0.00 56.93 57.37 2q4s s PHE 70 Cb 0.08 0.51 -0.03 0.00 -0.63 0.00 0.00 43.02 42.95 2q4s s PHE 70 CO 0.76 -0.63 -0.05 -0.80 -0.05 0.00 0.00 175.22 174.45 2q4s s ASN 71 N -2.18 4.74 0.10 1.98 0.01 -0.74 -2.08 114.94 116.77 2q4s s ASN 71 Ca 0.00 -0.09 0.09 0.00 -0.71 0.00 0.00 52.86 52.15 2q4s s ASN 71 Cb -0.01 -1.15 -0.03 0.00 0.41 0.00 0.00 41.25 40.46 2q4s s ASN 71 CO -0.06 0.30 -0.23 -0.22 -1.51 0.00 0.00 177.10 175.38 2q4s s LEU 72 N -1.32 2.28 -0.15 0.60 2.96 -0.06 -1.74 118.68 121.26 2q4s s LEU 72 Ca 0.17 -0.68 -0.06 0.00 -0.22 0.00 0.00 54.13 53.33 2q4s s LEU 72 Cb -0.11 -1.01 0.07 0.00 0.50 0.00 0.00 46.19 45.63 2q4s s LEU 72 CO 0.07 0.11 0.33 -0.63 -1.32 0.00 0.00 176.35 174.91 2q4s s ILE 74 N -1.07 -0.33 -0.12 6.68 1.01 -0.08 -0.93 121.20 126.36 2q4s s ILE 74 Ca 0.09 0.19 -0.05 0.00 0.00 0.00 0.00 60.65 60.88 2q4s s ILE 74 Cb -0.10 -0.52 -0.04 0.00 0.01 0.00 0.00 42.46 41.81 2q4s s ILE 74 CO 0.04 0.08 0.08 -0.76 0.00 0.00 0.00 174.94 174.38 2q4s s LEU 75 N 2.05 3.99 -0.21 2.97 1.02 0.38 -0.83 118.68 128.04 2q4s s LEU 75 Ca -0.04 0.27 0.02 0.00 0.02 0.00 0.00 54.13 54.40 2q4s s LEU 75 Cb -0.11 -1.96 0.03 0.00 0.02 0.00 0.00 46.19 44.17 2q4s s LEU 75 CO -0.10 0.34 -0.17 0.00 0.02 0.00 0.00 176.35 176.44 2q4s s TRP 77 N 1.23 3.55 1.23 0.00 0.52 -0.82 -1.26 118.94 123.39 2q4s s TRP 77 Ca 0.00 -2.41 -0.17 0.00 0.02 0.00 0.00 56.10 53.54 2q4s s TRP 77 Cb -0.15 -2.94 0.26 0.00 -1.15 0.00 0.00 33.47 29.48 2q4s s TRP 77 CO -0.10 -0.93 0.63 0.41 0.02 0.00 0.00 176.95 176.98 2q4s n GLY 78 N 4.54 -2.70 3.68 0.98 0.00 -1.26 -2.66 105.19 107.77 2q4s n GLY 78 Ca -0.03 -1.17 -0.45 0.00 0.00 0.00 0.00 46.02 44.37 2q4s n GLY 78 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2q4s n GLU 79 N -4.08 2.22 -0.17 1.61 4.71 -1.26 -1.33 120.64 122.35 2q4s n GLU 79 Ca 0.05 0.79 0.00 0.00 -0.01 0.00 0.00 57.16 57.99 2q4s n GLU 79 Cb 0.55 -2.52 0.00 0.00 -1.01 0.00 0.00 31.44 28.46 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 2.73 2.56 3.78 0.62 0.00 -0.87 -4.99 105.19 109.02 2q4s n GLY 80 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.09 2.64 0.00 1.61 3.76 -0.44 -4.74 115.29 115.04 2q4s s HIS 81 Ca 0.00 1.06 0.00 0.00 -0.15 0.00 0.00 55.06 55.97 2q4s s HIS 81 Cb 0.00 -3.22 0.00 0.00 1.11 0.00 0.00 32.58 30.47 2q4s s HIS 81 CO 0.00 -2.07 0.00 0.41 -0.85 0.00 0.00 174.74 172.23 2q4s n GLY 82 N -1.98 1.02 2.63 -2.22 0.00 -1.26 -0.20 105.19 103.18 2q4s n GLY 82 Ca 0.07 -0.50 -0.20 0.00 0.00 0.00 0.00 46.02 45.39 2q4s n GLY 82 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2q4s n SER 83 N 0.00 0.08 -4.79 1.61 7.64 -0.99 -4.81 113.62 112.36 2q4s n SER 83 Ca 0.00 -1.34 -0.22 0.00 1.01 0.00 0.00 58.87 58.32 2q4s n SER 83 Cb 0.00 -0.69 0.10 0.00 -1.01 0.00 0.00 64.21 62.61 2q4s n SER 83 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2q4s s SER 84 N -4.30 4.50 0.17 6.43 1.04 -1.26 -4.64 113.70 115.64 2q4s s SER 84 Ca 0.51 -0.67 -0.30 0.00 0.48 0.00 0.00 55.95 55.96 2q4s s SER 84 Cb -0.01 0.33 -0.08 0.00 0.10 0.00 0.00 66.02 66.35 2q4s s SER 84 CO 0.36 -1.78 1.33 -0.63 0.98 0.00 0.00 173.24 173.50 2q4s s ILE 85 N -3.00 3.25 0.24 -1.02 1.01 -1.26 -4.43 121.20 115.99 2q4s s ILE 85 Ca 0.66 0.99 -0.14 0.00 0.00 0.00 0.00 60.65 62.15 2q4s s ILE 85 Cb -0.04 -3.63 0.00 0.00 0.01 0.00 0.00 42.46 38.80 2q4s s ILE 85 CO 0.43 0.13 0.51 -1.38 0.00 0.00 0.00 174.94 174.63 2q4s s HIS 86 N 0.41 0.22 0.53 3.97 -3.43 0.46 -1.65 115.29 115.79 2q4s s HIS 86 Ca 0.59 -0.59 0.06 0.00 -0.80 0.00 0.00 55.06 54.31 2q4s s HIS 86 Cb -0.36 0.28 0.06 0.00 -1.43 0.00 0.00 32.58 31.12 2q4s s HIS 86 CO 0.36 -1.00 0.49 -0.40 -2.00 0.00 0.00 174.74 172.18 2q4s n ASP 87 N -0.38 2.49 -0.24 7.38 5.75 -1.12 -2.28 116.55 128.15 2q4s n ASP 87 Ca -0.03 -2.71 0.06 