#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rkq s LEU 2 N 0.00 2.53 0.61 1.04 1.43 -1.26 -5.13 118.68 117.90 1rkq s LEU 2 Ca 0.00 -0.59 -0.16 0.00 -1.03 0.00 0.00 54.13 52.35 1rkq s LEU 2 Cb 0.00 -1.43 -0.02 0.00 0.03 0.00 0.00 46.19 44.77 1rkq s LEU 2 CO 0.00 0.20 1.09 0.00 0.23 0.00 0.00 176.35 177.87 1rkq s ALA 3 N -1.05 2.61 0.12 4.21 0.00 -1.26 -4.80 121.76 121.58 1rkq s ALA 3 Ca 0.16 0.53 -0.30 0.00 0.00 0.00 0.00 51.96 52.34 1rkq s ALA 3 Cb -0.10 -3.29 -0.07 0.00 0.00 0.00 0.00 23.12 19.66 1rkq s ALA 3 CO 0.07 -1.01 1.18 0.42 0.00 0.00 0.00 175.76 176.43 1rkq s ILE 4 N -2.29 3.87 -0.01 0.00 -1.09 -1.26 -4.59 121.20 115.82 1rkq s ILE 4 Ca 0.66 1.44 0.07 0.00 -2.23 0.00 0.00 60.65 60.60 1rkq s ILE 4 Cb -0.19 -3.92 -0.11 0.00 -1.58 0.00 0.00 42.46 36.66 1rkq s ILE 4 CO 0.37 0.17 0.15 0.29 -1.23 0.00 0.00 174.94 174.69 1rkq n LYS 5 N 3.25 0.28 -3.80 2.79 5.02 0.67 -4.90 118.16 121.47 1rkq n LYS 5 Ca 0.07 -0.06 -0.13 0.00 -2.02 0.00 0.00 58.31 56.16 1rkq n LYS 5 Cb 0.46 -1.17 -0.14 0.00 -0.02 0.00 0.00 35.03 34.16 1rkq n LYS 5 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1rkq s LEU 6 N -3.51 1.25 -0.20 -0.35 0.20 -1.00 -1.06 118.68 114.01 1rkq s LEU 6 Ca -0.03 0.18 0.01 0.00 0.69 0.00 0.00 54.13 54.99 1rkq s LEU 6 Cb 0.04 0.23 0.03 0.00 -0.43 0.00 0.00 46.19 46.07 1rkq s LEU 6 CO 0.29 -0.09 -0.16 -0.63 -0.29 0.00 0.00 176.35 175.48 1rkq s ILE 7 N 0.62 2.00 -0.20 6.68 1.01 0.13 -1.18 121.20 130.26 1rkq s ILE 7 Ca -0.05 -1.11 -0.11 0.00 0.00 0.00 0.00 60.65 59.39 1rkq s ILE 7 Cb -0.07 -1.92 -0.05 0.00 0.01 0.00 0.00 42.46 40.43 1rkq s ILE 7 CO -0.03 0.34 0.16 0.00 0.00 0.00 0.00 174.94 175.41 1rkq s ALA 8 N 1.27 3.66 -0.07 9.38 0.00 0.02 -0.41 121.76 135.61 1rkq s ALA 8 Ca 0.01 -0.69 0.00 0.00 0.00 0.00 0.00 51.96 51.28 1rkq s ALA 8 Cb -0.15 -2.23 0.02 0.00 0.00 0.00 0.00 23.12 20.76 1rkq s ALA 8 CO -0.10 0.09 -0.06 0.42 0.00 0.00 0.00 175.76 176.11 1rkq s ILE 9 N 0.49 0.78 0.72 0.00 1.01 -0.50 -0.96 121.20 122.74 1rkq s ILE 9 Ca 0.09 -0.20 -0.12 0.00 0.00 0.00 0.00 60.65 60.42 1rkq s ILE 9 Cb -0.12 -0.80 0.03 0.00 0.01 0.00 0.00 42.46 41.58 1rkq s ILE 9 CO -0.00 0.30 1.09 -0.62 0.00 0.00 0.00 174.94 175.71 1rkq s ASP 10 N 1.29 4.88 0.00 3.58 2.15 -0.54 -1.00 116.67 127.03 1rkq s ASP 10 Ca -0.04 1.84 0.00 0.00 0.43 0.00 0.00 52.55 54.78 1rkq s ASP 10 Cb -0.14 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 39.96 1rkq s ASP 10 CO -0.03 -1.78 0.00 0.23 -0.17 0.00 0.00 175.17 173.42 1rkq n MET 11 N -3.07 0.00 -2.16 4.34 2.81 -1.26 -1.84 117.12 115.93 1rkq n MET 11 Ca 0.09 0.11 -0.42 0.00 -1.81 0.00 0.00 57.70 55.67 1rkq n MET 11 Cb 0.53 -0.52 -0.03 0.00 -0.71 0.00 0.00 33.22 32.49 1rkq n MET 11 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1rkq s ASP 12 N -3.03 6.81 0.00 7.83 1.01 -1.26 -1.71 116.67 126.31 1rkq s ASP 12 Ca 0.00 2.26 0.00 0.00 0.71 0.00 0.00 52.55 55.52 1rkq s ASP 12 Cb 0.00 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.36 1rkq s ASP 12 CO 0.00 -0.71 0.00 0.61 0.21 0.00 0.00 175.17 175.28 1rkq n GLY 13 N 3.61 2.02 0.43 0.21 0.00 -1.26 -4.83 105.19 105.37 1rkq n GLY 13 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1rkq n GLY 13 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1rkq n THR 14 N -2.00 0.00 -0.04 2.61 -1.04 -0.72 -4.44 114.28 108.65 1rkq n THR 14 Ca 0.00 0.00 -0.07 0.00 -2.04 0.00 0.00 64.05 61.94 1rkq n THR 14 Cb 0.00 -0.34 0.11 0.00 -1.82 0.00 0.00 70.33 68.28 1rkq n THR 14 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1rkq h LEU 15 N 0.00 0.68 -9.34 -4.42 5.85 -0.56 -3.43 115.31 104.09 1rkq h LEU 15 Ca 0.00 -0.27 -0.67 0.00 0.84 0.00 0.00 57.88 57.79 1rkq h LEU 15 Cb 0.00 -0.19 -0.13 0.00 0.37 0.00 0.00 40.66 40.71 1rkq h LEU 15 CO 0.00 0.94 -0.58 -0.76 -0.34 0.00 0.00 178.44 177.71 1rkq s LEU 16 N -8.72 3.83 1.20 2.25 1.43 -0.73 -4.63 118.68 113.31 1rkq s LEU 16 Ca -0.08 0.22 -0.15 0.00 -1.03 0.00 0.00 54.13 53.08 1rkq s LEU 16 Cb 0.13 -1.91 0.29 0.00 0.03 0.00 0.00 46.19 44.73 1rkq s LEU 16 CO 0.83 0.35 1.02 -0.76 0.23 0.00 0.00 176.35 178.02 1rkq s LEU 17 N -0.71 0.52 0.56 1.79 1.43 -0.00 -4.13 118.68 118.15 1rkq s LEU 17 Ca 0.12 1.26 0.36 0.00 -1.03 0.00 0.00 54.13 54.84 1rkq s LEU 17 Cb -0.12 -3.10 1.60 0.00 0.03 0.00 0.00 46.19 44.60 1rkq s LEU 17 CO 0.02 -4.29 2.06 1.55 0.23 0.00 0.00 176.35 175.93 1rkq h PRO 18 N -2.68 0.00 -0.29 1.29 0.13 -1.96 0.14 132.00 128.62 1rkq h PRO 18 Ca -0.57 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.56 1rkq h PRO 18 Cb 1.