#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 3.27 0.16 -4.62 1.43 -1.26 -4.99 118.68 112.67 2q4s s LEU 6 Ca 0.00 -0.09 -0.02 0.00 -1.03 0.00 0.00 54.13 52.99 2q4s s LEU 6 Cb 0.00 -2.73 -0.05 0.00 0.03 0.00 0.00 46.19 43.44 2q4s s LEU 6 CO 0.00 -1.86 0.35 -0.76 0.23 0.00 0.00 176.35 174.31 2q4s s LEU 7 N 6.28 4.26 0.61 1.79 1.43 -1.26 -5.05 118.68 126.74 2q4s s LEU 7 Ca 0.45 0.43 -0.19 0.00 -1.03 0.00 0.00 54.13 53.79 2q4s s LEU 7 Cb -0.09 -3.17 -0.03 0.00 0.03 0.00 0.00 46.19 42.92 2q4s s LEU 7 CO 0.19 0.03 1.23 1.17 0.23 0.00 0.00 176.35 179.20 2q4s n LYS 8 N -0.26 1.22 -3.06 1.70 4.81 -1.26 -4.95 118.16 116.35 2q4s n LYS 8 Ca -0.04 0.47 -0.35 0.00 -0.87 0.00 0.00 58.31 57.51 2q4s n LYS 8 Cb 0.53 -2.46 -0.06 0.00 0.02 0.00 0.00 35.03 33.06 2q4s n LYS 8 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 2q4s s PRO 9 N -3.09 4.23 0.11 1.64 0.02 -1.26 -4.99 135.00 131.65 2q4s s PRO 9 Ca 0.78 0.88 0.18 0.00 0.02 0.00 0.00 61.00 62.86 2q4s s PRO 9 Cb -0.40 -2.73 -0.09 0.00 0.02 0.00 0.00 34.50 31.30 2q4s s PRO 9 CO 0.44 0.31 0.91 0.00 -0.33 0.00 0.00 177.00 178.33 2q4s h ARG 10 N 3.04 0.00 -3.16 5.54 3.08 -1.92 -3.43 114.38 117.53 2q4s h ARG 10 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.58 2q4s h ARG 10 Cb 1.19 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.20 2q4s h ARG 10 CO 0.65 0.23 0.17 0.95 -1.07 0.00 0.00 179.97 180.89 2q4s s THR 11 N -3.03 0.00 0.18 2.04 -4.23 -1.26 -4.96 115.64 104.37 2q4s s THR 11 Ca -0.02 -1.10 -0.13 0.00 -1.18 0.00 0.00 61.69 59.26 2q4s s THR 11 Cb 0.09 -2.33 0.08 0.00 1.34 0.00 0.00 72.50 71.67 2q4s s THR 11 CO 0.80 0.00 1.84 0.25 -0.54 0.00 0.00 174.62 176.97 2q4s h LEU 12 N 2.04 0.65 -1.40 4.79 5.85 -1.93 0.26 115.31 125.58 2q4s h LEU 12 Ca -0.25 -0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.42 2q4s h LEU 12 Cb 1.25 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 42.10 2q4s h LEU 12 CO 0.31 0.48 0.07 0.00 -0.34 0.00 0.00 178.44 178.97 2q4s h ALA 13 N 1.20 1.52 0.50 1.25 0.00 -1.97 0.11 119.26 121.88 2q4s h ALA 13 Ca 0.21 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 2q4s h ALA 13 Cb -0.07 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.58 2q4s h ALA 13 CO -0.04 0.36 -0.24 0.22 0.00 0.00 0.00 179.25 179.54 2q4s h ASP 14 N 0.47 -0.57 -0.61 0.00 1.82 -1.43 -1.16 116.42 114.95 2q4s h ASP 14 Ca 0.11 0.01 0.12 0.00 -0.39 0.00 0.00 57.03 56.88 2q4s h ASP 14 Cb 0.19 0.15 -0.09 0.00 0.68 0.00 0.00 39.33 40.26 2q4s h ASP 14 CO -0.00 -0.40 0.10 0.25 -1.61 0.00 0.00 179.24 177.59 2q4s h LEU 15 N -0.69 -0.06 -0.96 2.28 5.85 0.07 -0.89 115.31 120.92 2q4s h LEU 15 Ca -0.07 0.12 0.03 0.00 0.84 0.00 0.00 57.88 58.81 2q4s h LEU 15 Cb 0.52 0.18 -0.06 0.00 0.37 0.00 0.00 40.66 41.68 2q4s h LEU 15 CO 0.11 -0.02 0.63 0.40 -0.34 0.00 0.00 178.44 179.22 2q4s h ILE 16 N 0.23 1.17 -0.19 4.05 2.04 -0.31 0.12 117.51 124.62 2q4s h ILE 16 Ca 0.32 -0.42 0.01 0.00 1.00 0.00 0.00 64.86 65.78 2q4s h ILE 16 Cb 0.50 -0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.41 2q4s h ILE 16 CO -0.44 0.22 0.09 -0.09 0.00 0.00 0.00 178.15 177.94 2q4s h ARG 17 N 1.22 0.19 -0.71 2.37 2.43 0.04 0.48 114.38 120.40 2q4s h ARG 17 Ca 0.38 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.47 2q4s h ARG 17 Cb -0.02 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.46 2q4s h ARG 17 CO -0.12 0.13 0.19 0.82 -1.51 0.00 0.00 179.97 179.48 2q4s h ILE 18 N 0.20 1.26 -0.54 1.20 2.04 -0.77 -0.48 117.51 120.41 2q4s h ILE 18 Ca 0.08 -0.94 -0.05 0.00 1.00 0.00 0.00 64.86 64.94 2q4s h ILE 18 Cb 0.02 0.51 -0.03 0.00 -0.74 0.00 0.00 36.82 36.58 2q4s h ILE 18 CO -0.05 0.36 0.13 -0.07 0.00 0.00 0.00 178.15 178.52 2q4s h LEU 19 N 1.07 0.78 -1.22 1.44 3.38 -0.41 0.29 115.31 120.63 2q4s h LEU 19 Ca 0.23 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 2q4s h LEU 19 Cb 0.34 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 2q4s h LEU 19 CO -0.00 0.76 0.02 0.45 0.09 0.00 0.00 178.44 179.76 2q4s h HIS 20 N 0.80 0.57 -0.35 1.13 3.86 0.01 -1.20 115.15 119.97 2q4s h HIS 20 Ca 0.18 -0.05 -0.17 0.00 -1.16 0.00 0.00 60.37 59.17 2q4s h HIS 20 Cb 0.29 -0.17 -0.00 0.00 1.06 0.00 0.00 27.41 28.59 2q4s h HIS 20 CO 0.02 0.54 -0.43 0.93 0.86 0.00 0.00 177.93 179.85 2q4s h GLU 21 N 0.54 0.91 0.00 2.45 5.08 0.55 -3.04 114.58 121.06 2q4s h GLU 21 Ca 0.12 -0.50 -0.03 0.00 -1.00 0.00 0.00 59.36 57.95 2q4s h GLU 21 Cb 0.31 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 2q4s h GLU 21 CO 0.01 1.15 -0.13 -0.07 -1.00 0.00 0.00 179.01 178.97 2q4s h LEU 22 N 0.73 0.00 -3.36 1.33 3.38 -0.11 -3.05 115.31 114.23 2q4s h LEU 22 Ca 0.05 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 2q4s h LEU 22 Cb 1.03 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.72 2q4s h LEU 22 CO 0.10 0.13 0.03 0.49 0.09 0.00 0.00 178.44 179.28 2q4s n PHE 23 N -3.29 1.21 0.23 1.13 3.72 -0.49 -4.63 117.46 115.34 2q4s n PHE 23 Ca 0.00 -1.14 0.10 0.00 -0.05 0.00 0.00 57.45 56.36 2q4s n PHE 23 Cb 0.37 -0.42 0.49 0.00 -0.94 0.00 0.00 39.48 38.97 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 1.66 1.05 -4.31 4.37 0.00 -1.42 -3.45 119.26 117.17 2q4s h ALA 24 Ca 0.11 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 2q4s h ALA 24 Cb 1.65 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.41 2q4s h ALA 24 CO 0.35 0.27 -0.01 0.41 0.00 0.00 0.00 179.25 180.28 2q4s n GLY 25 N 0.04 1.80 0.01 0.00 0.00 -1.26 -5.04 105.19 100.74 2q4s n GLY 25 Ca -0.00 -2.12 0.12 0.00 0.00 0.00 0.00 46.02 44.01 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 -2.92 0.56 -4.26 1.61 8.00 -1.26 -4.92 116.55 113.36 2q4s n ASP 26 Ca 0.02 -0.27 -0.25 0.00 0.71 0.00 0.00 54.79 55.00 2q4s n ASP 26 Cb 0.08 0.33 -0.03 0.00 -0.02 0.00 0.00 41.12 41.48 2q4s n ASP 26 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2q4s n GLU 27 N -1.57 0.92 -3.80 -1.24 -0.58 -1.26 -5.14 120.64 107.96 2q4s n GLU 27 Ca 0.05 -2.97 -0.16 0.00 -0.42 0.00 0.00 57.16 53.65 2q4s n GLU 27 Cb 0.35 