0.00 -0.01 0.00 0.00 54.79 52.11 2q4s n ASP 87 Cb 0.62 -0.13 0.09 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 -1.85 0.00 -3.56 2.11 8.25 -1.26 -4.53 115.22 114.38 2q4s n HIS 88 Ca 0.03 -0.67 -0.21 0.00 -0.26 0.00 0.00 57.72 56.61 2q4s n HIS 88 Cb 0.59 -0.12 0.07 0.00 1.12 0.00 0.00 29.99 31.65 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 -0.93 -4.61 -3.52 1.59 -1.04 -1.26 -2.39 114.28 102.12 2q4s n THR 89 Ca 0.11 -0.32 -0.24 0.00 -2.04 0.00 0.00 64.05 61.56 2q4s n THR 89 Cb 0.67 -4.37 0.07 0.00 -1.82 0.00 0.00 70.33 64.88 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 -3.06 -6.33 -4.37 8.00 8.00 -1.26 -5.01 116.55 112.52 2q4s n ASP 90 Ca -0.18 -0.51 -0.19 0.00 0.71 0.00 0.00 54.79 54.62 2q4s n ASP 90 Cb 0.63 -5.00 -0.10 0.00 -0.02 0.00 0.00 41.12 36.63 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 -3.23 2.68 0.02 -2.24 0.01 -1.01 -4.70 113.70 105.23 2q4s s SER 91 Ca 0.55 -1.05 -0.27 0.00 1.31 0.00 0.00 55.95 56.49 2q4s s SER 91 Cb -0.24 -0.15 -0.04 0.00 0.21 0.00 0.00 66.02 65.79 2q4s s SER 91 CO 0.68 -0.19 0.83 -1.00 0.41 0.00 0.00 173.24 173.98 2q4s s HIS 92 N -2.95 3.69 -0.11 2.43 3.76 -0.60 -4.40 115.29 117.11 2q4s s HIS 92 Ca 0.24 1.52 0.02 0.00 -0.15 0.00 0.00 55.06 56.69 2q4s s HIS 92 Cb -0.00 -2.93 0.01 0.00 1.11 0.00 0.00 32.58 30.78 2q4s s HIS 92 CO 0.08 0.15 -0.17 0.00 -0.85 0.00 0.00 174.74 173.95 2q4s s PHE 94 N 0.93 2.40 -0.15 0.00 0.08 -0.37 -1.12 117.98 119.75 2q4s s PHE 94 Ca -0.07 -0.66 -0.01 0.00 0.12 0.00 0.00 56.93 56.30 2q4s s PHE 94 Cb -0.15 -1.57 0.04 0.00 -0.57 0.00 0.00 43.02 40.78 2q4s s PHE 94 CO -0.01 -0.18 -0.01 -1.17 -0.10 0.00 0.00 175.22 173.75 2q4s s LEU 95 N -0.25 1.23 -0.13 -0.37 0.20 -0.10 -1.17 118.68 118.09 2q4s s LEU 95 Ca -0.01 -0.58 0.00 0.00 0.69 0.00 0.00 54.13 54.23 2q4s s LEU 95 Cb -0.13 -0.69 -0.01 0.00 -0.43 0.00 0.00 46.19 44.92 2q4s s LEU 95 CO 0.03 -0.23 -0.14 -0.75 -0.29 0.00 0.00 176.35 174.97 2q4s s LYS 96 N 1.79 3.36 0.14 1.98 2.20 0.21 0.32 119.74 129.73 2q4s s LYS 96 Ca 0.01 -0.70 -0.30 0.00 -0.36 0.00 0.00 55.97 54.62 2q4s s LYS 96 Cb -0.15 -2.61 -0.07 0.00 -1.51 0.00 0.00 37.83 33.49 2q4s s LYS 96 CO -0.07 0.20 1.02 -0.51 -0.36 0.00 0.00 175.35 175.63 2q4s s LEU 97 N 0.38 4.50 -0.10 5.43 2.01 0.16 0.10 118.68 131.16 2q4s s LEU 97 Ca -0.11 1.92 0.13 0.00 0.01 0.00 0.00 54.13 56.07 2q4s s LEU 97 Cb -0.16 -3.59 -0.18 0.00 0.01 0.00 0.00 46.19 42.26 2q4s s LEU 97 CO 0.06 -0.13 0.12 0.18 1.01 0.00 0.00 176.35 177.59 2q4s n LEU 98 N 2.63 0.00 -3.62 1.79 4.77 0.03 -0.95 117.00 121.65 2q4s n LEU 98 Ca 0.03 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.85 2q4s n LEU 98 Cb 0.48 0.24 -0.07 0.00 -2.33 0.00 0.00 43.42 41.73 2q4s n LEU 98 CO 0.52 0.24 0.33 -1.58 -1.33 0.00 0.00 177.39 175.56 2q4s s GLN 99 N -2.52 0.85 2.76 3.23 0.74 -0.56 -4.80 119.66 119.35 2q4s s GLN 99 Ca -0.06 0.51 0.00 0.00 0.05 0.00 0.00 55.36 55.85 2q4s s GLN 99 Cb 0.05 0.40 0.00 0.00 1.10 0.00 0.00 33.01 34.57 2q4s s GLN 99 CO 0.56 -0.19 0.00 0.41 -0.55 0.00 0.00 175.29 175.52 2q4s n GLY 100 N 1.87 -0.10 3.07 2.59 0.00 -1.26 -1.56 105.19 109.81 2q4s n GLY 100 Ca -0.17 -1.01 -0.12 0.00 0.00 0.00 0.00 46.02 44.72 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 0.84 -0.02 1.61 0.01 -1.26 -3.24 114.94 108.88 2q4s s ASN 101 Ca 0.00 -0.63 0.02 0.00 -0.71 0.00 0.00 52.86 51.54 2q4s s ASN 101 Cb 0.00 0.06 0.00 0.00 0.41 0.00 0.00 41.25 41.72 2q4s s ASN 101 CO 0.00 -0.27 -0.07 -0.76 -1.51 0.00 0.00 177.10 174.49 2q4s s LEU 102 N -1.85 1.84 -0.18 0.60 1.43 -0.50 -4.48 118.68 115.54 2q4s s LEU 102 Ca -0.06 -0.14 -0.14 0.00 -1.03 0.00 0.00 54.13 52.76 2q4s s LEU 102 Cb -0.07 -0.41 -0.04 0.00 0.03 0.00 0.00 46.19 45.70 2q4s s LEU 102 CO -0.01 0.06 0.31 -0.75 0.23 0.00 