#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r0q s ILE 2 N 0.00 4.10 -0.06 1.12 1.01 -1.26 -2.79 121.20 123.31 2r0q s ILE 2 Ca 0.00 1.44 0.04 0.00 0.00 0.00 0.00 60.65 62.13 2r0q s ILE 2 Cb 0.00 -3.93 0.00 0.00 0.01 0.00 0.00 42.46 38.54 2r0q s ILE 2 CO 0.00 0.01 -0.17 -0.63 0.00 0.00 0.00 174.94 174.15 2r0q s ILE 3 N 2.18 1.47 0.41 2.92 1.01 0.99 -1.13 121.20 129.04 2r0q s ILE 3 Ca 0.58 -0.71 0.08 0.00 0.00 0.00 0.00 60.65 60.60 2r0q s ILE 3 Cb -0.27 -1.28 -0.02 0.00 0.01 0.00 0.00 42.46 40.90 2r0q s ILE 3 CO 0.24 0.43 0.38 -0.83 0.00 0.00 0.00 174.94 175.15 2r0q s GLY 4 N 0.26 2.10 -0.19 6.18 0.00 -0.31 0.13 107.32 115.49 2r0q s GLY 4 Ca -0.09 -1.86 -0.08 0.00 0.00 0.00 0.00 44.72 42.68 2r0q s GLY 4 CO 0.04 -1.68 0.44 -0.47 0.00 0.00 0.00 173.10 171.42 2r0q s TYR 5 N -2.45 -0.75 0.21 1.90 5.04 -0.78 -2.26 117.35 118.26 2r0q s TYR 5 Ca 0.48 1.49 0.09 0.00 -2.44 0.00 0.00 57.07 56.69 2r0q s TYR 5 Cb -0.04 0.32 -0.05 0.00 0.35 0.00 0.00 41.96 42.55 2r0q s TYR 5 CO 0.28 -0.44 -0.16 0.00 -1.34 0.00 0.00 175.55 173.89 2r0q s ALA 6 N 2.12 2.17 -0.30 3.97 0.00 -0.55 -4.52 121.76 124.66 2r0q s ALA 6 Ca -0.05 -1.68 -0.10 0.00 0.00 0.00 0.00 51.96 50.13 2r0q s ALA 6 Cb -0.10 -0.14 0.16 0.00 0.00 0.00 0.00 23.12 23.04 2r0q s ALA 6 CO -0.13 0.14 0.80 0.50 0.00 0.00 0.00 175.76 177.07 2r0q s ARG 7 N -3.48 0.43 0.03 0.00 3.52 -1.26 -2.01 118.95 116.18 2r0q s ARG 7 Ca 0.23 0.96 -0.30 0.00 -0.13 0.00 0.00 55.73 56.49 2r0q s ARG 7 Cb -0.02 0.57 -0.07 0.00 -1.56 0.00 0.00 34.95 33.86 2r0q s ARG 7 CO 0.09 -0.27 1.63 0.14 -0.81 0.00 0.00 175.30 176.08 2r0q s VAL 8 N 2.76 3.26 0.26 7.11 -7.23 -1.26 -4.98 120.40 120.31 2r0q s VAL 8 Ca 0.02 0.60 -0.30 0.00 -1.81 0.00 0.00 61.98 60.49 2r0q s VAL 8 Cb -0.11 -3.39 -0.09 0.00 0.56 0.00 0.00 36.38 33.36 2r0q s VAL 8 CO -0.18 -0.02 1.07 -0.55 -0.31 0.00 0.00 175.10 175.11 2r0q s SER 9 N 2.65 7.35 0.60 4.85 0.15 -1.20 -4.91 113.70 123.18 2r0q s SER 9 Ca 0.73 2.18 0.30 0.00 0.70 0.00 0.00 55.95 59.86 2r0q s SER 9 Cb -0.37 -2.62 1.71 0.00 -1.71 0.00 0.00 66.02 63.02 2r0q s SER 9 CO 0.31 -0.09 2.12 0.28 1.20 0.00 0.00 173.24 177.07 2r0q h SER 10 N 4.03 0.00 0.96 5.45 0.02 -2.02 0.20 113.55 122.19 2r0q h SER 10 Ca -0.46 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.35 2r0q h SER 10 Cb 1.21 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.73 2r0q h SER 10 CO 0.68 0.00 -1.12 0.25 -1.14 0.00 0.00 176.83 175.50 2r0q h LEU 11 N 0.00 0.00 -6.32 5.07 5.85 -2.03 -3.39 115.31 114.49 2r0q h LEU 11 Ca 0.07 0.00 -0.61 0.00 0.84 0.00 0.00 57.88 58.18 2r0q h LEU 11 Cb 0.43 0.00 -0.42 0.00 0.37 0.00 0.00 40.66 41.04 2r0q h LEU 11 CO -0.00 0.51 -0.56 -0.67 -0.34 0.00 0.00 178.44 177.38 2r0q n ASP 12 N -2.97 3.75 -4.47 1.25 2.03 0.68 -5.04 116.55 111.78 2r0q n ASP 12 Ca -0.05 -3.42 -0.43 0.00 0.52 0.00 0.00 54.79 51.40 2r0q n ASP 12 Cb 0.79 -0.70 -0.05 0.00 -0.72 0.00 0.00 41.12 40.44 2r0q n ASP 12 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 2r0q s GLN 13 N -2.36 3.19 0.00 -0.67 -0.21 -1.08 -3.22 119.66 115.30 2r0q s GLN 13 Ca 0.38 -0.69 0.00 0.00 0.02 0.00 0.00 55.36 55.07 2r0q s GLN 13 Cb 0.12 -4.14 0.00 0.00 1.00 0.00 0.00 33.01 29.99 2r0q s GLN 13 CO -0.03 -1.54 0.00 -1.71 -2.12 0.00 0.00 175.29 169.89 2r0q n ASN 14 N 7.15 0.00 0.00 5.90 2.85 -1.26 -5.08 115.26 124.82 2r0q n ASN 14 Ca -0.03 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.44 2r0q n ASN 14 Cb 0.46 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.48 2r0q n ASN 14 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 2r0q n LEU 15 N -0.59 0.00 -0.15 1.20 7.94 -1.26 -3.83 117.00 120.30 2r0q n LEU 15 Ca 0.00 0.00 -0.02 0.00 -1.11 0.00 0.00 56.01 54.88 2r0q n LEU 15 Cb 0.00 0.00 -0.00 0.00 0.53 0.00 0.00 43.42 43.95 2r0q n LEU 15 CO 0.00 0.00 0.22 -0.62 -1.11 0.00 0.00 177.39 175.88 2r0q n GLU 16 N 0.00 -0.12 0.10 1.96 1.02 -1.26 0.13 120.64 122.47 2r0q n GLU 16 Ca 0.00 0.60 -0.13 0.00 -0.02 0.00 0.00 57.16 57.61 2r0q n GLU 16 Cb 0.00 -0.88 -0.06 0.00 -0.02 0.00 0.00 31.44 30.48 2r0q n GLU 16 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 2r0q h ARG 17 N 0.00 -0.47 -0.69 3.49 2.43 -2.00 -0.48 114.38 116.66 2r0q h ARG 17 Ca 0.11 0.03 0.13 0.00 -0.81 0.00 0.00 59.98 59.45 2r0q h ARG 17 Cb 0.21 0.11 -0.13 0.00 -0.42 0.00 0.00 29.97 29.74 2r0q h ARG 17 CO -0.38 -0.32 -0.23 0.37 -1.51 0.00 0.00 179.97 177.90 2r0q h GLN 18 N -0.49 -0.05 0.02 0.20 4.15 0.77 0.54 115.11 120.25 2r0q h GLN 18 Ca 0.04 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.47 2r0q h GLN 18 Cb 0.53 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.22 2r0q h GLN 18 CO -0.19 -0.03 -0.17 -0.07 -1.93 0.00 0.00 178.83 176.44 2r0q h LEU 19 N -0.05 -0.51 -0.08 -2.39 3.38 -0.04 -0.37 115.31 115.24 2r0q h LEU 19 Ca 0.31 0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.34 2r0q h LEU 19 Cb 0.54 0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 2r0q h LEU 19 CO -0.73 -0.17 -0.05 -0.62 0.09 0.00 0.00 178.44 176.96 2r0q n GLU 20 N -3.41 -0.04 -0.17 1.13 1.02 -0.30 0.54 120.64 119.41 2r0q n GLU 20 Ca -0.03 0.97 0.01 0.00 -0.02 0.00 0.00 57.16 58.09 2r0q n GLU 20 Cb 0.13 -1.46 0.03 0.00 -0.02 0.00 0.00 31.44 30.12 2r0q n GLU 20 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2r0q n ASN 21 N -3.13 -0.25 0.29 1.62 4.05 0.10 0.15 115.26 118.08 2r0q n ASN 21 Ca 0.00 0.79 -0.17 0.00 0.45 0.00 0.00 54.58 55.65 2r0q n ASN 21 Cb 0.02 -0.20 -0.08 0.00 1.23 0.00 0.00 39.78 40.75 2r0q n ASN 21 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 2r0q h LEU 22 N 0.00 -1.03 -1.37 1.20 3.38 0.18 -1.94 115.31 115.73 2r0q h LEU 22 Ca 0.18 0.08 0.18 0.00 0.09 0.00 0.00 57.88 58.40 2r0q h LEU 22 Cb 0.29 0.33 -0.07 0.00 0.09 0.00 0.00 40.66 41.30 2r0q h LEU 22 CO -0.45 -0.57 0.59 0.11 0.09 0.00 0.00 178.44 178.20 2r0q h LYS 23 N -0.87 0.54 0.00 1.13 1.57 0.21 0.31 116.57 119.47 2r0q h LYS 23 Ca -0.05 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2r0q h LYS 23 Cb 0.74 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.93 2r0q h LYS 23 CO -0.01 0.36 0.12 2.41 -0.57 0.00 0.00 179.45 181.76 2r0q n THR 24 N -4.56 0.89 0.30 -0.16 -1.04 0.38 0.22 114.28 110.32 2r0q n THR 24 Ca 0.19 0.73 0.05 0.00 -2.04 0.00 0.00 64.05 62.98 2r0q n THR 24 Cb 0.59 -1.73 0.06 0.00 -1.82 0.00 0.00 70.33 67.42 2r0q n THR 24 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 2r0q n PHE 25 N -2.15 0.07 0.00 -1.42 3.01 0.11 -4.99 117.46 112.09 2r0q n PHE 25 Ca -0.01 -0.09 0.00 0.00 1.01 0.00 0.00 57.45 58.36 2r0q n PHE 25 Cb 0.15 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.61 2r0q n PHE 25 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2r0q n