#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1obq s LYS 2 N 0.00 4.34 0.22 0.11 2.47 -1.26 -5.11 119.74 120.51 1obq s LYS 2 Ca 0.00 0.76 0.08 0.00 -1.56 0.00 0.00 55.97 55.25 1obq s LYS 2 Cb 0.00 -3.50 -0.05 0.00 -1.46 0.00 0.00 37.83 32.82 1obq s LYS 2 CO 0.00 -0.06 -0.13 0.96 0.16 0.00 0.00 175.35 176.28 1obq s ILE 3 N 1.26 1.74 0.63 5.43 -4.36 -1.26 -5.12 121.20 119.52 1obq s ILE 3 Ca 0.34 -2.20 -0.18 0.00 -0.26 0.00 0.00 60.65 58.34 1obq s ILE 3 Cb -0.17 -2.12 -0.03 0.00 1.25 0.00 0.00 42.46 41.40 1obq s ILE 3 CO 0.14 -0.54 1.11 -2.65 0.24 0.00 0.00 174.94 173.24 1obq n PRO 4 N -0.42 0.98 0.13 0.37 -0.02 -1.26 -4.87 135.00 129.91 1obq n PRO 4 Ca -0.07 0.38 0.12 0.00 -2.02 0.00 0.00 63.50 61.91 1obq n PRO 4 Cb 0.61 -2.33 0.49 0.00 -0.02 0.00 0.00 33.50 32.25 1obq n PRO 4 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1obq n ASP 5 N -1.31 0.63 -0.84 2.55 5.68 -1.26 -2.08 116.55 119.91 1obq n ASP 5 Ca 0.15 0.67 0.09 0.00 -0.50 0.00 0.00 54.79 55.20 1obq n ASP 5 Cb 0.48 -0.80 0.26 0.00 -1.14 0.00 0.00 41.12 39.92 1obq n ASP 5 CO 0.00 0.00 0.00 2.22 -1.33 0.00 0.00 177.20 178.09 1obq n PHE 6 N -2.21 0.51 -3.79 2.11 1.16 -1.26 -4.73 117.46 109.25 1obq n PHE 6 Ca 0.02 -0.25 -0.37 0.00 -1.87 0.00 0.00 57.45 54.97 1obq n PHE 6 Cb 0.20 0.00 -0.13 0.00 -1.61 0.00 0.00 39.48 37.95 1obq n PHE 6 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 1obq s VAL 7 N -1.49 3.71 -0.05 1.97 1.01 -0.88 -3.47 120.40 121.20 1obq s VAL 7 Ca 0.33 -0.95 0.04 0.00 0.00 0.00 0.00 61.98 61.40 1obq s VAL 7 Cb 0.18 -3.00 0.00 0.00 0.00 0.00 0.00 36.38 33.56 1obq s VAL 7 CO 0.25 -0.02 -0.15 -0.69 0.00 0.00 0.00 175.10 174.48 1obq s VAL 8 N 1.43 1.32 0.48 2.92 1.01 0.05 -4.78 120.40 122.82 1obq s VAL 8 Ca 0.00 -0.64 -0.24 0.00 0.00 0.00 0.00 61.98 61.11 1obq s VAL 8 Cb -0.18 -1.15 -0.07 0.00 0.00 0.00 0.00 36.38 34.98 1obq s VAL 8 CO 0.02 0.39 1.36 -2.65 0.00 0.00 0.00 175.10 174.21 1obq n PRO 9 N 3.33 1.95 0.00 2.72 -0.02 -1.26 -0.87 135.00 140.84 1obq n PRO 9 Ca -0.19 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 1obq n PRO 9 Cb 0.53 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 1obq n PRO 9 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1obq n GLY 10 N 0.72 0.72 3.93 -1.23 0.00 0.33 -4.75 105.19 104.91 1obq n GLY 10 Ca 0.08 -2.16 -0.27 0.00 0.00 0.00 0.00 46.02 43.67 1obq n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1obq s LYS 11 N -1.15 3.52 0.39 1.61 1.02 -1.26 -2.83 119.74 121.03 1obq s LYS 11 Ca 0.00 -0.35 -0.24 0.00 0.02 0.00 0.00 55.97 55.40 1obq s LYS 11 Cb 0.00 -2.83 -0.12 0.00 -0.52 0.00 0.00 37.83 34.36 1obq s LYS 11 CO 0.00 0.39 0.84 0.00 -0.92 0.00 0.00 175.35 175.66 1obq s ALA 13 N -1.28 2.48 0.10 0.00 0.00 -1.26 -4.98 121.76 116.81 1obq s ALA 13 Ca 0.62 0.67 -0.25 0.00 0.00 0.00 0.00 51.96 53.01 1obq s ALA 13 Cb -0.61 -3.35 -0.12 0.00 0.00 0.00 0.00 23.12 19.04 1obq s ALA 13 CO 0.58 -1.24 1.69 1.03 0.00 0.00 0.00 175.76 177.82 1obq h SER 14 N 0.28 -0.31 -4.50 0.00 0.87 -1.94 -3.49 113.55 104.46 1obq h SER 14 Ca -0.48 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.12 1obq h SER 14 Cb 1.26 0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 63.33 1obq h SER 14 CO 0.54 -0.17 -0.62 0.52 -0.53 0.00 0.00 176.83 176.57 1obq n VAL 15 N -5.24 -8.25 -1.58 2.23 0.31 -1.26 -4.52 118.33 100.02 1obq n VAL 15 Ca -0.07 1.94 -0.36 0.00 -0.01 0.00 0.00 64.34 65.84 1obq n VAL 15 Cb 0.16 -4.35 -0.06 0.00 -0.91 0.00 0.00 33.84 28.68 1obq n VAL 15 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1obq n ASP 16 N 1.92 2.75 0.03 4.52 -0.08 -1.26 -4.70 116.55 119.73 1obq n ASP 16 Ca -0.01 -2.68 -0.00 0.00 -1.51 0.00 0.00 54.79 50.58 1obq n ASP 16 Cb 0.02 -1.40 0.30 0.00 2.34 0.00 0.00 41.12 42.38 1obq n ASP 16 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 1obq h ARG 17 N 8.84 0.44 -0.24 -0.67 3.08 -1.88 -2.68 114.38 121.27 1obq h ARG 17 Ca 0.32 -0.11 -0.09 0.00 0.07 0.00 0.00 59.98 60.17 1obq h ARG 17 Cb 0.80 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.78 1obq h ARG 17 CO 1.61 0.54 -0.22 -0.91 -1.07 0.00 0.00 179.97 179.91 1obq h ASN 18 N 0.42 0.43 -0.18 7.04 2.35 -1.84 1.00 115.58 124.81 1obq h ASN 18 Ca 0.08 -0.13 -0.03 0.00 -0.55 0.00 0.00 56.30 55.67 1obq h ASN 18 Cb 0.40 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.65 1obq h ASN 18 CO 0.02 0.66 -0.01 0.50 -1.65 0.00 0.00 177.43 176.95 1obq h LYS 19 N 0.39 0.31 -0.50 0.81 3.64 -1.88 -2.74 116.57 116.60 1obq h LYS 19 Ca 0.06 -0.10 -0.10 0.00 -1.27 0.00 0.00 60.65 59.24 1obq h LYS 19 Cb 0.60 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.38 1obq h LYS 19 CO 0.04 0.54 -0.09 -0.07 -2.27 0.00 0.00 179.45 177.60 1obq h LEU 20 N 0.06 0.94 -0.56 5.20 3.38 -1.31 -1.96 115.31 121.06 1obq h LEU 20 Ca 0.05 -0.35 0.02 0.00 0.09 0.00 0.00 57.88 57.69 1obq h LEU 20 Cb 0.40 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 1obq h LEU 20 CO 0.01 1.07 0.35 -0.25 0.09 0.00 0.00 178.44 179.71 1obq h TRP 21 N 0.80 0.65 -0.51 1.13 2.91 -0.78 0.03 115.95 120.18 1obq h TRP 21 Ca 0.13 0.02 -0.09 0.00 1.13 0.00 0.00 58.89 60.08 1obq h TRP 21 Cb 0.64 -0.21 -0.02 0.00 -0.51 0.00 0.00 29.16 29.06 1obq h TRP 21 CO 0.05 0.37 -0.05 0.00 -1.03 0.00 0.00 178.44 177.78 1obq h ALA 22 N 1.24 0.95 -0.23 2.65 0.00 -1.32 0.15 119.26 122.71 1obq h ALA 22 Ca 0.23 -0.31 -0.15 0.00 0.00 0.00 0.00 54.91 54.67 1obq h ALA 22 Cb 0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1obq h ALA 22 CO -0.09 0.62 -0.49 0.93 0.00 0.00 0.00 179.25 180.22 1obq h GLU 23 N 0.82 0.62 0.00 0.00 5.08 -1.00 -3.35 114.58 116.75 1obq h GLU 23 Ca 0.15 -0.36 -0.23 0.00 -1.00 0.00 0.00 59.36 57.92 1obq h GLU 23 Cb 0.55 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.79 1obq h GLU 23 CO 0.03 0.97 -1.55 1.96 -1.00 0.00 0.00 179.01 179.42 1obq h GLN 24 N 0.49 0.00 -0.98 2.33 4.20 -0.80 -3.40 115.11 116.95 1obq h GLN 24 Ca 0.02 0.00 0.10 0.00 0.06 0.00 0.00 58.65 58.84 1obq h GLN 24 