0.00 176.35 176.19 2q4s s LYS 103 N 0.10 4.22 -0.18 1.70 2.20 0.15 0.30 119.74 128.23 2q4s s LYS 103 Ca -0.01 0.09 -0.04 0.00 -0.36 0.00 0.00 55.97 55.65 2q4s s LYS 103 Cb -0.06 -3.47 -0.02 0.00 -1.51 0.00 0.00 37.83 32.77 2q4s s LYS 103 CO -0.00 0.15 -0.02 -2.00 -0.36 0.00 0.00 175.35 173.11 2q4s s GLU 104 N 0.75 3.62 -0.18 4.03 2.12 0.11 -0.53 118.70 128.61 2q4s s GLU 104 Ca 0.16 -0.53 -0.03 0.00 0.36 0.00 0.00 54.97 54.94 2q4s s GLU 104 Cb -0.13 -3.00 -0.01 0.00 0.26 0.00 0.00 34.13 31.25 2q4s s GLU 104 CO 0.05 0.09 -0.07 0.99 -0.54 0.00 0.00 175.26 175.78 2q4s s THR 105 N 0.76 3.34 -0.05 -1.70 2.01 0.77 -1.33 115.64 119.45 2q4s s THR 105 Ca -0.01 -0.53 -0.08 0.00 0.31 0.00 0.00 61.69 61.38 2q4s s THR 105 Cb -0.14 -2.47 -0.05 0.00 0.01 0.00 0.00 72.50 69.85 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 0.95 4.40 0.03 4.42 1.43 0.38 -1.00 118.68 129.28 2q4s s LEU 106 Ca -0.01 0.60 0.02 0.00 -1.03 0.00 0.00 54.13 53.71 2q4s s LEU 106 Cb -0.15 -2.41 -0.02 0.00 0.03 0.00 0.00 46.19 43.64 2q4s s LEU 106 CO 0.00 0.33 -0.07 -0.36 0.23 0.00 0.00 176.35 176.49 2q4s s PHE 107 N -1.15 0.58 0.62 0.29 0.08 -0.87 0.99 117.98 118.53 2q4s s PHE 107 Ca 0.22 -0.38 -0.09 0.00 0.12 0.00 0.00 56.93 56.80 2q4s s PHE 107 Cb -0.13 -0.36 -0.01 0.00 -0.57 0.00 0.00 43.02 41.95 2q4s s PHE 107 CO 0.11 -0.07 0.98 -0.51 -0.10 0.00 0.00 175.22 175.64 2q4s s ASP 108 N -1.15 5.79 0.35 1.36 1.01 -1.26 -1.37 116.67 121.40 2q4s s ASP 108 Ca -0.07 1.06 -0.28 0.00 0.71 0.00 0.00 52.55 53.97 2q4s s ASP 108 Cb -0.08 -2.05 -0.11 0.00 1.01 0.00 0.00 42.92 41.70 2q4s s ASP 108 CO 0.00 -1.04 1.43 0.26 0.21 0.00 0.00 175.17 176.03 2q4s s TRP 109 N -3.13 2.78 0.60 4.23 0.52 -1.26 -4.76 118.94 117.91 2q4s s TRP 109 Ca 0.55 1.23 -0.13 0.00 0.02 0.00 0.00 56.10 57.76 2q4s s TRP 109 Cb -0.11 -3.90 -0.04 0.00 -1.15 0.00 0.00 33.47 28.27 2q4s s TRP 109 CO 0.50 -2.62 1.03 -2.14 0.02 0.00 0.00 176.95 173.74 2q4s s PRO 110 N -1.82 3.51 0.58 4.98 0.02 -1.26 -5.07 135.00 135.94 2q4s s PRO 110 Ca 0.52 0.94 -0.06 0.00 0.02 0.00 0.00 61.00 62.42 2q4s s PRO 110 Cb -0.44 -2.07 0.00 0.00 0.02 0.00 0.00 34.50 32.01 2q4s s PRO 110 CO 0.58 -0.64 0.89 -0.51 -0.33 0.00 0.00 177.00 176.99 2q4s s ASP 111 N -3.51 5.67 0.35 2.53 1.01 -1.26 -4.95 116.67 116.51 2q4s s ASP 111 Ca 0.58 0.75 0.26 0.00 0.71 0.00 0.00 52.55 54.85 2q4s s ASP 111 Cb -0.12 -1.78 1.25 0.00 1.01 0.00 0.00 42.92 43.28 2q4s s ASP 111 CO 0.44 -1.02 1.78 0.11 0.21 0.00 0.00 175.17 176.69 2q4s h LYS 112 N -0.15 0.00 -6.29 8.23 1.79 -1.96 -3.42 116.57 114.78 2q4s h LYS 112 Ca -0.45 0.00 -0.55 0.00 -2.18 0.00 0.00 60.65 57.46 2q4s h LYS 112 Cb 1.25 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.87 2q4s h LYS 112 CO 0.61 0.00 0.44 0.15 -1.08 0.00 0.00 179.45 179.57 2q4s s LYS 113 N -3.54 4.47 -0.04 3.15 -0.14 -1.26 -4.97 119.74 117.41 2q4s s LYS 113 Ca -0.00 1.34 -0.30 0.00 -1.36 0.00 0.00 55.97 55.66 2q4s s LYS 113 Cb 0.08 -3.50 -0.07 0.00 -1.68 0.00 0.00 37.83 32.66 2q4s s LYS 113 CO 0.31 -0.18 1.92 0.45 -0.76 0.00 0.00 175.35 177.10 2q4s s SER 114 N 1.04 6.32 0.06 2.83 0.15 -1.26 -4.92 113.70 117.93 2q4s s SER 114 Ca 0.48 2.38 -0.26 0.00 0.70 0.00 0.00 55.95 59.26 2q4s s SER 114 Cb -0.19 -2.53 0.07 0.00 -1.71 0.00 0.00 66.02 61.65 2q4s s SER 114 CO 0.22 -1.19 0.61 0.20 1.20 0.00 0.00 173.24 174.27 2q4s s ASN 115 N 4.83 -0.57 0.00 5.45 0.01 -0.98 -4.99 114.94 118.70 2q4s s ASN 115 Ca 0.86 0.29 0.00 0.00 -0.71 0.00 0.00 52.86 53.30 2q4s s ASN 115 Cb -0.38 0.55 0.00 0.00 0.41 0.00 0.00 41.25 41.83 2q4s s ASN 115 CO 0.37 -0.78 0.00 1.21 -1.51 0.00 0.00 177.10 176.39 2q4s n GLU 116 N 0.26 2.42 -3.64 -0.60 4.07 -1.05 -3.35 120.64 118.75 2q4s n GLU 116 Ca -0.18 0.00 -0.08 0.00 -0.06 0.00 0.00 57.16 56.84 2q4s n GLU 116 