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.47 1rkq h PRO 18 CO 0.47 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.84 1rkq n ASP 19 N -3.04 1.56 -0.38 1.44 5.75 -1.26 -4.91 116.55 115.70 1rkq n ASP 19 Ca -0.00 -2.00 -0.05 0.00 -0.01 0.00 0.00 54.79 52.73 1rkq n ASP 19 Cb 0.25 -0.19 -0.02 0.00 -1.03 0.00 0.00 41.12 40.12 1rkq n ASP 19 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 1rkq n HIS 20 N 0.35 0.00 -3.30 2.11 8.25 0.47 -5.03 115.22 118.07 1rkq n HIS 20 Ca 0.10 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.37 1rkq n HIS 20 Cb 0.25 -1.22 0.00 0.00 1.12 0.00 0.00 29.99 30.13 1rkq n HIS 20 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1rkq s THR 21 N -2.14 3.78 -0.22 1.59 -4.23 -1.26 -4.84 115.64 108.33 1rkq s THR 21 Ca 0.00 -0.95 -0.06 0.00 -1.18 0.00 0.00 61.69 59.50 1rkq s THR 21 Cb 0.00 -3.31 -0.03 0.00 1.34 0.00 0.00 72.50 70.50 1rkq s THR 21 CO 0.00 -0.13 0.03 -0.63 -0.54 0.00 0.00 174.62 173.35 1rkq s ILE 22 N -2.26 4.16 0.76 2.99 1.01 -1.26 -0.82 121.20 125.77 1rkq s ILE 22 Ca 0.48 -0.24 -0.13 0.00 0.00 0.00 0.00 60.65 60.76 1rkq s ILE 22 Cb -0.10 -2.90 0.05 0.00 0.01 0.00 0.00 42.46 39.52 1rkq s ILE 22 CO 0.32 0.40 1.15 -0.94 0.00 0.00 0.00 174.94 175.87 1rkq s SER 23 N 1.16 4.21 0.22 3.58 1.04 -1.26 -4.80 113.70 117.85 1rkq s SER 23 Ca 0.03 2.15 -0.09 0.00 0.48 0.00 0.00 55.95 58.53 1rkq s SER 23 Cb -0.14 -2.56 0.26 0.00 0.10 0.00 0.00 66.02 63.67 1rkq s SER 23 CO 0.02 -2.24 1.82 -0.65 0.98 0.00 0.00 173.24 173.17 1rkq h PRO 24 N -0.67 0.73 -0.38 4.02 0.11 -1.99 -0.95 132.00 132.88 1rkq h PRO 24 Ca -0.46 -0.04 0.07 0.00 0.11 0.00 0.00 66.00 65.68 1rkq h PRO 24 Cb 1.27 -0.17 -0.06 0.00 0.11 0.00 0.00 31.00 32.15 1rkq h PRO 24 CO 0.49 0.48 0.00 0.00 -0.21 0.00 0.00 178.00 178.77 1rkq h ALA 25 N 1.36 0.35 -0.48 -0.75 0.00 -1.99 0.03 119.26 117.78 1rkq h ALA 25 Ca 0.31 0.11 -0.12 0.00 0.00 0.00 0.00 54.91 55.21 1rkq h ALA 25 Cb 0.17 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1rkq h ALA 25 CO -0.17 -0.39 -0.19 0.28 0.00 0.00 0.00 179.25 178.77 1rkq h VAL 26 N 0.11 1.27 -0.63 0.00 2.07 -1.80 -1.81 116.25 115.47 1rkq h VAL 26 Ca 0.19 -1.35 -0.05 0.00 0.82 0.00 0.00 66.70 66.31 1rkq h VAL 26 Cb 0.26 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 31.11 1rkq h VAL 26 CO -0.31 0.46 0.20 0.11 0.02 0.00 0.00 177.57 178.05 1rkq h LYS 27 N 0.83 0.95 -0.03 1.57 1.57 -0.89 -1.68 116.57 118.88 1rkq h LYS 27 Ca 0.11 -0.18 -0.15 0.00 -1.87 0.00 0.00 60.65 58.57 1rkq h LYS 27 Cb 0.76 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.90 1rkq h LYS 27 CO 0.06 0.81 -0.66 -0.91 -0.57 0.00 0.00 179.45 178.18 1rkq h ASN 28 N 0.92 0.15 -0.10 0.86 2.35 -0.90 -1.30 115.58 117.55 1rkq h ASN 28 Ca 0.21 -0.09 -0.18 0.00 -0.55 0.00 0.00 56.30 55.68 1rkq h ASN 28 Cb 0.25 -0.04 -0.00 0.00 0.05 0.00 0.00 38.32 38.58 1rkq h ASN 28 CO -0.01 0.76 -0.60 0.00 -1.65 0.00 0.00 177.43 175.93 1rkq h ALA 29 N 1.24 0.54 -0.37 -0.83 0.00 -1.09 -0.50 119.26 118.25 1rkq h ALA 29 Ca -0.01 -0.54 -0.12 0.00 0.00 0.00 0.00 54.91 54.24 1rkq h ALA 29 Cb 1.18 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1rkq h ALA 29 CO 0.09 0.69 -0.26 0.82 0.00 0.00 0.00 179.25 180.60 1rkq h ILE 30 N 0.53 1.27 -0.65 0.00 2.04 -1.15 -1.09 117.51 118.47 1rkq h ILE 30 Ca -0.00 -1.38 -0.06 0.00 1.00 0.00 0.00 64.86 64.42 1rkq h ILE 30 Cb 1.19 1.26 -0.03 0.00 -0.74 0.00 0.00 36.82 38.50 1rkq h ILE 30 CO 0.12 0.46 0.18 0.00 0.00 0.00 0.00 178.15 