Cb 1.03 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 28.74 1obq h GLN 24 CO 0.10 0.39 0.63 1.15 -0.67 0.00 0.00 178.83 180.43 1obq h THR 25 N 0.00 0.97 0.00 -0.54 2.02 -1.10 -1.95 112.91 112.31 1obq h THR 25 Ca -0.22 -0.35 0.00 0.00 0.77 0.00 0.00 66.41 66.61 1obq h THR 25 Cb 1.80 -0.13 0.00 0.00 -1.74 0.00 0.00 68.15 68.07 1obq h THR 25 CO 0.06 0.18 -0.03 -2.65 0.37 0.00 0.00 175.52 173.46 1obq n PRO 26 N -4.57 0.04 -0.62 6.66 -0.02 -1.26 -3.84 135.00 131.38 1obq n PRO 26 Ca 0.17 0.03 0.08 0.00 -2.02 0.00 0.00 63.50 61.77 1obq n PRO 26 Cb 0.31 -1.54 0.34 0.00 -0.02 0.00 0.00 33.50 32.59 1obq n PRO 26 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1obq n ASN 27 N -1.60 4.70 -0.28 2.55 3.02 -0.74 -4.73 115.26 118.18 1obq n ASN 27 Ca 0.07 -2.61 0.00 0.00 -0.03 0.00 0.00 54.58 52.01 1obq n ASN 27 Cb 0.35 -0.57 0.13 0.00 -0.61 0.00 0.00 39.78 39.08 1obq n ASN 27 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 1obq h ARG 28 N 3.53 0.83 -0.60 3.52 2.47 -1.66 0.26 114.38 122.74 1obq h ARG 28 Ca 0.00 -0.05 0.08 0.00 -1.26 0.00 0.00 59.98 58.75 1obq h ARG 28 Cb 1.51 -0.19 -0.04 0.00 -1.65 0.00 0.00 29.97 29.61 1obq h ARG 28 CO 0.27 0.55 0.40 -0.91 0.56 0.00 0.00 179.97 180.84 1obq h ASN 29 N 0.86 0.45 1.10 7.04 2.35 -1.92 -1.14 115.58 124.32 1obq h ASN 29 Ca 0.35 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.10 1obq h ASN 29 Cb 0.19 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.47 1obq h ASN 29 CO -0.18 0.29 0.00 0.28 -1.65 0.00 0.00 177.43 176.17 1obq h SER 30 N 0.51 0.00 1.37 5.81 0.02 -1.31 -2.65 113.55 117.31 1obq h SER 30 Ca 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 1obq h SER 30 Cb 0.39 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.93 1obq h SER 30 CO -0.08 0.00 -0.25 0.22 -1.14 0.00 0.00 176.83 175.58 1obq h TYR 31 N 0.00 0.00 -3.47 3.45 3.20 -1.12 -3.46 116.97 115.58 1obq h TYR 31 Ca 0.00 0.00 -0.41 0.00 3.14 0.00 0.00 58.73 61.46 1obq h TYR 31 Cb 0.55 0.00 0.20 0.00 1.54 0.00 0.00 36.73 39.02 1obq h TYR 31 CO 0.00 0.00 0.14 0.00 -1.64 0.00 0.00 178.16 176.66 1obq s ALA 32 N -3.16 0.66 0.00 1.82 0.00 -1.00 -4.89 121.76 115.19 1obq s ALA 32 Ca 0.08 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 50.97 1obq s ALA 32 Cb 0.11 -2.84 0.00 0.00 0.00 0.00 0.00 23.12 20.40 1obq s ALA 32 CO 0.66 -3.65 0.00 0.41 0.00 0.00 0.00 175.76 173.18 1obq n GLY 33 N -1.12 -1.15 3.70 0.00 0.00 0.00 -4.91 105.19 101.71 1obq n GLY 33 Ca 0.15 -1.95 -0.35 0.00 0.00 0.00 0.00 46.02 43.87 1obq n GLY 33 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1obq s VAL 34 N 0.00 4.98 -0.05 1.61 1.01 -1.26 0.29 120.40 126.97 1obq s VAL 34 Ca 0.00 0.03 0.03 0.00 0.00 0.00 0.00 61.98 62.04 1obq s VAL 34 Cb 0.00 -3.22 0.01 0.00 0.00 0.00 0.00 36.38 33.17 1obq s VAL 34 CO 0.00 0.50 -0.13 0.26 0.00 0.00 0.00 175.10 175.73 1obq s TRP 35 N -0.02 1.45 -0.06 5.22 0.52 0.11 -4.66 118.94 121.50 1obq s TRP 35 Ca 0.07 -0.48 -0.13 0.00 0.02 0.00 0.00 56.10 55.59 1obq s TRP 35 Cb -0.12 -1.03 -0.05 0.00 -1.15 0.00 0.00 33.47 31.12 1obq s TRP 35 CO 0.01 -0.22 0.32 0.71 0.02 0.00 0.00 176.95 177.79 1obq s TYR 36 N 0.40 3.65 -0.40 -1.98 1.51 0.80 0.32 117.35 121.66 1obq s TYR 36 Ca -0.10 0.81 -0.29 0.00 -1.01 0.00 0.00 57.07 56.48 1obq s TYR 36 Cb -0.13 -2.21 0.02 0.00 -0.11 0.00 0.00 41.96 39.53 1obq s TYR 36 CO 0.03 0.60 1.15 -1.14 -1.11 0.00 0.00 175.55 175.08 1obq s GLN 37 N -0.80 3.86 0.02 -0.62 0.74 -0.76 -1.03 119.66 121.07 1obq s GLN 37 Ca 0.20 0.84 -0.09 0.00 0.05 0.00 0.00 55.36 56.37 1obq s GLN 37 Cb -0.15 -3.85 -0.31 0.00 1.10 0.00 0.00 33.01 29.80 1obq s GLN 37 CO 0.09 -1.19 0.92 0.35 -0.55 0.00 0.00 175.29 174.91 1obq h PHE 38 N 8.89 0.68 -2.69 1.67 3.57 -1.01 -3.42 116.94 124.64 1obq h PHE 38 Ca -0.23 -0.50 0.02 0.00 3.53 0.00 0.00 57.97 60.80 1obq h PHE 38 Cb 1.07 -0.03 -0.14 0.00 2.79 0.00 0.00 35.95 39.64 1obq h PHE 38 CO 0.91 1.48 0.30 0.00 -2.23 0.00 0.00 178.31 178.78 1obq s ALA 39 N -2.61 -1.69 0.10 2.41 0.00 -1.09 -1.24 121.76 117.64 1obq s ALA 39 Ca -0.09 0.73 -0.17 0.00 0.00 0.00 0.00 51.96 52.43 1obq s ALA 39 Cb 0.06 0.66 0.03 0.00 0.00 0.00 0.00 23.12 23.87 1obq s ALA 39 CO 0.89 -0.71 0.40 -0.48 0.00 0.00 0.00 175.76 175.86 1obq s LEU 40 N -2.54 0.43 0.48 0.00 2.34 -0.81 -0.90 118.68 117.67 1obq s LEU 40 Ca 0.01 -0.22 -0.14 0.00 0.06 0.00 0.00 54.13 53.85 1obq s LEU 40 Cb -0.01 1.79 -0.07 0.00 -0.56 0.00 0.00 46.19 47.34 1obq s LEU 40 CO -0.10 -0.79 0.90 0.42 -1.06 0.00 0.00 176.35 175.72 1obq s THR 41 N -3.37 4.65 -0.16 5.48 -4.23 -0.63 -0.63 115.64 116.76 1obq s THR 41 Ca 0.00 0.95 -0.41 0.00 -1.18 0.00 0.00 61.69 61.05 1obq s THR 41 Cb 0.01 -3.74 -0.18 0.00 1.34 0.00 0.00 72.50 69.93 1obq s THR 41 CO -0.09 -0.65 1.43 -3.20 -0.54 0.00 0.00 174.62 171.57 1obq n ASN 42 N -1.54 1.30 -3.55 3.99 5.15 -1.26 -4.70 115.26 114.66 1obq n ASN 42 Ca 0.05 1.13 -0.23 0.00 -0.60 0.00 0.00 54.58 54.94 1obq n ASN 42 Cb 0.54 -1.04 -0.15 0.00 -0.53 0.00 0.00 39.78 38.60 1obq n ASN 42 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 1obq s ASN 43 N 1.70 2.00 0.00 1.20 3.84 -1.26 -4.84 114.94 117.58 1obq s ASN 43 Ca 0.94 -0.50 0.30 0.00 0.21 0.00 0.00 52.86 53.81 1obq s ASN 43 Cb -1.19 0.04 1.74 0.00 -0.55 0.00 0.00 41.25 41.28 1obq s ASN 43 CO 0.62 -0.35 2.09 -0.81 -2.79 0.00 0.00 177.10 175.87 1obq n PRO 44 N 5.30 0.88 -0.00 0.43 -0.04 -1.26 -3.45 135.00 136.84 1obq n PRO 44 Ca -0.06 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.50 1obq n PRO 44 Cb 0.49 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.31 1obq n PRO 44 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1obq n TYR 45 N -1.03 0.00 -2.70 0.54 4.01 -1.26 -4.91 117.16 111.81 1obq n TYR 45 Ca 0.21 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.53 1obq n TYR 45 Cb 0.11 -0.23 -0.03 0.00 -0.31 0.00 0.00 39.34 38.89 1obq n TYR 45 CO 0.00 0.00 0.00 -1.14 -0.46 0.00 0.00 176.86 175.26 1obq s GLN 46 N -3.14 4.03 0.12 -0.72 2.00 -1.22 -4.91 119.66 115.82 1obq s GLN 46 Ca 0.00 0.95 0.25 0.00 -2.00 0.00 0.00 55.36 54.57 1obq s GLN 46 Cb 0.14 -3.74 0.57 0.00 0.80 0.00 0.00 33.01 30.78 1obq s GLN 46 CO 0.83 -0.87 1.52 1.28 -0.50 0.00 0.00 175.29 177.54 1obq n LEU 47 N 6.76 0.66 -4.52 3.68 4.77 -1.26 -4.77 117.00 122.31 1obq n LEU 47 Ca 0.10 0.33 -0.39 0.00 -0.03 0.00 0.00 56.01 56.03 1obq n LEU 47 Cb 0.47 -0.26 -0.11 0.00 -2.33 0.00 0.00 43.42 41.20 1obq n LEU 47 CO 0.58 -0.07 -0.18 -0.63 -1.33 0.00 0.00 177.39 175.76 1obq s ILE 48 N -3.12 5.03 -0.16 -0.08 1.01 -1.26 -3.40 121.20 119.22 1obq s ILE 48 Ca 0.09 -0.10 -0.18 0.00 0.00 0.00 0.00 60.65 60.45 1obq s ILE 48 Cb 0.14 -3.48 -0.23 0.00 0.01 0.00 0.00 42.46 38.90 1obq s ILE 48 CO 0.67 0.15 0.39 -0.08 0.00 0.00 0.00 174.94 176.07 1obq h GLU 49 N 8.38 0.12 -5.05 2.79 4.81 -1.17 -3.47 114.58 120.99 1obq h GLU 49 Ca -0.34 -0.20 -0.33 0.00 -0.13 0.00 0.00 59.36 58.36 1obq h GLU 49 Cb 1.17 0.07 -0.15 0.00 0.63 0.00 0.00 28.75 30.48 1obq h GLU 49 CO 0.59 1.10 -0.70 0.15 -0.73 0.00 0.00 179.01 179.42 1obq s LYS 50 N -2.42 1.11 -1.61 1.92 1.02 -0.91 -4.59 119.74 114.27 1obq s LYS 50 Ca -0.24 -1.50 -0.02 0.00 0.02 0.00 0.00 55.97 54.22 1obq s LYS 50 Cb 0.05 -0.60 0.00 0.00 -0.52 0.00 0.00 37.83 36.76 1obq s LYS 50 CO 0.68 0.03 0.33 0.00 -0.92 0.00 0.00 175.35 175.47 1obq s VAL 52 N -3.10 3.80 -0.14 0.00 1.01 -1.26 -4.26 120.40 116.46 1obq s VAL 52 Ca 0.16 0.96 -0.01 0.00 0.00 0.00 0.00 61.98 63.10 1obq s VAL 52 Cb -0.07 -3.64 0.04 0.00 0.00 0.00 0.00 36.38 32.71 1obq s VAL 52 CO 0.20 -0.10 -0.02 -0.60 0.00 0.00 0.00 175.10 174.58 1obq s ARG 53 N 3.92 1.06 -0.26 2.72 3.52 -0.15 -1.83 118.95 127.93 1obq s ARG 53 Ca 0.68 -0.28 -0.07 0.00 -0.13 0.00 0.00 55.73 55.92 1obq s ARG 53 Cb -0.29 -1.68 -0.02 0.00 -1.56 0.00 0.00 34.95 31.41 1obq s ARG 53 CO 0.25 -0.41 0.07 -0.80 -0.81 0.00 0.00 175.30 173.60 1obq s ASN 54 N 1.78 5.09 -0.30 -2.12 0.01 0.15 -1.26 114.94 118.29 1obq s ASN 54 Ca 0.02 -0.37 -0.10 0.00 -0.71 0.00 0.00 52.86 51.70 1obq s ASN 54 Cb -0.14 -1.90 -0.02 0.00 0.41 0.00 0.00 41.25 39.59 1obq s ASN 54 CO -0.07 -0.08 0.17 -0.70 -1.51 0.00 0.00 177.10 174.90 1obq s GLU 55 N 1.58 3.53 -0.17 -0.60 2.12 -0.37 -0.71 118.70 124.08 1obq s GLU 55 Ca 0.05 -0.59 -0.06 0.00 0.36 0.00 0.00 54.97 54.73 1obq s GLU 55 Cb -0.16 -3.60 -0.04 0.00 0.26 0.00 0.00 34.13 30.59 1obq s GLU 55 CO 0.03 -0.35 0.03 0.71 -0.54 0.00 0.00 175.26 175.14 1obq s TYR 56 N 1.67 3.19 -0.05 5.30 1.51 0.14 -0.76 117.35 128.35 1obq s TYR 56 Ca 0.06 -0.01 0.07 0.00 -1.01 0.00 0.00 57.07 56.17 1obq s TYR 56 Cb -0.17 -2.02 -0.01 0.00 -0.11 0.00 0.00 41.96 39.65 1obq s TYR 56 CO 0.08 0.14 -0.25 -1.12 -1.11 0.00 0.00 175.55 173.28 1obq s SER 57 N 0.24 3.04 -0.14 2.29 0.01 -0.09 -0.82 113.70 118.24 1obq s SER 57 Ca 0.02 -0.50 -0.01 0.00 1.31 0.00 0.00 55.95 56.77 1obq s SER 57 Cb -0.13 -0.69 -0.02 0.00 0.21 0.00 0.00 66.02 65.39 1obq s SER 57 CO 0.01 0.26 -0.09 0.12 0.41 0.00 0.00 173.24 173.95 1obq s PHE 58 N -0.29 2.90 -1.29 2.43 5.36 -1.26 -0.51 117.98 125.32 1obq s PHE 58 Ca 0.00 -0.49 0.16 0.00 -0.96 0.00 0.00 56.93 55.64 1obq s PHE 58 Cb -0.13 -1.88 0.46 0.00 -0.34 0.00 0.00 43.02 41.13 1obq s PHE 58 CO 0.02 -0.13 1.38 -0.40 -1.46 0.00 0.00 175.22 174.64 1obq n ASP 59 N 3.49 3.43 0.00 6.13 5.68 -0.10 -4.92 116.55 130.26 1obq n ASP 59 Ca -0.18 -2.06 0.00 0.00 -0.50 0.00 0.00 54.79 52.06 1obq n ASP 59 Cb 0.53 -0.35 0.00 0.00 -1.14 0.00 0.00 41.12 40.15 1obq n ASP 59 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1obq n GLY 60 N 0.93 2.98 0.03 6.12 0.00 -1.26 -4.76 105.19 109.22 1obq n GLY 60 Ca 0.17 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.16 1obq n GLY 60 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1obq n LYS 61 N -0.53 2.38 -3.95 1.61 2.85 -1.26 -5.09 118.16 114.17 1obq n LYS 61 Ca 0.00 0.01 -0.11 0.00 -1.05 0.00 0.00 58.31 57.16 1obq n LYS 61 Cb 0.00 -1.14 -0.01 0.00 -0.65 0.00 0.00 35.03 33.23 1obq n LYS 61 CO 0.00 0.00 0.00 1.14 -0.05 0.00 0.00 177.40 178.49 1obq s GLN 62 N -2.13 2.02 -0.12 -1.58 -2.07 -1.26 -4.63 119.66 109.88 1obq s GLN 62 Ca -0.04 -1.54 -0.04 0.00 -1.82 0.00 0.00 55.36 51.92 1obq s GLN 62 Cb 0.02 0.54 -0.03 0.00 -1.09 0.00 0.00 33.01 32.44 1obq s GLN 62 CO 0.21 -0.89 0.02 -0.06 -1.32 0.00 0.00 175.29 173.25 1obq s PHE 63 N -2.85 3.20 -0.07 9.60 0.40 -0.34 -0.92 117.98 126.99 1obq s PHE 63 Ca 0.22 0.11 -0.06 0.00 -0.60 0.00 0.00 56.93 56.60 1obq s PHE 63 Cb -0.03 -1.90 -0.04 0.00 0.51 0.00 0.00 43.02 41.56 1obq s PHE 63 CO 0.15 0.34 0.18 0.08 0.70 0.00 0.00 175.22 176.67 1obq s VAL 64 N -0.40 5.44 -0.03 -0.44 1.01 0.33 -1.58 120.40 124.73 1obq s VAL 64 Ca 0.08 0.16 0.04 0.00 0.00 0.00 0.00 61.98 62.27 1obq s VAL 64 Cb -0.12 -3.47 -0.01 0.00 0.00 0.00 0.00 36.38 32.78 1obq s VAL 64 CO 0.02 0.52 -0.16 -0.63 0.00 0.00 0.00 175.10 174.85 1obq s ILE 65 N -1.13 1.34 -0.34 2.22 1.01 -0.04 -0.91 121.20 123.35 1obq s ILE 65 Ca 0.20 -0.68 0.00 0.00 0.00 0.00 0.00 60.65 60.16 1obq s ILE 65 Cb -0.13 -1.15 0.08 0.00 0.01 0.00 0.00 42.46 41.28 1obq s ILE 65 CO 0.09 0.39 0.06 -1.61 0.00 0.00 0.00 174.94 173.87 1obq s GLU 66 N -0.06 2.03 -0.12 2.79 2.02 0.06 -1.49 118.70 123.94 1obq s GLU 66 Ca -0.01 -1.60 -0.17 0.00 0.02 0.00 0.00 54.97 53.22 1obq s GLU 66 Cb -0.10 -3.27 -0.04 0.00 0.10 0.00 0.00 34.13 30.82 1obq s GLU 66 CO 0.01 -0.83 0.42 -1.12 0.02 0.00 0.00 175.26 173.77 1obq s SER 67 N 1.31 6.63 0.09 -0.19 0.01 0.47 -1.24 113.70 120.78 1obq s SER 67 Ca 0.02 0.75 0.01 0.00 1.31 0.00 0.00 55.95 58.05 1obq s SER 67 Cb -0.20 -2.26 -0.04 0.00 0.21 0.00 0.00 66.02 63.73 1obq s SER 67 CO -0.04 0.06 -0.06 0.42 0.41 0.00 0.00 173.24 174.03 1obq s THR 68 N 0.40 0.58 -4.46 1.44 -4.23 -0.39 -0.51 115.64 108.47 1obq s THR 68 Ca 0.23 -1.88 0.00 0.00 -1.18 0.00 0.00 61.69 58.86 1obq s THR 68 Cb -0.15 -1.61 0.00 0.00 1.34 0.00 0.00 72.50 72.08 1obq s THR 68 CO 0.09 -0.89 0.00 0.61 -0.54 0.00 0.00 174.62 173.89 1obq n GLY 69 N 0.04 -1.12 