Cb 0.61 0.00 -0.07 0.00 -0.06 0.00 0.00 31.44 31.92 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 0.50 6.31 -1.09 -1.26 -4.95 121.20 120.71 2q4s s ILE 118 Ca 0.00 0.00 -0.24 0.00 -2.23 0.00 0.00 60.65 58.19 2q4s s ILE 118 Cb 0.00 -0.98 -0.07 0.00 -1.58 0.00 0.00 42.46 39.83 2q4s s ILE 118 CO 0.00 0.00 1.40 -1.59 -1.23 0.00 0.00 174.94 173.52 2q4s s LYS 119 N 1.44 3.43 -0.05 2.79 -2.85 -1.26 -4.60 119.74 118.64 2q4s s LYS 119 Ca -0.09 2.35 0.06 0.00 -1.00 0.00 0.00 55.97 57.29 2q4s s LYS 119 Cb -0.05 -2.47 -0.24 0.00 -2.06 0.00 0.00 37.83 33.00 2q4s s LYS 119 CO -0.17 -1.00 0.63 1.57 0.10 0.00 0.00 175.35 176.49 2q4s h LYS 120 N 1.92 0.09 -1.83 1.78 2.10 0.27 -3.49 116.57 117.42 2q4s h LYS 120 Ca -0.51 -0.16 0.28 0.00 -2.00 0.00 0.00 60.65 58.27 2q4s h LYS 120 Cb 1.28 0.06 -0.10 0.00 -0.90 0.00 0.00 32.23 32.57 2q4s h LYS 120 CO 0.59 0.75 0.74 -1.54 -2.00 0.00 0.00 179.45 178.00 2q4s s SER 121 N -6.44 -0.07 0.01 7.07 1.04 -1.16 -5.01 113.70 109.14 2q4s s SER 121 Ca -0.09 -0.26 -0.19 0.00 0.48 0.00 0.00 55.95 55.89 2q4s s SER 121 Cb 0.08 0.26 0.04 0.00 0.10 0.00 0.00 66.02 66.50 2q4s s SER 121 CO 0.81 -0.50 0.42 -1.83 0.98 0.00 0.00 173.24 173.13 2q4s s GLU 122 N -2.54 0.85 0.12 4.02 -1.05 -1.26 -0.47 118.70 118.37 2q4s s GLU 122 Ca 0.16 -0.19 -0.11 0.00 -0.15 0.00 0.00 54.97 54.68 2q4s s GLU 122 Cb 0.02 0.38 0.01 0.00 -0.44 0.00 0.00 34.13 34.10 2q4s s GLU 122 CO -0.01 -0.27 0.28 -0.98 0.95 0.00 0.00 175.26 175.23 2q4s s ARG 123 N -1.83 1.01 -0.28 -4.83 1.70 -0.44 -5.00 118.95 109.28 2q4s s ARG 123 Ca -0.09 -0.95 -0.03 0.00 -0.47 0.00 0.00 55.73 54.18 2q4s s ARG 123 Cb -0.02 0.39 0.03 0.00 -0.57 0.00 0.00 34.95 34.78 2q4s s ARG 123 CO 0.02 -0.36 0.01 0.99 -1.08 0.00 0.00 175.30 174.88 2q4s s THR 124 N -3.88 3.24 0.08 4.99 2.01 -1.26 0.06 115.64 120.89 2q4s s THR 124 Ca 0.08 -1.07 -0.23 0.00 0.31 0.00 0.00 61.69 60.78 2q4s s THR 124 Cb 0.03 -2.74 -0.07 0.00 0.01 0.00 0.00 72.50 69.74 2q4s s THR 124 CO -0.08 0.04 0.69 -0.76 -0.69 0.00 0.00 174.62 173.82 2q4s s LEU 125 N 1.35 4.51 0.50 4.42 1.43 0.15 -4.94 118.68 126.09 2q4s s LEU 125 Ca -0.01 1.41 0.03 0.00 -1.03 0.00 0.00 54.13 54.53 2q4s s LEU 125 Cb -0.18 -3.11 -0.02 0.00 0.03 0.00 0.00 46.19 42.91 2q4s s LEU 125 CO -0.01 0.16 0.08 -0.13 0.23 0.00 0.00 176.35 176.68 2q4s s ARG 126 N -0.69 2.18 0.18 1.70 0.52 -1.26 -1.41 118.95 120.17 2q4s s ARG 126 Ca 0.34 -2.26 -0.32 0.00 -0.52 0.00 0.00 55.73 52.96 2q4s s ARG 126 Cb -0.21 -1.67 -0.15 0.00 0.52 0.00 0.00 34.95 33.44 2q4s s ARG 126 CO 0.22 -0.35 1.20 0.39 0.02 0.00 0.00 175.30 176.78 2q4s n GLU 127 N -1.31 1.31 -0.52 3.54 1.02 -1.20 -2.23 120.64 121.25 2q4s n GLU 127 Ca -0.13 0.47 0.00 0.00 -0.02 0.00 0.00 57.16 57.48 2q4s n GLU 127 Cb 0.66 -1.99 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 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 2.03 0.00 -4.79 1.62 3.02 -0.12 -4.97 115.26 112.05 2q4s n ASN 128 Ca 0.14 0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 54.34 2q4s n ASN 128 Cb 0.26 -0.78 -0.05 0.00 -0.61 0.00 0.00 39.78 38.60 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 -0.23 4.16 -0.12 3.52 0.74 -0.95 -4.66 119.66 122.12 2q4s s GLN 129 Ca 0.00 1.41 0.01 0.00 0.05 0.00 0.00 55.36 56.83 2q4s s GLN 129 Cb 0.00 -2.45 0.02 0.00 1.10 0.00 0.00 33.01 31.68 2q4s s GLN 129 CO 0.00 -0.13 -0.12 0.00 -0.55 0.00 0.00 175.29 174.49 2q4s s ALA 131 N 1.37 4.26 -0.02 0.00 0.00 0.15 -4.91 121.76 122.62 2q4s s ALA 131 Ca 0.01 -1.48 -0.03 0.00 0.00 0.00 0.00 51.96 50.46 2q4s s ALA 131 Cb -0.13 -1.74 0.00 0.00 0.00 0.00 0.00 23.12 21.25 2q4s s ALA 131 CO -0.07 -0.20 0.07 -0.47 0.00 0.00 0.00 175.76 175.09 2q4s s TYR 132 N -2.31 -0.03 0.04 0.00 6.14 -1.26 -0.92 117.35 119.01 2q4s s TYR 132 Ca 0.49 