178.91 1rkq h ALA 31 N 1.05 0.85 -0.31 1.87 0.00 -1.07 -1.06 119.26 120.60 1rkq h ALA 31 Ca 0.09 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 1rkq h ALA 31 Cb 0.77 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1rkq h ALA 31 CO 0.06 0.55 0.08 0.00 0.00 0.00 0.00 179.25 179.94 1rkq h ALA 32 N 1.07 0.40 -0.83 0.00 0.00 -0.83 0.38 119.26 119.44 1rkq h ALA 32 Ca 0.21 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1rkq h ALA 32 Cb 0.33 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 1rkq h ALA 32 CO -0.00 0.06 0.44 0.00 0.00 0.00 0.00 179.25 179.75 1rkq h ALA 33 N 0.91 1.20 0.00 0.00 0.00 -1.02 -2.86 119.26 117.48 1rkq h ALA 33 Ca 0.10 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 1rkq h ALA 33 Cb 0.29 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1rkq h ALA 33 CO 0.00 0.63 -0.59 0.00 0.00 0.00 0.00 179.25 179.29 1rkq h ARG 34 N 1.17 0.00 0.00 0.00 3.08 -0.99 -1.73 114.38 115.91 1rkq h ARG 34 Ca 0.29 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.31 1rkq h ARG 34 Cb 0.06 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 1rkq h ARG 34 CO -0.04 0.59 -0.17 0.00 -1.07 0.00 0.00 179.97 179.28 1rkq h ALA 35 N 1.41 1.33 -0.00 0.04 0.00 -0.71 0.04 119.26 121.37 1rkq h ALA 35 Ca -0.01 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1rkq h ALA 35 Cb 1.08 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1rkq h ALA 35 CO 0.08 0.21 -0.08 0.54 0.00 0.00 0.00 179.25 180.00 1rkq n ARG 36 N -3.78 0.75 -0.30 0.00 1.74 -0.94 -4.93 116.66 109.20 1rkq n ARG 36 Ca -0.02 -0.23 0.00 0.00 -0.77 0.00 0.00 57.85 56.83 1rkq n ARG 36 Cb 0.28 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.22 1rkq n ARG 36 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1rkq n GLY 37 N 1.25 0.77 3.72 -0.13 0.00 0.00 -5.05 105.19 105.75 1rkq n GLY 37 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 1rkq n GLY 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rkq s VAL 38 N -2.23 5.00 0.09 1.61 1.01 -0.69 -5.00 120.40 120.19 1rkq s VAL 38 Ca 0.00 1.56 -0.26 0.00 0.00 0.00 0.00 61.98 63.28 1rkq s VAL 38 Cb 0.00 -4.09 -0.06 0.00 0.00 0.00 0.00 36.38 32.23 1rkq s VAL 38 CO 0.00 0.24 0.80 0.21 0.00 0.00 0.00 175.10 176.35 1rkq s ASN 39 N 0.79 7.32 -0.16 3.32 2.47 -0.22 -3.99 114.94 124.46 1rkq s ASN 39 Ca 0.40 1.57 0.01 0.00 0.42 0.00 0.00 52.86 55.26 1rkq s ASN 39 Cb -0.18 -2.50 0.01 0.00 -1.45 0.00 0.00 41.25 37.13 1rkq s ASN 39 CO 0.20 0.06 -0.19 -0.69 -3.72 0.00 0.00 177.10 172.77 1rkq s VAL 40 N -0.39 2.27 -0.18 -5.21 1.01 -1.26 -0.70 120.40 115.94 1rkq s VAL 40 Ca 0.39 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.48 1rkq s VAL 40 Cb -0.22 -1.95 0.04 0.00 0.00 0.00 0.00 36.38 34.26 1rkq s VAL 40 CO 0.25 0.53 -0.08 0.54 0.00 0.00 0.00 175.10 176.35 1rkq s VAL 41 N 1.05 1.37 0.16 2.92 0.11 0.45 -4.74 120.40 121.71 1rkq s VAL 41 Ca -0.01 -0.82 -0.31 0.00 -2.93 0.00 0.00 61.98 57.90 1rkq s VAL 41 Cb -0.14 -1.50 -0.09 0.00 -1.53 0.00 0.00 36.38 33.11 1rkq s VAL 41 CO -0.06 0.14 1.51 -0.76 -3.33 0.00 0.00 175.10 172.60 1rkq s LEU 42 N 1.52 4.37 -0.33 2.54 1.43 -1.26 -1.41 118.68 125.53 1rkq s LEU 42 Ca -0.00 2.54 -0.01 0.00 -1.03 0.00 0.00 54.13 55.62 1rkq s LEU 42 Cb -0.16 -3.59 0.11 0.00 0.03 0.00 0.00 46.19 42.58 1rkq s LEU 42 CO -0.08 -0.77 0.14 -0.89 0.23 0.00 0.00 176.35 174.99 1rkq s THR 43 N 1.05 0.68 0.04 5.49 2.01 -0.17 -1.21 115.64 123.54 1rkq s THR 43 Ca 0.68 -1.50 -0.01 0.00 0.31 0.00 0.00 61.69 61.17 1rkq s THR 43 Cb -0.42 -1.51 -0.03 0.00 0.01 0.00 0.00 72.50 70.55 1rkq s THR 43 CO 0.32 -0.76 -0.03 0.28 -0.69 0.00 0.00 174.62 173.73 1rkq s THR 44 N 1.43 0.18 0.15 -0.82 -1.32 -0.17 -3.83 115.64 111.27 1rkq s THR 44 Ca 0.12 -1.49 0.28 0.00 -1.21 0.00 0.00 61.69 59.40 1rkq s THR 44 Cb -0.19 -1.07 0.30 0.00 -1.51 0.00 0.00 72.50 70.04 1rkq s THR 44 CO -0.20 -0.82 1.91 1.23 -2.21 0.00 0.00 174.62 174.54 1rkq h GLY 45 N 3.69 0.00 -2.06 6.08 0.00 -1.90 -0.14 103.07 108.75 1rkq h GLY 45 Ca -0.33 