0.62 -0.16 0.00 -0.57 0.00 0.00 31.44 31.68 2q4s n GLU 27 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2q4s s VAL 28 N -2.41 0.01 -0.67 2.62 1.01 -1.26 -4.87 120.40 114.82 2q4s s VAL 28 Ca 0.10 0.20 -0.20 0.00 0.00 0.00 0.00 61.98 62.07 2q4s s VAL 28 Cb -0.01 -0.15 0.10 0.00 0.00 0.00 0.00 36.38 36.32 2q4s s VAL 28 CO 0.06 0.12 0.87 0.21 0.00 0.00 0.00 175.10 176.36 2q4s s ASN 29 N 1.18 6.25 0.14 3.32 3.84 -1.26 -4.92 114.94 123.49 2q4s s ASN 29 Ca -0.08 -1.35 -0.23 0.00 0.21 0.00 0.00 52.86 51.42 2q4s s ASN 29 Cb -0.13 -2.36 0.00 0.00 -0.55 0.00 0.00 41.25 38.21 2q4s s ASN 29 CO -0.03 -1.24 1.64 0.58 -2.79 0.00 0.00 177.10 175.27 2q4s h VAL 30 N 5.91 0.47 -0.86 -5.21 2.07 -1.98 0.34 116.25 116.99 2q4s h VAL 30 Ca -0.22 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.30 2q4s h VAL 30 Cb 1.07 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 31.27 2q4s h VAL 30 CO 1.13 0.00 0.54 -0.33 0.02 0.00 0.00 177.57 178.93 2q4s h GLU 31 N -0.24 1.14 0.16 1.57 3.07 -1.98 0.50 114.58 118.80 2q4s h GLU 31 Ca 0.11 -0.08 -0.01 0.00 -0.50 0.00 0.00 59.36 58.88 2q4s h GLU 31 Cb 0.41 -0.25 0.00 0.00 -0.84 0.00 0.00 28.75 28.07 2q4s h GLU 31 CO -0.31 0.78 -0.08 0.93 -1.40 0.00 0.00 179.01 178.93 2q4s h GLU 32 N 1.17 -0.21 -0.94 2.33 5.08 -1.69 0.23 114.58 120.55 2q4s h GLU 32 Ca 0.31 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.71 2q4s h GLU 32 Cb -0.09 0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.15 2q4s h GLU 32 CO -0.06 0.12 0.62 0.28 -1.00 0.00 0.00 179.01 178.96 2q4s h VAL 33 N -0.55 1.19 -0.38 3.13 2.07 0.09 0.15 116.25 121.94 2q4s h VAL 33 Ca -0.02 -0.42 -0.08 0.00 0.82 0.00 0.00 66.70 67.01 2q4s h VAL 33 Cb 0.42 -0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.04 2q4s h VAL 33 CO 0.04 0.22 -0.08 -0.61 0.02 0.00 0.00 177.57 177.16 2q4s h GLN 34 N 1.22 0.65 -0.80 1.57 4.15 0.01 -2.77 115.11 119.13 2q4s h GLN 34 Ca 0.37 -0.19 -0.02 0.00 0.77 0.00 0.00 58.65 59.58 2q4s h GLN 34 Cb -0.05 -0.07 -0.04 0.00 0.21 0.00 0.00 27.48 27.54 2q4s h GLN 34 CO -0.11 0.72 0.44 0.00 -1.93 0.00 0.00 178.83 177.95 2q4s h ALA 35 N 1.32 1.03 -0.35 3.38 0.00 0.22 -2.06 119.26 122.79 2q4s h ALA 35 Ca 0.11 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 2q4s h ALA 35 Cb 0.49 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2q4s h ALA 35 CO 0.03 0.54 -0.15 -0.24 0.00 0.00 0.00 179.25 179.43 2q4s h VAL 36 N 1.12 1.25 -0.18 0.00 3.04 -0.99 -2.72 116.25 117.78 2q4s h VAL 36 Ca 0.28 -1.15 -0.04 0.00 -1.01 0.00 0.00 66.70 64.78 2q4s h VAL 36 Cb 0.03 1.14 -0.01 0.00 -2.01 0.00 0.00 31.29 30.45 2q4s h VAL 36 CO -0.05 0.38 -0.06 -0.07 -1.01 0.00 0.00 177.57 176.77 2q4s h LEU 37 N 0.57 0.36 -1.63 3.16 3.38 -1.19 -2.68 115.31 117.28 2q4s h LEU 37 Ca 0.10 -0.39 -0.00 0.00 0.09 0.00 0.00 57.88 57.68 2q4s h LEU 37 Cb 0.58 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 2q4s h LEU 37 CO 0.04 0.66 0.17 -0.08 0.09 0.00 0.00 178.44 179.32 2q4s h GLU 38 N 0.05 0.42 0.00 1.13 4.81 -1.34 -2.84 114.58 116.80 2q4s h GLU 38 Ca 0.04 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.15 2q4s h GLU 38 Cb 0.52 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 2q4s h GLU 38 CO 0.02 0.31 -0.41 0.00 -0.73 0.00 0.00 179.01 178.20 2q4s h ALA 39 N 1.77 1.05 -2.49 2.92 0.00 -1.16 -3.44 119.26 117.91 2q4s h ALA 39 Ca 0.11 -0.37 -0.53 0.00 0.00 0.00 0.00 54.91 54.12 2q4s h ALA 39 Cb 0.01 -0.06 0.02 0.00 0.00 0.00 0.00 17.79 17.75 2q4s h ALA 39 CO -0.02 0.51 0.86 -0.47 0.00 0.00 0.00 179.25 180.12 2q4s s TYR 40 N -3.71 2.89 -0.35 0.00 5.04 -1.07 -4.55 117.35 115.59 2q4s s TYR 40 Ca -0.01 0.68 -0.25 0.00 -2.44 0.00 0.00 57.07 55.05 2q4s s TYR 40 Cb 0.12 -3.81 0.01 0.00 0.35 0.00 0.00 41.96 38.63 2q4s s TYR 40 CO 0.70 -3.03 0.87 -1.21 -1.34 0.00 0.00 175.55 171.54 2q4s s GLU 41 N 1.82 3.85 0.12 4.97 2.02 -1.26 -4.98 118.70 125.25 2q4s s GLU 41 Ca 0.68 0.53 -0.33 0.00 0.02 0.00 0.00 54.97 55.88 2q4s s GLU 41 Cb -0.38 -3.79 -0.12 0.00 0.10 0.00 0.00 34.13 29.94 2q4s s GLU 41 CO 0.30 -0.86 1.72 0.45 0.02 0.00 0.00 175.26 176.88 2q4s n SER 42 N 6.57 3.56 -3.93 -0.19 2.88 -1.26 -4.92 113.62 116.33 2q4s n SER 42 Ca 0.06 1.04 -0.30 0.00 -1.33 0.00 0.00 58.87 58.33 2q4s n SER 42 Cb 0.48 -1.48 -0.16 0.00 -0.75 0.00 0.00 64.21 62.31 2q4s n SER 42 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 2q4s s ASN 43 N 1.90 3.81 0.57 -3.46 2.47 -1.26 -5.01 114.94 113.95 2q4s s ASN 43 Ca 0.81 -1.17 0.28 0.00 0.42 0.00 0.00 52.86 53.21 2q4s s ASN 43 Cb -0.60 -1.15 1.48 0.00 -1.45 0.00 0.00 41.25 39.53 2q4s s ASN 43 CO 0.39 -0.24 1.94 -0.65 -3.72 0.00 0.00 177.10 174.81 2q4s h PRO 44 N 7.97 0.00 -0.55 0.43 0.11 -1.92 -1.59 132.00 136.44 2q4s h PRO 44 Ca -0.18 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.93 2q4s h PRO 44 Cb 1.07 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.16 2q4s h PRO 44 CO 0.41 0.00 0.33 0.00 -0.21 0.00 0.00 178.00 178.53 2q4s h ALA 45 N 1.57 1.54 0.00 -0.75 0.00 -2.01 -0.50 119.26 119.12 2q4s h ALA 45 Ca 0.25 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 2q4s h ALA 45 Cb 1.16 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 2q4s h ALA 45 CO -0.00 0.40 -0.49 0.93 0.00 0.00 0.00 179.25 180.09 2q4s h GLU 46 N 0.76 0.00 -0.10 0.00 5.08 -1.73 -3.32 114.58 115.27 2q4s h GLU 46 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 2q4s h GLU 46 Cb -0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.22 2q4s h GLU 46 CO -0.04 0.49 0.00 -2.67 -1.00 0.00 0.00 179.01 175.79 2q4s n TRP 47 N -3.54 0.13 -0.26 4.33 4.27 -1.03 -4.67 117.44 116.67 2q4s n TRP 47 Ca -0.00 -0.24 0.04 0.00 -3.89 0.00 0.00 57.50 53.41 2q4s n TRP 47 Cb 0.59 -0.02 0.18 0.00 -1.36 0.00 0.00 31.31 30.70 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 1.25 1.09 -1.05 -1.67 0.00 -1.20 -0.31 119.26 117.36 2q4s h ALA 48 Ca 0.00 0.09 0.28 0.00 0.00 0.00 0.00 54.91 55.28 2q4s h ALA 48 Cb 0.45 0.01 -0.11 0.00 0.00 0.00 0.00 17.79 18.14 2q4s h ALA 48 CO 0.00 -0.12 