0.07 -0.17 0.00 0.64 0.00 0.00 57.07 58.11 2q4s s TYR 132 Cb -0.10 -0.01 0.03 0.00 0.42 0.00 0.00 41.96 42.31 2q4s s TYR 132 CO 0.33 -0.08 0.39 -1.50 0.64 0.00 0.00 175.55 175.32 2q4s s ILE 133 N -0.29 0.06 0.23 3.14 2.07 -0.27 -5.03 121.20 121.11 2q4s s ILE 133 Ca -0.04 -0.50 -0.11 0.00 -1.41 0.00 0.00 60.65 58.60 2q4s s ILE 133 Cb -0.02 -0.94 -0.01 0.00 0.13 0.00 0.00 42.46 41.62 2q4s s ILE 133 CO 0.00 -0.28 0.42 0.54 -1.91 0.00 0.00 174.94 173.71 2q4s s ASN 134 N -1.98 -0.05 0.21 4.50 2.20 -1.26 -1.46 114.94 117.09 2q4s s ASN 134 Ca -0.06 -0.99 -0.10 0.00 -0.94 0.00 0.00 52.86 50.78 2q4s s ASN 134 Cb -0.01 0.55 0.15 0.00 -2.00 0.00 0.00 41.25 39.94 2q4s s ASN 134 CO -0.02 -1.08 1.83 0.44 -2.94 0.00 0.00 177.10 175.32 2q4s h ASP 135 N 2.32 0.94 -0.95 3.54 3.32 -1.77 -2.16 116.42 121.66 2q4s h ASP 135 Ca -0.28 -0.09 0.16 0.00 0.02 0.00 0.00 57.03 56.84 2q4s h ASP 135 Cb 1.25 -0.24 -0.10 0.00 0.22 0.00 0.00 39.33 40.46 2q4s h ASP 135 CO 0.39 0.76 0.56 0.28 -1.72 0.00 0.00 179.24 179.51 2q4s h SER 136 N 1.04 0.75 0.40 6.45 0.02 -1.97 -2.41 113.55 117.82 2q4s h SER 136 Ca 0.27 0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 61.28 2q4s h SER 136 Cb 0.03 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.52 2q4s h SER 136 CO -0.04 0.32 -0.19 0.40 -1.14 0.00 0.00 176.83 176.17 2q4s h ILE 137 N 0.78 0.60 0.00 3.27 2.04 -1.82 -3.50 117.51 118.88 2q4s h ILE 137 Ca 0.52 -0.34 0.00 0.00 1.00 0.00 0.00 64.86 66.04 2q4s h ILE 137 Cb 0.71 0.76 0.00 0.00 -0.74 0.00 0.00 36.82 37.55 2q4s h ILE 137 CO -0.34 0.06 0.00 0.61 0.00 0.00 0.00 178.15 178.48 2q4s n GLY 138 N -0.76 -0.42 3.62 5.37 0.00 -0.91 -4.90 105.19 107.19 2q4s n GLY 138 Ca -0.11 -0.82 -0.26 0.00 0.00 0.00 0.00 46.02 44.84 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 2.91 0.11 0.99 1.43 -0.47 -4.37 118.68 119.28 2q4s s LEU 139 Ca 0.00 -1.14 -0.19 0.00 -1.03 0.00 0.00 54.13 51.77 2q4s s LEU 139 Cb 0.00 -1.17 0.05 0.00 0.03 0.00 0.00 46.19 45.09 2q4s s LEU 139 CO 0.00 -0.31 0.47 -1.38 0.23 0.00 0.00 176.35 175.36 2q4s s HIS 140 N -2.59 -0.33 -0.02 0.29 -3.43 -0.97 -2.05 115.29 106.19 2q4s s HIS 140 Ca 0.35 0.14 0.07 0.00 -0.80 0.00 0.00 55.06 54.83 2q4s s HIS 140 Cb 0.03 0.34 -0.02 0.00 -1.43 0.00 0.00 32.58 31.50 2q4s s HIS 140 CO 0.19 -0.71 -0.24 0.50 -2.00 0.00 0.00 174.74 172.47 2q4s s ARG 141 N -3.39 2.16 -0.06 -0.38 3.52 -0.17 -0.41 118.95 120.23 2q4s s ARG 141 Ca 0.00 -0.90 0.06 0.00 -0.13 0.00 0.00 55.73 54.76 2q4s s ARG 141 Cb 0.00 -2.09 -0.01 0.00 -1.56 0.00 0.00 34.95 31.29 2q4s s ARG 141 CO -0.09 0.57 -0.24 0.08 -0.81 0.00 0.00 175.30 174.80 2q4s s VAL 142 N -0.64 2.13 -0.01 7.11 1.01 -1.26 -0.16 120.40 128.58 2q4s s VAL 142 Ca 0.10 -1.04 -0.03 0.00 0.00 0.00 0.00 61.98 61.01 2q4s s VAL 142 Cb -0.10 -1.77 0.00 0.00 0.00 0.00 0.00 36.38 34.51 2q4s s VAL 142 CO -0.01 0.57 0.07 -1.61 0.00 0.00 0.00 175.10 174.12 2q4s s GLU 143 N -0.20 0.22 -0.57 2.72 2.02 0.31 -2.36 118.70 120.84 2q4s s GLU 143 Ca -0.02 -0.14 -0.19 0.00 0.02 0.00 0.00 54.97 54.63 2q4s s GLU 143 Cb -0.13 0.09 0.09 0.00 0.10 0.00 0.00 34.13 34.27 2q4s s GLU 143 CO 0.03 -0.04 0.71 1.21 0.02 0.00 0.00 175.26 177.19 2q4s s ASN 144 N -0.56 6.20 0.00 -0.19 2.47 0.72 0.30 114.94 123.88 2q4s s ASN 144 Ca -0.06 -1.24 0.31 0.00 0.42 0.00 0.00 52.86 52.29 2q4s s ASN 144 Cb -0.04 -2.31 1.63 0.00 -1.45 0.00 0.00 41.25 39.08 2q4s s ASN 144 CO 0.00 -1.08 2.09 1.33 -3.72 0.00 0.00 177.10 175.73 2q4s n VAL 145 N 5.60 0.00 -2.03 -5.21 0.24 -1.26 -2.05 118.33 113.62 2q4s n VAL 145 Ca -0.08 -0.01 -0.41 0.00 -2.04 0.00 0.00 64.34 61.80 2q4s n VAL 145 Cb 0.44 -0.42 -0.02 0.00 -1.47 0.00 0.00 33.84 32.36 2q4s n VAL 145 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2q4s s SER 146 N -2.32 6.66 0.04 -1.34 