GLY 26 N 0.51 1.42 3.49 1.37 0.00 0.13 -5.06 105.19 107.06 2r0q n GLY 26 Ca 0.06 0.00 -0.62 0.00 0.00 0.00 0.00 46.02 45.46 2r0q n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r0q n ALA 27 N -0.24 -0.32 -0.09 4.61 0.00 -1.18 -4.73 120.51 118.56 2r0q n ALA 27 Ca 0.00 0.30 -0.16 0.00 0.00 0.00 0.00 53.44 53.58 2r0q n ALA 27 Cb 0.00 -2.07 -0.08 0.00 0.00 0.00 0.00 19.45 17.30 2r0q n ALA 27 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2r0q h GLU 28 N 7.65 0.00 -6.27 0.00 5.08 -1.50 -3.41 114.58 116.14 2r0q h GLU 28 Ca -0.27 0.00 -0.68 0.00 -1.00 0.00 0.00 59.36 57.40 2r0q h GLU 28 Cb 1.38 0.00 -0.20 0.00 0.50 0.00 0.00 28.75 30.43 2r0q h GLU 28 CO 1.03 0.65 -0.73 0.21 -1.00 0.00 0.00 179.01 179.17 2r0q s LYS 29 N -2.31 2.58 -0.08 2.33 2.20 -1.16 -5.02 119.74 118.28 2r0q s LYS 29 Ca -0.24 -0.67 0.00 0.00 -0.36 0.00 0.00 55.97 54.71 2r0q s LYS 29 Cb 0.04 -2.48 0.02 0.00 -1.51 0.00 0.00 37.83 33.91 2r0q s LYS 29 CO 0.46 0.63 -0.07 0.42 -0.36 0.00 0.00 175.35 176.43 2r0q s ILE 30 N -0.85 0.83 0.04 5.43 1.01 -1.26 -1.16 121.20 125.24 2r0q s ILE 30 Ca 0.14 -0.22 -0.13 0.00 0.00 0.00 0.00 60.65 60.44 2r0q s ILE 30 Cb -0.11 -0.85 -0.06 0.00 0.01 0.00 0.00 42.46 41.46 2r0q s ILE 30 CO 0.03 0.32 0.41 -0.36 0.00 0.00 0.00 174.94 175.33 2r0q s PHE 31 N 1.36 3.66 -0.05 3.97 0.40 -0.96 -4.98 117.98 121.38 2r0q s PHE 31 Ca -0.03 0.91 0.03 0.00 -0.60 0.00 0.00 56.93 57.25 2r0q s PHE 31 Cb -0.14 -2.24 0.00 0.00 0.51 0.00 0.00 43.02 41.16 2r0q s PHE 31 CO -0.03 0.59 -0.15 0.99 0.70 0.00 0.00 175.22 177.32 2r0q s THR 32 N -1.22 1.28 -0.05 0.64 2.01 -1.26 -1.47 115.64 115.56 2r0q s THR 32 Ca 0.28 -0.60 -0.20 0.00 0.31 0.00 0.00 61.69 61.48 2r0q s THR 32 Cb -0.15 -1.12 -0.05 0.00 0.01 0.00 0.00 72.50 71.18 2r0q s THR 32 CO 0.15 0.38 0.56 -0.70 -0.69 0.00 0.00 174.62 174.32 2r0q s GLU 33 N 0.31 4.32 0.03 4.92 2.56 -0.85 -4.90 118.70 125.09 2r0q s GLU 33 Ca -0.09 0.65 0.18 0.00 0.00 0.00 0.00 54.97 55.71 2r0q s GLU 33 Cb -0.13 -3.38 -0.16 0.00 2.00 0.00 0.00 34.13 32.46 2r0q s GLU 33 CO 0.03 0.28 0.73 1.63 -0.56 0.00 0.00 175.26 177.37 2r0q n LYS 34 N 3.09 0.63 0.00 4.30 5.02 -1.26 -4.61 118.16 125.33 2r0q n LYS 34 Ca -0.07 0.16 0.00 0.00 -2.02 0.00 0.00 58.31 56.38 2r0q n LYS 34 Cb 0.51 -1.75 0.00 0.00 -0.02 0.00 0.00 35.03 33.77 2r0q n LYS 34 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2r0q n ASN 42 N -2.81 0.00 -3.44 4.39 3.02 -1.26 -5.04 115.26 110.12 2r0q n ASN 42 Ca -0.11 0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.31 2r0q n ASN 42 Cb 0.83 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 40.00 2r0q n ASN 42 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2r0q n ARG 43 N 0.00 -1.46 0.09 3.52 1.74 -1.26 -4.95 116.66 114.33 2r0q n ARG 43 Ca 0.00 1.13 -0.22 0.00 -0.77 0.00 0.00 57.85 57.99 2r0q n ARG 43 Cb 0.00 -3.92 -0.14 0.00 -1.02 0.00 0.00 32.46 27.38 2r0q n ARG 43 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 2r0q h PRO 44 N 0.14 0.51 -0.30 5.56 0.13 -2.00 -3.27 132.00 132.76 2r0q h PRO 44 Ca -0.34 -0.76 0.07 0.00 -0.87 0.00 0.00 66.00 64.10 2r0q h PRO 44 Cb 1.21 0.27 -0.08 0.00 0.13 0.00 0.00 31.00 32.53 2r0q h PRO 44 CO 0.33 1.35 -0.28 0.82 -0.23 0.00 0.00 178.00 179.99 2r0q h ILE 45 N 0.06 0.32 -0.65 -3.56 1.08 -1.92 -0.27 117.51 112.56 2r0q h ILE 45 Ca -0.19 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.36 2r0q h ILE 45 Cb 1.88 0.32 -0.11 0.00 -3.07 0.00 0.00 36.82 35.84 2r0q h ILE 45 CO 0.22 0.00 -0.50 0.25 -0.69 0.00 0.00 178.15 177.44 2r0q h LEU 46 N -0.26 -1.72 -1.10 1.44 5.85 -1.93 0.71 115.31 118.29 2r0q h LEU 46 Ca 0.15 0.27 0.11 0.00 0.84 0.00 0.00 57.88 59.25 2r0q h LEU 46 Cb 0.50 0.76 -0.08 0.00 0.37 0.00 0.00 40.66 42.22 2r0q h LEU 46 CO -0.45 -0.33 0.61 -0.61 -0.34 0.00 0.00 178.44 177.32 2r0q h GLN 47 N -0.21 0.91 0.09 1.25 5.75 -1.35 0.09 115.11 121.65 2r0q h GLN 47 Ca 0.16 -0.05 0.01 0.00 -0.15 0.00 0.00 58.65 58.61 2r0q h GLN 47 Cb 0.55 -0.21 -0.02 0.00 1.07 0.00 0.00 27.48 28.87 2r0q h GLN 47 CO -0.74 0.60 -0.13 -0.22 -2.65 0.00 0.00 178.83 175.70 2r0q h LYS 48 N 0.94 -0.26 -0.36 1.69 3.64 0.20 -1.28 116.57 121.14 2r0q h LYS 48 Ca 0.46 0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.91 2r0q h LYS 48 Cb 0.47 0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.30 2r0q h LYS 48 CO -0.22 -0.17 0.07 0.00 -2.27 0.00 0.00 179.45 176.85 2r0q h ALA 49 N 0.61 0.38 -0.54 5.00 0.00 0.60 -1.01 119.26 124.30 2r0q h ALA 49 Ca 0.02 0.07 0.09 0.00 0.00 0.00 0.00 54.91 55.09 2r0q h ALA 49 Cb 0.28 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 2r0q h ALA 49 CO -0.07 -0.34 0.36 -0.07 0.00 0.00 0.00 179.25 179.14 2r0q h LEU 50 N 0.19 0.31 -0.56 0.00 3.38 -0.65 0.65 115.31 118.62 2r0q h LEU 50 Ca 0.17 0.01 -0.10 0.00 0.09 0.00 0.00 57.88 58.05 2r0q h LEU 50 Cb 0.20 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2r0q h LEU 50 CO -0.23 0.19 -0.46 0.78 0.09 0.00 0.00 178.44 178.81 2r0q h ASN 51 N 0.35 0.00 -0.11 -0.43 2.35 -0.03 -3.28 115.58 114.44 2r0q h ASN 51 Ca 0.25 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.95 2r0q h ASN 51 Cb 0.51 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.88 2r0q h ASN 51 CO -0.06 0.46 -0.12 0.15 -1.65 0.00 0.00 177.43 176.21 2r0q h PHE 52 N 0.00 0.33 -4.22 1.19 3.57 -0.12 -3.45 116.94 114.24 2r0q h PHE 52 Ca -0.00 -0.10 -0.53 0.00 3.53 0.00 0.00 57.97 60.86 2r0q h PHE 52 Cb 1.12 -0.07 0.19 0.00 2.79 0.00 0.00 35.95 39.98 2r0q h PHE 52 CO 0.00 0.70 0.29 1.33 -2.23 0.00 0.00 178.31 178.40 2r0q n VAL 53 N -4.62 1.31 -3.58 1.41 0.24 -0.95 -5.04 118.33 107.10 2r0q n VAL 53 Ca -0.07 -0.13 -0.11 0.00 -2.04 0.00 0.00 64.34 61.99 2r0q n VAL 53 Cb 0.34 -1.13 -0.04 0.00 -1.47 0.00 0.00 33.84 31.55 2r0q n VAL 53 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2r0q s ARG 54 N -4.29 1.10 -0.36 7.34 1.70 -1.26 -5.01 118.95 118.17 2r0q s ARG 54 Ca 0.71 -0.60 -0.39 0.00 -0.47 0.00 0.00 55.73 54.98 2r0q s ARG 54 Cb -0.27 0.49 -0.17 0.00 -0.57 0.00 0.00 34.95 34.43 2r0q s ARG 54 CO 0.53 -0.44 1.29 -0.12 -1.08 0.00 0.00 175.30 175.48 2r0q n MET 55 N -0.17 0.00 0.00 3.89 0.00 -1.15 -1.36 117.12 118.32 2r0q n MET 55 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.53 2r0q n MET 55 Cb 0.64 -1.27 0.00 0.00 0.00 0.00 0.00 33.22 32.59 2r0q n MET 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2r0q n GLY 56 N 3.08 1.60 3.81 -5.12 0.00 -1.22 -5.02 105.19 102.33 2r0q n GLY 56 Ca 0.25 -0.23 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 2r0q n GLY 56 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2r0q s ASP 57 N -0.31 3.81 -0.10 1.61 1.01 -0.47 -4.22 116.67 118.01 2r0q s ASP 57 Ca 0.00 0.96 0.02 0.00 0.71 