0.65 1.25 0.00 0.00 0.00 179.25 181.03 2q4s h LEU 49 N 0.55 0.52 0.00 0.00 5.85 -1.84 -0.85 115.31 119.54 2q4s h LEU 49 Ca 0.40 0.12 0.00 0.00 0.84 0.00 0.00 57.88 59.24 2q4s h LEU 49 Cb 0.54 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.61 2q4s h LEU 49 CO -0.34 0.04 -0.54 -1.22 -0.34 0.00 0.00 178.44 176.04 2q4s n TYR 50 N -4.78 0.08 -2.08 1.25 4.01 -0.15 -4.63 117.16 110.86 2q4s n TYR 50 Ca 0.28 0.02 -0.42 0.00 -0.16 0.00 0.00 57.90 57.62 2q4s n TYR 50 Cb 0.89 -0.31 0.00 0.00 -0.31 0.00 0.00 39.34 39.61 2q4s n TYR 50 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2q4s n ALA 51 N -1.56 5.35 -3.45 -0.72 0.00 -0.32 -4.85 120.51 114.96 2q4s n ALA 51 Ca 0.05 -4.10 -0.37 0.00 0.00 0.00 0.00 53.44 49.03 2q4s n ALA 51 Cb 0.35 -3.26 -0.13 0.00 0.00 0.00 0.00 19.45 16.41 2q4s n ALA 51 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2q4s s LYS 52 N 1.84 2.49 0.57 0.00 1.02 -1.26 -5.04 119.74 119.37 2q4s s LYS 52 Ca 0.44 -1.28 -0.02 0.00 0.02 0.00 0.00 55.97 55.13 2q4s s LYS 52 Cb 0.11 -3.37 0.03 0.00 -0.52 0.00 0.00 37.83 34.08 2q4s s LYS 52 CO -0.04 -0.69 0.83 -0.06 -0.92 0.00 0.00 175.35 174.47 2q4s s PHE 53 N 1.32 3.01 0.01 3.18 0.08 -1.26 -4.78 117.98 119.55 2q4s s PHE 53 Ca -0.02 0.26 0.08 0.00 0.12 0.00 0.00 56.93 57.37 2q4s s PHE 53 Cb -0.20 -2.77 -0.02 0.00 -0.57 0.00 0.00 43.02 39.46 2q4s s PHE 53 CO 0.01 -0.89 -0.23 0.34 -0.10 0.00 0.00 175.22 174.35 2q4s s ASP 54 N -4.38 2.72 0.16 1.36 2.15 -1.26 -5.04 116.67 112.37 2q4s s ASP 54 Ca 0.56 -0.48 -0.26 0.00 0.43 0.00 0.00 52.55 52.79 2q4s s ASP 54 Cb -0.10 -0.27 0.01 0.00 -0.30 0.00 0.00 42.92 42.26 2q4s s ASP 54 CO 0.41 0.24 1.58 -0.61 -0.17 0.00 0.00 175.17 176.62 2q4s h GLN 55 N 5.21 -0.31 -0.00 4.34 4.15 -2.01 -3.31 115.11 123.17 2q4s h GLN 55 Ca -0.42 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.02 2q4s h GLN 55 Cb 1.14 0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.90 2q4s h GLN 55 CO 0.46 -0.21 -0.52 0.66 -1.93 0.00 0.00 178.83 177.29 2q4s n TYR 56 N -5.42 0.00 -3.68 3.99 4.01 -1.26 -4.92 117.16 109.88 2q4s n TYR 56 Ca -0.00 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.64 2q4s n TYR 56 Cb 0.35 -0.12 -0.03 0.00 -0.31 0.00 0.00 39.34 39.22 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 -2.77 1.40 0.52 -0.72 1.70 -1.25 -5.00 118.95 112.83 2q4s s ARG 57 Ca 0.16 -0.79 -0.20 0.00 -0.47 0.00 0.00 55.73 54.42 2q4s s ARG 57 Cb 0.18 0.54 -0.07 0.00 -0.57 0.00 0.00 34.95 35.03 2q4s s ARG 57 CO 0.66 -0.60 1.10 1.52 -1.08 0.00 0.00 175.30 176.90 2q4s s TYR 58 N -3.85 2.79 0.07 5.89 -0.85 -1.26 -4.11 117.35 116.03 2q4s s TYR 58 Ca 0.07 1.56 0.08 0.00 -0.52 0.00 0.00 57.07 58.26 2q4s s TYR 58 Cb -0.01 -3.22 -0.04 0.00 0.38 0.00 0.00 41.96 39.07 2q4s s TYR 58 CO -0.04 -1.32 -0.17 0.95 -1.52 0.00 0.00 175.55 173.45 2q4s s THR 59 N -1.82 2.86 0.07 -3.49 -4.23 -0.87 -4.96 115.64 103.20 2q4s s THR 59 Ca 0.70 -1.29 0.01 0.00 -1.18 0.00 0.00 61.69 59.94 2q4s s THR 59 Cb -0.22 -2.25 -0.04 0.00 1.34 0.00 0.00 72.50 71.33 2q4s s THR 59 CO 0.25 0.24 0.15 -0.13 -0.54 0.00 0.00 174.62 174.59 2q4s s ARG 60 N -1.72 3.17 -0.11 3.99 0.52 -1.26 -1.53 118.95 122.01 2q4s s ARG 60 Ca 0.16 -0.56 -0.04 0.00 -0.52 0.00 0.00 55.73 54.76 2q4s s ARG 60 Cb -0.11 -2.89 0.05 0.00 0.52 0.00 0.00 34.95 32.53 2q4s s ARG 60 CO 0.07 0.59 0.23 -0.80 0.02 0.00 0.00 175.30 175.41 2q4s s ASN 61 N -2.46 0.19 -0.31 0.23 -0.87 0.54 -1.27 114.94 110.99 2q4s s ASN 61 Ca 0.32 0.50 -0.29 0.00 -1.57 0.00 0.00 52.86 51.83 2q4s s ASN 61 Cb -0.13 0.49 -0.01 0.00 -0.02 0.00 0.00 41.25 41.59 2q4s s ASN 61 CO 0.25 -0.21 1.57 -0.22 -2.57 0.00 0.00 177.10 175.93 2q4s s LEU 62 N 1.94 3.70 -0.25 0.60 2.96 0.18 0.34 118.68 128.15 2q4s s LEU 62 Ca -0.03 1.27 -0.16 0.00 -0.22 0.00 0.00 54.13 55.00 2q4s s LEU 62 Cb -0.11 -3.53 -0.12 0.00 0.50 0.00 0.00 46.19 42.92 2q4s s LEU 62 CO -0.08 -1.41 -0.23 0.52 -1.32 0.00 0.00 176.35 173.83 2q4s n VAL 63 N 6.84 1.52 -3.70 1.68 0.31 -1.13 0.15 118.33 124.01 2q4s n VAL 63 Ca 0.19 -0.23 -0.11 0.00 -0.01 0.00 0.00 64.34 64.18 2q4s n VAL 63 Cb 0.46 -1.99 -0.11 0.00 -0.91 0.00 0.00 33.84 31.30 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 -7.12 -0.51 0.08 4.52 2.15 -1.03 -4.72 116.67 110.04 2q4s s ASP 64 Ca -0.35 0.89 0.20 0.00 0.43 0.00 0.00 52.55 53.73 2q4s s ASP 64 Cb 0.11 0.80 0.84 0.00 -0.30 0.00 0.00 42.92 44.37 2q4s s ASP 64 CO 0.49 -0.19 1.64 0.00 -0.17 0.00 0.00 175.17 176.95 2q4s n GLN 65 N 4.01 0.07 -1.00 4.34 6.02 -1.26 -1.49 117.38 128.07 2q4s n GLN 65 Ca -0.22 0.24 0.00 0.00 -0.01 0.00 0.00 57.00 57.01 2q4s n GLN 65 Cb 0.56 -1.61 0.00 0.00 1.02 0.00 0.00 30.24 30.20 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 0.42 0.51 2.21 1.08 0.00 -1.21 -3.95 105.19 104.25 2q4s n GLY 66 Ca 0.04 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.06 -4.04 0.00 1.61 4.13 -1.26 -3.62 115.26 112.01 2q4s n ASN 67 Ca 0.00 0.30 0.00 0.00 1.68 0.00 0.00 54.58 56.56 2q4s n ASN 67 Cb 0.03 -3.63 0.00 0.00 -1.54 0.00 0.00 39.78 34.64 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 -0.43 3.33 1.20 7.41 0.00 -1.25 -4.94 105.19 110.51 2q4s n GLY 68 Ca -0.15 -0.94 0.11 0.00 0.00 0.00 0.00 46.02 45.03 2q4s n GLY 68 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2q4s n LYS 69 N 0.00 2.51 -3.54 1.61 5.02 -1.24 -4.65 118.16 117.87 2q4s n LYS 69 Ca 0.00 -2.34 -0.08 0.00 -2.02 0.00 0.00 58.31 53.87 2q4s n LYS 69 Cb 0.00 -1.51 -0.02 0.00 -0.02 0.00 0.00 35.03 33.47 2q4s n LYS 69 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 2q4s s PHE 70 N -1.17 -0.29 0.06 2.13 -0.12 -1.26 -3.97 117.98 113.37 2q4s s PHE 70 Ca 0.43 0.23 0.05 0.00 -0.05 0.00 0.00 56.93 57.59 2q4s s PHE 70 Cb 0.23 0.52 -0.03 0.00 -0.63 0.00 0.00 43.02 43.11 2q4s s PHE 70 CO 0.30 -0.42 -0.14 -0.80 -0.05 0.00 0.00 175.22 174.11 2q4s s ASN 71 N -2.21 1.61 0.30 1.98 0.01 -1.02 -3.28 114.94 112.33 2q4s s ASN 71 Ca 0.05 -0.58 0.10 0.00 -0.71 0.00 0.00 52.86 51.72 2q4s s ASN 71 Cb -0.01 -0.05 -0.06 0.00 