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 46.45 1rkq h GLY 45 CO 0.57 0.00 0.19 0.54 0.00 0.00 0.00 176.54 177.84 1rkq n ARG 46 N -3.30 0.50 -1.16 4.80 1.74 -1.26 -3.43 116.66 114.56 1rkq n ARG 46 Ca 0.00 0.23 -0.31 0.00 -0.77 0.00 0.00 57.85 57.00 1rkq n ARG 46 Cb 0.36 -2.30 0.11 0.00 -1.02 0.00 0.00 32.46 29.61 1rkq n ARG 46 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1rkq s PRO 47 N -3.50 1.94 0.45 5.56 0.04 -1.26 -1.22 135.00 137.02 1rkq s PRO 47 Ca 0.74 1.34 0.18 0.00 0.04 0.00 0.00 61.00 63.30 1rkq s PRO 47 Cb -0.34 -1.85 1.13 0.00 0.04 0.00 0.00 34.50 33.48 1rkq s PRO 47 CO 0.49 -1.90 1.93 -0.92 0.04 0.00 0.00 177.00 176.64 1rkq h TYR 48 N -1.17 0.38 -0.53 0.56 3.20 -1.94 0.34 116.97 117.81 1rkq h TYR 48 Ca -0.44 0.01 0.15 0.00 3.14 0.00 0.00 58.73 61.59 1rkq h TYR 48 Cb 1.25 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 39.38 1rkq h TYR 48 CO 0.55 0.14 0.39 0.00 -1.64 0.00 0.00 178.16 177.60 1rkq h ALA 49 N 1.66 2.47 -0.40 1.82 0.00 -1.88 0.16 119.26 123.08 1rkq h ALA 49 Ca 0.35 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1rkq h ALA 49 Cb 0.91 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1rkq h ALA 49 CO -0.10 -0.67 0.00 0.41 0.00 0.00 0.00 179.25 178.90 1rkq n GLY 50 N -1.63 1.11 0.00 0.00 0.00 0.11 -4.42 105.19 100.36 1rkq n GLY 50 Ca 0.10 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.59 1rkq n GLY 50 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1rkq n VAL 51 N 0.86 0.00 0.27 1.61 0.31 0.47 -4.83 118.33 117.02 1rkq n VAL 51 Ca 0.17 0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.61 1rkq n VAL 51 Cb 0.42 -0.58 0.73 0.00 -0.91 0.00 0.00 33.84 33.50 1rkq n VAL 51 CO 0.00 0.00 0.00 1.12 -1.32 0.00 0.00 176.83 176.63 1rkq h HIS 52 N 0.00 0.00 -0.24 3.52 -0.00 -1.51 0.10 115.15 117.02 1rkq h HIS 52 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 60.37 60.24 1rkq h HIS 52 Cb 0.94 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.34 1rkq h HIS 52 CO 0.00 0.07 -0.39 -0.91 -0.00 0.00 0.00 177.93 176.70 1rkq h ASN 53 N 0.00 0.57 0.37 3.10 -0.26 -1.87 -2.04 115.58 115.45 1rkq h ASN 53 Ca -0.00 -0.25 -0.15 0.00 -0.56 0.00 0.00 56.30 55.34 1rkq h ASN 53 Cb 0.14 -0.16 -0.01 0.00 -1.06 0.00 0.00 38.32 37.23 1rkq h ASN 53 CO 0.01 0.90 -0.64 1.88 -1.06 0.00 0.00 177.43 178.52 1rkq h TYR 54 N 0.45 0.33 -0.60 1.19 0.05 -1.32 -1.66 116.97 115.41 1rkq h TYR 54 Ca 0.04 -0.13 0.02 0.00 0.05 0.00 0.00 58.73 58.72 1rkq h TYR 54 Cb 0.88 -0.06 -0.04 0.00 1.01 0.00 0.00 36.73 38.53 1rkq h TYR 54 CO 0.03 0.82 0.37 -0.07 -1.05 0.00 0.00 178.16 178.26 1rkq h LEU 55 N 0.18 0.61 -0.64 3.88 3.38 -1.00 -1.30 115.31 120.42 1rkq h LEU 55 Ca -0.01 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 1rkq h LEU 55 Cb 1.16 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 1rkq h LEU 55 CO 0.10 0.43 -0.24 0.50 0.09 0.00 0.00 178.44 179.31 1rkq h LYS 56 N 0.73 0.81 -0.71 1.13 3.64 -1.25 0.47 116.57 121.40 1rkq h LYS 56 Ca 0.24 -0.34 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1rkq h LYS 56 Cb 0.01 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 1rkq h LYS 56 CO -0.10 0.96 0.46 1.49 -2.27 0.00 0.00 179.45 180.00 1rkq h GLU 57 N 0.70 0.94 -0.22 1.90 4.81 -0.93 -1.89 114.58 119.89 1rkq h GLU 57 Ca 0.09 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1rkq h GLU 57 Cb 0.77 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.94 1rkq h GLU 57 CO 0.06 0.63 0.00 1.28 -0.73 0.00 0.00 179.01 180.25 1rkq n LEU 58 N -4.42 1.68 -3.76 1.64 4.77 -0.52 -4.93 117.00 111.45 1rkq n LEU 58 Ca 0.07 -0.75 -0.26 0.00 -0.03 0.00 0.00 56.01 55.05 1rkq n LEU 58 Cb 0.04 -0.14 0.04 0.00 -2.33 0.00 0.00 43.42 41.03 1rkq n LEU 58 CO 0.36 0.37 0.10 1.41 -1.33 0.00 0.00 177.39 178.31 1rkq n HIS 59 N 0.35 -2.35 -2.76 -1.77 8.25 -0.71 -4.89 115.22 111.35 1rkq n HIS 59 Ca 0.15 0.92 -0.43 0.00 -0.26 0.00 0.00 57.72 58.09 1rkq n HIS 59 Cb 0.31 -4.40 0.00 0.00 1.12 0.00 0.00 29.99 27.03 1rkq n HIS 59 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1rkq