0.15 -1.26 -4.70 113.70 110.94 2q4s s SER 146 Ca 0.37 2.75 0.23 0.00 0.70 0.00 0.00 55.95 59.99 2q4s s SER 146 Cb 0.21 -2.65 0.00 0.00 -1.71 0.00 0.00 66.02 61.87 2q4s s SER 146 CO 0.42 -0.64 0.98 1.41 1.20 0.00 0.00 173.24 176.62 2q4s n HIS 147 N 1.14 0.21 -0.36 3.44 8.25 -1.26 -2.06 115.22 124.58 2q4s n HIS 147 Ca 0.02 0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 2q4s n HIS 147 Cb 0.41 -0.39 0.00 0.00 1.12 0.00 0.00 29.99 31.13 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 -1.93 0.00 -4.95 1.59 -2.24 -1.26 -4.93 114.28 100.56 2q4s n THR 148 Ca 0.02 -0.23 -0.28 0.00 -2.27 0.00 0.00 64.05 61.29 2q4s n THR 148 Cb 0.43 1.36 -0.16 0.00 -2.10 0.00 0.00 70.33 69.86 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 -0.15 2.12 0.19 -0.78 0.41 -1.26 -5.03 118.70 114.19 2q4s s GLU 149 Ca 0.00 -0.68 -0.23 0.00 -0.41 0.00 0.00 54.97 53.64 2q4s s GLU 149 Cb 0.00 -1.77 -0.08 0.00 -1.78 0.00 0.00 34.13 30.50 2q4s s GLU 149 CO 0.00 0.23 0.76 -1.25 -0.49 0.00 0.00 175.26 174.52 2q4s s PRO 150 N 0.13 4.46 -0.11 0.39 0.04 -1.26 -4.32 135.00 134.32 2q4s s PRO 150 Ca -0.08 1.07 0.01 0.00 0.04 0.00 0.00 61.00 62.04 2q4s s PRO 150 Cb -0.14 -3.12 -0.01 0.00 0.04 0.00 0.00 34.50 31.28 2q4s s PRO 150 CO 0.04 0.50 -0.17 0.00 0.04 0.00 0.00 177.00 177.41 2q4s s ALA 151 N -1.29 2.47 -0.05 8.56 0.00 -1.09 -3.98 121.76 126.39 2q4s s ALA 151 Ca 0.38 -0.92 0.04 0.00 0.00 0.00 0.00 51.96 51.46 2q4s s ALA 151 Cb -0.21 -1.06 -0.03 0.00 0.00 0.00 0.00 23.12 21.82 2q4s s ALA 151 CO 0.24 0.28 -0.14 0.08 0.00 0.00 0.00 175.76 176.23 2q4s s VAL 152 N 0.28 3.11 0.02 0.00 1.01 -0.60 -1.94 120.40 122.28 2q4s s VAL 152 Ca -0.12 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 61.16 2q4s s VAL 152 Cb -0.16 -2.22 -0.02 0.00 0.00 0.00 0.00 36.38 33.98 2q4s s VAL 152 CO 0.06 0.58 -0.07 -0.94 0.00 0.00 0.00 175.10 174.74 2q4s s SER 153 N -0.77 0.76 -0.12 3.32 1.04 -0.14 -0.79 113.70 117.01 2q4s s SER 153 Ca 0.12 -0.38 -0.12 0.00 0.48 0.00 0.00 55.95 56.05 2q4s s SER 153 Cb -0.11 -0.00 -0.05 0.00 0.10 0.00 0.00 66.02 65.96 2q4s s SER 153 CO 0.01 -0.10 0.26 -0.22 0.98 0.00 0.00 173.24 174.17 2q4s s LEU 154 N -1.02 4.33 -0.02 2.42 2.96 0.29 -0.47 118.68 127.16 2q4s s LEU 154 Ca -0.05 0.57 0.03 0.00 -0.22 0.00 0.00 54.13 54.46 2q4s s LEU 154 Cb -0.07 -2.31 -0.00 0.00 0.50 0.00 0.00 46.19 44.31 2q4s s LEU 154 CO 0.00 0.24 -0.11 -1.00 -1.32 0.00 0.00 176.35 174.17 2q4s s HIS 155 N -0.29 1.06 -0.09 5.38 3.76 -1.26 0.65 115.29 124.49 2q4s s HIS 155 Ca 0.17 -0.25 0.02 0.00 -0.15 0.00 0.00 55.06 54.85 2q4s s HIS 155 Cb -0.13 -0.72 0.01 0.00 1.11 0.00 0.00 32.58 32.85 2q4s s HIS 155 CO 0.05 -0.08 -0.15 -1.17 -0.85 0.00 0.00 174.74 172.55 2q4s s LEU 156 N 0.02 1.70 -0.07 0.89 0.20 -0.32 -4.26 118.68 116.84 2q4s s LEU 156 Ca -0.01 -0.39 0.02 0.00 0.69 0.00 0.00 54.13 54.44 2q4s s LEU 156 Cb -0.07 -1.02 0.01 0.00 -0.43 0.00 0.00 46.19 44.68 2q4s s LEU 156 CO 0.00 0.03 -0.12 -0.31 -0.29 0.00 0.00 176.35 175.66 2q4s s TYR 157 N 0.86 1.46 -0.12 5.38 2.02 -0.71 -1.24 117.35 125.00 2q4s s TYR 157 Ca -0.10 -0.56 -0.05 0.00 -0.37 0.00 0.00 57.07 55.99 2q4s s TYR 157 Cb -0.15 -1.09 0.06 0.00 -0.40 0.00 0.00 41.96 40.38 2q4s s TYR 157 CO 0.01 -0.30 0.27 0.45 -1.57 0.00 0.00 175.55 174.40 2q4s s SER 158 N 0.78 -0.01 0.96 2.29 0.15 -1.00 -1.78 113.70 115.08 2q4s s SER 158 Ca -0.12 0.59 -0.12 0.00 0.70 0.00 0.00 55.95 57.00 2q4s s SER 158 Cb -0.15 0.58 0.17 0.00 -1.71 0.00 0.00 66.02 64.90 2q4s s SER 158 CO 0.02 -0.20 1.09 -2.84 1.20 0.00 0.00 173.24 172.51 2q4s s PRO 159 N 1.80 0.70 0.93 5.44 0.02 -1.26 -1.55 135.00 141.07 2q4s s PRO 159 Ca -0.05 0.86 -0.10 0.00 0.02 0.00 0.00 61.00 61.73 2q4s s PRO 159 Cb -0.11 -1.74 0.15 0.00 0.02 0.00 0.00 34.50 32.82 2q4s s PRO 159 