0.41 0.00 0.00 41.25 41.54 2q4s s ASN 71 CO -0.07 -0.07 -0.14 -0.22 -1.51 0.00 0.00 177.10 175.10 2q4s s LEU 72 N -1.62 2.63 -0.06 0.60 2.96 -0.56 -2.46 118.68 120.19 2q4s s LEU 72 Ca -0.02 -1.12 0.04 0.00 -0.22 0.00 0.00 54.13 52.81 2q4s s LEU 72 Cb -0.10 -0.97 -0.02 0.00 0.50 0.00 0.00 46.19 45.60 2q4s s LEU 72 CO 0.02 -0.12 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.14 2q4s s ILE 74 N -2.65 2.93 -0.11 6.68 1.01 0.15 -2.45 121.20 126.76 2q4s s ILE 74 Ca 0.30 -0.77 0.01 0.00 0.00 0.00 0.00 60.65 60.20 2q4s s ILE 74 Cb -0.01 -2.14 -0.02 0.00 0.01 0.00 0.00 42.46 40.30 2q4s s ILE 74 CO 0.15 0.58 -0.14 -0.76 0.00 0.00 0.00 174.94 174.77 2q4s s LEU 75 N -0.58 2.71 -0.18 2.97 1.02 -0.46 0.20 118.68 124.36 2q4s s LEU 75 Ca 0.08 -0.30 -0.01 0.00 0.02 0.00 0.00 54.13 53.92 2q4s s LEU 75 Cb -0.11 -1.59 0.00 0.00 0.02 0.00 0.00 46.19 44.51 2q4s s LEU 75 CO 0.01 0.21 -0.14 0.00 0.02 0.00 0.00 176.35 176.45 2q4s s TRP 77 N 1.13 2.95 0.18 0.00 0.52 -0.26 -2.06 118.94 121.40 2q4s s TRP 77 Ca 0.01 -0.45 -0.17 0.00 0.02 0.00 0.00 56.10 55.51 2q4s s TRP 77 Cb -0.14 -1.93 -0.08 0.00 -1.15 0.00 0.00 33.47 30.18 2q4s s TRP 77 CO -0.05 -0.12 0.64 0.20 0.02 0.00 0.00 176.95 177.64 2q4s s GLY 78 N 0.41 2.55 -0.39 0.98 0.00 -1.26 -2.23 107.32 107.38 2q4s s GLY 78 Ca -0.06 0.03 -0.39 0.00 0.00 0.00 0.00 44.72 44.29 2q4s s GLY 78 CO 0.04 0.35 1.32 1.18 0.00 0.00 0.00 173.10 175.99 2q4s n GLU 79 N 0.82 0.00 -0.72 2.90 4.71 -1.26 0.20 120.64 127.28 2q4s n GLU 79 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.11 2q4s n GLU 79 Cb 0.51 -1.27 0.00 0.00 -1.01 0.00 0.00 31.44 29.67 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 3.23 1.49 3.74 0.62 0.00 0.05 -4.97 105.19 109.34 2q4s n GLY 80 Ca 0.26 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.87 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 -3.66 3.66 0.28 1.61 3.76 0.54 -4.79 115.29 116.70 2q4s s HIS 81 Ca 0.00 1.67 0.02 0.00 -0.15 0.00 0.00 55.06 56.60 2q4s s HIS 81 Cb 0.00 -3.22 -0.06 0.00 1.11 0.00 0.00 32.58 30.41 2q4s s HIS 81 CO 0.00 -0.39 0.08 0.20 -0.85 0.00 0.00 174.74 173.78 2q4s s GLY 82 N -0.33 1.87 0.49 -2.22 0.00 -1.26 -1.14 107.32 104.73 2q4s s GLY 82 Ca 0.47 -1.93 0.07 0.00 0.00 0.00 0.00 44.72 43.34 2q4s s GLY 82 CO 0.35 -1.68 0.50 -1.35 0.00 0.00 0.00 173.10 170.92 2q4s s SER 83 N -3.38 4.98 0.82 1.64 1.04 0.58 -4.76 113.70 114.63 2q4s s SER 83 Ca 0.37 -0.90 -0.11 0.00 0.48 0.00 0.00 55.95 55.79 2q4s s SER 83 Cb 0.08 -0.07 0.08 0.00 0.10 0.00 0.00 66.02 66.21 2q4s s SER 83 CO 0.14 -0.96 1.10 -0.94 0.98 0.00 0.00 173.24 173.56 2q4s s SER 84 N -4.32 4.24 -0.25 7.02 1.04 -1.26 -4.39 113.70 115.78 2q4s s SER 84 Ca 0.48 1.36 -0.29 0.00 0.48 0.00 0.00 55.95 57.98 2q4s s SER 84 Cb -0.04 -2.08 0.00 0.00 0.10 0.00 0.00 66.02 64.00 2q4s s SER 84 CO 0.29 -2.13 1.18 -0.63 0.98 0.00 0.00 173.24 172.93 2q4s s ILE 85 N -3.09 4.38 0.20 -1.02 1.01 -1.25 -4.06 121.20 117.36 2q4s s ILE 85 Ca 0.61 1.63 0.04 0.00 0.00 0.00 0.00 60.65 62.94 2q4s s ILE 85 Cb -0.15 -4.20 -0.02 0.00 0.01 0.00 0.00 42.46 38.11 2q4s s ILE 85 CO 0.55 -0.30 0.15 0.00 0.00 0.00 0.00 174.94 175.34 2q4s n HIS 86 N 6.86 -0.38 -2.55 3.97 1.44 0.82 -0.25 115.22 125.12 2q4s n HIS 86 Ca 0.13 -1.63 0.00 0.00 -2.01 0.00 0.00 57.72 54.21 2q4s n HIS 86 Cb 0.46 0.14 0.00 0.00 0.12 0.00 0.00 29.99 30.71 2q4s n HIS 86 CO 0.00 0.00 0.00 -0.40 -2.81 0.00 0.00 176.34 173.13 2q4s n ASP 87 N -2.15 1.18 -1.59 4.39 5.75 -1.19 0.11 116.55 123.06 2q4s n ASP 87 Ca 0.03 0.00 0.02 0.00 -0.01 0.00 0.00 54.79 54.83 2q4s n ASP 87 Cb 0.36 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.46 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 0.00 0.08 -4.34 2.11 8.25 -1.26 -4.88 115.22 115.18 2q4s n HIS 88 Ca 0.00 -0.69 -0.34 0.00 -0.26 0.00 0.00 57.72 56.43 2q4s n HIS 88 Cb 0.00 -0.03 -0.08 0.00 1.12 0.00 0.00 29.99 31.00 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 0.27 -0.94 -1.98 1.59 -1.04 -1.26 -0.00 114.28 110.91 2q4s n THR 89 Ca 0.01 -0.33 -0.20 0.00 -2.04 0.00 0.00 64.05 61.48 2q4s n THR 89 Cb 1.04 -1.08 -0.05 0.00 -1.82 0.00 0.00 70.33 68.42 2q4s n THR 89 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2q4s n ASP 90 N -2.77 -5.63 -4.61 8.00 8.00 -1.26 -4.97 116.55 113.31 2q4s n ASP 90 Ca -0.18 0.25 -0.23 0.00 0.71 0.00 0.00 54.79 55.34 2q4s n ASP 90 Cb 0.62 -4.79 -0.08 0.00 -0.02 0.00 0.00 41.12 36.84 2q4s n ASP 90 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2q4s s SER 91 N -2.44 4.30 0.42 -2.24 0.01 0.99 -4.80 113.70 109.95 2q4s s SER 91 Ca 0.00 -0.79 -0.23 0.00 1.31 0.00 0.00 55.95 56.25 2q4s s SER 91 Cb 0.00 -0.68 -0.09 0.00 0.21 0.00 0.00 66.02 65.46 2q4s s SER 91 CO 0.00 -0.05 1.02 -1.00 0.41 0.00 0.00 173.24 173.62 2q4s s HIS 92 N -2.40 3.23 -0.31 2.43 3.76 0.23 -4.38 115.29 117.86 2q4s s HIS 92 Ca 0.32 1.63 0.01 0.00 -0.15 0.00 0.00 55.06 56.87 2q4s s HIS 92 Cb -0.05 -3.05 0.14 0.00 1.11 0.00 0.00 32.58 30.74 2q4s s HIS 92 CO 0.19 -0.52 0.32 0.00 -0.85 0.00 0.00 174.74 173.87 2q4s s PHE 94 N 2.11 3.65 -0.24 0.00 0.08 -0.54 -0.71 117.98 122.33 2q4s s PHE 94 Ca 0.11 0.94 -0.03 0.00 0.12 0.00 0.00 56.93 58.07 2q4s s PHE 94 Cb -0.14 -2.26 0.08 0.00 -0.57 0.00 0.00 43.02 40.12 2q4s s PHE 94 CO -0.25 0.55 0.09 -1.17 -0.10 0.00 0.00 175.22 174.33 2q4s s LEU 95 N -1.60 1.06 -0.19 -0.37 0.20 0.97 -2.08 118.68 116.68 2q4s s LEU 95 Ca 0.31 -1.09 -0.05 0.00 0.69 0.00 0.00 54.13 53.98 2q4s s LEU 95 Cb -0.15 -0.52 -0.03 0.00 -0.43 0.00 0.00 46.19 45.06 2q4s s LEU 95 CO 0.17 -0.38 0.01 -0.75 -0.29 0.00 0.00 176.35 175.11 2q4s s LYS 96 N 1.93 3.71 0.08 1.98 2.20 -0.04 -0.40 119.74 129.19 2q4s s LYS 96 Ca 0.05 -0.48 -0.30 0.00 -0.36 0.00 0.00 55.97 54.87 2q4s s LYS 96 Cb -0.17 -3.09 -0.06 0.00 -1.51 0.00 0.00 37.83 33.01 2q4s s LYS 96 CO -0.20 0.10 1.11 -0.51 -0.36 0.00 0.00 175.35 175.50 2q4s s LEU 97 N 0.77 4.40 -0.07 5.43 2.01 -0.24 -0.53 118.68 130.45 2q4s s LEU 97 Ca 0.01 1.94 0.19 0.00 0.01 0.00 0.00 54.13 56.27 