n MET 60 N -4.64 3.72 -0.07 -0.41 2.81 0.09 -4.54 117.12 114.10 1rkq n MET 60 Ca -0.06 -3.94 0.01 0.00 -1.81 0.00 0.00 57.70 51.90 1rkq n MET 60 Cb 0.58 -2.82 0.01 0.00 -0.71 0.00 0.00 33.22 30.27 1rkq n MET 60 CO 0.00 0.00 0.00 -0.85 1.51 0.00 0.00 175.97 176.63 1rkq n GLU 61 N 3.66 1.11 -3.30 0.03 0.28 -1.26 -4.19 120.64 116.96 1rkq n GLU 61 Ca 0.34 -1.08 -0.27 0.00 -0.16 0.00 0.00 57.16 55.99 1rkq n GLU 61 Cb 0.38 -0.76 -0.02 0.00 1.43 0.00 0.00 31.44 32.47 1rkq n GLU 61 CO 0.00 0.00 0.00 1.14 -0.16 0.00 0.00 177.13 178.11 1rkq s GLN 62 N -0.59 3.57 0.52 3.44 -2.07 -1.26 -4.72 119.66 118.54 1rkq s GLN 62 Ca 0.03 -0.11 0.26 0.00 -1.82 0.00 0.00 55.36 53.72 1rkq s GLN 62 Cb 0.03 -2.64 1.38 0.00 -1.09 0.00 0.00 33.01 30.69 1rkq s GLN 62 CO 0.00 0.16 1.95 -1.35 -1.32 0.00 0.00 175.29 174.73 1rkq h PRO 63 N 1.24 0.06 -0.64 9.60 0.11 -2.01 -2.29 132.00 138.07 1rkq h PRO 63 Ca -0.48 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1rkq h PRO 63 Cb 1.20 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1rkq h PRO 63 CO 0.64 0.04 0.00 0.41 -0.21 0.00 0.00 178.00 178.88 1rkq n GLY 64 N -1.65 2.32 3.84 -0.55 0.00 -1.26 -4.92 105.19 102.97 1rkq n GLY 64 Ca 0.14 -0.69 -0.38 0.00 0.00 0.00 0.00 46.02 45.09 1rkq n GLY 64 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1rkq s ASP 65 N -0.76 6.66 0.18 1.61 1.01 -0.86 -5.03 116.67 119.49 1rkq s ASP 65 Ca 0.42 0.79 0.03 0.00 0.71 0.00 0.00 52.55 54.49 1rkq s ASP 65 Cb 0.28 -2.20 -0.05 0.00 1.01 0.00 0.00 42.92 41.97 1rkq s ASP 65 CO 0.18 0.33 -0.01 -0.31 0.21 0.00 0.00 175.17 175.56 1rkq s TYR 66 N -0.92 1.30 0.05 4.23 1.51 -1.26 -1.13 117.35 121.13 1rkq s TYR 66 Ca 0.21 -0.96 -0.01 0.00 -1.01 0.00 0.00 57.07 55.30 1rkq s TYR 66 Cb -0.15 -0.74 -0.04 0.00 -0.11 0.00 0.00 41.96 40.93 1rkq s TYR 66 CO 0.10 -0.14 -0.03 0.00 -1.11 0.00 0.00 175.55 174.37 1rkq s ILE 68 N -3.47 1.74 0.32 0.00 1.01 -0.35 -1.12 121.20 119.34 1rkq s ILE 68 Ca 0.03 -0.85 0.04 0.00 0.00 0.00 0.00 60.65 59.87 1rkq s ILE 68 Cb 0.05 -1.67 -0.06 0.00 0.01 0.00 0.00 42.46 40.79 1rkq s ILE 68 CO -0.08 0.39 0.04 0.42 0.00 0.00 0.00 174.94 175.70 1rkq s THR 69 N 1.40 1.29 -1.44 2.92 -4.23 -0.55 -1.00 115.64 114.02 1rkq s THR 69 Ca 0.03 -2.02 -0.09 0.00 -1.18 0.00 0.00 61.69 58.43 1rkq s THR 69 Cb -0.14 -2.74 0.05 0.00 1.34 0.00 0.00 72.50 71.01 1rkq s THR 69 CO -0.10 -0.06 0.71 -1.22 -0.54 0.00 0.00 174.62 173.40 1rkq n TYR 70 N -0.67 -2.06 -1.83 3.99 4.02 -0.36 -1.25 117.16 119.00 1rkq n TYR 70 Ca -0.03 0.64 -0.16 0.00 -0.01 0.00 0.00 57.90 58.34 1rkq n TYR 70 Cb 0.66 -3.84 -0.04 0.00 -0.02 0.00 0.00 39.34 36.10 1rkq n TYR 70 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 1rkq n ASN 71 N -2.55 -4.85 0.00 7.72 5.15 -0.09 -1.87 115.26 118.76 1rkq n ASN 71 Ca -0.03 0.22 0.00 0.00 -0.60 0.00 0.00 54.58 54.17 1rkq n ASN 71 Cb 0.56 -3.85 0.00 0.00 -0.53 0.00 0.00 39.78 35.96 1rkq n ASN 71 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1rkq n GLY 72 N -1.02 0.12 0.28 8.20 0.00 -0.38 -2.76 105.19 109.63 1rkq n GLY 72 Ca -0.17 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.03 1rkq n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rkq h ALA 73 N 0.00 1.00 -3.66 4.61 0.00 -1.31 -3.42 119.26 116.48 1rkq h ALA 73 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.55 1rkq h ALA 73 Cb 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 17.79 17.47 1rkq h ALA 73 CO 0.00 0.00 -0.76 -1.17 0.00 0.00 0.00 179.25 177.32 1rkq s LEU 74 N -6.00 1.58 -0.08 0.00 2.96 -1.07 -1.57 118.68 114.50 1rkq s LEU 74 Ca -0.01 -0.10 0.05 0.00 -0.22 0.00 0.00 54.13 53.85 1rkq s LEU 74 Cb 0.10 -0.34 -0.01 0.00 0.50 0.00 0.00 46.19 46.45 1rkq s LEU 74 CO 0.48 -0.01 -0.23 -0.69 -1.32 0.00 0.00 176.35 174.57 1rkq s VAL 75 N 0.49 2.16 0.12 1.68 1.01 0.01 -1.48 120.40 124.39 1rkq s VAL 75 Ca -0.06 -1.01 0.04 0.00 0.00 0.00 0.00 61.98 60.95 1rkq s VAL 75 Cb -0.09 -1.81 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 1rkq s VAL 