0.00 0.00 52.55 54.24 2r0q s ASP 57 Cb 0.00 -1.54 0.01 0.00 1.01 0.00 0.00 42.92 42.41 2r0q s ASP 57 CO 0.00 -2.36 -0.15 -0.60 0.21 0.00 0.00 175.17 172.27 2r0q s ARG 58 N -5.33 2.11 -0.33 8.23 3.52 -1.12 -1.61 118.95 124.42 2r0q s ARG 58 Ca 0.63 -0.53 -0.13 0.00 -0.13 0.00 0.00 55.73 55.57 2r0q s ARG 58 Cb -0.14 -1.78 -0.02 0.00 -1.56 0.00 0.00 34.95 31.45 2r0q s ARG 58 CO 0.53 -0.04 0.28 0.12 -0.81 0.00 0.00 175.30 175.38 2r0q s PHE 59 N 0.90 3.22 -0.10 5.12 5.36 0.98 -0.01 117.98 133.45 2r0q s PHE 59 Ca -0.09 -0.09 -0.02 0.00 -0.96 0.00 0.00 56.93 55.77 2r0q s PHE 59 Cb -0.15 -2.53 -0.03 0.00 -0.34 0.00 0.00 43.02 39.97 2r0q s PHE 59 CO 0.00 -0.36 -0.02 0.42 -1.46 0.00 0.00 175.22 173.81 2r0q s ILE 60 N 1.83 4.15 0.07 3.12 1.01 0.35 -1.83 121.20 129.90 2r0q s ILE 60 Ca 0.08 -0.30 -0.07 0.00 0.00 0.00 0.00 60.65 60.36 2r0q s ILE 60 Cb -0.17 -2.76 -0.01 0.00 0.01 0.00 0.00 42.46 39.53 2r0q s ILE 60 CO 0.11 0.57 0.14 0.68 0.00 0.00 0.00 174.94 176.44 2r0q s VAL 61 N -0.55 0.15 0.04 2.92 -7.23 -0.94 -1.86 120.40 112.93 2r0q s VAL 61 Ca 0.09 -1.27 -0.18 0.00 -1.81 0.00 0.00 61.98 58.81 2r0q s VAL 61 Cb -0.12 -1.32 -0.20 0.00 0.56 0.00 0.00 36.38 35.30 2r0q s VAL 61 CO 0.02 -0.70 1.18 -0.08 -0.31 0.00 0.00 175.10 175.21 2r0q h GLU 62 N 2.93 0.52 -2.89 4.82 4.81 -1.87 0.61 114.58 123.51 2r0q h GLU 62 Ca -0.34 -0.48 -0.12 0.00 -0.13 0.00 0.00 59.36 58.29 2r0q h GLU 62 Cb 1.19 0.12 -0.22 0.00 0.63 0.00 0.00 28.75 30.46 2r0q h GLU 62 CO 0.57 1.11 -0.26 0.45 -0.73 0.00 0.00 179.01 180.16 2r0q s SER 63 N -6.79 -0.31 0.09 1.04 0.15 -1.26 -1.64 113.70 104.97 2r0q s SER 63 Ca -0.12 0.45 -0.11 0.00 0.70 0.00 0.00 55.95 56.87 2r0q s SER 63 Cb 0.05 0.55 0.04 0.00 -1.71 0.00 0.00 66.02 64.95 2r0q s SER 63 CO 0.84 -0.29 0.70 -0.38 1.20 0.00 0.00 173.24 175.31 2r0q n ILE 64 N 2.08 -0.27 0.24 6.45 2.08 -1.26 0.57 119.36 129.24 2r0q n ILE 64 Ca -0.17 1.08 0.10 0.00 0.56 0.00 0.00 62.75 64.32 2r0q n ILE 64 Cb 0.57 -1.38 0.53 0.00 -0.75 0.00 0.00 39.64 38.61 2r0q n ILE 64 CO 0.00 0.00 0.00 -2.24 0.56 0.00 0.00 176.55 174.87 2r0q h ASP 65 N 0.00 0.00 0.41 4.38 3.04 -1.97 0.27 116.42 122.54 2r0q h ASP 65 Ca 0.11 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.90 2r0q h ASP 65 Cb 0.23 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.52 2r0q h ASP 65 CO -0.44 0.00 0.00 0.54 -2.04 0.00 0.00 179.24 177.30 2r0q n ARG 66 N -2.42 0.41 0.00 4.15 5.12 0.19 -2.59 116.66 121.53 2r0q n ARG 66 Ca -0.01 0.05 0.13 0.00 -1.93 0.00 0.00 57.85 56.08 2r0q n ARG 66 Cb 0.38 -1.50 0.34 0.00 -1.16 0.00 0.00 32.46 30.52 2r0q n ARG 66 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2r0q n LEU 67 N -1.25 1.68 0.00 0.55 4.77 0.95 -4.97 117.00 118.72 2r0q n LEU 67 Ca 0.13 -0.55 0.00 0.00 -0.03 0.00 0.00 56.01 55.56 2r0q n LEU 67 Cb 0.18 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 2r0q n LEU 67 CO 0.18 0.29 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 2r0q n GLY 68 N 1.29 1.01 0.16 -0.72 0.00 -1.07 -4.15 105.19 101.70 2r0q n GLY 68 Ca 0.15 -0.44 0.13 0.00 0.00 0.00 0.00 46.02 45.85 2r0q n GLY 68 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2r0q h ARG 69 N 0.00 0.00 -2.91 1.61 2.43 -1.94 -3.45 114.38 110.12 2r0q h ARG 69 Ca 0.00 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.20 2r0q h ARG 69 Cb 0.00 0.00 -0.10 0.00 -0.42 0.00 0.00 29.97 29.45 2r0q h ARG 69 CO 0.00 0.00 0.25 0.54 -1.51 0.00 0.00 179.97 179.25 2r0q s ASN 70 N -4.55 -0.44 0.12 -3.80 2.20 -1.26 -5.05 114.94 102.16 2r0q s ASN 70 Ca 0.04 -0.21 -0.29 0.00 -0.94 0.00 0.00 52.86 51.46 2r0q s ASN 70 Cb 0.09 0.62 -0.08 0.00 -2.00 0.00 0.00 41.25 39.88 2r0q s ASN 70 CO 0.44 -1.06 1.60 0.10 -2.94 0.00 0.00 177.10 175.24 2r0q h TYR 71 N 2.00 -1.03 -1.33 1.54 -0.00 -2.00 -1.39 116.97 114.76 2r0q h TYR 71 Ca -0.28 0.03 0.46 0.00 0.00 0.00 0.00 58.73 58.94 2r0q h TYR 71 Cb 1.28 0.44 -0.14 0.00 0.00 0.00 0.00 36.73 38.32 2r0q h TYR 71 CO 0.30 -0.47 0.85 0.09 -0.00 0.00 0.00 178.16 178.93 2r0q n ASN 72 N -5.44 0.21 -0.01 0.10 4.13 -1.26 0.82 115.26 113.80 2r0q n ASN 72 Ca -0.07 1.36 -0.17 0.00 1.68 0.00 0.00 54.58 57.38 2r0q n ASN 72 Cb 0.36 -0.67 -0.11 0.00 -1.54 0.00 0.00 39.78 37.82 2r0q n ASN 72 CO 0.00 0.00 0.00 -0.08 0.28 0.00 0.00 177.26 177.46 2r0q h GLU 73 N 0.00 0.35 -0.62 3.52 4.81 -1.64 -2.96 114.58 118.04 2r0q h GLU 73 Ca 0.86 -0.37 0.13 0.00 -0.13 0.00 0.00 59.36 59.85 2r0q h GLU 73 Cb 2.75 0.10 -0.10 0.00 0.63 0.00 0.00 28.75 32.13 2r0q h GLU 73 CO -0.46 1.05 0.07 0.28 -0.73 0.00 0.00 179.01 179.21 2r0q h VAL 74 N -0.19 0.55 -0.09 0.32 2.07 0.83 0.31 116.25 120.05 2r0q h VAL 74 Ca -0.06 -0.06 0.04 0.00 0.82 0.00 0.00 66.70 67.44 2r0q h VAL 74 Cb 1.21 0.35 -0.06 0.00 -1.52 0.00 0.00 31.29 31.27 2r0q h VAL 74 CO 0.10 0.03 -0.37 0.40 0.02 0.00 0.00 177.57 177.75 2r0q h ILE 75 N 0.19 0.22 -0.28 4.57 5.03 -1.27 0.29 117.51 126.26 2r0q h ILE 75 Ca 0.33 0.00 0.06 0.00 -0.12 0.00 0.00 64.86 65.13 2r0q h ILE 75 Cb 0.53 0.22 -0.08 0.00 -3.03 0.00 0.00 36.82 34.46 2r0q h ILE 75 CO -0.48 0.00 -0.39 -0.74 -0.68 0.00 0.00 178.15 175.86 2r0q h HIS 76 N -0.47 -1.10 -0.09 1.37 2.76 -0.40 0.51 115.15 117.74 2r0q h HIS 76 Ca 0.08 0.06 0.02 0.00 -2.20 0.00 0.00 60.37 58.32 2r0q h HIS 76 Cb 0.59 0.52 -0.03 0.00 1.55 0.00 0.00 27.41 30.04 2r0q h HIS 76 CO -0.43 -0.43 -0.27 1.15 -1.30 0.00 0.00 177.93 176.65 2r0q h THR 77 N -0.37 0.00 -0.42 6.26 2.02 0.51 0.40 112.91 121.31 2r0q h THR 77 Ca 0.12 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.39 2r0q h THR 77 Cb 0.58 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 66.91 2r0q h THR 77 CO -0.48 0.00 -0.14 0.58 0.37 0.00 0.00 175.52 175.86 2r0q h VAL 78 N -0.28 0.52 -0.70 3.16 2.07 -0.02 0.12 116.25 121.12 2r0q h VAL 78 Ca 0.02 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.65 2r0q h VAL 78 Cb 0.33 0.52 -0.08 0.00 -1.52 0.00 0.00 31.29 30.54 2r0q h VAL 78 CO -0.23 0.00 0.30 0.78 0.02 0.00 0.00 177.57 178.44 2r0q h ASN 79 N -0.04 0.32 0.19 0.57 2.35 0.73 0.85 115.58 120.55 2r0q h ASN 79 Ca 0.20 0.09 0.01 0.00 -0.55 0.00 0.00 56.30 56.04 2r0q h ASN 79 Cb 0.35 0.05 -0.04 0.00 0.05 0.00 0.00 38.32 38.73 2r0q h ASN 79 CO -0.45 0.16 -0.47 0.22 -1.65 0.00 0.00 177.43 175.24 2r0q h TYR 80 N 0.49 -1.34 -0.89 1.19 3.20 0.24 -1.94 116.97 117.92 2r0q h TYR 80 Ca 0.37 0.03 0.16 0.00 3.14 0.00 0.00 58.73 62.43 2r0q h TYR 80 Cb 0.48 0.56 -0.10 0.00 1.54 0.00 0.00 36.73 39.21 2r0q h TYR 80 CO -0.15 -0.55 0.48 -0.07 -1.64 0.00 0.00 178.16 176.24 2r0q h LEU 81 N -0.72 0.59 -1.08 2.82 3.38 -0.61 -0.16 115.31 119.53 2r0q h LEU 81 Ca -0.02 0.09 0.05 0.00 0.09 0.00 0.00 57.88 58.10 2r0q h LEU 81 Cb 0.70 -0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.38 2r0q h LEU 81 CO -0.21 0.23 0.62 0.50 0.09 0.00 0.00 178.44 179.68 2r0q h LYS 82 N 0.66 1.10 0.08 1.13 3.64 -0.14 -0.79 116.57 122.25 2r0q h LYS 82 Ca 0.49 -0.07 -0.22 0.00 -1.27 0.00 0.00 60.65 59.59 2r0q h LYS 82 Cb 0.72 -0.25 0.02 0.00 -0.41 0.00 0.00 32.23 32.31 2r0q h LYS 82 CO -0.37 0.73 -0.91 -0.44 -2.27 0.00 0.00 179.45 176.19 2r0q h ASP 83 N 1.14 0.67 0.08 4.20 5.19 -0.35 -2.99 116.42 124.35 2r0q h ASP 83 Ca 0.40 -0.83 0.00 0.00 -0.62 0.00 0.00 57.03 55.98 2r0q h ASP 83 Cb 0.12 -0.21 0.00 0.00 0.18 0.00 0.00 39.33 39.42 2r0q h ASP 83 CO -0.14 1.42 0.00 1.17 -3.12 0.00 0.00 179.24 178.57 2r0q n LYS 84 N -4.02 0.50 -3.53 3.56 4.81 -0.53 -4.86 118.16 114.09 2r0q n LYS 84 Ca -0.12 0.03 -0.19 0.00 -0.87 0.00 0.00 58.31 57.16 2r0q n LYS 84 Cb 0.83 -1.50 0.07 0.00 0.02 0.00 0.00 35.03 34.45 2r0q n LYS 84 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2r0q n GLU 85 N -1.07 -6.11 -4.19 1.64 1.02 -0.43 -2.94 120.64 108.55 2r0q n GLU 85 Ca 0.13 0.77 -0.34 0.00 -0.02 0.00 0.00 57.16 57.70 2r0q n GLU 85 Cb 0.08 -5.64 -0.10 0.00 -0.02 0.00 0.00 31.44 25.76 2r0q n GLU 85 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2r0q s VAL 86 N -3.46 4.42 0.28 2.62 1.01 -0.46 -3.39 120.40 121.42 2r0q s VAL 86 Ca 0.03 -0.17 -0.30 0.00 0.00 0.00 0.00 61.98 61.54 2r0q s VAL 86 Cb -0.01 -2.96 -0.11 0.00 0.00 0.00 0.00 36.38 33.30 2r0q s VAL 86 CO 0.76 0.49 1.53 -1.10 0.00 0.00 0.00 175.10 176.78 2r0q s GLN 87 N 0.18 4.18 -0.12 2.72 -0.21 -0.64 -4.62 119.66 121.15 2r0q s GLN 87 Ca 0.02 2.47 -0.02 0.00 0.02 0.00 0.00 55.36 57.85 2r0q s GLN 87 Cb -0.13 -3.06 -0.03 0.00 1.00 0.00 0.00 33.01 30.80 2r0q s GLN 87 CO 0.01 -0.55 -0.04 -1.17 -2.12 0.00 0.00 175.29 171.43 2r0q s LEU 88 N -0.46 3.27 0.00 2.90 2.96 -1.26 -0.01 118.68 126.08 2r0q s LEU 88 Ca 0.62 -0.05 0.02 0.00 -0.22 0.00 0.00 54.13 54.49 2r0q s LEU 88 Cb -0.45 -1.76 -0.01 0.00 0.50 0.00 0.00 46.19 44.47 2r0q s LEU 88 CO 0.46 0.26 -0.06 -0.32 -1.32 0.00 0.00 176.35 175.37 2r0q s MET 89 N -0.19 0.48 -0.18 1.98 -2.45 -0.76 -4.95 119.30 113.22 2r0q s MET 89 Ca 0.03 -0.28 -0.01 0.00 -1.25 0.00 0.00 55.69 54.19 2r0q s MET 89 Cb -0.13 -0.44 0.05 0.00 1.25 0.00 0.00 34.83 35.56 2r0q s MET 89 CO 0.02 0.12 -0.04 0.42 1.05 0.00 0.00 175.02 176.59 2r0q s ILE 90 N -0.29 1.13 0.10 10.11 1.01 -1.26 -2.22 121.20 129.78 2r0q s ILE 90 Ca 0.01 -0.75 -0.24 0.00 0.00 0.00 0.00 60.65 59.66 2r0q s ILE 90 Cb -0.03 -1.37 -0.07 0.00 0.01 0.00 0.00 42.46 41.00 2r0q s ILE 90 CO -0.00 0.04 1.41 0.74 0.00 0.00 0.00 174.94 177.13 2r0q h THR 91 N 6.46 0.00 0.00 2.92 2.02 -0.89 -2.99 112.91 120.43 2r0q h THR 91 Ca -0.22 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.96 2r0q h THR 91 Cb 1.10 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.51 2r0q h THR 91 CO 0.40 0.00 0.38 0.77 0.37 0.00 0.00 175.52 177.44 2r0q h SER 92 N -0.21 0.00 -2.78 4.18 4.64 -1.58 -3.43 113.55 114.37 2r0q h SER 92 Ca 0.07 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.84 2r0q h SER 92 Cb 0.41 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.49 2r0q h SER 92 CO -0.52 0.00 0.95 -0.76 -0.87 0.00 0.00 176.83 175.63 2r0q s LEU 93 N -5.64 4.29 0.28 5.97 1.43 -1.13 -4.96 118.68 118.93 2r0q s LEU 93 Ca -0.03 2.09 -0.30 0.00 -1.03 0.00 0.00 54.13 54.86 2r0q s LEU 93 Cb 0.08 -3.55 -0.13 0.00 0.03 0.00 0.00 46.19 42.63 2r0q s LEU 93 CO 0.25 -0.82 1.42 -2.65 0.23 0.00 0.00 176.35 174.78 2r0q n PRO 94 N 6.31 2.22 -1.64 1.29 -0.02 -1.26 -1.34 135.00 140.57 2r0q n PRO 94 Ca 0.15 0.79 -0.19 0.00 -2.02 0.00 0.00 63.50 62.23 2r0q n PRO 94 Cb 0.43 -2.46 -0.08 0.00 -0.02 0.00 0.00 33.50 31.38 2r0q n PRO 94 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 2r0q n MET 95 N 1.66 -1.36 -0.13 -0.52 2.81 -1.26 -4.87 117.12 113.46 2r0q n MET 95 Ca 0.09 1.15 0.08 0.00 -1.81 0.00 0.00 57.70 57.22 2r0q n MET 95 Cb 0.34 -5.49 0.41 0.00 -0.71 0.00 0.00 33.22 27.77 2r0q n MET 95 CO 0.00 0.00 0.00 1.98 1.51 0.00 0.00 175.97 179.46 2r0q h MET 96 N 0.00 0.59 0.58 0.03 4.05 -1.53 -1.34 114.93 117.31 2r0q h MET 96 Ca -0.40 -0.04 -0.03 0.00 -0.28 0.00 0.00 59.70 58.96 2r0q h MET 96 Cb 1.26 -0.13 0.01 0.00 -0.80 0.00 0.00 31.60 31.93 2r0q h MET 96 CO 0.57 0.39 -0.28 -0.91 0.23 0.00 0.00 176.91 176.92 2r0q h ASN 97 N 0.61 -0.66 -1.28 1.39 4.21 -1.89 -1.69 115.58 116.28 2r0q h ASN 97 Ca 0.29 0.02 0.42 0.00 1.21 0.00 0.00 56.30 58.25 2r0q h ASN 97 Cb 0.35 0.17 -0.11 0.00 -1.12 0.00 0.00 38.32 37.62 2r0q h ASN 97 CO -0.09 -0.30 0.85 -0.62 -1.29 0.00 0.00 177.43 175.98 2r0q n GLU 98 N -5.06 -0.02 0.07 0.81 4.71 -1.02 -0.67 120.64 119.46 2r0q n GLU 98 Ca -0.10 1.03 -0.03 0.00 -0.01 0.00 0.00 57.16 58.05 2r0q n GLU 98 Cb 0.31 -2.10 -0.02 0.00 -1.01 0.00 0.00 31.44 28.62 2r0q n GLU 98 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 2r0q h VAL 99 N 0.00 0.00 0.00 2.62 2.07 -0.99 -3.33 116.25 116.61 2r0q h VAL 99 Ca 0.76 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.95 2r0q h VAL 99 Cb 2.58 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 32.35 2r0q h VAL 99 CO -0.31 0.00 0.00 2.30 0.02 0.00 0.00 177.57 179.58 2r0q n ILE 100 N -3.49 0.00 1.19 4.57 -5.35 0.15 -2.13 119.36 114.29 2r0q n ILE 100 Ca -0.03 0.00 0.14 0.00 -0.27 0.00 0.00 62.75 62.59 2r0q n ILE 100 Cb 0.09 -0.22 0.58 0.00 -1.74 0.00 0.00 39.64 38.34 2r0q n ILE 100 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2r0q n GLY 101 N 0.22 -1.26 3.76 3.28 0.00 -0.35 -4.61 105.19 106.24 2r0q n GLY 101 Ca 0.00 -0.20 -0.33 0.00 0.00 0.00 0.00 46.02 45.49 2r0q n GLY 101 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2r0q s ASN 102 N -2.78 5.57 0.17 1.61 3.84 -0.91 -5.03 114.94 117.42 2r0q s ASN 102 Ca 0.20 0.11 0.18 0.00 0.21 0.00 0.00 52.86 53.56 2r0q s ASN 102 Cb 0.19 -1.57 -0.02 0.00 -0.55 0.00 0.00 41.25 39.30 2r0q s ASN 102 CO 0.53 0.27 1.10 1.55 -2.79 0.00 0.00 177.10 177.76 2r0q h PRO 103 N 4.10 0.00 0.00 0.43 0.13 -1.86 -3.35 132.00 131.45 2r0q h PRO 103 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2r0q h PRO 103 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2r0q h PRO 103 CO 0.62 0.29 -0.06 1.28 -0.23 0.00 0.00 178.00 179.89 2r0q n LEU 104 N -2.97 0.83 -0.07 1.56 4.32 -1.26 -2.97 117.00 116.44 2r0q n LEU 104 Ca -0.04 0.54 0.10 0.00 -0.02 0.00 0.00 56.01 56.59 2r0q n LEU 104 Cb 0.74 -0.30 0.54 0.00 -1.62 0.00 0.00 43.42 42.78 2r0q n LEU 104 CO 0.41 -0.17 0.85 0.18 -1.22 0.00 0.00 177.39 177.44 2r0q n LEU 105 N -2.27 0.21 0.00 2.23 4.77 -1.26 -3.18 117.00 117.51 2r0q n LEU 105 Ca 0.05 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 2r0q n LEU 105 Cb 0.43 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 