2q4s s LEU 97 Cb -0.14 -3.58 -0.28 0.00 0.01 0.00 0.00 46.19 42.20 2q4s s LEU 97 CO 0.02 -0.34 0.33 0.18 1.01 0.00 0.00 176.35 177.54 2q4s n LEU 98 N 3.49 0.00 -3.65 1.79 4.77 0.28 -0.53 117.00 123.16 2q4s n LEU 98 Ca 0.06 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.98 2q4s n LEU 98 Cb 0.47 0.12 -0.07 0.00 -2.33 0.00 0.00 43.42 41.62 2q4s n LEU 98 CO 0.54 0.12 0.30 -1.58 -1.33 0.00 0.00 177.39 175.44 2q4s s GLN 99 N -3.10 0.65 1.68 3.23 0.74 -0.64 -4.81 119.66 117.42 2q4s s GLN 99 Ca -0.08 1.23 0.00 0.00 0.05 0.00 0.00 55.36 56.56 2q4s s GLN 99 Cb 0.10 0.26 0.00 0.00 1.10 0.00 0.00 33.01 34.48 2q4s s GLN 99 CO 0.79 -0.16 0.00 0.41 -0.55 0.00 0.00 175.29 175.77 2q4s n GLY 100 N 4.54 -1.29 3.14 2.59 0.00 -1.26 -0.40 105.19 112.51 2q4s n GLY 100 Ca -0.19 -1.44 -0.11 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 -0.00 0.08 1.61 0.01 -1.26 -2.24 114.94 109.14 2q4s s ASN 101 Ca 0.00 -0.20 0.07 0.00 -0.71 0.00 0.00 52.86 52.02 2q4s s ASN 101 Cb 0.00 0.23 -0.03 0.00 0.41 0.00 0.00 41.25 41.86 2q4s s ASN 101 CO 0.00 -0.42 -0.17 -0.76 -1.51 0.00 0.00 177.10 174.24 2q4s s LEU 102 N -1.51 2.27 -0.27 0.60 1.43 -0.41 -4.70 118.68 116.09 2q4s s LEU 102 Ca -0.13 -0.63 -0.14 0.00 -1.03 0.00 0.00 54.13 52.20 2q4s s LEU 102 Cb -0.06 -0.71 -0.04 0.00 0.03 0.00 0.00 46.19 45.41 2q4s s LEU 102 CO 0.01 0.00 0.33 -0.75 0.23 0.00 0.00 176.35 176.17 2q4s s LYS 103 N -1.74 4.00 -0.21 1.70 2.20 -0.64 -0.18 119.74 124.88 2q4s s LYS 103 Ca 0.02 -0.05 -0.07 0.00 -0.36 0.00 0.00 55.97 55.51 2q4s s LYS 103 Cb -0.10 -3.66 -0.04 0.00 -1.51 0.00 0.00 37.83 32.53 2q4s s LYS 103 CO 0.03 -0.25 0.07 -2.00 -0.36 0.00 0.00 175.35 172.84 2q4s s GLU 104 N 1.99 3.85 -0.14 4.03 2.12 0.64 -2.84 118.70 128.35 2q4s s GLU 104 Ca 0.13 -0.40 -0.02 0.00 0.36 0.00 0.00 54.97 55.04 2q4s s GLU 104 Cb -0.16 -3.26 -0.02 0.00 0.26 0.00 0.00 34.13 30.95 2q4s s GLU 104 CO 0.10 0.09 -0.07 0.99 -0.54 0.00 0.00 175.26 175.83 2q4s s THR 105 N 0.86 3.57 -0.07 -1.70 2.01 -1.10 -1.40 115.64 117.81 2q4s s THR 105 Ca 0.04 -0.48 -0.02 0.00 0.31 0.00 0.00 61.69 61.54 2q4s s THR 105 Cb -0.14 -2.54 -0.04 0.00 0.01 0.00 0.00 72.50 69.80 2q4s s THR 105 CO 0.02 0.51 0.03 -0.76 -0.69 0.00 0.00 174.62 173.74 2q4s s LEU 106 N 0.32 3.74 0.10 4.42 1.43 -0.33 -2.29 118.68 126.06 2q4s s LEU 106 Ca -0.06 0.18 0.03 0.00 -1.03 0.00 0.00 54.13 53.25 2q4s s LEU 106 Cb -0.15 -1.94 -0.04 0.00 0.03 0.00 0.00 46.19 44.09 2q4s s LEU 106 CO 0.04 0.36 -0.10 -0.36 0.23 0.00 0.00 176.35 176.52 2q4s s PHE 107 N -0.97 1.03 0.40 0.29 0.08 -0.57 -0.42 117.98 117.81 2q4s s PHE 107 Ca 0.16 -0.68 0.00 0.00 0.12 0.00 0.00 56.93 56.53 2q4s s PHE 107 Cb -0.12 -0.56 -0.02 0.00 -0.57 0.00 0.00 43.02 41.75 2q4s s PHE 107 CO 0.05 -0.02 0.61 -0.51 -0.10 0.00 0.00 175.22 175.25 2q4s s ASP 108 N -2.50 6.08 0.45 1.36 1.01 -1.26 -0.77 116.67 121.04 2q4s s ASP 108 Ca 0.06 0.38 -0.25 0.00 0.71 0.00 0.00 52.55 53.45 2q4s s ASP 108 Cb -0.02 -1.79 -0.09 0.00 1.01 0.00 0.00 42.92 42.03 2q4s s ASP 108 CO -0.01 -0.49 1.29 0.79 0.21 0.00 0.00 175.17 176.97 2q4s n TRP 109 N -1.93 2.18 -3.48 4.23 7.02 -1.26 -4.74 117.44 119.46 2q4s n TRP 109 Ca -0.02 0.48 -0.31 0.00 -1.02 0.00 0.00 57.50 56.63 2q4s n TRP 109 Cb 0.57 -2.38 -0.05 0.00 -2.42 0.00 0.00 31.31 27.03 2q4s n TRP 109 CO 0.00 0.00 0.00 -1.25 -2.02 0.00 0.00 177.69 174.42 2q4s s PRO 110 N -2.37 3.71 0.96 -0.99 0.04 -1.26 -5.05 135.00 130.04 2q4s s PRO 110 Ca 0.63 0.10 -0.11 0.00 0.04 0.00 0.00 61.00 61.66 2q4s s PRO 110 Cb -0.48 -2.71 0.17 0.00 0.04 0.00 0.00 34.50 31.52 2q4s s PRO 110 CO 0.56 0.34 1.10 -0.51 0.04 0.00 0.00 177.00 178.53 2q4s s ASP 111 N -2.55 2.75 0.35 6.66 1.01 -1.26 -4.89 116.67 118.74 2q4s s ASP 111 Ca 0.45 1.78 0.26 0.00 0.71 0.00 0.00 52.55 55.75 2q4s s ASP 111 Cb -0.11 -2.38 1.21 0.00 1.01 0.00 0.00 42.92 42.64 2q4s s ASP 111 CO 0.24 -3.14 1.79 0.11 0.21 0.00 0.00 175.17 174.39 2q4s h LYS 112 N -1.89 0.00 -6.24 8.23 1.79 -1.97 -3.42 116.57 113.07 2q4s h LYS 112 Ca -0.50 0.00 -0.56 0.00 -2.18 0.00 0.00 60.65 57.42 2q4s h LYS 112 Cb 1.28 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.90 2q4s h LYS 112 CO 0.48 0.00 0.47 0.15 -1.08 0.00 0.00 179.45 179.47 2q4s s LYS 113 N -3.50 4.44 -0.87 3.15 -0.14 -1.26 -4.94 119.74 116.62 2q4s s LYS 113 Ca 0.01 1.32 -0.26 0.00 -1.36 0.00 0.00 55.97 55.69 2q4s s LYS 113 Cb 0.09 -3.52 -0.12 0.00 -1.68 0.00 0.00 37.83 32.59 2q4s s LYS 113 CO 0.37 -0.23 2.25 0.45 -0.76 0.00 0.00 175.35 177.43 2q4s s SER 114 N 1.06 4.17 0.11 2.83 0.15 -1.26 -4.88 113.70 115.88 2q4s s SER 114 Ca 0.47 -0.31 -0.00 0.00 0.70 0.00 0.00 55.95 56.81 2q4s s SER 114 Cb -0.19 -2.56 -0.04 0.00 -1.71 0.00 0.00 66.02 61.52 2q4s s SER 114 CO 0.20 -3.69 0.01 0.20 1.20 0.00 0.00 173.24 171.15 2q4s s ASN 115 N 9.76 0.62 0.00 5.45 0.01 -0.76 -4.89 114.94 125.13 2q4s s ASN 115 Ca 0.85 -1.11 0.00 0.00 -0.71 0.00 0.00 52.86 51.89 2q4s s ASN 115 Cb -0.10 0.21 0.00 0.00 0.41 0.00 0.00 41.25 41.77 2q4s s ASN 115 CO 0.07 -0.63 0.00 1.21 -1.51 0.00 0.00 177.10 176.24 2q4s n GLU 116 N -0.05 2.88 -3.15 -0.60 4.07 -0.86 -3.06 120.64 119.86 2q4s n GLU 116 Ca -0.09 0.00 0.05 0.00 -0.06 0.00 0.00 57.16 57.06 2q4s n GLU 116 Cb 0.62 0.00 -0.01 0.00 -0.06 0.00 0.00 31.44 32.00 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 -0.64 1.03 6.31 -1.09 -1.26 -4.89 121.20 120.66 2q4s s ILE 118 Ca 0.00 0.00 -0.18 0.00 -2.23 0.00 0.00 60.65 58.24 2q4s s ILE 118 Cb 0.00 -0.81 0.06 0.00 -1.58 0.00 0.00 42.46 40.14 2q4s s ILE 118 CO 0.00 0.00 -0.19 2.29 -1.23 0.00 0.00 174.94 175.81 2q4s n LYS 119 N 5.36 -1.46 0.00 2.79 2.85 -1.26 -4.43 118.16 122.00 2q4s n LYS 119 Ca 0.02 -0.42 0.00 0.00 -1.05 0.00 0.00 58.31 56.85 2q4s n LYS 119 Cb 0.54 -1.44 0.00 0.00 -0.65 0.00 0.00 35.03 33.48 2q4s n LYS 119 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 177.40 177.71 2q4s n LYS 120 N -0.87 0.00 -3.85 -1.58 2.85 0.44 -4.87 118.16 110.28 2q4s n LYS 120 Ca 0.02 0.00 -0.09 0.00 -1.05 0.00 0.00 58.31 57.18 