CO -0.09 -2.63 1.14 -2.30 -0.33 0.00 0.00 177.00 172.78 2q4s n PRO 160 N -4.16 -0.54 -3.65 5.54 -0.02 -1.23 -4.80 135.00 126.15 2q4s n PRO 160 Ca 0.06 -0.09 -0.03 0.00 -2.02 0.00 0.00 63.50 61.42 2q4s n PRO 160 Cb 0.55 -2.37 -0.05 0.00 -0.02 0.00 0.00 33.50 31.61 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 -2.63 -1.25 -0.63 6.00 -0.12 -1.26 -5.02 117.98 113.07 2q4s s PHE 161 Ca 0.67 2.26 0.21 0.00 -0.05 0.00 0.00 56.93 60.03 2q4s s PHE 161 Cb -0.23 0.75 -0.26 0.00 -0.63 0.00 0.00 43.02 42.65 2q4s s PHE 161 CO 0.58 -0.62 0.75 -0.40 -0.05 0.00 0.00 175.22 175.49 2q4s n ASP 162 N 5.04 0.61 -4.56 1.98 5.68 -1.26 -4.93 116.55 119.10 2q4s n ASP 162 Ca -0.15 -0.60 -0.30 0.00 -0.50 0.00 0.00 54.79 53.24 2q4s n ASP 162 Cb 0.53 1.36 -0.10 0.00 -1.14 0.00 0.00 41.12 41.77 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 -3.20 3.28 0.08 2.12 -4.23 -1.26 -4.41 115.64 108.03 2q4s s THR 163 Ca 0.02 -1.33 -0.03 0.00 -1.18 0.00 0.00 61.69 59.18 2q4s s THR 163 Cb 0.15 -2.54 0.01 0.00 1.34 0.00 0.00 72.50 71.47 2q4s s THR 163 CO 0.88 0.10 0.15 0.00 -0.54 0.00 0.00 174.62 175.21 2q4s s HIS 165 N -7.45 1.95 0.02 0.00 3.76 -1.26 -0.43 115.29 111.88 2q4s s HIS 165 Ca 0.03 -0.38 -0.00 0.00 -0.15 0.00 0.00 55.06 54.56 2q4s s HIS 165 Cb -0.01 -1.18 -0.04 0.00 1.11 0.00 0.00 32.58 32.46 2q4s s HIS 165 CO 0.02 0.07 0.12 0.00 -0.85 0.00 0.00 174.74 174.11 2q4s s ALA 166 N -0.74 3.73 -0.12 -1.40 0.00 -0.57 -2.79 121.76 119.87 2q4s s ALA 166 Ca 0.09 -0.87 0.03 0.00 0.00 0.00 0.00 51.96 51.20 2q4s s ALA 166 Cb -0.09 -1.66 0.00 0.00 0.00 0.00 0.00 23.12 21.37 2q4s s ALA 166 CO 0.01 0.74 -0.22 -0.06 0.00 0.00 0.00 175.76 176.23 2q4s s PHE 167 N -1.31 2.63 -0.25 0.00 0.08 -0.66 -1.64 117.98 116.83 2q4s s PHE 167 Ca 0.27 -1.08 -0.29 0.00 0.12 0.00 0.00 56.93 55.95 2q4s s PHE 167 Cb -0.12 -1.77 -0.00 0.00 -0.57 0.00 0.00 43.02 40.56 2q4s s PHE 167 CO 0.19 -0.45 1.29 0.34 -0.10 0.00 0.00 175.22 176.49 2q4s s ASP 168 N 0.50 6.77 0.66 1.36 2.15 -0.55 -4.44 116.67 123.13 2q4s s ASP 168 Ca -0.14 1.39 0.42 0.00 0.43 0.00 0.00 52.55 54.66 2q4s s ASP 168 Cb -0.17 -2.54 2.34 0.00 -0.30 0.00 0.00 42.92 42.25 2q4s s ASP 168 CO 0.05 -0.96 2.35 -0.61 -0.17 0.00 0.00 175.17 175.83 2q4s h GLN 169 N 8.89 0.00 0.00 4.34 4.15 -1.95 0.34 115.11 130.88 2q4s h GLN 169 Ca -0.26 0.00 -0.17 0.00 0.77 0.00 0.00 58.65 58.99 2q4s h GLN 169 Cb 1.10 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.76 2q4s h GLN 169 CO 1.01 0.00 -1.12 0.00 -1.93 0.00 0.00 178.83 176.78 2q4s h ARG 170 N 0.00 0.00 0.00 1.69 2.47 -1.90 -3.40 114.38 113.24 2q4s h ARG 170 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2q4s h ARG 170 Cb 0.03 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.35 2q4s h ARG 170 CO -0.00 0.45 -0.80 0.25 0.56 0.00 0.00 179.97 180.43 2q4s n THR 171 N -3.06 0.00 -0.84 2.04 -2.24 -0.95 -2.52 114.28 106.72 2q4s n THR 171 Ca -0.06 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 2q4s n THR 171 Cb 0.84 0.20 0.00 0.00 -2.10 0.00 0.00 70.33 69.27 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 2.09 0.74 3.72 3.38 0.00 0.11 -2.31 105.19 112.94 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 -2.81 3.68 0.32 1.61 5.04 -1.25 -4.70 115.29 117.18 2q4s s HIS 173 Ca 0.00 1.66 0.07 0.00 -1.54 0.00 0.00 55.06 55.26 2q4s s HIS 173 Cb 0.00 -3.17 -0.03 0.00 0.04 0.00 0.00 32.58 29.42 2q4s s HIS 173 CO 0.00 -0.23 0.28 -1.59 -2.34 0.00 0.00 174.74 170.86 2q4s s LYS 174 N 0.27 2.77 -0.02 2.88 -2.85 -1.26 -1.48 119.74 120.06 2q4s s LYS 174 Ca 0.50 -1.25 -0.02 0.00 -1.00 0.00 0.00 55.97 54.20 2q4s s LYS 174 Cb -0.25 -2.50 0.00 0.00 -2.06 0.00 0.00 37.83 33.02 2q4s s LYS 174 CO 0.31 0.14 0.06 0.54 0.10 0.00 0.00 175.35 176.50 2q4s s ASN 175 N -3.98 -0.01 0.10 0.03 