75 CO -0.00 0.56 -0.09 -1.10 0.00 0.00 0.00 175.10 174.47 1rkq s GLN 76 N 0.05 0.93 0.07 2.72 -0.21 -0.27 -0.43 119.66 122.52 1rkq s GLN 76 Ca -0.10 -1.32 -0.30 0.00 0.02 0.00 0.00 55.36 53.66 1rkq s GLN 76 Cb -0.15 -0.50 -0.05 0.00 1.00 0.00 0.00 33.01 33.30 1rkq s GLN 76 CO 0.06 0.06 1.12 0.15 -2.12 0.00 0.00 175.29 174.56 1rkq s LYS 77 N -3.41 4.50 0.41 2.91 -0.14 0.02 -1.14 119.74 122.89 1rkq s LYS 77 Ca 0.11 1.67 0.22 0.00 -1.36 0.00 0.00 55.97 56.62 1rkq s LYS 77 Cb 0.01 -3.36 0.78 0.00 -1.68 0.00 0.00 37.83 33.59 1rkq s LYS 77 CO -0.01 -0.13 1.77 0.00 -0.76 0.00 0.00 175.35 176.22 1rkq h ALA 78 N 6.43 0.99 -0.51 5.17 0.00 -1.41 -0.23 119.26 129.69 1rkq h ALA 78 Ca -0.42 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.14 1rkq h ALA 78 Cb 1.21 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 1rkq h ALA 78 CO 0.78 0.35 -0.05 0.00 0.00 0.00 0.00 179.25 180.33 1rkq h ALA 79 N 1.72 0.70 0.00 0.00 0.00 -1.76 -3.37 119.26 116.55 1rkq h ALA 79 Ca -0.00 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1rkq h ALA 79 Cb 0.84 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1rkq h ALA 79 CO 0.04 0.56 -0.01 -0.40 0.00 0.00 0.00 179.25 179.44 1rkq n ASP 80 N -4.25 0.48 0.00 0.00 5.68 -1.24 -4.99 116.55 112.23 1rkq n ASP 80 Ca 0.01 -1.26 0.00 0.00 -0.50 0.00 0.00 54.79 53.04 1rkq n ASP 80 Cb 0.36 -0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.33 1rkq n ASP 80 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1rkq n GLY 81 N -0.12 0.32 3.76 6.12 0.00 -0.10 -5.00 105.19 110.17 1rkq n GLY 81 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1rkq n GLY 81 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1rkq s SER 82 N -2.15 5.72 0.08 1.61 1.04 -1.24 -4.65 113.70 114.10 1rkq s SER 82 Ca 0.00 2.45 -0.31 0.00 0.48 0.00 0.00 55.95 58.57 1rkq s SER 82 Cb 0.00 -2.61 -0.07 0.00 0.10 0.00 0.00 66.02 63.44 1rkq s SER 82 CO 0.00 -1.24 1.31 -0.89 0.98 0.00 0.00 173.24 173.40 1rkq s THR 83 N -1.50 3.65 -0.15 2.02 2.01 -1.26 -0.80 115.64 119.62 1rkq s THR 83 Ca 0.69 1.17 0.10 0.00 0.31 0.00 0.00 61.69 63.96 1rkq s THR 83 Cb -0.32 -3.75 -0.16 0.00 0.01 0.00 0.00 72.50 68.27 1rkq s THR 83 CO 0.38 0.08 0.00 0.52 -0.69 0.00 0.00 174.62 174.91 1rkq n VAL 84 N 4.03 1.00 -3.69 3.82 0.31 0.43 -4.87 118.33 119.36 1rkq n VAL 84 Ca 0.11 -0.56 -0.14 0.00 -0.01 0.00 0.00 64.34 63.73 1rkq n VAL 84 Cb 0.44 -0.74 -0.08 0.00 -0.91 0.00 0.00 33.84 32.55 1rkq n VAL 84 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1rkq s ALA 85 N -2.35 -1.17 -0.09 3.52 0.00 -1.02 -4.96 121.76 115.68 1rkq s ALA 85 Ca -0.11 0.97 -0.09 0.00 0.00 0.00 0.00 51.96 52.73 1rkq s ALA 85 Cb 0.05 -0.29 0.02 0.00 0.00 0.00 0.00 23.12 22.90 1rkq s ALA 85 CO 0.55 -0.27 0.24 -1.14 0.00 0.00 0.00 175.76 175.14 1rkq s GLN 86 N -0.66 0.30 -0.13 0.00 0.74 -1.26 -0.81 119.66 117.84 1rkq s GLN 86 Ca -0.08 0.31 -0.04 0.00 0.05 0.00 0.00 55.36 55.61 1rkq s GLN 86 Cb -0.03 0.15 0.05 0.00 1.10 0.00 0.00 33.01 34.27 1rkq s GLN 86 CO 0.04 -0.04 0.07 0.99 -0.55 0.00 0.00 175.29 175.80 1rkq s THR 87 N 0.05 0.02 0.16 -0.34 2.01 -0.61 -5.03 115.64 111.90 1rkq s THR 87 Ca -0.01 -0.04 0.02 0.00 0.31 0.00 0.00 61.69 61.97 1rkq s THR 87 Cb -0.02 -0.52 -0.04 0.00 0.01 0.00 0.00 72.50 71.93 1rkq s THR 87 CO 0.00 -0.11 0.30 0.00 -0.69 0.00 0.00 174.62 174.12 1rkq s ALA 88 N 2.10 3.96 0.58 7.40 0.00 -1.26 -4.72 121.76 129.82 1rkq s ALA 88 Ca 0.03 -1.03 -0.18 0.00 0.00 0.00 0.00 51.96 50.78 1rkq s ALA 88 Cb -0.15 -1.79 -0.04 0.00 0.00 0.00 0.00 23.12 21.14 1rkq s ALA 88 CO -0.07 0.52 1.13 -0.51 0.00 0.00 0.00 175.76 176.82 1rkq s LEU 89 N -3.28 3.62 0.86 0.00 1.43 0.28 -4.84 118.68 116.75 1rkq s LEU 89 Ca 0.35 2.13 -0.13 0.00 -1.03 0.00 0.00 54.13 55.44 1rkq s LEU 89 Cb -0.11 -4.57 0.13 0.00 0.03 0.00 0.00 46.19 41.67 1rkq s LEU 89 CO 0.29 -1.37 1.22 -0.94 0.23 0.00 0.00 176.35 175.77 1rkq s SER 90 N -2.04 3.99 0.22 2.29 1.04 -1.26 -4.08 113.70 113.85 1rkq s SER 90 Ca 0.71 0.54 -0.07 0.00 0.48 0.00 0.00 