2q4s n LYS 120 Cb 0.52 -0.88 0.01 0.00 -0.65 0.00 0.00 35.03 34.04 2q4s n LYS 120 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 2q4s s SER 121 N -4.21 0.11 -0.28 -5.58 1.04 -1.23 -5.03 113.70 98.53 2q4s s SER 121 Ca 0.00 -1.16 -0.17 0.00 0.48 0.00 0.00 55.95 55.10 2q4s s SER 121 Cb 0.00 0.82 0.08 0.00 0.10 0.00 0.00 66.02 67.02 2q4s s SER 121 CO 0.00 -1.61 0.69 -1.83 0.98 0.00 0.00 173.24 171.46 2q4s s GLU 122 N -2.52 0.72 0.29 4.02 -1.05 -1.26 -1.19 118.70 117.71 2q4s s GLU 122 Ca 0.17 1.18 0.06 0.00 -0.15 0.00 0.00 54.97 56.24 2q4s s GLU 122 Cb -0.04 0.18 -0.06 0.00 -0.44 0.00 0.00 34.13 33.76 2q4s s GLU 122 CO 0.12 -0.14 -0.04 -0.98 0.95 0.00 0.00 175.26 175.18 2q4s s ARG 123 N 1.44 1.59 -0.43 -4.83 1.70 -0.49 -4.99 118.95 112.94 2q4s s ARG 123 Ca -0.08 -1.82 -0.02 0.00 -0.47 0.00 0.00 55.73 53.33 2q4s s ARG 123 Cb -0.05 -1.13 0.12 0.00 -0.57 0.00 0.00 34.95 33.32 2q4s s ARG 123 CO -0.17 -0.00 0.22 0.99 -1.08 0.00 0.00 175.30 175.26 2q4s s THR 124 N -3.04 3.26 0.21 4.99 2.01 -1.26 -0.26 115.64 121.54 2q4s s THR 124 Ca 0.31 -2.21 -0.30 0.00 0.31 0.00 0.00 61.69 59.79 2q4s s THR 124 Cb 0.05 -3.23 -0.09 0.00 0.01 0.00 0.00 72.50 69.24 2q4s s THR 124 CO 0.13 -0.71 1.37 -0.76 -0.69 0.00 0.00 174.62 173.96 2q4s s LEU 125 N 0.95 4.40 0.43 4.42 1.43 0.75 -4.88 118.68 126.18 2q4s s LEU 125 Ca 0.10 2.49 0.07 0.00 -1.03 0.00 0.00 54.13 55.76 2q4s s LEU 125 Cb -0.22 -3.61 -0.04 0.00 0.03 0.00 0.00 46.19 42.34 2q4s s LEU 125 CO -0.04 -0.61 0.20 -0.13 0.23 0.00 0.00 176.35 176.00 2q4s s ARG 126 N -0.02 2.25 0.12 1.70 0.52 -1.26 -1.29 118.95 120.96 2q4s s ARG 126 Ca 0.59 -1.86 -0.35 0.00 -0.52 0.00 0.00 55.73 53.59 2q4s s ARG 126 Cb -0.39 -2.00 -0.17 0.00 0.52 0.00 0.00 34.95 32.92 2q4s s ARG 126 CO 0.39 -0.17 1.21 -1.91 0.02 0.00 0.00 175.30 174.83 2q4s n GLU 127 N -1.30 1.02 -0.22 3.54 2.13 -0.95 -1.68 120.64 123.18 2q4s n GLU 127 Ca -0.02 0.37 0.00 0.00 0.66 0.00 0.00 57.16 58.17 2q4s n GLU 127 Cb 0.64 -1.91 0.00 0.00 0.27 0.00 0.00 31.44 30.45 2q4s n GLU 127 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2q4s n ASN 128 N 2.17 0.00 -4.79 4.31 3.02 0.31 -4.96 115.26 115.33 2q4s n ASN 128 Ca 0.17 0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 54.36 2q4s n ASN 128 Cb 0.21 -0.57 -0.03 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 -0.08 3.93 -0.13 3.52 0.74 -0.68 -4.61 119.66 122.35 2q4s s GLN 129 Ca 0.00 1.50 0.02 0.00 0.05 0.00 0.00 55.36 56.93 2q4s s GLN 129 Cb 0.00 -2.33 0.01 0.00 1.10 0.00 0.00 33.01 31.79 2q4s s GLN 129 CO 0.00 -0.35 -0.19 0.00 -0.55 0.00 0.00 175.29 174.20 2q4s s ALA 131 N 0.94 3.83 0.01 0.00 0.00 0.46 -4.90 121.76 122.11 2q4s s ALA 131 Ca -0.05 -1.52 0.02 0.00 0.00 0.00 0.00 51.96 50.40 2q4s s ALA 131 Cb -0.15 -1.33 -0.01 0.00 0.00 0.00 0.00 23.12 21.63 2q4s s ALA 131 CO -0.03 0.09 -0.05 -0.47 0.00 0.00 0.00 175.76 175.30 2q4s s TYR 132 N -2.21 0.48 0.01 0.00 6.14 -1.26 -0.02 117.35 120.48 2q4s s TYR 132 Ca 0.39 -0.23 -0.14 0.00 0.64 0.00 0.00 57.07 57.72 2q4s s TYR 132 Cb -0.07 -0.30 0.02 0.00 0.42 0.00 0.00 41.96 42.03 2q4s s TYR 132 CO 0.27 -0.04 0.30 -1.50 0.64 0.00 0.00 175.55 175.22 2q4s s ILE 133 N -0.58 0.07 0.25 3.14 2.07 0.12 -5.00 121.20 121.27 2q4s s ILE 133 Ca -0.03 -0.57 -0.09 0.00 -1.41 0.00 0.00 60.65 58.56 2q4s s ILE 133 Cb -0.05 -0.74 -0.01 0.00 0.13 0.00 0.00 42.46 41.79 2q4s s ILE 133 CO -0.00 -0.31 0.40 0.54 -1.91 0.00 0.00 174.94 173.66 2q4s s ASN 134 N -1.63 0.12 0.42 4.50 2.20 -1.26 -1.42 114.94 117.88 2q4s s ASN 134 Ca -0.10 -1.12 0.08 0.00 -0.94 0.00 0.00 52.86 50.78 2q4s s ASN 134 Cb -0.03 0.55 0.91 0.00 -2.00 0.00 0.00 41.25 40.68 2q4s s ASN 134 CO 0.01 -1.10 2.07 0.44 -2.94 0.00 0.00 177.10 175.58 2q4s h ASP 135 N 2.31 0.40 -0.26 3.54 5.19 -1.78 -1.45 116.42 124.38 2q4s h ASP 135 Ca -0.29 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.11 2q4s h ASP 135 Cb 1.25 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 40.66 2q4s h ASP 135 CO 0.40 0.30 0.00 -1.20 -3.12 0.00 0.00 179.24 175.61 2q4s n SER 136 N -4.48 2.40 -0.07 6.45 7.64 -1.26 -3.56 113.62 120.74 2q4s n SER 136 Ca 0.02 -2.23 -0.08 0.00 1.01 0.00 0.00 58.87 57.59 2q4s n SER 136 Cb 0.07 -0.43 -0.09 0.00 -1.01 0.00 0.00 64.21 62.75 2q4s n SER 136 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2q4s n ILE 137 N 0.30 0.87 -2.74 0.44 5.41 -0.56 -5.13 119.36 117.95 2q4s n ILE 137 Ca 0.11 -0.44 0.00 0.00 1.00 0.00 0.00 62.75 63.42 2q4s n ILE 137 Cb 0.48 -0.85 0.00 0.00 -0.71 0.00 0.00 39.64 38.56 2q4s n ILE 137 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2q4s n GLY 138 N 2.47 -0.60 3.50 7.39 0.00 -1.10 -4.94 105.19 111.92 2q4s n GLY 138 Ca -0.24 -1.44 -0.26 0.00 0.00 0.00 0.00 46.02 44.08 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 2.73 0.07 0.99 1.43 0.05 -4.46 118.68 119.48 2q4s s LEU 139 Ca 0.00 -0.75 -0.06 0.00 -1.03 0.00 0.00 54.13 52.28 2q4s s LEU 139 Cb 0.00 -1.40 -0.01 0.00 0.03 0.00 0.00 46.19 44.81 2q4s s LEU 139 CO 0.00 0.10 0.13 -1.38 0.23 0.00 0.00 176.35 175.42 2q4s s HIS 140 N -1.83 0.23 -0.05 0.29 -3.43 0.12 -1.51 115.29 109.11 2q4s s HIS 140 Ca 0.24 -0.65 0.00 0.00 -0.80 0.00 0.00 55.06 53.85 2q4s s HIS 140 Cb -0.08 -0.14 -0.03 0.00 -1.43 0.00 0.00 32.58 30.89 2q4s s HIS 140 CO 0.13 -0.47 -0.01 0.50 -2.00 0.00 0.00 174.74 172.90 2q4s s ARG 141 N -3.54 2.86 -0.04 -0.38 6.06 -0.97 0.28 118.95 123.22 2q4s s ARG 141 Ca 0.03 -0.52 0.04 0.00 -2.50 0.00 0.00 55.73 52.78 2q4s s ARG 141 Cb 0.04 -2.71 -0.00 0.00 0.06 0.00 0.00 34.95 32.34 2q4s s ARG 141 CO -0.09 0.66 -0.16 0.08 -2.50 0.00 0.00 175.30 173.29 2q4s s VAL 142 N -0.96 1.36 -0.18 7.11 1.01 -1.26 -2.71 120.40 124.77 2q4s s VAL 142 Ca 0.16 -0.68 -0.17 0.00 0.00 0.00 0.00 61.98 61.29 2q4s s VAL 142 Cb -0.11 -1.17 0.05 0.00 0.00 0.00 0.00 36.38 35.15 2q4s s VAL 142 CO 0.06 0.39 0.48 -1.83 0.00 0.00 0.00 175.10 174.20 2q4s s GLU 143 N 0.00 0.56 -0.52 2.72 -1.05 -1.13 0.22 118.70 119.49 2q4s s GLU 143 Ca -0.02 0.68 -0.24 0.00 -0.15 0.00 