3.62 3.99 0.00 -0.94 -0.98 105.19 109.80 1obq n GLY 69 Ca -0.13 -1.15 -0.39 0.00 0.00 0.00 0.00 46.02 44.36 1obq n GLY 69 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1obq s ILE 70 N -3.00 5.21 1.04 -0.61 -1.09 -0.68 -0.65 121.20 121.42 1obq s ILE 70 Ca 0.00 0.52 -0.13 0.00 -2.23 0.00 0.00 60.65 58.81 1obq s ILE 70 Cb 0.00 -3.67 0.21 0.00 -1.58 0.00 0.00 42.46 37.42 1obq s ILE 70 CO 0.00 0.20 1.08 0.00 -1.23 0.00 0.00 174.94 174.99 1obq s ALA 71 N 1.80 0.67 0.12 9.38 0.00 0.60 -0.69 121.76 133.64 1obq s ALA 71 Ca 0.14 -0.35 0.32 0.00 0.00 0.00 0.00 51.96 52.07 1obq s ALA 71 Cb -0.15 -3.13 1.63 0.00 0.00 0.00 0.00 23.12 21.47 1obq s ALA 71 CO 0.09 -3.05 1.98 1.88 0.00 0.00 0.00 175.76 176.66 1obq h TYR 72 N -2.05 0.00 -0.20 0.00 -1.99 -1.87 -1.05 116.97 109.82 1obq h TYR 72 Ca -0.56 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.17 1obq h TYR 72 Cb 1.33 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.06 1obq h TYR 72 CO 0.27 0.00 0.00 -0.40 -0.00 0.00 0.00 178.16 178.03 1obq n ASP 73 N -2.69 2.51 0.00 3.88 5.75 -1.26 -4.93 116.55 119.81 1obq n ASP 73 Ca -0.01 -1.83 0.00 0.00 -0.01 0.00 0.00 54.79 52.94 1obq n ASP 73 Cb 0.13 -0.12 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1obq n ASP 73 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1obq n GLY 74 N 1.31 0.74 3.95 6.12 0.00 -0.40 -5.05 105.19 111.87 1obq n GLY 74 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.97 1obq n GLY 74 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1obq s ASN 75 N -2.93 6.16 0.45 1.61 0.01 -1.26 -4.78 114.94 114.20 1obq s ASN 75 Ca 0.00 0.28 -0.23 0.00 -0.71 0.00 0.00 52.86 52.20 1obq s ASN 75 Cb 0.00 -1.80 -0.08 0.00 0.41 0.00 0.00 41.25 39.78 1obq s ASN 75 CO 0.00 -0.37 1.12 -0.76 -1.51 0.00 0.00 177.10 175.59 1obq s LEU 76 N -4.30 4.02 -0.00 0.60 1.43 -1.26 -0.29 118.68 118.87 1obq s LEU 76 Ca 0.41 2.20 -0.01 0.00 -1.03 0.00 0.00 54.13 55.71 1obq s LEU 76 Cb -0.10 -4.27 -0.00 0.00 0.03 0.00 0.00 46.19 41.85 1obq s LEU 76 CO 0.35 -0.82 0.02 -0.22 0.23 0.00 0.00 176.35 175.91 1obq s LEU 77 N -3.00 1.96 -0.10 1.79 2.96 0.18 -4.79 118.68 117.67 1obq s LEU 77 Ca 0.63 -0.06 0.04 0.00 -0.22 0.00 0.00 54.13 54.52 1obq s LEU 77 Cb -0.26 0.10 0.00 0.00 0.50 0.00 0.00 46.19 46.54 1obq s LEU 77 CO 0.31 -0.07 -0.23 -0.75 -1.32 0.00 0.00 176.35 174.29 1obq s LYS 78 N -0.31 2.96 -0.02 1.98 2.20 -1.26 -2.23 119.74 123.07 1obq s LYS 78 Ca -0.03 -0.86 0.07 0.00 -0.36 0.00 0.00 55.97 54.79 1obq s LYS 78 Cb -0.02 -2.25 -0.02 0.00 -1.51 0.00 0.00 37.83 34.03 1obq s LYS 78 CO -0.00 0.18 -0.23 1.03 -0.36 0.00 0.00 175.35 175.97 1obq s ARG 79 N 0.34 2.18 -0.21 4.03 0.52 0.33 -5.00 118.95 121.15 1obq s ARG 79 Ca -0.18 -0.89 -0.10 0.00 -0.52 0.00 0.00 55.73 54.03 1obq s ARG 79 Cb -0.18 -2.12 -0.05 0.00 0.52 0.00 0.00 34.95 33.13 1obq s ARG 79 CO 0.09 0.57 0.15 -0.80 0.02 0.00 0.00 175.30 175.33 1obq s ASN 80 N -0.70 6.21 0.34 0.23 0.01 -1.26 -0.39 114.94 119.37 1obq s ASN 80 Ca 0.11 0.23 0.03 0.00 -0.71 0.00 0.00 52.86 52.52 1obq s ASN 80 Cb -0.10 -2.10 -0.04 0.00 0.41 0.00 0.00 41.25 39.41 1obq s ASN 80 CO -0.00 0.14 0.11 -0.83 -1.51 0.00 0.00 177.10 175.02 1obq s GLY 81 N 0.53 2.20 -0.02 0.66 0.00 -0.55 -1.27 107.32 108.86 1obq s GLY 81 Ca 0.09 -1.68 -0.12 0.00 0.00 0.00 0.00 44.72 43.01 1obq s GLY 81 CO -0.00 -1.73 0.25 0.54 0.00 0.00 0.00 173.10 172.17 1obq s LYS 82 N -3.83 0.55 -0.14 2.90 1.02 0.67 -0.86 119.74 120.05 1obq s LYS 82 Ca 0.32 -0.15 -0.00 0.00 0.02 0.00 0.00 55.97 56.15 1obq s LYS 82 Cb 0.06 0.24 0.03 0.00 -0.52 0.00 0.00 37.83 37.64 1obq s LYS 82 CO 0.15 -0.14 -0.07 -1.17 -0.92 0.00 0.00 175.35 173.20 1obq s LEU 83 N -1.09 1.40 0.05 3.17 2.96 -0.61 -0.84 118.68 123.72 1obq s LEU 83 Ca -0.12 -0.46 -0.03 0.00 -0.22 0.00 0.00 54.13 53.30 1obq s LEU 83 Cb -0.05 -0.90 -0.02 0.00 0.50 0.00 0.00 46.19 45.71 1obq s LEU 83 CO 0.03 -0.14 0.04 -0.72 -1.32 0.00 0.00 176.35 174.24 1obq s TYR 84 N 1.66 0.33 0.45 5.38 -0.85 -0.93 -1.20 117.35 122.18 1obq s TYR 84 Ca 0.03 -0.74 -0.25 0.00 -0.52 0.00 0.00 57.07 55.60 1obq s TYR 84 Cb -0.14 -0.24 -0.09 0.00 0.38 0.00 0.00 41.96 41.88 1obq s TYR 84 CO -0.08 -0.37 1.28 -2.30 -1.52 0.00 0.00 175.55 172.55 1obq n PRO 85 N 0.51 1.87 -1.64 -3.49 -0.02 -1.26 0.05 135.00 131.02 1obq n PRO 85 Ca -0.17 0.67 -0.48 0.00 -2.02 0.00 0.00 63.50 61.50 1obq n PRO 85 Cb 0.60 -2.41 -0.04 0.00 -0.02 0.00 0.00 33.50 31.62 1obq n PRO 85 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1obq n ASN 86 N -0.02 2.51 0.13 2.55 2.85 -0.15 -4.61 115.26 118.52 1obq n ASN 86 Ca 0.07 1.11 0.11 0.00 -0.11 0.00 0.00 54.58 55.76 1obq n ASN 86 Cb 0.41 -1.35 0.49 0.00 1.24 0.00 0.00 39.78 40.58 1obq n ASN 86 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 1obq n PRO 87 N 2.81 0.15 -0.16 1.20 -0.02 -1.26 -1.89 135.00 135.84 1obq n PRO 87 Ca 0.16 0.50 0.11 0.00 -2.02 0.00 0.00 63.50 62.25 1obq n PRO 87 Cb 0.26 -1.87 0.28 0.00 -0.02 0.00 0.00 33.50 32.15 1obq n PRO 87 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1obq n PHE 88 N -2.17 0.42 -0.83 6.00 3.72 -1.26 -4.95 117.46 118.39 1obq n PHE 88 Ca 0.01 -0.21 0.00 0.00 -0.05 0.00 0.00 57.45 57.20 1obq n PHE 88 Cb 0.14 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.68 1obq n PHE 88 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1obq n GLY 89 N 1.32 0.62 3.77 1.37 0.00 -0.79 -5.03 105.19 106.45 1obq n GLY 89 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 1obq n GLY 89 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1obq s GLU 90 N -0.17 4.01 -0.52 1.61 2.02 -1.26 -4.87 118.70 119.52 1obq s GLU 90 Ca 0.00 1.82 -0.05 0.00 0.02 0.00 0.00 54.97 56.77 1obq s GLU 90 Cb 0.00 -2.63 -0.09 0.00 0.10 0.00 0.00 34.13 31.50 1obq s GLU 90 CO 0.00 -0.35 2.17 -0.35 0.02 0.00 0.00 175.26 176.74 1obq n PRO 91 N -0.01 1.67 -3.98 0.39 -0.04 -1.26 -4.34 135.00 127.43 1obq n PRO 91 Ca 0.05 -1.07 -0.10 0.00 -0.04 0.00 0.00 63.50 62.34 1obq n PRO 91 Cb 0.47 -2.16 -0.04 0.00 -0.04 0.00 0.00 33.50 31.73 1obq n PRO 91 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 1obq s HIS 92 N 2.76 0.38 0.21 0.54 -3.43 -1.26 -4.70 115.29 109.79 1obq s HIS 92 Ca 0.38 -0.77 0.06 0.00 -0.80 0.00 0.00 55.06 53.94 1obq s HIS 92 Cb 0.13 0.28 -0.04 0.00 -1.43 0.00 0.00 32.58 31.53 1obq s HIS 92 CO -0.02 -1.11 0.15 -0.51 -2.00 0.00 0.00 174.74 171.25 1obq s LEU 93 N -3.05 3.77 -0.15 5.38 1.43 -1.11 -0.98 118.68 123.96 1obq s LEU 93 Ca 0.22 -0.22 -0.06 0.00 -1.03 0.00 0.00 54.13 53.05 1obq s LEU 93 Cb -0.02 -2.34 -0.04 0.00 0.03 0.00 0.00 46.19 43.83 1obq s LEU 93 CO 0.11 0.02 0.03 -0.44 0.23 0.00 0.00 176.35 176.30 1obq s SER 94 N -3.46 5.41 -0.21 2.29 0.01 0.11 -0.97 113.70 116.88 1obq s SER 94 Ca 0.32 0.07 -0.09 0.00 1.31 0.00 0.00 55.95 57.55 1obq s SER 94 Cb -0.09 -1.84 -0.04 0.00 0.21 0.00 0.00 66.02 64.26 1obq s SER 94 CO 0.24 0.22 0.10 -0.51 0.41 0.00 0.00 173.24 173.71 1obq s ILE 95 N 0.06 5.06 -0.04 1.44 1.10 0.31 -2.19 121.20 126.94 1obq s ILE 95 Ca 0.04 0.07 0.02 0.00 -0.51 0.00 0.00 60.65 60.26 1obq s ILE 95 Cb -0.13 -3.31 0.02 0.00 0.15 0.00 0.00 42.46 39.19 1obq s ILE 95 CO 0.01 0.42 -0.06 -0.62 -2.11 0.00 0.00 174.94 172.58 1obq s ASP 96 N 0.63 1.04 0.10 4.50 -1.08 -0.02 -1.02 116.67 120.82 1obq s ASP 96 Ca 0.06 -0.15 0.10 0.00 -0.52 0.00 0.00 52.55 52.03 1obq s ASP 96 Cb -0.13 -0.44 -0.04 0.00 -1.46 0.00 0.00 42.92 40.86 1obq s ASP 96 CO 0.01 -0.01 -0.26 -0.31 0.52 0.00 0.00 175.17 175.12 1obq s TYR 97 N 0.67 2.24 0.17 -5.34 1.51 -1.21 -0.24 117.35 115.15 1obq s TYR 97 Ca -0.10 -0.39 -0.32 0.00 -1.01 0.00 0.00 57.07 55.26 1obq s TYR 97 Cb -0.13 -1.24 -0.11 0.00 -0.11 0.00 0.00 41.96 40.36 1obq s TYR 97 CO 0.01 0.27 1.76 -2.00 -1.11 0.00 0.00 175.55 174.48 1obq s GLU 98 N -1.83 4.13 -1.36 -0.62 2.12 -0.40 -0.89 118.70 119.86 1obq s GLU 98 Ca 0.12 2.60 0.00 0.00 0.36 0.00 0.00 54.97 58.06 1obq s GLU 98 Cb -0.10 -3.28 0.00 0.00 0.26 0.00 0.00 34.13 31.01 1obq s GLU 98 CO 0.05 -0.79 0.00 0.09 -0.54 0.00 0.00 175.26 174.07 1obq n ASN 99 N 4.66 -4.63 0.00 -1.70 5.03 -1.26 -4.89 115.26 112.47 1obq n ASN 99 Ca 0.17 0.06 0.00 0.00 0.87 0.00 0.00 54.58 55.68 1obq n ASN 99 Cb 0.36 -3.71 0.00 0.00 -1.02 0.00 0.00 39.78 35.42 1obq n ASN 99 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 1obq n SER 100 N -0.81 0.00 -3.95 6.41 2.88 -0.07 -5.18 113.62 112.91 1obq n SER 100 Ca -0.17 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.20 1obq n SER 100 Cb 0.61 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.98 1obq n SER 100 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 1obq s PHE 101 N 2.74 1.48 0.03 0.66 -0.12 -1.25 -4.90 117.98 116.61 1obq s PHE 101 Ca 0.00 -1.42 0.05 0.00 -0.05 0.00 0.00 56.93 55.50 1obq s PHE 101 Cb 0.00 -0.73 -0.03 0.00 -0.63 0.00 0.00 43.02 41.63 1obq s PHE 101 CO 0.00 -0.62 -0.10 0.00 -0.05 0.00 0.00 175.22 174.44 1obq s ALA 102 N -3.77 2.89 0.05 1.99 0.00 -1.26 -3.33 121.76 118.33 1obq s ALA 102 Ca 0.38 -1.10 0.01 0.00 0.00 0.00 0.00 51.96 51.25 1obq s ALA 102 Cb 0.05 -0.99 -0.03 0.00 0.00 0.00 0.00 23.12 22.15 1obq s ALA 102 CO 0.18 0.61 -0.05 0.00 0.00 0.00 0.00 175.76 176.49 1obq s ALA 103 N -1.01 0.48 0.46 0.00 0.00 -0.19 -4.95 121.76 116.56 1obq s ALA 103 Ca 0.17 -0.90 -0.23 0.00 0.00 0.00 0.00 51.96 51.00 1obq s ALA 103 Cb -0.11 0.14 -0.07 0.00 0.00 0.00 0.00 23.12 23.08 1obq s ALA 103 CO 0.08 -0.17 1.21 -1.25 0.00 0.00 0.00 175.76 175.63 1obq s PRO 104 N -2.39 3.72 -0.03 0.00 0.04 -1.26 -0.53 135.00 134.55 1obq s PRO 104 Ca -0.05 1.90 -0.00 0.00 0.04 0.00 0.00 61.00 62.89 1obq s PRO 104 Cb -0.04 -2.45 0.03 0.00 0.04 0.00 0.00 34.50 32.08 1obq s PRO 104 CO -0.03 -0.62 0.04 -1.17 0.04 0.00 0.00 177.00 175.25 1obq s LEU 105 N -2.98 0.85 -0.06 -3.56 1.98 -0.14 -4.45 118.68 110.32 1obq s LEU 105 Ca 0.63 0.05 0.03 0.00 -2.89 0.00 0.00 54.13 51.94 1obq s LEU 105 Cb -0.32 -0.10 -0.03 0.00 0.66 0.00 0.00 46.19 46.41 1obq s LEU 105 CO 0.39 -0.16 -0.12 -0.69 -1.89 0.00 0.00 176.35 173.88 1obq s VAL 106 N 1.34 3.24 -0.57 1.68 1.01 0.05 -2.77 120.40 124.39 1obq s VAL 106 Ca -0.06 -0.65 -0.20 0.00 0.00 0.00 0.00 61.98 61.08 1obq s VAL 106 Cb -0.13 -2.29 0.08 0.00 0.00 0.00 0.00 36.38 34.04 1obq s VAL 106 CO -0.03 0.59 0.72 -0.63 0.00 0.00 0.00 175.10 175.75 1obq s ILE 107 N -0.69 4.76 0.29 2.22 1.01 -1.26 -1.04 121.20 126.49 1obq s ILE 107 Ca 0.10 -0.67 0.05 0.00 0.00 0.00 0.00 60.65 60.13 1obq s ILE 107 Cb -0.11 -4.45 0.06 0.00 0.01 0.00 0.00 42.46 37.98 1obq s ILE 107 CO 0.01 -1.05 1.73 -0.07 0.00 0.00 0.00 174.94 175.56 1obq h LEU 108 N 10.09 0.37 -7.00 2.97 3.38 -1.24 -3.45 115.31 120.43 1obq h LEU 108 Ca -0.28 -0.13 0.04 0.00 0.09 0.00 0.00 57.88 57.60 1obq h LEU 108 Cb 1.09 -0.10 -0.25 0.00 0.09 0.00 0.00 40.66 41.48 1obq h LEU 108 CO 1.06 0.67 0.40 -0.70 0.09 0.00 0.00 178.44 179.96 1obq s GLU 109 N -4.37 0.56 0.02 1.13 2.12 -1.19 -5.00 118.70 111.97 1obq s GLU 109 Ca -0.06 0.65 -0.20 0.00 0.36 0.00 0.00 54.97 55.72 1obq s GLU 109 Cb 0.14 0.27 0.04 0.00 0.26 0.00 0.00 34.13 34.84 1obq s GLU 109 CO 0.78 -0.07 0.46 -0.08 -0.54 0.00 0.00 175.26 175.81 1obq s THR 110 N 0.22 0.04 -1.35 -1.70 -1.32 -1.26 -0.54 115.64 109.73 1obq s THR 110 Ca 0.03 -0.34 0.15 0.00 -1.21 0.00 0.00 61.69 60.31 1obq s THR 110 Cb -0.05 -0.90 0.38 0.00 -1.51 0.00 0.00 72.50 70.42 1obq s THR 110 CO -0.05 -0.19 1.30 -0.90 -2.21 0.00 0.00 174.62 172.58 1obq n ASP 111 N 0.69 3.14 0.00 8.08 5.75 -1.07 -5.01 116.55 128.13 1obq n ASP 111 Ca -0.19 -1.95 0.00 0.00 -0.01 0.00 0.00 54.79 52.64 1obq n ASP 111 Cb 0.59 -0.28 0.00 0.00 -1.03 0.00 0.00 41.12 40.40 1obq n ASP 111 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 1obq n TYR 112 N 0.88 0.00 0.25 2.11 4.01 -1.26 -4.43 117.16 118.73 1obq n TYR 112 Ca 0.15 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.96 1obq n TYR 112 Cb 0.48 0.00 -0.09 0.00 -0.31 0.00 0.00 39.34 39.41 1obq n TYR 112 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1obq