55.95 57.61 1rkq s SER 90 Cb -0.23 -0.86 0.18 0.00 0.10 0.00 0.00 66.02 65.21 1rkq s SER 90 CO 0.32 -2.20 1.73 0.22 0.98 0.00 0.00 173.24 174.28 1rkq h TYR 91 N -1.24 1.11 -0.36 5.02 3.20 -1.87 -1.01 116.97 121.81 1rkq h TYR 91 Ca -0.45 -0.14 -0.07 0.00 3.14 0.00 0.00 58.73 61.21 1rkq h TYR 91 Cb 1.29 -0.31 -0.02 0.00 1.54 0.00 0.00 36.73 39.23 1rkq h TYR 91 CO -0.26 0.92 -0.06 -0.44 -1.64 0.00 0.00 178.16 176.68 1rkq h ASP 92 N 0.99 0.58 -0.55 -2.11 3.32 -1.94 -0.40 116.42 116.30 1rkq h ASP 92 Ca 0.20 -0.14 -0.10 0.00 0.02 0.00 0.00 57.03 57.02 1rkq h ASP 92 Cb 0.40 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 1rkq h ASP 92 CO 0.01 0.68 -0.03 0.44 -1.72 0.00 0.00 179.24 178.62 1rkq h ASP 93 N 0.56 0.98 -0.30 6.45 3.32 -1.83 -1.44 116.42 124.16 1rkq h ASP 93 Ca 0.11 -0.32 0.06 0.00 0.02 0.00 0.00 57.03 56.89 1rkq h ASP 93 Cb 0.44 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 39.68 1rkq h ASP 93 CO 0.02 1.06 -0.03 0.22 -1.72 0.00 0.00 179.24 178.80 1rkq h TYR 94 N 0.87 -0.06 -0.45 4.55 3.20 -0.55 -0.04 116.97 124.49 1rkq h TYR 94 Ca 0.15 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.97 1rkq h TYR 94 Cb 0.58 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.91 1rkq h TYR 94 CO 0.04 -0.08 -0.05 0.00 -1.64 0.00 0.00 178.16 176.43 1rkq h ARG 95 N 0.06 0.76 -0.38 1.82 2.47 -0.94 0.32 114.38 118.48 1rkq h ARG 95 Ca 0.15 -0.22 -0.01 0.00 -1.26 0.00 0.00 59.98 58.64 1rkq h ARG 95 Cb 0.21 -0.08 -0.02 0.00 -1.65 0.00 0.00 29.97 28.43 1rkq h ARG 95 CO -0.27 0.80 0.21 0.35 0.56 0.00 0.00 179.97 181.62 1rkq h PHE 96 N 0.70 0.53 0.00 3.04 3.57 -0.93 -2.33 116.94 121.52 1rkq h PHE 96 Ca 0.13 -0.01 -0.18 0.00 3.53 0.00 0.00 57.97 61.43 1rkq h PHE 96 Cb 0.50 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 39.05 1rkq h PHE 96 CO 0.03 0.42 -0.84 -0.07 -2.23 0.00 0.00 178.31 175.61 1rkq h LEU 97 N 0.49 0.09 -0.86 0.59 3.38 -0.74 -0.51 115.31 117.75 1rkq h LEU 97 Ca 0.14 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 1rkq h LEU 97 Cb 0.06 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 1rkq h LEU 97 CO -0.02 0.89 0.35 -0.08 0.09 0.00 0.00 178.44 179.67 1rkq h GLU 98 N 0.04 1.18 -0.30 1.13 4.22 -0.91 -0.94 114.58 119.00 1rkq h GLU 98 Ca -0.02 -0.19 -0.17 0.00 0.08 0.00 0.00 59.36 59.06 1rkq h GLU 98 Cb 1.48 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 30.52 1rkq h GLU 98 CO 0.12 0.93 -0.47 -0.22 -2.18 0.00 0.00 179.01 177.18 1rkq h LYS 99 N 1.16 0.84 -0.74 1.92 3.64 -1.26 -2.79 116.57 119.34 1rkq h LYS 99 Ca 0.27 -0.51 0.05 0.00 -1.27 0.00 0.00 60.65 59.19 1rkq h LYS 99 Cb 0.17 0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.98 1rkq h LYS 99 CO -0.03 1.15 0.44 1.25 -2.27 0.00 0.00 179.45 179.99 1rkq h LEU 100 N 0.62 0.69 -1.00 5.20 5.85 -0.82 -1.18 115.31 124.67 1rkq h LEU 100 Ca 0.02 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.78 1rkq h LEU 100 Cb 1.08 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.93 1rkq h LEU 100 CO 0.11 0.45 0.66 0.77 -0.34 0.00 0.00 178.44 180.09 1rkq h SER 101 N 0.82 1.13 0.46 1.25 4.64 -0.96 -0.28 113.55 120.62 1rkq h SER 101 Ca 0.32 -0.02 -0.09 0.00 -0.47 0.00 0.00 61.79 61.52 1rkq h SER 101 Cb 0.14 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 61.94 1rkq h SER 101 CO -0.16 0.80 -0.45 0.03 -0.87 0.00 0.00 176.83 176.18 1rkq h ARG 102 N 1.32 0.00 -0.15 4.77 3.08 -1.12 -1.44 114.38 120.84 1rkq h ARG 102 Ca 0.38 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 60.22 1rkq h ARG 102 Cb -0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.95 1rkq h ARG 102 CO -0.09 0.45 -0.73 0.93 -1.07 0.00 0.00 179.97 179.45 1rkq h GLU 103 N 0.00 0.71 -0.01 0.04 5.08 0.07 -3.09 114.58 117.37 1rkq h GLU 103 Ca -0.00 -0.55 0.00 0.00 -1.00 0.00 0.00 59.36 57.80 1rkq h GLU 103 Cb 0.80 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.16 1rkq h GLU 103 CO 0.06 1.17 -0.08 1.33 -1.00 0.00 0.00 179.01 180.49 1rkq n VAL 104 N -3.92 0.00 -1.94 3.13 0.24 -0.27 -4.97 118.33 110.59 