0.00 54.97 55.23 2q4s s GLU 143 Cb -0.11 0.26 0.04 0.00 -0.44 0.00 0.00 34.13 33.89 2q4s s GLU 143 CO 0.02 -0.07 0.91 1.21 0.95 0.00 0.00 175.26 178.27 2q4s s ASN 144 N 0.30 6.37 0.00 0.83 2.47 -0.29 -1.61 114.94 123.01 2q4s s ASN 144 Ca -0.00 -0.28 0.27 0.00 0.42 0.00 0.00 52.86 53.27 2q4s s ASN 144 Cb -0.04 -2.43 0.90 0.00 -1.45 0.00 0.00 41.25 38.23 2q4s s ASN 144 CO 0.00 -1.15 1.65 1.33 -3.72 0.00 0.00 177.10 175.21 2q4s n VAL 145 N 6.20 0.00 -1.99 -5.21 0.24 -1.26 -0.77 118.33 115.53 2q4s n VAL 145 Ca 0.02 -0.14 -0.40 0.00 -2.04 0.00 0.00 64.34 61.77 2q4s n VAL 145 Cb 0.48 0.34 -0.01 0.00 -1.47 0.00 0.00 33.84 33.18 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 -2.38 6.51 0.02 -1.34 0.15 -1.26 -4.63 113.70 110.76 2q4s s SER 146 Ca 0.28 2.80 0.23 0.00 0.70 0.00 0.00 55.95 59.97 2q4s s SER 146 Cb 0.20 -2.65 0.20 0.00 -1.71 0.00 0.00 66.02 62.05 2q4s s SER 146 CO 0.47 -0.73 1.18 1.41 1.20 0.00 0.00 173.24 176.77 2q4s n HIS 147 N 0.51 0.10 0.00 3.44 8.25 -1.26 -2.52 115.22 123.75 2q4s n HIS 147 Ca 0.01 0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 2q4s n HIS 147 Cb 0.41 -0.27 0.00 0.00 1.12 0.00 0.00 29.99 31.26 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 -1.66 0.00 -4.02 1.59 -2.24 -1.26 -4.93 114.28 101.76 2q4s n THR 148 Ca 0.04 -0.31 -0.28 0.00 -2.27 0.00 0.00 64.05 61.23 2q4s n THR 148 Cb 0.37 0.97 -0.17 0.00 -2.10 0.00 0.00 70.33 69.40 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 -0.68 1.90 1.27 -0.78 0.41 -1.26 -5.06 118.70 114.51 2q4s s GLU 149 Ca 0.00 -0.41 -0.17 0.00 -0.41 0.00 0.00 54.97 53.98 2q4s s GLU 149 Cb 0.00 -1.82 0.32 0.00 -1.78 0.00 0.00 34.13 30.85 2q4s s GLU 149 CO 0.00 -0.23 0.99 -2.14 -0.49 0.00 0.00 175.26 173.39 2q4s s PRO 150 N 1.52 -1.76 0.06 0.39 0.02 -1.26 -4.60 135.00 129.38 2q4s s PRO 150 Ca 0.03 0.52 0.03 0.00 0.02 0.00 0.00 61.00 61.60 2q4s s PRO 150 Cb -0.13 -1.48 -0.03 0.00 0.02 0.00 0.00 34.50 32.88 2q4s s PRO 150 CO -0.08 -4.20 -0.08 0.00 -0.33 0.00 0.00 177.00 172.31 2q4s s ALA 151 N -2.41 0.74 -0.05 -1.55 0.00 -0.95 -4.37 121.76 113.18 2q4s s ALA 151 Ca 0.69 -0.92 -0.01 0.00 0.00 0.00 0.00 51.96 51.72 2q4s s ALA 151 Cb -0.20 0.05 0.03 0.00 0.00 0.00 0.00 23.12 22.99 2q4s s ALA 151 CO 0.62 -0.04 -0.00 0.08 0.00 0.00 0.00 175.76 176.42 2q4s s VAL 152 N -1.84 0.31 0.19 0.00 1.01 0.47 -1.10 120.40 119.43 2q4s s VAL 152 Ca -0.04 0.10 0.11 0.00 0.00 0.00 0.00 61.98 62.14 2q4s s VAL 152 Cb -0.07 -0.43 -0.04 0.00 0.00 0.00 0.00 36.38 35.83 2q4s s VAL 152 CO -0.00 0.22 -0.23 -0.94 0.00 0.00 0.00 175.10 174.15 2q4s s SER 153 N 1.55 3.29 -0.20 3.32 1.04 -0.32 0.10 113.70 122.48 2q4s s SER 153 Ca -0.02 -0.87 -0.00 0.00 0.48 0.00 0.00 55.95 55.53 2q4s s SER 153 Cb -0.13 -0.24 0.02 0.00 0.10 0.00 0.00 66.02 65.77 2q4s s SER 153 CO -0.03 0.09 -0.14 -0.22 0.98 0.00 0.00 173.24 173.92 2q4s s LEU 154 N -2.71 2.54 -0.05 2.42 2.96 0.31 -1.36 118.68 122.78 2q4s s LEU 154 Ca 0.20 -0.66 0.05 0.00 -0.22 0.00 0.00 54.13 53.50 2q4s s LEU 154 Cb -0.07 -1.57 -0.02 0.00 0.50 0.00 0.00 46.19 45.02 2q4s s LEU 154 CO 0.09 -0.03 -0.19 -1.00 -1.32 0.00 0.00 176.35 173.90 2q4s s HIS 155 N 1.33 2.56 -0.06 5.38 3.76 -1.26 -0.87 115.29 126.13 2q4s s HIS 155 Ca 0.04 -0.41 0.03 0.00 -0.15 0.00 0.00 55.06 54.57 2q4s s HIS 155 Cb -0.14 -1.61 0.01 0.00 1.11 0.00 0.00 32.58 31.94 2q4s s HIS 155 CO -0.09 -0.00 -0.15 -1.17 -0.85 0.00 0.00 174.74 172.48 2q4s s LEU 156 N -0.45 1.77 -0.04 0.89 0.20 -0.88 -4.27 118.68 115.89 2q4s s LEU 156 Ca 0.05 -0.34 0.04 0.00 0.69 0.00 0.00 54.13 54.57 2q4s s LEU 156 Cb -0.12 -0.92 -0.00 0.00 -0.43 0.00 0.00 46.19 44.73 2q4s s LEU 156 CO 0.01 0.08 -0.15 -0.31 -0.29 0.00 0.00 176.35 175.70 2q4s s TYR 157 N 0.45 1.47 -0.07 5.38 2.02 -1.03 -1.46 117.35 124.12 2q4s s TYR 157 Ca -0.12 -0.41 -0.03 0.00 -0.37 0.00 0.00 57.07 56.14 2q4s s TYR 157 Cb -0.15 -1.01 0.04 0.00 -0.40 0.00 0.00 41.96 40.45 2q4s s TYR 157 CO 0.04 -0.14 0.13 0.45 -1.57 0.00 0.00 175.55 174.45 2q4s s SER 158 N 0.09 0.78 1.01 2.29 0.15 -0.91 -2.42 113.70 114.68 2q4s s SER 158 Ca -0.04 0.25 -0.12 0.00 0.70 0.00 0.00 55.95 56.74 2q4s s SER 158 Cb -0.11 0.14 0.19 0.00 -1.71 0.00 0.00 66.02 64.54 2q4s s SER 158 CO 0.02 -0.24 1.09 -2.84 1.20 0.00 0.00 173.24 172.47 2q4s s PRO 159 N 2.14 0.36 0.58 5.44 0.02 -1.25 -0.60 135.00 141.68 2q4s s PRO 159 Ca 0.02 0.52 -0.19 0.00 0.02 0.00 0.00 61.00 61.38 2q4s s PRO 159 Cb -0.12 -1.73 -0.04 0.00 0.02 0.00 0.00 34.50 32.63 2q4s s PRO 159 CO -0.05 -2.78 1.15 -2.14 -0.33 0.00 0.00 177.00 172.85 2q4s s PRO 160 N -4.95 3.14 0.01 5.54 0.02 -1.25 -4.79 135.00 132.72 2q4s s PRO 160 Ca 0.65 1.64 -0.03 0.00 0.02 0.00 0.00 61.00 63.29 2q4s s PRO 160 Cb -0.19 -1.97 -0.01 0.00 0.02 0.00 0.00 34.50 32.35 2q4s s PRO 160 CO 0.58 -1.03 0.05 -0.59 -0.33 0.00 0.00 177.00 175.68 2q4s s PHE 161 N -1.81 0.14 0.00 6.54 -0.12 -1.26 -5.04 117.98 116.43 2q4s s PHE 161 Ca 0.73 -0.30 0.00 0.00 -0.05 0.00 0.00 56.93 57.31 2q4s s PHE 161 Cb -0.25 -0.11 0.00 0.00 -0.63 0.00 0.00 43.02 42.03 2q4s s PHE 161 CO 0.31 -0.21 0.78 -0.40 -0.05 0.00 0.00 175.22 175.65 2q4s n ASP 162 N 1.69 1.51 -4.04 1.98 5.68 -1.26 -5.02 116.55 117.08 2q4s n ASP 162 Ca -0.22 -1.60 -0.11 0.00 -0.50 0.00 0.00 54.79 52.36 2q4s n ASP 162 Cb 0.56 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 -0.60 0.36 0.20 2.12 -4.23 -1.26 -4.49 115.64 107.74 2q4s s THR 163 Ca 0.00 -1.17 -0.23 0.00 -1.18 0.00 0.00 61.69 59.11 2q4s s THR 163 Cb 0.00 -0.67 0.05 0.00 1.34 0.00 0.00 72.50 73.22 2q4s s THR 163 CO 0.00 -0.53 0.87 0.00 -0.54 0.00 0.00 174.62 174.42 2q4s s HIS 165 N -3.52 3.34 -0.07 0.00 3.76 -1.26 -0.44 115.29 117.10 2q4s s HIS 165 Ca 0.12 0.17 0.01 0.00 -0.15 0.00 0.00 55.06 55.20 2q4s s HIS 165 Cb -0.03 -1.69 -0.03 0.00 1.11 0.00 0.00 32.58 31.94 2q4s s HIS 165 CO 0.04 0.56 -0.06 0.00 -0.85 0.00 0.00 174.74 174.43 2q4s s ALA 166 N -1.42 3.03 -0.13 -1.40 0.00 -0.72 -3.18 121.76 117.94 2q4s s ALA 166 Ca 0.31 -0.89 -0.00 0.00 0.00 0.00 0.00 