n SER 113 N 0.39 1.37 0.00 7.72 3.41 -1.26 -4.76 113.62 120.48 1obq n SER 113 Ca 0.00 -0.33 0.00 0.00 -0.26 0.00 0.00 58.87 58.28 1obq n SER 113 Cb 0.00 1.37 0.00 0.00 -0.26 0.00 0.00 64.21 65.32 1obq n SER 113 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1obq n ASN 114 N -1.70 1.47 -3.85 4.04 3.02 -1.26 -4.73 115.26 112.25 1obq n ASN 114 Ca -0.00 0.00 -0.09 0.00 -0.03 0.00 0.00 54.58 54.45 1obq n ASN 114 Cb 0.29 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.40 1obq n ASN 114 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 1obq s TYR 115 N -1.92 0.17 -0.09 3.10 1.13 -1.26 -1.59 117.35 116.89 1obq s TYR 115 Ca 0.00 -0.55 -0.13 0.00 -1.41 0.00 0.00 57.07 54.98 1obq s TYR 115 Cb 0.00 0.02 0.03 0.00 -1.10 0.00 0.00 41.96 40.91 1obq s TYR 115 CO 0.00 -0.66 0.33 0.00 -2.51 0.00 0.00 175.55 172.71 1obq s ALA 116 N -3.89 -0.81 -0.18 9.51 0.00 -0.49 -2.60 121.76 123.30 1obq s ALA 116 Ca 0.09 0.75 0.00 0.00 0.00 0.00 0.00 51.96 52.81 1obq s ALA 116 Cb 0.03 -0.36 0.01 0.00 0.00 0.00 0.00 23.12 22.80 1obq s ALA 116 CO -0.07 -0.19 -0.17 0.00 0.00 0.00 0.00 175.76 175.34 1obq s LEU 118 N 1.16 2.57 -0.15 0.00 1.43 -0.41 -0.64 118.68 122.64 1obq s LEU 118 Ca 0.01 -0.76 -0.10 0.00 -1.03 0.00 0.00 54.13 52.25 1obq s LEU 118 Cb -0.14 -1.33 0.05 0.00 0.03 0.00 0.00 46.19 44.80 1obq s LEU 118 CO -0.07 0.13 0.37 -0.47 0.23 0.00 0.00 176.35 176.53 1obq s TYR 119 N -1.55 -0.47 0.02 0.29 5.04 -0.21 -1.41 117.35 119.06 1obq s TYR 119 Ca 0.21 1.07 0.02 0.00 -2.44 0.00 0.00 57.07 55.93 1obq s TYR 119 Cb -0.09 0.17 -0.02 0.00 0.35 0.00 0.00 41.96 42.38 1obq s TYR 119 CO 0.11 -0.26 -0.07 0.45 -1.34 0.00 0.00 175.55 174.44 1obq s SER 120 N 0.79 0.75 -0.06 4.32 0.15 0.93 -0.77 113.70 119.81 1obq s SER 120 Ca -0.05 -0.35 -0.08 0.00 0.70 0.00 0.00 55.95 56.17 1obq s SER 120 Cb -0.06 -0.01 0.02 0.00 -1.71 0.00 0.00 66.02 64.26 1obq s SER 120 CO -0.06 -0.08 0.22 0.00 1.20 0.00 0.00 173.24 174.52 1obq s ILE 122 N -0.28 0.79 0.14 0.00 1.10 -0.08 -4.84 121.20 118.03 1obq s ILE 122 Ca -0.04 -0.27 -0.25 0.00 -0.51 0.00 0.00 60.65 59.59 1obq s ILE 122 Cb -0.03 -0.77 -0.07 0.00 0.15 0.00 0.00 42.46 41.74 1obq s ILE 122 CO 0.01 0.28 0.76 -1.81 -2.11 0.00 0.00 174.94 172.07 1obq s ASP 123 N 0.85 7.34 0.40 4.50 1.01 -1.26 -0.51 116.67 129.00 1obq s ASP 123 Ca -0.12 1.59 0.07 0.00 0.71 0.00 0.00 52.55 54.79 1obq s ASP 123 Cb -0.15 -2.48 0.00 0.00 1.01 0.00 0.00 42.92 41.30 1obq s ASP 123 CO 0.01 0.19 0.55 -0.31 0.21 0.00 0.00 175.17 175.82 1obq s TYR 124 N -0.98 2.94 -1.34 4.23 2.02 -0.32 -4.98 117.35 118.93 1obq s TYR 124 Ca 0.36 -0.28 0.22 0.00 -0.37 0.00 0.00 57.07 57.00 1obq s TYR 124 Cb -0.22 -2.27 1.09 0.00 -0.40 0.00 0.00 41.96 40.16 1obq s TYR 124 CO 0.25 -0.31 1.73 0.27 -1.57 0.00 0.00 175.55 175.92 1obq n ASN 125 N -1.82 0.00 -1.41 2.29 0.23 -1.26 -4.09 115.26 109.20 1obq n ASN 125 Ca 0.05 0.08 -0.10 0.00 -0.53 0.00 0.00 54.58 54.07 1obq n ASN 125 Cb 0.59 -0.33 0.15 0.00 -2.08 0.00 0.00 39.78 38.11 1obq n ASN 125 CO 0.00 0.00 0.00 2.22 -0.93 0.00 0.00 177.26 178.55 1obq n PHE 126 N -1.33 1.54 -1.13 -2.53 1.16 -1.26 -4.96 117.46 108.95 1obq n PHE 126 Ca 0.09 -1.87 -0.01 0.00 -1.87 0.00 0.00 57.45 53.79 1obq n PHE 126 Cb 0.20 -0.53 -0.01 0.00 -1.61 0.00 0.00 39.48 37.53 1obq n PHE 126 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1obq n GLY 127 N -1.02 0.47 3.27 4.97 0.00 -1.26 -5.03 105.19 106.59 1obq n GLY 127 Ca 0.37 -1.01 -0.15 0.00 0.00 0.00 0.00 46.02 45.24 1obq n GLY 127 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1obq s TYR 128 N -2.05 1.32 0.18 1.61 1.51 -1.25 -0.51 117.35 118.15 1obq s TYR 128 Ca 0.00 -0.99 0.02 0.00 -1.01 0.00 0.00 57.07 55.09 1obq s TYR 128 Cb 0.00 -0.75 -0.05 0.00 -0.11 0.00 0.00 41.96 41.05 1obq s TYR 128 CO 0.00 -0.16 -0.01 -3.38 -1.11 0.00 0.00 175.55 170.88 1obq s HIS 129 N -3.59 1.28 -0.06 2.71 -3.43 -0.05 -1.17 115.29 110.98 1obq s HIS 129 Ca 0.25 -0.96 0.04 0.00 -0.80 0.00 0.00 55.06 53.59 1obq s HIS 129 Cb 0.06 -0.72 0.00 0.00 -1.43 0.00 0.00 32.58 30.49 1obq s HIS 129 CO 0.05 -0.14 -0.17 -1.12 -2.00 0.00 0.00 174.74 171.36 1obq s SER 130 N -3.20 2.26 0.16 7.38 0.01 0.33 -0.77 113.70 119.88 1obq s SER 130 Ca 0.24 -0.38 0.08 0.00 1.31 0.00 0.00 55.95 57.20 1obq s SER 130 Cb 0.06 -0.83 -0.04 0.00 0.21 0.00 0.00 66.02 65.42 1obq s SER 130 CO 0.04 0.12 -0.18 1.51 0.41 0.00 0.00 173.24 175.15 1obq s ASP 131 N 0.27 2.63 -0.05 2.44 1.47 -1.23 -0.90 116.67 121.31 1obq s ASP 131 Ca -0.10 -0.86 -0.01 0.00 1.18 0.00 0.00 52.55 52.76 1obq s ASP 131 Cb -0.14 -0.15 0.03 0.00 -0.34 0.00 0.00 42.92 42.32 1obq s ASP 131 CO 0.04 -0.05 0.01 -0.36 0.68 0.00 0.00 175.17 175.50 1obq s PHE 132 N -2.07 0.42 0.06 2.11 0.08 -0.30 -4.91 117.98 113.36 1obq s PHE 132 Ca 0.15 -0.02 0.08 0.00 0.12 0.00 0.00 56.93 57.26 1obq s PHE 132 Cb -0.06 -0.59 -0.03 0.00 -0.57 0.00 0.00 43.02 41.78 1obq s PHE 132 CO 0.06 -0.22 -0.21 -1.12 -0.10 0.00 0.00 175.22 173.63 1obq s SER 133 N 1.62 2.55 0.05 1.36 0.01 -1.26 -0.05 113.70 117.97 1obq s SER 133 Ca -0.01 -0.57 0.03 0.00 1.31 0.00 0.00 55.95 56.70 1obq s SER 133 Cb -0.13 -0.19 -0.03 0.00 0.21 0.00 0.00 66.02 65.88 1obq s SER 133 CO -0.03 0.14 -0.09 -0.36 0.41 0.00 0.00 173.24 173.31 1obq s PHE 134 N -0.89 0.77 -0.19 2.43 0.40 -0.50 -1.60 117.98 118.40 1obq s PHE 134 Ca 0.08 -0.52 0.00 0.00 -0.60 0.00 0.00 56.93 55.89 1obq s PHE 134 Cb -0.09 -0.45 0.02 0.00 0.51 0.00 0.00 43.02 43.00 1obq s PHE 134 CO 0.02 -0.06 -0.18 0.42 0.70 0.00 0.00 175.22 176.12 1obq s ILE 135 N -1.51 2.25 0.05 0.64 1.01 -0.08 -1.29 121.20 122.27 1obq s ILE 135 Ca -0.07 -0.89 0.04 0.00 0.00 0.00 0.00 60.65 59.73 1obq s ILE 135 Cb -0.09 -1.97 -0.04 0.00 0.01 0.00 0.00 42.46 40.38 1obq s ILE 135 CO 0.00 0.51 -0.04 -0.36 0.00 0.00 0.00 174.94 175.06 1obq s PHE 136 N 1.31 2.93 0.06 3.97 0.40 0.31 -0.32 117.98 126.65 1obq s PHE 136 Ca 0.05 -0.04 0.05 0.00 -0.60 0.00 0.00 56.93 56.39 1obq s PHE 136 Cb -0.13 -1.56 -0.03 0.00 0.51 0.00 0.00 43.02 41.81 1obq s PHE 136 CO -0.11 0.44 -0.13 0.45 0.70 0.00 0.00 175.22 176.56 1obq s SER 137 N -1.93 1.52 0.00 1.36 0.15 -0.20 -1.40 113.70 113.21 1obq s SER 137 Ca 0.22 -0.57 0.30 0.00 0.70 0.00 0.00 55.95 56.60 1obq s SER 137 Cb -0.11 -0.04 1.58 0.00 -1.71 0.00 0.00 66.02 65.73 1obq s SER 137 CO 0.13 -0.08 2.07 0.54 1.20 0.00 0.00 173.24 177.11 1obq n ARG 138 N 1.42 0.60 -4.32 5.44 5.12 -0.62 -0.14 116.66 124.16 1obq n ARG 138 Ca -0.21 -0.03 -0.20 0.00 -1.93 0.00 0.00 57.85 55.47 1obq n ARG 138 Cb 0.54 -1.50 -0.08 0.00 -1.16 0.00 0.00 32.46 30.26 1obq n ARG 138 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1obq s SER 139 N -2.42 1.84 0.48 0.55 1.04 -1.26 -4.81 113.70 109.11 1obq s SER 139 Ca 0.33 -1.74 0.24 0.00 0.48 0.00 0.00 55.95 55.26 1obq s SER 139 Cb 0.21 0.55 1.19 0.00 0.10 0.00 0.00 66.02 68.07 1obq s SER 139 CO 0.44 -1.04 1.97 0.00 0.98 0.00 0.00 173.24 175.59 1obq h ALA 140 N 2.08 1.22 -2.06 5.32 0.00 -1.97 -3.43 119.26 120.42 1obq h ALA 140 Ca -0.27 -0.17 -0.59 0.00 0.00 0.00 0.00 54.91 53.88 1obq h ALA 140 Cb 1.24 -0.03 -0.14 0.00 0.00 0.00 0.00 17.79 18.86 1obq h ALA 140 CO 0.40 0.24 -0.71 -0.80 0.00 0.00 0.00 179.25 178.38 1obq s ASN 141 N -6.28 3.49 -0.06 0.00 0.01 -1.26 -4.60 114.94 106.24 1obq s ASN 141 Ca -0.02 -1.13 -0.03 0.00 -0.71 0.00 0.00 52.86 50.97 1obq s ASN 141 Cb 0.12 -0.30 0.04 0.00 0.41 0.00 0.00 41.25 41.53 1obq s ASN 141 CO 0.62 -0.14 0.14 -0.22 -1.51 0.00 0.00 177.10 175.99 1obq s LEU 142 N -3.54 0.60 0.46 0.60 2.96 -1.26 -4.81 118.68 113.69 1obq s LEU 142 Ca 0.31 0.28 -0.24 0.00 -0.22 0.00 0.00 54.13 54.25 1obq s LEU 142 Cb -0.00 0.29 -0.07 0.00 0.50 0.00 0.00 46.19 46.91 1obq s LEU 142 CO 0.15 -0.17 1.28 0.00 -1.32 0.00 0.00 176.35 176.29 1obq s ALA 143 N 1.38 3.06 0.38 5.97 0.00 -1.26 -4.79 121.76 126.50 1obq s ALA 143 Ca -0.07 1.18 0.17 0.00 0.00 0.00 0.00 51.96 53.24 1obq s ALA 143 Cb -0.12 -3.48 1.07 0.00 0.00 0.00 0.00 23.12 20.59 1obq s ALA 143 CO -0.06 -0.93 1.74 -0.44 0.00 0.00 0.00 175.76 176.08 1obq h ASP 144 N 2.16 0.50 -0.20 0.00 5.19 -2.00 0.67 116.42 122.73 1obq h ASP 144 Ca -0.50 0.11 -0.01 0.00 -0.62 0.00 0.00 57.03 56.01 1obq h ASP 144 Cb 1.26 0.04 -0.01 0.00 0.18 0.00 0.00 39.33 40.79 1obq h ASP 144 CO 0.60 0.05 0.10 0.06 -3.12 0.00 0.00 179.24 176.93 1obq h GLN 145 N 0.42 0.34 0.13 3.56 3.07 -2.00 -1.14 115.11 119.48 1obq h GLN 145 Ca 0.64 -0.03 -0.32 0.00 0.09 0.00 0.00 58.65 59.02 1obq h GLN 145 Cb 1.53 -0.07 -0.00 0.00 0.08 0.00 0.00 27.48 29.02 1obq h GLN 145 CO -0.38 0.28 -1.60 1.88 0.09 0.00 0.00 178.83 179.10 1obq h TYR 146 N 0.34 0.51 -0.84 0.06 0.05 -1.23 -3.22 116.97 112.63 1obq h TYR 146 Ca 0.09 -0.38 0.12 0.00 0.05 0.00 0.00 58.73 58.62 1obq h TYR 146 Cb 0.08 -0.02 -0.08 0.00 1.01 0.00 0.00 36.73 37.71 1obq h TYR 146 CO 0.00 1.46 0.46 0.28 -1.05 0.00 0.00 178.16 179.30 1obq h VAL 147 N 0.08 0.81 -0.08 -2.88 2.07 -1.08 -1.99 116.25 113.17 1obq h VAL 147 Ca -0.27 -0.24 -0.06 0.00 0.82 0.00 0.00 66.70 66.95 1obq h VAL 147 Cb 2.04 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.85 1obq h VAL 147 CO 0.16 0.13 -0.22 0.11 0.02 0.00 0.00 177.57 177.77 1obq h LYS 148 N 0.70 0.13 -0.44 1.57 1.57 -1.29 -0.25 116.57 118.56 1obq h LYS 148 Ca 0.44 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 59.15 1obq h LYS 148 Cb 0.53 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.80 1obq h LYS 148 CO -0.31 0.36 0.14 0.87 -0.57 0.00 0.00 179.45 179.94 1obq h LYS 149 N 0.12 0.68 -0.29 3.15 1.57 -1.37 -1.70 116.57 118.73 1obq h LYS 149 Ca 0.02 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 58.64 1obq h LYS 149 Cb 0.47 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 1obq h LYS 149 CO 0.03 0.65 0.09 0.00 -0.57 0.00 0.00 179.45 179.65 1obq h GLU 151 N 0.31 0.55 -0.67 0.00 4.81 -0.98 -0.15 114.58 118.44 1obq h GLU 151 Ca 0.09 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.25 1obq h GLU 151 Cb 0.24 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.46 1obq h GLU 151 CO -0.00 0.36 0.28 0.00 -0.73 0.00 0.00 179.01 178.91 1obq h ALA 152 N 1.49 0.87 -0.39 2.92 0.00 -1.14 0.17 119.26 123.18 1obq h ALA 152 Ca 0.39 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 1obq h ALA 152 Cb 0.49 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1obq h ALA 152 CO -0.32 0.48 0.08 0.00 0.00 0.00 0.00 179.25 179.50 1obq h ALA 153 N 1.12 0.52 -0.32 0.00 0.00 -0.49 -0.69 119.26 119.40 1obq h ALA 153 Ca 0.23 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1obq h ALA 153 Cb 0.20 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1obq h ALA 153 CO -0.02 0.20 -0.03 0.74 0.00 0.00 0.00 179.25 180.14 1obq h PHE 154 N 0.49 0.65 -0.59 0.00 0.04 -0.88 -2.97 116.94 113.68 1obq h PHE 154 Ca 0.12 -0.12 0.07 0.00 2.80 0.00 0.00 57.97 60.84 1obq h PHE 154 Cb 0.33 -0.16 -0.04 0.00 2.20 0.00 0.00 35.95 38.28 1obq h PHE 154 CO 0.02 0.74 0.39 0.87 -0.60 0.00 0.00 178.31 179.73 1obq h LYS 155 N 0.38 0.50 0.00 1.51 1.57 -0.38 -0.03 116.57 120.12 1obq h LYS 155 Ca 0.09 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1obq h LYS 155 Cb 0.50 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1obq h LYS 155 CO 0.02 0.33 0.00 -0.97 -0.57 0.00 0.00 179.45 178.26 1obq h ASN 156 N 0.52 0.00 -0.26 0.86 -1.24 -0.97 -2.11 115.58 112.38 1obq h ASN 156 Ca 0.26 0.00 -0.07 0.00 0.71 0.00 0.00 56.30 57.20 1obq h ASN 156 Cb 0.36 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 39.37 1obq h ASN 156 CO -0.08 0.00 -0.04 2.30 -1.29 0.00 0.00 177.43 178.32 1obq n ILE 157 N -2.32 2.35 -1.40 2.57 -5.35 -0.09 -4.97 119.36 110.14 1obq n ILE 157 Ca 0.03 -2.31 -0.07 0.00 -0.27 0.00 0.00 62.75 60.13 1obq n ILE 157 Cb 0.28 -0.28 -0.03 0.00 -1.74 0.00 0.00 39.64 37.88 1obq n ILE 157 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1obq n ASN 158 N -0.89 -3.67 -4.73 7.28 4.13 -0.79 -4.81 115.26 111.79 1obq n ASN 158 Ca 0.25 0.15 -0.39 0.00 1.68 0.00 0.00 54.58 56.27 