2r0q n LEU 105 CO 0.31 0.04 0.00 -0.67 -1.33 0.00 0.00 177.39 175.74 2r0q n ASP 106 N -0.65 0.00 -0.20 -1.43 2.03 -1.16 -2.66 116.55 112.48 2r0q n ASP 106 Ca 0.15 0.22 0.01 0.00 0.52 0.00 0.00 54.79 55.68 2r0q n ASP 106 Cb 0.10 -0.23 0.04 0.00 -0.72 0.00 0.00 41.12 40.31 2r0q n ASP 106 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 2r0q n LYS 107 N -1.26 -0.10 0.00 -0.67 3.00 -1.23 -1.26 118.16 116.65 2r0q n LYS 107 Ca 0.00 0.84 0.00 0.00 -0.00 0.00 0.00 58.31 59.15 2r0q n LYS 107 Cb 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 35.03 33.79 2r0q n LYS 107 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 2r0q n PHE 108 N -4.83 0.00 -0.35 5.64 7.35 -1.19 -1.03 117.46 123.05 2r0q n PHE 108 Ca 0.07 0.00 0.03 0.00 -0.76 0.00 0.00 57.45 56.78 2r0q n PHE 108 Cb 0.24 -0.11 0.09 0.00 0.35 0.00 0.00 39.48 40.05 2r0q n PHE 108 CO 0.00 0.00 0.00 -0.12 -0.76 0.00 0.00 176.76 175.88 2r0q n MET 109 N -1.16 -0.15 -0.01 -4.13 1.56 -0.39 -0.32 117.12 112.52 2r0q n MET 109 Ca 0.00 1.47 -0.10 0.00 -0.27 0.00 0.00 57.70 58.80 2r0q n MET 109 Cb 0.00 -2.19 -0.04 0.00 2.15 0.00 0.00 33.22 33.14 2r0q n MET 109 CO 0.00 0.00 0.00 0.87 -0.73 0.00 0.00 175.97 176.11 2r0q h LYS 110 N 0.00 -0.35 0.64 2.12 1.57 -1.13 -1.51 116.57 117.90 2r0q h LYS 110 Ca 0.40 0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 59.17 2r0q h LYS 110 Cb 0.63 0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.02 2r0q h LYS 110 CO -0.96 -0.23 -0.34 -0.44 -0.57 0.00 0.00 179.45 176.90 2r0q h ASP 111 N -0.36 -0.84 -0.72 0.86 3.32 0.11 -2.56 116.42 116.21 2r0q h ASP 111 Ca 0.11 0.04 0.15 0.00 0.02 0.00 0.00 57.03 57.35 2r0q h ASP 111 Cb 0.53 0.23 -0.13 0.00 0.22 0.00 0.00 39.33 40.18 2r0q h ASP 111 CO -0.37 -0.56 -0.11 0.25 -1.72 0.00 0.00 179.24 176.73 2r0q h LEU 112 N -0.91 -0.54 0.30 1.55 5.85 -1.03 0.12 115.31 120.64 2r0q h LEU 112 Ca -0.08 0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 2r0q h LEU 112 Cb 0.72 0.40 -0.04 0.00 0.37 0.00 0.00 40.66 42.12 2r0q h LEU 112 CO 0.11 -0.22 -0.52 0.40 -0.34 0.00 0.00 178.44 177.88 2r0q h ILE 113 N 0.04 0.00 -0.57 4.05 2.04 -1.16 -0.48 117.51 121.42 2r0q h ILE 113 Ca 0.37 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.30 2r0q h ILE 113 Cb 0.60 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.57 2r0q h ILE 113 CO -0.71 0.00 -0.48 0.40 0.00 0.00 0.00 178.15 177.36 2r0q h ILE 114 N -0.87 0.05 0.00 -0.67 2.04 -0.73 -1.59 117.51 115.74 2r0q h ILE 114 Ca -0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.83 2r0q h ILE 114 Cb 0.81 0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.94 2r0q h ILE 114 CO -0.18 0.00 0.00 0.00 0.00 0.00 0.00 178.15 177.97 2r0q n GLN 115 N -5.39 0.00 -0.12 2.37 1.13 0.26 -0.44 117.38 115.19 2r0q n GLN 115 Ca 0.00 0.26 -0.03 0.00 -1.94 0.00 0.00 57.00 55.29 2r0q n GLN 115 Cb 0.34 -0.83 -0.03 0.00 0.11 0.00 0.00 30.24 29.83 2r0q n GLN 115 CO 0.00 0.00 0.00 -0.89 -1.44 0.00 0.00 177.06 174.73 2r0q n ILE 116 N -0.59 -0.19 -0.16 5.09 5.41 -0.24 0.17 119.36 128.85 2r0q n ILE 116 Ca 0.00 0.72 -0.02 0.00 1.00 0.00 0.00 62.75 64.45 2r0q n ILE 116 Cb 0.00 -0.89 0.07 0.00 -0.71 0.00 0.00 39.64 38.11 2r0q n ILE 116 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2r0q h LEU 117 N 0.00 -0.01 -0.61 1.39 3.38 -0.93 -0.87 115.31 117.66 2r0q h LEU 117 Ca 0.04 0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 2r0q h LEU 117 Cb 0.11 0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 2r0q h LEU 117 CO -0.26 0.02 0.29 0.00 0.09 0.00 0.00 178.44 178.59 2r0q h ALA 118 N 1.40 0.79 0.00 1.53 0.00 0.45 0.16 119.26 123.59 2r0q h ALA 118 Ca 0.26 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2r0q h ALA 118 Cb 0.35 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2r0q h ALA 118 CO -0.34 0.35 0.00 -0.12 0.00 0.00 0.00 179.25 179.14 2r0q n MET 119 N -4.51 0.02 -0.09 0.00 0.00 0.30 -1.57 117.12 111.27 2r0q n MET 119 Ca 0.04 0.35 -0.22 0.00 -0.00 0.00 0.00 57.70 57.87 2r0q n MET 119 Cb 0.13 -1.50 -0.12 0.00 0.00 0.00 0.00 33.22 31.72 2r0q n MET 119 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 2r0q n VAL 120 N -1.39 1.58 -0.05 1.12 0.31 0.47 -4.10 118.33 116.26 2r0q n VAL 120 Ca 0.01 -0.48 -0.11 0.00 -0.01 0.00 0.00 64.34 63.75 2r0q n VAL 120 Cb 0.03 -1.68 -0.04 0.00 -0.91 0.00 0.00 33.84 31.24 2r0q n VAL 120 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2r0q h SER 121 N -0.33 0.25 0.00 4.52 4.64 -0.55 -0.71 113.55 121.37 2r0q h SER 121 Ca -0.54 -0.12 0.00 0.00 -0.47 0.00 0.00 61.79 60.67 2r0q h SER 121 Cb 1.80 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.82 2r0q h SER 121 CO -0.13 0.30 0.00 1.21 -0.87 0.00 0.00 176.83 177.33 2r0q n GLU 122 N -4.87 0.49 -0.01 4.77 2.13 -0.61 -0.00 120.64 122.54 2r0q n GLU 122 Ca -0.04 0.00 -0.01 0.00 0.66 0.00 0.00 57.16 57.77 2r0q n GLU 122 Cb 0.09 -1.25 -0.01 0.00 0.27 0.00 0.00 31.44 30.54 2r0q n GLU 122 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 2r0q n GLN 123 N 0.37 1.80 0.14 5.31 7.27 -0.31 -4.65 117.38 127.31 2r0q n GLN 123 Ca 0.00 0.01 -0.24 0.00 0.07 0.00 0.00 57.00 56.83 2r0q n GLN 123 Cb 0.15 -1.04 -0.16 0.00 2.41 0.00 0.00 30.24 31.60 2r0q n GLN 123 CO 0.00 0.00 0.00 1.49 0.07 0.00 0.00 177.06 178.62 2r0q h GLU 124 N 0.00 0.52 0.00 3.69 4.81 -0.12 -2.94 114.58 120.53 2r0q h GLU 124 Ca -0.04 -0.88 0.00 0.00 -0.13 0.00 0.00 59.36 58.30 2r0q h GLU 124 Cb 1.08 0.33 0.00 0.00 0.63 0.00 0.00 28.75 30.79 2r0q h GLU 124 CO -0.00 1.42 0.43 0.00 -0.73 0.00 0.00 179.01 180.13 2r0q h ARG 125 N 0.14 0.00 0.00 1.92 3.08 -0.69 0.80 114.38 119.63 2r0q h ARG 125 Ca -0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.78 2r0q h ARG 125 Cb 2.