4.22 -0.65 -4.96 114.94 109.68 2q4s s ASN 175 Ca 0.40 0.00 -0.30 0.00 -2.14 0.00 0.00 52.86 50.82 2q4s s ASN 175 Cb -0.06 0.14 -0.06 0.00 1.28 0.00 0.00 41.25 42.55 2q4s s ASN 175 CO 0.26 -0.10 0.96 -0.75 -2.04 0.00 0.00 177.10 175.44 2q4s s LYS 176 N -0.33 4.68 -0.03 3.55 2.20 -1.26 -1.51 119.74 127.05 2q4s s LYS 176 Ca -0.04 1.44 0.04 0.00 -0.36 0.00 0.00 55.97 57.06 2q4s s LYS 176 Cb -0.03 -3.38 -0.00 0.00 -1.51 0.00 0.00 37.83 32.91 2q4s s LYS 176 CO 0.00 0.19 -0.16 0.08 -0.36 0.00 0.00 175.35 175.11 2q4s s VAL 177 N 0.08 1.29 0.30 4.02 1.01 0.42 -4.96 120.40 122.55 2q4s s VAL 177 Ca 0.47 -0.65 0.08 0.00 0.00 0.00 0.00 61.98 61.88 2q4s s VAL 177 Cb -0.23 -1.10 -0.04 0.00 0.00 0.00 0.00 36.38 35.01 2q4s s VAL 177 CO 0.30 0.37 0.12 -0.89 0.00 0.00 0.00 175.10 175.00 2q4s s THR 178 N -0.05 3.53 0.02 3.92 2.01 -1.26 -1.45 115.64 122.36 2q4s s THR 178 Ca -0.01 -1.67 -0.27 0.00 0.31 0.00 0.00 61.69 60.05 2q4s s THR 178 Cb -0.10 -3.05 0.09 0.00 0.01 0.00 0.00 72.50 69.46 2q4s s THR 178 CO 0.01 -0.28 0.80 0.42 -0.69 0.00 0.00 174.62 174.87 2q4s s THR 180 N -2.32 0.00 -0.14 -0.82 -4.23 -1.26 -4.99 115.64 101.88 2q4s s THR 180 Ca 0.35 0.00 -0.16 0.00 -1.18 0.00 0.00 61.69 60.69 2q4s s THR 180 Cb -0.05 -1.00 -0.04 0.00 1.34 0.00 0.00 72.50 72.74 2q4s s THR 180 CO 0.23 0.00 0.41 -0.36 -0.54 0.00 0.00 174.62 174.36 2q4s s PHE 181 N -2.92 3.47 0.11 3.99 0.08 -1.26 -4.63 117.98 116.83 2q4s s PHE 181 Ca 0.02 0.76 0.26 0.00 0.12 0.00 0.00 56.93 58.09 2q4s s PHE 181 Cb -0.01 -2.48 1.03 0.00 -0.57 0.00 0.00 43.02 40.98 2q4s s PHE 181 CO -0.07 0.16 1.86 1.25 -0.10 0.00 0.00 175.22 178.32 2q4s h HIS 182 N 6.81 0.00 -2.23 0.36 -0.00 -0.01 -3.42 115.15 116.66 2q4s h HIS 182 Ca -0.40 0.00 0.15 0.00 -0.00 0.00 0.00 60.37 60.11 2q4s h HIS 182 Cb 1.17 0.00 -0.13 0.00 -0.00 0.00 0.00 27.41 28.45 2q4s h HIS 182 CO 0.62 0.16 0.52 0.45 -0.00 0.00 0.00 177.93 179.68 2q4s s SER 183 N -6.06 -0.29 -0.05 3.26 0.15 -1.17 -2.46 113.70 107.08 2q4s s SER 183 Ca 0.01 -0.12 -0.02 0.00 0.70 0.00 0.00 55.95 56.51 2q4s s SER 183 Cb 0.10 0.39 0.04 0.00 -1.71 0.00 0.00 66.02 64.84 2q4s s SER 183 CO 0.61 -0.67 0.10 -0.54 1.20 0.00 0.00 173.24 173.94 2q4s s LYS 184 N -3.11 -0.00 -1.44 5.44 1.02 0.73 -1.01 119.74 121.38 2q4s s LYS 184 Ca 0.08 0.38 -0.08 0.00 0.02 0.00 0.00 55.97 56.37 2q4s s LYS 184 Cb -0.01 -0.31 0.02 0.00 -0.52 0.00 0.00 37.83 37.01 2q4s s LYS 184 CO -0.05 -0.25 0.98 1.19 -0.92 0.00 0.00 175.35 176.30 2q4s n PHE 185 N 4.79 -2.54 -0.18 3.18 3.72 -0.93 -0.75 117.46 124.75 2q4s n PHE 185 Ca -0.15 0.84 0.00 0.00 -0.05 0.00 0.00 57.45 58.10 2q4s n PHE 185 Cb 0.50 -4.75 0.00 0.00 -0.94 0.00 0.00 39.48 34.30 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 -1.82 2.41 3.63 1.37 0.00 -1.26 -5.00 105.19 104.52 2q4s n GLY 186 Ca -0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.61 2q4s n GLY 186 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2q4s s ILE 187 N -3.10 5.27 0.31 -0.61 -1.09 0.07 -4.98 121.20 117.06 2q4s s ILE 187 Ca 0.00 0.38 -0.30 0.00 -2.23 0.00 0.00 60.65 58.51 2q4s s ILE 187 Cb 0.00 -3.60 -0.12 0.00 -1.58 0.00 0.00 42.46 37.16 2q4s s ILE 187 CO 0.00 0.25 1.53 -1.14 -1.23 0.00 0.00 174.94 174.35 2q4s n ARG 188 N 4.79 2.57 -3.56 2.79 3.00 -1.26 -0.19 116.66 124.79 2q4s n ARG 188 Ca -0.12 0.91 -0.28 0.00 -0.00 0.00 0.00 57.85 58.37 2q4s n ARG 188 Cb 0.51 -2.65 -0.11 0.00 0.00 0.00 0.00 32.46 30.22 2q4s n ARG 188 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 2q4s s THR 189 N -0.34 1.14 0.00 5.15 -4.23 -1.03 -4.85 115.64 111.48 2q4s s THR 189 Ca 0.61 -3.08 0.00 0.00 -1.18 0.00 0.00 61.69 58.04 2q4s s THR 189 Cb -0.52 -1.77 0.00 0.00 1.34 0.00 0.00 72.50 71.55 2q4s s THR 189 CO 0.53 -1.14 0.00 -2.65 -0.54 0.00 0.00 174.62 170.82