1obq n ASN 158 Cb 0.92 -2.05 -0.05 0.00 -1.54 0.00 0.00 39.78 37.06 1obq n ASN 158 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1obq s VAL 159 N -2.29 5.06 -0.58 2.41 1.01 -0.79 -4.99 120.40 120.23 1obq s VAL 159 Ca 0.00 1.27 -0.27 0.00 0.00 0.00 0.00 61.98 62.98 1obq s VAL 159 Cb 0.00 -3.96 -0.00 0.00 0.00 0.00 0.00 36.38 32.42 1obq s VAL 159 CO 0.00 0.30 1.64 -0.62 0.00 0.00 0.00 175.10 176.42 1obq s ASP 160 N 0.59 5.71 0.00 3.32 -1.08 -1.26 -4.17 116.67 119.78 1obq s ASP 160 Ca 0.33 0.32 0.14 0.00 -0.52 0.00 0.00 52.55 52.82 1obq s ASP 160 Cb -0.17 -2.54 0.72 0.00 -1.46 0.00 0.00 42.92 39.47 1obq s ASP 160 CO 0.16 -2.04 1.39 0.35 0.52 0.00 0.00 175.17 175.55 1obq n THR 161 N 7.01 0.62 0.39 1.71 -2.24 -1.26 -0.69 114.28 119.82 1obq n THR 161 Ca 0.16 0.15 0.11 0.00 -2.27 0.00 0.00 64.05 62.21 1obq n THR 161 Cb 0.50 -0.92 0.48 0.00 -2.10 0.00 0.00 70.33 68.29 1obq n THR 161 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1obq n THR 162 N -1.29 0.87 0.88 4.28 -2.24 -1.26 -2.17 114.28 113.34 1obq n THR 162 Ca 0.07 0.26 0.11 0.00 -2.27 0.00 0.00 64.05 62.22 1obq n THR 162 Cb 0.12 -1.18 0.51 0.00 -2.10 0.00 0.00 70.33 67.68 1obq n THR 162 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1obq n ARG 163 N -2.17 0.11 -2.43 -0.78 1.74 0.13 -4.86 116.66 108.41 1obq n ARG 163 Ca 0.02 0.10 -0.41 0.00 -0.77 0.00 0.00 57.85 56.79 1obq n ARG 163 Cb 0.21 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.11 1obq n ARG 163 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1obq s PHE 164 N -2.85 3.51 -0.05 -1.55 0.08 -0.92 -4.00 117.98 112.19 1obq s PHE 164 Ca 0.15 1.63 0.04 0.00 0.12 0.00 0.00 56.93 58.87 1obq s PHE 164 Cb 0.15 -3.34 -0.00 0.00 -0.57 0.00 0.00 43.02 39.26 1obq s PHE 164 CO 0.39 -0.76 -0.19 0.08 -0.10 0.00 0.00 175.22 174.63 1obq s VAL 165 N -0.93 1.59 0.22 -0.44 1.01 0.20 -4.95 120.40 117.10 1obq s VAL 165 Ca 0.46 -0.79 -0.30 0.00 0.00 0.00 0.00 61.98 61.35 1obq s VAL 165 Cb -0.33 -1.37 -0.08 0.00 0.00 0.00 0.00 36.38 34.60 1obq s VAL 165 CO 0.41 0.45 0.96 -0.75 0.00 0.00 0.00 175.10 176.17 1obq s LYS 166 N 0.10 4.81 0.16 2.72 2.20 -1.26 -1.93 119.74 126.54 1obq s LYS 166 Ca -0.07 1.51 -0.13 0.00 -0.36 0.00 0.00 55.97 56.93 1obq s LYS 166 Cb -0.13 -3.29 -0.07 0.00 -1.51 0.00 0.00 37.83 32.83 1obq s LYS 166 CO 0.03 0.43 0.55 0.99 -0.36 0.00 0.00 175.35 176.99 1obq s THR 167 N -0.95 4.87 0.03 3.43 2.01 -0.37 -4.95 115.64 119.72 1obq s THR 167 Ca 0.43 0.75 -0.30 0.00 0.31 0.00 0.00 61.69 62.87 1obq s THR 167 Cb -0.26 -3.71 -0.07 0.00 0.01 0.00 0.00 72.50 68.47 1obq s THR 167 CO 0.32 0.18 1.51 -0.69 -0.69 0.00 0.00 174.62 175.25 1obq s VAL 168 N -1.54 3.42 0.22 3.82 1.01 -1.26 -4.90 120.40 121.17 1obq s VAL 168 Ca 0.40 0.83 -0.03 0.00 0.00 0.00 0.00 61.98 63.18 1obq s VAL 168 Cb -0.14 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 32.67 1obq s VAL 168 CO 0.19 -0.00 0.22 -1.10 0.00 0.00 0.00 175.10 174.41 1obq s GLN 169 N 2.51 1.33 0.00 2.72 -1.52 -1.26 0.01 119.66 123.45 1obq s GLN 169 Ca 0.68 -1.58 0.00 0.00 -1.95 0.00 0.00 55.36 52.51 1obq s GLN 169 Cb -0.35 0.32 0.00 0.00 -0.22 0.00 0.00 33.01 32.76 1obq s GLN 169 CO 0.29 -0.47 0.00 0.41 -0.25 0.00 0.00 175.29 175.27 1obq n GLY 170 N -0.33 -0.31 0.00 3.09 0.00 -1.26 -4.73 105.19 101.66 1obq n GLY 170 Ca 0.02 -2.25 0.04 0.00 0.00 0.00 0.00 46.02 43.82 1obq n GLY 170 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1obq n SER 171 N 0.00 0.00 0.00 1.61 3.41 -1.26 -0.89 113.62 116.49 1obq n SER 171 Ca 0.00 0.40 0.13 0.00 -0.26 0.00 0.00 58.87 59.14 1obq n SER 171 Cb 0.00 -0.44 0.57 0.00 -0.26 0.00 0.00 64.21 64.08 1obq n SER 171 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1obq n SER 172 N -1.44 0.00 -4.84 4.04 3.41 -1.26 -4.81 113.62 108.72 1obq n SER 172 Ca 0.03 0.39 -0.37 0.00 -0.26 0.00 0.00 58.87 58.65 1obq n SER 172 Cb 0.09 -0.46 -0.06 0.00 -0.26 0.00 0.00 64.21 63.52 1obq n SER 172 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1obq n PRO 174 N 1.62 3.64 -0.33 0.00 -0.04 -1.26 -4.73 135.00 133.90 1obq n PRO 174 Ca -0.12 -2.73 0.13 0.00 -0.04 0.00 0.00 63.50 60.74 1obq n PRO 174 Cb 0.52 -2.47 0.34 0.00 -0.04 0.00 0.00 33.50 31.85 1obq n PRO 174 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1obq h TYR 175 N 4.10 0.98 -0.28 0.54 0.05 -1.93 -0.86 116.97 119.56 1obq h TYR 175 Ca 0.60 0.03 -0.06 0.00 0.05 0.00 0.00 58.73 59.35 1obq h TYR 175 Cb 0.52 -0.30 -0.02 0.00 1.01 0.00 0.00 36.73 37.95 1obq h TYR 175 CO 1.64 0.27 -0.10 -0.44 -1.05 0.00 0.00 178.16 178.47 1obq h ASP 176 N 0.74 0.44 -0.23 3.88 3.32 -2.00 0.04 116.42 122.61 1obq h ASP 176 Ca 0.54 -0.10 -0.12 0.00 0.02 0.00 0.00 57.03 57.37 1obq h ASP 176 Cb 0.86 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 40.29 1obq h ASP 176 CO -0.31 0.58 -0.31 0.74 -1.72 0.00 0.00 179.24 178.22 1obq h THR 177 N 0.43 1.32 -0.87 0.35 2.02 -1.69 -3.23 112.91 111.24 1obq h THR 177 Ca 0.08 -1.51 0.08 0.00 0.77 0.00 0.00 66.41 65.84 1obq h THR 177 Cb 0.44 1.75 -0.07 0.00 -1.74 0.00 0.00 68.15 68.53 1obq h THR 177 CO 0.02 0.47 0.52 1.56 0.37 0.00 0.00 175.52 178.47 1obq h GLN 178 N 0.31 0.88 0.00 6.66 4.20 -0.29 -0.17 115.11 126.70 1obq h GLN 178 Ca 0.03 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.68 1obq h GLN 178 Cb 0.89 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.47 1obq h GLN 178 CO 0.07 0.58 0.00 0.36 -0.67 0.00 0.00 178.83 179.17 1obq n LYS 179 N -4.67 0.01 0.00 1.46 2.85 -0.08 -1.55 118.16 116.17 1obq n LYS 179 Ca 0.14 0.33 0.12 0.00 -1.05 0.00 0.00 58.31 57.85 1obq n LYS 179 Cb 0.24 -1.50 0.10 0.00 -0.65 0.00 0.00 35.03 33.22 1obq n LYS 179 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1obq n THR 180 N -1.48 0.00 1.55 0.58 -2.24 -0.08 -5.12 114.28 107.49 1obq n THR 180 Ca 0.02 -0.25 0.12 0.00 -2.27 0.00 0.00 64.05 61.68 1obq n THR 180 Cb 0.10 1.06 0.74 0.00 -2.10 0.00 0.00 70.33 70.13 1obq n THR 180 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68