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.21 2r0q h ARG 125 CO 0.26 0.00 -0.00 0.09 -1.07 0.00 0.00 179.97 179.25 2r0q n ASN 126 N -2.14 1.48 0.18 7.04 3.02 -1.20 -4.66 115.26 118.98 2r0q n ASN 126 Ca -0.01 -1.77 0.16 0.00 -0.03 0.00 0.00 54.58 52.93 2r0q n ASN 126 Cb 0.45 -0.01 0.77 0.00 -0.61 0.00 0.00 39.78 40.38 2r0q n ASN 126 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 2r0q h GLU 127 N 0.00 0.00 0.00 3.52 4.57 0.83 -1.50 114.58 122.00 2r0q h GLU 127 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2r0q h GLU 127 Cb 0.65 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.24 2r0q h GLU 127 CO 0.00 0.00 0.00 0.43 -1.18 0.00 0.00 179.01 178.26 2r0q n SER 128 N -4.07 0.00 -0.64 1.04 7.64 -1.26 -2.03 113.62 114.30 2r0q n SER 128 Ca 0.02 0.00 0.48 0.00 1.01 0.00 0.00 58.87 60.38 2r0q n SER 128 Cb 0.31 0.00 0.75 0.00 -1.01 0.00 0.00 64.21 64.26 2r0q n SER 128 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2r0q n LYS 129 N 0.00 -0.00 0.35 1.43 5.02 -1.21 -0.38 118.16 123.37 2r0q n LYS 129 Ca 0.00 1.03 -0.18 0.00 -2.02 0.00 0.00 58.31 57.14 2r0q n LYS 129 Cb 0.00 -2.33 -0.09 0.00 -0.02 0.00 0.00 35.03 32.59 2r0q n LYS 129 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 2r0q h ARG 130 N 0.00 -0.83 -0.16 1.97 2.43 -1.19 0.83 114.38 117.43 2r0q h ARG 130 Ca 0.87 0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 60.02 2r0q h ARG 130 Cb 3.42 0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 33.15 2r0q h ARG 130 CO -0.06 -0.55 -0.27 0.00 -1.51 0.00 0.00 179.97 177.58 2r0q h ARG 131 N -0.88 0.29 0.44 0.20 3.08 -0.10 0.22 114.38 117.64 2r0q h ARG 131 Ca -0.09 -0.10 -0.02 0.00 0.07 0.00 0.00 59.98 59.84 2r0q h ARG 131 Cb 0.67 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.70 2r0q h ARG 131 CO 0.14 0.54 -0.21 0.37 -1.07 0.00 0.00 179.97 179.74 2r0q h GLN 132 N 0.26 -0.57 -0.93 0.04 4.15 -1.00 0.13 115.11 117.18 2r0q h GLN 132 Ca 0.04 0.04 0.22 0.00 0.77 0.00 0.00 58.65 59.72 2r0q h GLN 132 Cb 0.61 0.13 -0.07 0.00 0.21 0.00 0.00 27.48 28.36 2r0q h GLN 132 CO 0.04 -0.38 0.62 0.00 -1.93 0.00 0.00 178.83 177.18 2r0q h ALA 133 N -1.65 2.28 0.00 3.38 0.00 0.74 0.29 119.26 124.30 2r0q h ALA 133 Ca -0.06 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2r0q h ALA 133 Cb 0.45 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2r0q h ALA 133 CO 0.10 -0.58 -0.00 0.37 0.00 0.00 0.00 179.25 179.14 2r0q h GLN 134 N 0.37 -0.00 -0.35 0.00 4.15 -0.32 -2.07 115.11 116.89 2r0q h GLN 134 Ca 0.49 0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.85 2r0q h GLN 134 Cb 1.29 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.97 2r0q h GLN 134 CO -0.18 0.07 -0.03 0.78 -1.93 0.00 0.00 178.83 177.53 2r0q h GLY 135 N -0.07 0.69 0.08 2.39 0.00 0.23 -2.77 103.07 103.62 2r0q h GLY 135 Ca -0.00 -0.53 0.01 0.00 0.00 0.00 0.00 47.33 46.81 2r0q h GLY 135 CO 0.00 0.49 -0.28 -2.22 0.00 0.00 0.00 176.54 174.53 2r0q h ILE 136 N 0.44 0.00 -0.88 2.60 2.04 -0.73 -1.99 117.51 118.99 2r0q h ILE 136 Ca 0.09 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.10 2r0q h ILE 136 Cb 0.50 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 36.43 2r0q h ILE 136 CO 0.02 0.00 -0.35 -0.61 0.00 0.00 0.00 178.15 177.22 2r0q h GLN 137 N -0.41 -0.04 -0.57 2.37 4.15 -1.39 0.60 115.11 119.81 2r0q h GLN 137 Ca -0.01 0.00 0.11 0.00 0.77 0.00 0.00 58.65 59.53 2r0q h GLN 137 Cb 0.41 0.01 -0.11 0.00 0.21 0.00 0.00 27.48 28.00 2r0q h GLN 137 CO -0.14 -0.03 -0.17 0.28 -1.93 0.00 0.00 178.83 176.84 2r0q h VAL 138 N -0.04 0.38 0.54 2.39 2.07 -1.18 -1.05 116.25 119.36 2r0q h VAL 138 Ca 0.33 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.83 2r0q h VAL 138 Cb 0.60 0.38 0.01 0.00 -1.52 0.00 0.00 31.29 30.75 2r0q h VAL 138 CO -0.90 0.00 -0.26 0.00 0.02 0.00 0.00 177.57 176.43 2r0q h ALA 139 N 1.50 -0.72 -0.45 1.67 0.00 0.63 -2.20 119.26 119.68 2r0q h ALA 139 Ca 0.27 -0.18 0.13 0.00 0.00 0.00 0.00 54.91 55.13 2r0q h ALA 139 Cb 0.45 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 2r0q h ALA 139 CO -0.61 -0.83 0.79 -0.22 0.00 0.00 0.00 179.25 178.38 2r0q h LYS 140 N -0.86 0.00 0.11 0.00 3.64 0.56 2.15 116.57 122.17 2r0q h LYS 140 Ca -0.07 0.00 -0.30 0.00 -1.27 0.00 0.00 60.65 59.01 2r0q h LYS 140 Cb 0.61 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.42 2r0q h LYS 140 CO 0.12 0.00 -1.49 1.49 -2.27 0.00 0.00 179.45 177.30 2r0q h GLU 141 N 0.00 0.23 0.00 1.90 4.81 -0.63 -3.21 114.58 117.68 2r0q h GLU 141 Ca 0.22 -0.39 0.00 0.00 -0.13 0.00 0.00 59.36 59.06 2r0q h GLU 141 Cb 1.79 0.14 0.00 0.00 0.63 0.00 0.00 28.75 31.31 2r0q h GLU 141 CO -0.00 1.09 0.00 1.63 -0.73 0.00 0.00 179.01 181.00 2r0q n LYS 142 N -3.43 0.65 -2.98 1.92 5.02 0.72 -4.89 118.16 115.16 2r0q n LYS 142 Ca -0.15 0.02 -0.12 0.00 -2.02 0.00 0.00 58.31 56.03 2r0q n LYS 142 Cb 1.04 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 34.61 2r0q n LYS 142 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2r0q n GLY 143 N 0.55 -0.51 0.11 0.72 0.00 -0.66 -4.99 105.19 100.42 2r0q n GLY 143 Ca 0.16 0.23 -0.18 0.00 0.00 0.00 0.00 46.02 46.24 2r0q n GLY 143 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2r0q n VAL 144 N -3.11 1.51 -1.62 1.61 0.31 -1.22 -4.88 118.33 110.94 2r0q n VAL 144 Ca -0.13 -0.08 -0.49 0.00 -0.01 0.00 0.00 64.34 63.64 2r0q n VAL 144 Cb 0.61 -2.16 -0.05 0.00 -0.91 0.00 0.00 33.84 31.33 2r0q n VAL 144 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 2r0q n TYR 145 N -4.37 2.09 -2.17 3.52 4.01 -1.26 -4.84 117.16 114.14 2r0q n TYR 145 Ca -0.31 0.06 -0.05 0.00 -0.16 0.00 0.00 57.90 57.45 2r0q n TYR 145 Cb 0.67 -2.64 0.08 0.00 -0.31 0.00 0.00 39.34 37.15 2r0q n TYR 145 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2r0q n LYS 146 N 7.30 1.90 0.00 -0.72 5.02 -1.26 -5.07 118.16 125.32 2r0q n LYS 146 Ca 0.28 -3.34 0.00 0.00 -2.02 0.00 0.00 58.31 53.23 2r0q n LYS 146 Cb 0.29 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.82 2r0q n LYS 146 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2r0q n GLY 147 N -0.56 0.65 3.80 0.72 0.00 -1.26 -4.71 105.19 103.83 2r0q n GLY 147 Ca 0.21 -0.78 -0.38 0.00 0.00 0.00 0.00 46.02 45.07 2r0q n GLY 147 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2r0q s ARG 148 N 0.00 4.15 0.66 1.61 3.52 -1.26 -5.08 118.95 122.55 2r0q s ARG 148 Ca 0.00 0.60 -0.04 0.00 -0.13 0.00 0.00 55.73 56.16 2r0q s ARG 148 Cb 0.00 -3.28 0.05 0.00 -1.56 0.00 0.00 34.95 30.17 2r0q s ARG 148 CO 0.00 0.55 0.94 -2.14 -0.81 0.00 0.00 175.30 173.84 2r0q s PRO 149 N -0.72 2.29 0.31 5.12 0.02 -1.26 -4.99 135.00 135.76 2r0q s PRO 149 Ca 0.27 -0.43 -0.29 0.00 0.02 0.00 0.00 61.00 60.58 2r0q s PRO 149 Cb -0.18 -2.27 -0.12 0.00 0.02 0.00 0.00 34.50 31.95 2r0q s PRO 149 CO 0.16 -1.09 1.38 1.28 -0.33 0.00 0.00 177.00 178.40 2r0q n LEU 150 N -2.75 3.61 -0.00 -5.54 4.77 -1.26 -4.90 117.00 110.93 2r0q n LEU 150 Ca 0.08 1.18 -0.05 0.00 -0.03 0.00 0.00 56.01 57.19 2r0q n LEU 150 Cb 0.60 -1.49 -0.12 0.00 -2.33 0.00 0.00 43.42 40.08 2r0q n LEU 150 CO 0.50 -0.36 -0.47 0.18 -1.33 0.00 0.00 177.39 175.91 2r0q n LEU 151 N 1.35 0.80 -3.92 2.23 4.32 -1.26 -4.73 117.00 115.79 2r0q n LEU 151 Ca 0.07 0.37 -0.30 0.00 -0.02 0.00 0.00 56.01 56.13 2r0q n LEU 151 Cb 0.35 0.15 -0.16 0.00 -1.62 0.00 0.00 43.42 42.14 2r0q n LEU 151 CO 0.63 0.29 -0.41 -0.31 -1.22 0.00 0.00 177.39 176.37 2r0q s TYR 152 N -2.74 2.37 0.00 -1.77 1.51 -1.26 -4.76 117.35 110.70 2r0q s TYR 152 Ca -0.04 -1.79 0.00 0.00 -1.01 0.00 0.00 57.07 54.22 2r0q s TYR 152 Cb 0.08 -1.65 0.00 0.00 -0.11 0.00 0.00 41.96 40.28 2r0q s TYR 152 CO 0.82 -0.79 0.00 -1.13 -1.11 0.00 0.00 175.55 173.35 2r0q n SER 153 N 4.67 0.00 -4.42 2.29 