51.96 51.38 2q4s s ALA 166 Cb -0.13 -1.26 -0.02 0.00 0.00 0.00 0.00 23.12 21.72 2q4s s ALA 166 CO 0.24 0.58 -0.12 -0.06 0.00 0.00 0.00 175.76 176.40 2q4s s PHE 167 N -0.84 2.83 -0.24 0.00 0.08 0.65 -1.77 117.98 118.69 2q4s s PHE 167 Ca 0.13 -0.57 -0.29 0.00 0.12 0.00 0.00 56.93 56.32 2q4s s PHE 167 Cb -0.11 -1.84 0.00 0.00 -0.57 0.00 0.00 43.02 40.50 2q4s s PHE 167 CO 0.02 -0.16 1.14 0.34 -0.10 0.00 0.00 175.22 176.46 2q4s s ASP 168 N 0.28 6.96 0.62 1.36 3.68 -0.49 -4.30 116.67 124.78 2q4s s ASP 168 Ca -0.09 1.36 0.35 0.00 2.13 0.00 0.00 52.55 56.30 2q4s s ASP 168 Cb -0.15 -2.54 2.01 0.00 -1.45 0.00 0.00 42.92 40.79 2q4s s ASP 168 CO 0.05 -0.80 2.26 -0.61 0.13 0.00 0.00 175.17 176.20 2q4s h GLN 169 N 8.05 0.00 0.00 4.34 4.15 -1.96 0.27 115.11 129.95 2q4s h GLN 169 Ca -0.22 0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.12 2q4s h GLN 169 Cb 1.08 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.75 2q4s h GLN 169 CO 1.00 0.00 -0.70 0.00 -1.93 0.00 0.00 178.83 177.20 2q4s h ARG 170 N 0.00 0.00 0.00 1.69 2.47 -1.91 -3.41 114.38 113.23 2q4s h ARG 170 Ca 0.01 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.73 2q4s h ARG 170 Cb 0.10 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.42 2q4s h ARG 170 CO -0.00 0.24 -0.59 0.25 0.56 0.00 0.00 179.97 180.42 2q4s n THR 171 N -3.01 0.00 -0.90 2.04 -2.24 -0.91 -2.03 114.28 107.23 2q4s n THR 171 Ca -0.01 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 2q4s n THR 171 Cb 0.67 0.36 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 1.53 0.78 3.72 3.38 0.00 0.89 -1.84 105.19 113.65 2q4s n GLY 172 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 -3.02 3.64 0.41 1.61 5.04 -1.25 -4.70 115.29 117.01 2q4s s HIS 173 Ca 0.00 1.63 0.08 0.00 -1.54 0.00 0.00 55.06 55.22 2q4s s HIS 173 Cb 0.00 -3.19 -0.02 0.00 0.04 0.00 0.00 32.58 29.41 2q4s s HIS 173 CO 0.00 -0.30 0.35 -1.59 -2.34 0.00 0.00 174.74 170.86 2q4s s LYS 174 N 0.61 2.52 0.02 2.88 -2.85 -1.26 -1.39 119.74 120.27 2q4s s LYS 174 Ca 0.52 -1.54 -0.11 0.00 -1.00 0.00 0.00 55.97 53.84 2q4s s LYS 174 Cb -0.24 -2.35 0.01 0.00 -2.06 0.00 0.00 37.83 33.19 2q4s s LYS 174 CO 0.30 -0.16 0.23 0.54 0.10 0.00 0.00 175.35 176.36 2q4s s ASN 175 N -4.09 -0.05 0.20 0.03 4.22 -0.73 -4.97 114.94 109.55 2q4s s ASN 175 Ca 0.47 -0.19 -0.28 0.00 -2.14 0.00 0.00 52.86 50.72 2q4s s ASN 175 Cb -0.03 0.29 -0.08 0.00 1.28 0.00 0.00 41.25 42.71 2q4s s ASN 175 CO 0.27 -0.50 0.86 -0.75 -2.04 0.00 0.00 177.10 174.94 2q4s s LYS 176 N -2.03 4.71 -0.02 3.55 2.20 -1.26 -1.76 119.74 125.14 2q4s s LYS 176 Ca -0.09 1.32 0.03 0.00 -0.36 0.00 0.00 55.97 56.87 2q4s s LYS 176 Cb -0.03 -3.27 -0.00 0.00 -1.51 0.00 0.00 37.83 33.01 2q4s s LYS 176 CO -0.01 0.53 -0.09 0.08 -0.36 0.00 0.00 175.35 175.51 2q4s s VAL 177 N -1.12 0.75 0.32 4.02 1.01 0.41 -4.93 120.40 120.86 2q4s s VAL 177 Ca 0.39 -0.37 0.02 0.00 0.00 0.00 0.00 61.98 62.02 2q4s s VAL 177 Cb -0.24 -0.65 0.02 0.00 0.00 0.00 0.00 36.38 35.51 2q4s s VAL 177 CO 0.29 0.23 0.21 0.41 0.00 0.00 0.00 175.10 176.23 2q4s n THR 178 N 3.12 0.00 -3.86 3.92 -1.04 -1.26 -1.34 114.28 113.82 2q4s n THR 178 Ca -0.16 -1.32 -0.10 0.00 -2.04 0.00 0.00 64.05 60.43 2q4s n THR 178 Cb 0.55 -0.14 0.01 0.00 -1.82 0.00 0.00 70.33 68.93 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 -1.70 0.00 -0.00 12.58 -4.23 -1.26 -5.02 115.64 116.01 2q4s s THR 180 Ca 0.16 -1.10 -0.01 0.00 -1.18 0.00 0.00 61.69 59.55 2q4s s THR 180 Cb -0.01 -2.77 -0.04 0.00 1.34 0.00 0.00 72.50 71.02 2q4s s THR 180 CO 0.10 0.00 0.11 -0.36 -0.54 0.00 0.00 174.62 173.93 2q4s s PHE 181 N -2.57 3.37 0.02 3.99 0.08 -1.26 -4.72 117.98 116.88 2q4s s PHE 181 Ca 0.18 0.25 -0.08 0.00 0.12 0.00 0.00 56.93 57.40 2q4s s PHE 181 Cb -0.04 -1.76 -0.30 0.00 -0.57 0.00 0.00 43.02 40.34 2q4s s PHE 181 CO 0.12 0.58 0.93 1.25 -0.10 0.00 0.00 175.22 178.00 2q4s h HIS 182 N 3.96 0.65 -3.60 0.36 -0.00 -1.46 -3.44 115.15 111.61 2q4s h HIS 182 Ca -0.49 -0.47 -0.10 0.00 -0.00 0.00 0.00 60.37 59.31 2q4s h HIS 182 Cb 1.18 -0.03 -0.16 0.00 -0.00 0.00 0.00 27.41 28.41 2q4s h HIS 182 CO 0.65 1.46 -0.35 -1.54 -0.00 0.00 0.00 177.93 178.14 2q4s s SER 183 N -7.23 0.03 -0.13 3.26 1.04 -1.23 -0.65 113.70 108.79 2q4s s SER 183 Ca -0.09 -0.43 -0.01 0.00 0.48 0.00 0.00 55.95 55.90 2q4s s SER 183 Cb 0.06 0.32 0.03 0.00 0.10 0.00 0.00 66.02 66.53 2q4s s SER 183 CO 0.88 -0.63 -0.06 -0.54 0.98 0.00 0.00 173.24 173.87 2q4s s LYS 184 N -3.03 1.39 -1.39 4.02 1.02 -0.03 0.50 119.74 122.23 2q4s s LYS 184 Ca -0.01 -0.32 0.00 0.00 0.02 0.00 0.00 55.97 55.65 2q4s s LYS 184 Cb 0.01 -1.70 0.00 0.00 -0.52 0.00 0.00 37.83 35.62 2q4s s LYS 184 CO -0.06 -0.34 0.00 1.19 -0.92 0.00 0.00 175.35 175.22 2q4s n PHE 185 N 4.94 0.00 -0.00 3.18 3.72 0.40 -2.17 117.46 127.53 2q4s n PHE 185 Ca -0.12 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.28 2q4s n PHE 185 Cb 0.49 -2.51 0.00 0.00 -0.94 0.00 0.00 39.48 36.53 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 -0.95 0.89 3.27 1.37 0.00 -1.26 -5.03 105.19 103.49 2q4s n GLY 186 Ca -0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.55 2q4s n GLY 186 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2q4s s ILE 187 N -2.00 2.91 0.17 -0.61 -1.09 -0.92 -4.94 121.20 114.72 2q4s s ILE 187 Ca 0.00 -0.67 -0.33 0.00 -2.23 0.00 0.00 60.65 57.42 2q4s s ILE 187 Cb 0.00 -2.27 -0.13 0.00 -1.58 0.00 0.00 42.46 38.47 2q4s s ILE 187 CO 0.00 0.48 1.63 -1.14 -1.23 0.00 0.00 174.94 174.68 2q4s n ARG 188 N 4.40 2.33 -3.90 2.79 3.00 -1.26 -0.85 116.66 123.17 2q4s n ARG 188 Ca -0.19 0.84 -0.29 0.00 -0.00 0.00 0.00 57.85 58.21 2q4s n ARG 188 Cb 0.51 -2.64 -0.13 0.00 0.00 0.00 0.00 32.46 30.20 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 1.10 2.49 -1.16 5.15 -4.23 0.18 -4.87 115.64 114.29 2q4s s THR 189 Ca 0.78 -3.44 0.00 0.00 -1.18 0.00 0.00 61.69 57.85 2q4s s THR 189 Cb -0.63 -2.71 0.00 0.00 1.34 0.00 0.00 72.50 70.50 2q4s s THR 189 CO 0.37 -0.86 0.29 -2.65 -0.54 0.00 0.00 174.62 171.22