3.41 -1.26 -4.93 113.62 113.39 2r0q n SER 153 Ca -0.10 0.00 -0.28 0.00 -0.26 0.00 0.00 58.87 58.23 2r0q n SER 153 Cb 0.44 0.00 0.27 0.00 -0.26 0.00 0.00 64.21 64.66 2r0q n SER 153 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 2r0q s PRO 154 N -2.00 -1.32 0.00 4.33 0.04 -1.26 -2.15 135.00 132.64 2r0q s PRO 154 Ca 0.00 0.80 0.00 0.00 0.04 0.00 0.00 61.00 61.84 2r0q s PRO 154 Cb 0.00 -1.51 0.00 0.00 0.04 0.00 0.00 34.50 33.03 2r0q s PRO 154 CO 0.00 -3.98 0.00 0.09 0.04 0.00 0.00 177.00 173.15 2r0q n ASN 155 N -5.09 0.00 -2.82 6.66 3.02 -1.26 -4.95 115.26 110.82 2r0q n ASN 155 Ca 0.02 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.25 2r0q n ASN 155 Cb 0.54 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.69 2r0q n ASN 155 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2r0q n ALA 156 N 0.00 -2.26 -0.63 5.41 0.00 -0.91 -4.85 120.51 117.26 2r0q n ALA 156 Ca 0.00 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.74 2r0q n ALA 156 Cb 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.40 2r0q n ALA 156 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2r0q n LYS 157 N 0.70 0.00 -1.80 0.00 4.81 -1.26 -4.30 118.16 116.31 2r0q n LYS 157 Ca 0.12 0.61 -0.43 0.00 -0.87 0.00 0.00 58.31 57.74 2r0q n LYS 157 Cb 0.14 -1.07 -0.03 0.00 0.02 0.00 0.00 35.03 34.09 2r0q n LYS 157 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 2r0q s ASP 158 N -2.85 6.02 0.36 3.14 -1.08 -1.26 -4.89 116.67 116.11 2r0q s ASP 158 Ca 0.00 1.98 0.11 0.00 -0.52 0.00 0.00 52.55 54.13 2r0q s ASP 158 Cb 0.00 -2.52 0.90 0.00 -1.46 0.00 0.00 42.92 39.84 2r0q s ASP 158 CO 0.00 -1.50 1.83 -0.65 0.52 0.00 0.00 175.17 175.37 2r0q h PRO 159 N 12.46 0.59 -0.23 4.34 0.11 -1.96 -2.00 132.00 145.31 2r0q h PRO 159 Ca -0.41 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.66 2r0q h PRO 159 Cb 1.21 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 2r0q h PRO 159 CO 0.97 0.39 0.12 1.96 -0.21 0.00 0.00 178.00 181.23 2r0q h GLN 160 N 0.60 0.33 -0.48 1.05 4.20 -1.93 -0.55 115.11 118.33 2r0q h GLN 160 Ca 0.51 -0.04 0.03 0.00 0.06 0.00 0.00 58.65 59.20 2r0q h GLN 160 Cb 0.98 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.67 2r0q h GLN 160 CO -0.25 0.32 0.32 0.87 -0.67 0.00 0.00 178.83 179.41 2r0q h LYS 161 N 0.26 0.52 -0.23 1.46 1.57 -1.69 0.25 116.57 118.71 2r0q h LYS 161 Ca 0.08 -0.03 0.05 0.00 -1.87 0.00 0.00 60.65 58.88 2r0q h LYS 161 Cb 0.09 -0.12 -0.06 0.00 0.08 0.00 0.00 32.23 32.22 2r0q h LYS 161 CO -0.01 0.35 -0.13 0.00 -0.57 0.00 0.00 179.45 179.08 2r0q h ARG 162 N 0.54 -0.11 -0.40 3.15 3.08 -0.89 0.35 114.38 120.10 2r0q h ARG 162 Ca 0.19 0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.32 2r0q h ARG 162 Cb 0.10 0.03 -0.07 0.00 0.08 0.00 0.00 29.97 30.11 2r0q h ARG 162 CO -0.05 -0.07 -0.01 0.28 -1.07 0.00 0.00 179.97 179.05 2r0q h VAL 163 N -0.12 0.69 0.05 2.04 2.07 0.25 -1.66 116.25 119.57 2r0q h VAL 163 Ca 0.13 -0.03 0.02 0.00 0.82 0.00 0.00 66.70 67.63 2r0q h VAL 163 Cb 0.31 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 2r0q h VAL 163 CO -0.30 0.02 -0.17 0.40 0.02 0.00 0.00 177.57 177.54 2r0q h ILE 164 N 0.09 0.60 -0.76 4.57 2.04 0.70 -2.11 117.51 122.65 2r0q h ILE 164 Ca 0.20 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.15 2r0q h ILE 164 Cb 0.28 0.60 -0.11 0.00 -0.74 0.00 0.00 36.82 36.85 2r0q h ILE 164 CO -0.34 0.00 -0.51 0.22 0.00 0.00 0.00 178.15 177.52 2r0q h TYR 165 N -0.30 -1.57 -0.32 1.37 3.20 0.51 -0.18 116.97 119.68 2r0q h TYR 165 Ca 0.04 0.10 0.07 0.00 3.14 0.00 0.00 58.73 62.08 2r0q h TYR 165 Cb 0.35 0.79 -0.07 0.00 1.54 0.00 0.00 36.73 39.34 2r0q h TYR 165 CO -0.19 -0.42 -0.12 0.45 -1.64 0.00 0.00 178.16 176.24 2r0q h HIS 166 N -0.14 -0.29 -0.95 -3.82 3.86 -1.08 -0.15 115.15 112.58 2r0q h HIS 166 Ca 0.18 0.03 0.12 0.00 -1.16 0.00 0.00 60.37 59.54 2r0q h HIS 166 Cb 0.52 0.18 -0.08 0.00 1.06 0.00 0.00 27.41 29.09 2r0q h HIS 166 CO -0.86 -0.19 0.60 -0.09 0.86 0.00 0.00 177.93 178.26 2r0q h ARG 167 N -0.06 0.86 0.30 2.45 9.65 -0.44 0.17 114.38 127.30 2r0q h ARG 167 Ca 0.16 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.99 2r0q h ARG 167 Cb 0.31 -0.19 -0.02 0.00 -1.39 0.00 0.00 29.97 28.67 2r0q h ARG 167 CO -0.36 0.57 -0.31 0.28 2.80 0.00 0.00 179.97 182.95 2r0q h VAL 168 N 0.89 0.34 0.05 0.20 2.07 0.61 0.47 116.25 120.88 2r0q h VAL 168 Ca 0.47 0.00 0.01 0.00 0.82 0.00 0.00 66.70 68.00 2r0q h VAL 168 Cb 0.53 0.34 -0.04 0.00 -1.52 0.00 0.00 31.29 30.60 2r0q h VAL 168 CO -0.23 0.00 -0.45 0.58 0.02 0.00 0.00 177.57 177.49 2r0q h VAL 169 N -0.65 0.00 -0.91 2.57 2.07 -0.38 -0.68 116.25 118.28 2r0q h VAL 169 Ca -0.01 0.00 0.22 0.00 0.82 0.00 0.00 66.70 67.73 2r0q h VAL 169 Cb 0.60 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.20 2r0q h VAL 169 CO -0.07 0.00 -0.06 -0.08 0.02 0.00 0.00 177.57 177.37 2r0q h GLU 170 N -0.61 0.03 0.00 1.57 4.81 -0.53 2.13 114.58 121.98 2r0q h GLU 170 Ca 0.00 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2r0q h GLU 170 Cb 0.63 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.00 2r0q h GLU 170 CO -0.27 0.02 0.00 0.52 -0.73 0.00 0.00 179.01 178.55 2r0q h MET 171 N 0.03 0.00 0.07 1.92 2.86 0.29 -0.15 114.93 119.95 2r0q h MET 171 Ca 0.50 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 58.02 2r0q h MET 171 Cb 0.92 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.58 2r0q h MET 171 CO -0.87 0.00 -0.57 -0.07 1.06 0.00 0.00 176.91 176.46 2r0q h LEU 172 N 0.00 0.23 -0.78 1.22 3.38 0.48 -1.51 115.31 118.33 2r0q h LEU 172 Ca 0.00 -0.93 -0.02 0.00 0.09 0.00 0.00 57.88 57.02 2r0q h LEU 172 Cb 0.29 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 2r0q h LEU 172 CO 0.00 1.26 0.41 -0.33 0.09 0.00 0.00 178.44 179.87 2r0q h GLU 173 N -0.67 1.10 0.00 1.13 5.08 -0.84 0.29 114.58 120.67 2r0q h GLU 173 Ca -0.12 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 2r0q h GLU 173 Cb 1.37 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.41 2r0q h GLU 173 CO 0.05 0.83 0.00 -1.91 -1.00 0.00 0.00 179.01 176.98 2r0q n GLU 174 N -4.41 0.08 -1.41 2.33 2.13 -0.10 -4.82 120.64 114.45 2r0q n GLU 174 Ca 0.07 0.16 -0.14 0.00 0.66 0.00 0.00 57.16 57.91 2r0q n GLU 174 Cb 0.11 -1.50 -0.06 0.00 0.27 0.00 0.00 31.44 30.26 2r0q n GLU 174 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2r0q n GLY 175 N -0.89 1.45 3.53 8.31 0.00 0.10 -5.01 105.19 112.67 2r0q n GLY 175 Ca 0.02 -0.32 -0.29 0.00 0.00 0.00 0.00 46.02 45.43 2r0q n GLY 175 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2r0q s GLN 176 N -3.16 -1.09 0.25 1.61 -0.21 -0.57 -5.00 119.66 111.49 2r0q s GLN 176 Ca 0.00 0.36 -0.14 0.00 0.02 0.00 0.00 55.36 55.60 2r0q s GLN 176 Cb 0.00 -1.57 -0.08 0.00 1.00 0.00 0.00 33.01 32.36 2r0q s GLN 176 CO 0.00 -3.72 0.65 0.00 -2.12 0.00 0.00 175.29 170.10 2r0q s ALA 177 N -2.70 3.45 0.01 6.09 0.00 -1.26 -4.86 121.76 122.48 2r0q s ALA 177 Ca 0.68 -0.06 -0.03 0.00 0.00 0.00 0.00 51.96 52.56 2r0q s ALA 177 Cb -0.17 -2.64 -0.01 0.00 0.00 0.00 0.00 23.12 20.30 2r0q s ALA 177 CO 0.59 0.40 1.04 0.82 0.00 0.00 0.00 175.76 178.62 2r0q h ILE 178 N 2.21 0.00 -0.87 0.00 1.08 -1.97 -1.40 117.51 116.56 2r0q h ILE 178 Ca -0.48 0.00 0.25 0.00 -0.39 0.00 0.00 64.86 64.24 2r0q h ILE 178 Cb 1.18 0.00 -0.16 0.00 -3.07 0.00 0.00 36.82 34.77 2r0q h ILE 178 CO 0.67 0.00 0.04 -1.20 -0.69 0.00 0.00 178.15 176.97 2r0q n SER 179 N -2.77 -0.08 -0.09 1.72 7.64 -1.26 0.13 113.62 118.91 2r0q n SER 179 Ca -0.01 1.48 -0.10 0.00 1.01 0.00 0.00 58.87 61.25 2r0q n SER 179 Cb 0.03 -0.55 -0.03 0.00 -1.01 0.00 0.00 64.21 62.65 2r0q n SER 179 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 2r0q h LYS 180 N 0.00 0.45 0.20 1.43 3.64 -1.85 -2.24 116.57 118.21 2r0q h LYS 180 Ca 0.54 -0.10 0.01 0.00 -1.27 0.00 0.00 60.65 59.83 2r0q h LYS 180 Cb 1.14 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.85 2r0q h LYS 180 CO -0.81 0.52 -0.47 0.82 -2.27 0.00 0.00 179.45 177.24 2r0q h ILE 181 N 0.30 0.08 -0.48 2.00 1.08 0.21 0.13 117.51 120.83 2r0q h ILE 181 Ca 0.09 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.61 2r0q h ILE 181 Cb 0.27 0.08 -0.07 0.00 -3.07 0.00 0.00 36.82 34.02 2r0q h ILE 181 CO -0.00 0.00 -0.40 0.00 -0.69 0.00 0.00 178.15 177.06 2r0q h ALA 182 N -0.43 -0.51 -0.98 1.87 0.00 -1.02 -0.08 119.26 118.11 2r0q h ALA 182 Ca -0.00 0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.02 2r0q h ALA 182 Cb 0.75 1.13 -0.07 0.00 0.00 0.00 0.00 17.79 19.60 2r0q h ALA 182 CO -0.22 -0.75 0.63 0.87 0.00 0.00 0.00 179.25 179.78 2r0q h LYS 183 N -0.14 1.09 0.00 0.00 1.57 -1.13 0.31 116.57 118.26 2r0q h LYS 183 Ca 0.08 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.75 2r0q h LYS 183 Cb 0.35 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 2r0q h LYS 183 CO -0.53 0.72 -0.20 1.49 -0.57 0.00 0.00 179.45 180.36 2r0q h GLU 184 N 1.12 0.00 -0.17 3.15 4.81 0.72 -2.95 114.58 121.26 2r0q h GLU 184 Ca 0.43 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.66 2r0q h GLU 184 Cb 0.21 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.59 2r0q h GLU 184 CO -0.19 0.20 0.00 0.28 -0.73 0.00 0.00 179.01 178.57 2r0q n VAL 185 N -3.92 0.77 -3.75 0.32 0.31 -0.19 -5.00 118.33 106.88 2r0q n VAL 185 Ca -0.02 -0.89 -0.23 0.00 -0.01 0.00 0.00 64.34 63.20 2r0q n VAL 185 Cb 0.29 0.65 0.02 0.00 -0.91 0.00 0.00 33.84 33.89 2r0q n VAL 185 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2r0q n ASN 186 N 0.20 -1.43 -4.40 4.52 5.15 0.10 -4.99 115.26 114.42 2r0q n ASN 186 Ca 0.07 -0.88 -0.20 0.00 -0.60 0.00 0.00 54.58 52.97 2r0q n ASN 186 Cb 0.32 -3.79 -0.10 0.00 -0.53 0.00 0.00 39.78 35.68 2r0q n ASN 186 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2r0q s ILE 187 N -3.72 1.12 0.37 -1.44 1.01 -0.78 -5.04 121.20 112.73 2r0q s ILE 187 Ca 0.05 -2.02 -0.14 0.00 0.00 0.00 0.00 60.65 58.54 2r0q s ILE 187 Cb -0.02 -2.60 -0.08 0.00 0.01 0.00 0.00 42.46 39.77 2r0q s ILE 187 CO 0.83 -0.13 0.79 -0.89 0.00 0.00 0.00 174.94 175.54 2r0q s THR 188 N -3.36 4.67 0.09 2.92 2.01 -1.26 -4.50 115.64 116.21 2r0q s THR 188 Ca 0.33 0.93 -0.27 0.00 0.31 0.00 0.00 61.69 63.00 2r0q s THR 188 Cb 0.07 -3.65 -0.15 0.00 0.01 0.00 0.00 72.50 68.78 2r0q s THR 188 CO 0.13 -0.33 1.69 0.03 -0.69 0.00 0.00 174.62 175.44 2r0q h ARG 189 N 1.83 -0.36 -0.92 4.92 3.08 -1.95 -1.47 114.38 119.51 2r0q h ARG 189 Ca -0.48 0.02 0.24 0.00 0.07 0.00 0.00 59.98 59.84 2r0q h ARG 189 Cb 1.18 0.08 -0.17 0.00 0.08 0.00 0.00 29.97 31.14 2r0q h ARG 189 CO 0.64 -0.24 0.04 0.37 -1.07 0.00 0.00 179.97 179.72 2r0q h GLN 190 N -0.37 0.06 -0.40 0.04 4.15 -1.99 0.68 115.11 117.28 2r0q h GLN 190 Ca -0.02 -0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.39 2r0q h GLN 190 Cb 0.31 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.97 2r0q h GLN 190 CO 0.02 0.04 0.23 1.15 -1.93 0.00 0.00 178.83 178.33 2r0q h THR 191 N 0.06 1.15 -0.41 2.39 2.02 -1.75 0.50 112.91 116.87 2r0q h THR 191 Ca 0.55 -0.37 0.01 0.00 0.77 0.00 0.00 66.41 67.36 2r0q h THR 191 Cb 1.09 0.66 -0.02 0.00 -1.74 0.00 0.00 68.15 68.13 2r0q h THR 191 CO -0.83 0.15 0.26 0.58 0.37 0.00 0.00 175.52 176.06 2r0q h VAL 192 N 0.52 1.09 -0.43 3.16 2.07 0.12 -0.70 116.25 122.09 2r0q h VAL 192 Ca 0.14 -0.19 0.07 0.00 0.82 0.00 0.00 66.70 67.55 2r0q h VAL 192 Cb 0.04 0.50 -0.06 0.00 -1.52 0.00 0.00 31.29 30.26 2r0q h VAL 192 CO -0.02 0.10 0.07 1.88 0.02 0.00 0.00 177.57 179.61 2r0q h TYR 193 N 0.54 0.10 -0.63 1.57 -1.99 -0.14 0.11 116.97 116.54 2r0q h TYR 193 Ca 0.15 0.03 0.12 0.00 2.00 0.00 0.00 58.73 61.03 2r0q h TYR 193 Cb -0.05 0.02 -0.09 0.00 2.00 0.00 0.00 36.73 38.61 2r0q h TYR 193 CO -0.05 -0.02 0.15 -0.09 -0.00 0.00 0.00 178.16 178.15 2r0q h ARG 194 N 0.19 0.28 -0.17 4.88 1.12 -0.01 0.39 114.38 121.07 2r0q h ARG 194 Ca 0.21 -0.02 -0.04 0.00 -1.11 0.00 0.00 59.98 59.03 2r0q h ARG 194 Cb 0.28 -0.06 -0.01 0.00 -0.01 0.00 0.00 29.97 30.16 2r0q h ARG 194 CO -0.30 0.18 -0.07 0.82 -3.11 0.00 0.00 179.97 177.50 2r0q h ILE 195 N 0.29 1.15 0.04 1.20 2.04 0.50 -2.20 117.51 120.53 2r0q h ILE 195 Ca 0.33 -0.65 -0.00 0.00 1.00 0.00 0.00 64.86 65.54 2r0q h ILE 195 Cb 0.49 1.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.68 2r0q h ILE 195 CO -0.40 0.21 -0.02 0.50 0.00 0.00 0.00 178.15 178.43 2r0q h LYS 196 N 0.25 -0.06 0.00 2.37 3.64 0.19 -2.20 116.57 120.76 2r0q h LYS 196 Ca 0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 2r0q h LYS 196 Cb 0.29 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 2r0q h LYS 196 CO 0.01 -0.04 0.00 0.72 -2.27 0.00 0.00 179.45 177.88 2r0q n HIS 197 N -2.28 0.00 -0.04 1.91 8.25 1.00 -0.07 115.22 123.99 2r0q n HIS 197 Ca -0.01 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.38 2r0q n HIS 197 Cb 0.02 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.09 2r0q n HIS 197 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 2r0q n ASP 198 N -0.56 2.86 -4.59 0.41 -0.08 -0.83 -4.96 116.55 108.80 2r0q n ASP 198 Ca 0.00 -0.02 -0.42 0.00 -1.51 0.00 0.00 54.79 52.84 2r0q n ASP 198 Cb 0.00 -0.16 -0.03 0.00 2.34 0.00 0.00 41.12 43.27 2r0q n ASP 198 CO 0.00 0.00 0.00 0.21 0.12 0.00 0.00 177.20 177.53 2r0q s ASN 199 N -5.02 5.73 0.00 1.67 3.84 0.90 -5.09 114.94 116.96 2r0q s ASN 199 Ca -0.12 1.18 0.00 0.00 0.21 0.00 0.00 52.86 54.13 2r0q s ASN 199 Cb 0.03 -2.52 0.00 0.00 -0.55 0.00 0.00 41.25 38.21 2r0q s ASN 199 CO 0.20 -1.86 0.00 0.61 -2.79 0.00 0.00 177.10 173.26