1rkq n VAL 104 Ca -0.06 -0.18 0.00 0.00 -2.04 0.00 0.00 64.34 62.06 1rkq n VAL 104 Cb 0.72 0.34 0.00 0.00 -1.47 0.00 0.00 33.84 33.42 1rkq n VAL 104 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1rkq n GLY 105 N 1.21 0.51 3.52 7.63 0.00 -0.61 -4.23 105.19 113.22 1rkq n GLY 105 Ca 0.17 -0.82 -0.29 0.00 0.00 0.00 0.00 46.02 45.08 1rkq n GLY 105 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1rkq s SER 106 N -2.95 4.03 0.88 1.61 0.15 -0.78 -4.92 113.70 111.72 1rkq s SER 106 Ca 0.00 -0.55 -0.11 0.00 0.70 0.00 0.00 55.95 55.99 1rkq s SER 106 Cb 0.00 -0.62 0.12 0.00 -1.71 0.00 0.00 66.02 63.81 1rkq s SER 106 CO 0.00 0.16 1.09 -1.00 1.20 0.00 0.00 173.24 174.69 1rkq s HIS 107 N -1.29 2.35 -0.09 3.44 3.76 -1.19 -4.40 115.29 117.86 1rkq s HIS 107 Ca 0.20 1.30 -0.17 0.00 -0.15 0.00 0.00 55.06 56.24 1rkq s HIS 107 Cb -0.10 -3.15 0.04 0.00 1.11 0.00 0.00 32.58 30.48 1rkq s HIS 107 CO 0.12 -2.31 0.41 0.12 -0.85 0.00 0.00 174.74 172.22 1rkq s PHE 108 N -2.93 -0.38 0.07 1.40 5.36 -1.26 -1.85 117.98 118.39 1rkq s PHE 108 Ca 0.63 0.81 -0.13 0.00 -0.96 0.00 0.00 56.93 57.28 1rkq s PHE 108 Cb -0.18 0.16 0.02 0.00 -0.34 0.00 0.00 43.02 42.68 1rkq s PHE 108 CO 0.57 -0.33 0.30 -3.38 -1.46 0.00 0.00 175.22 170.92 1rkq s HIS 109 N -0.51 -0.07 0.06 10.12 -3.43 -0.67 -4.47 115.29 116.31 1rkq s HIS 109 Ca -0.06 -0.17 0.07 0.00 -0.80 0.00 0.00 55.06 54.10 1rkq s HIS 109 Cb -0.03 0.10 -0.03 0.00 -1.43 0.00 0.00 32.58 31.19 1rkq s HIS 109 CO 0.03 -0.56 -0.19 0.00 -2.00 0.00 0.00 174.74 172.02 1rkq s ALA 110 N -3.15 1.64 -0.02 -1.38 0.00 -0.17 -1.15 121.76 117.53 1rkq s ALA 110 Ca -0.01 -1.06 0.05 0.00 0.00 0.00 0.00 51.96 50.94 1rkq s ALA 110 Cb 0.01 -0.28 -0.01 0.00 0.00 0.00 0.00 23.12 22.84 1rkq s ALA 110 CO -0.07 0.35 -0.18 -0.51 0.00 0.00 0.00 175.76 175.35 1rkq s LEU 111 N -1.37 2.01 0.00 0.00 1.02 -0.35 -0.52 118.68 119.46 1rkq s LEU 111 Ca 0.06 -0.34 0.00 0.00 0.02 0.00 0.00 54.13 53.87 1rkq s LEU 111 Cb -0.09 -0.95 0.00 0.00 0.02 0.00 0.00 46.19 45.17 1rkq s LEU 111 CO 0.02 0.21 0.00 -0.90 0.02 0.00 0.00 176.35 175.70 1rkq n ASP 112 N 2.76 1.19 0.29 2.29 5.68 -0.75 -1.73 116.55 126.28 1rkq n ASP 112 Ca -0.16 -0.34 0.19 0.00 -0.50 0.00 0.00 54.79 53.98 1rkq n ASP 112 Cb 0.54 0.00 0.86 0.00 -1.14 0.00 0.00 41.12 41.37 1rkq n ASP 112 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 1rkq h ARG 113 N 0.00 0.00 0.00 0.11 9.65 -2.01 -3.33 114.38 118.80 1rkq h ARG 113 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1rkq h ARG 113 Cb 0.00 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.58 1rkq h ARG 113 CO 0.00 0.00 -0.26 0.25 2.80 0.00 0.00 179.97 182.76 1rkq n THR 114 N -3.02 0.00 -3.93 0.20 -2.24 -1.26 -4.84 114.28 99.20 1rkq n THR 114 Ca -0.01 -0.14 -0.10 0.00 -2.27 0.00 0.00 64.05 61.53 1rkq n THR 114 Cb 0.21 0.65 -0.12 0.00 -2.10 0.00 0.00 70.33 68.98 1rkq n THR 114 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1rkq s THR 115 N -0.80 0.07 -0.20 4.28 2.01 -1.25 -4.28 115.64 115.47 1rkq s THR 115 Ca 0.00 -0.60 -0.06 0.00 0.31 0.00 0.00 61.69 61.34 1rkq s THR 115 Cb 0.00 -0.22 -0.03 0.00 0.01 0.00 0.00 72.50 72.26 1rkq s THR 115 CO 0.00 -0.33 0.04 -0.22 -0.69 0.00 0.00 174.62 173.42 1rkq s LEU 116 N -0.99 3.53 0.03 4.42 2.96 -0.22 -1.82 118.68 126.60 1rkq s LEU 116 Ca -0.11 -0.08 0.09 0.00 -0.22 0.00 0.00 54.13 53.81 1rkq s LEU 116 Cb -0.07 -1.91 -0.03 0.00 0.50 0.00 0.00 46.19 44.69 1rkq s LEU 116 CO -0.00 0.09 -0.26 -0.31 -1.32 0.00 0.00 176.35 174.55 1rkq s TYR 117 N 0.87 2.34 0.02 5.38 1.51 0.32 -0.61 117.35 127.17 1rkq s TYR 117 Ca 0.03 -0.41 -0.02 0.00 -1.01 0.00 0.00 57.07 55.65 1rkq s TYR 117 Cb -0.14 -1.42 -0.01 0.00 -0.11 0.00 0.00 41.96 40.28 1rkq s TYR 117 CO 0.02 0.10 0.02 -0.08 -1.11 0.00 0.00 175.55 174.51 1rkq s THR 118 N -0.77 0.11 -2.45 -0.71 -1.32 -0.63 -1.00 115.64 108.87 1rkq s THR 118 Ca 0.12 -0.92 0.20 0.00 -1.21 0.00 0.00 61.69 59.88 1rkq s THR 118 Cb -0.10 -0.42 0.15 0.00 -1.51 0.00 0.00 72.50 70.62 1rkq s THR 118 CO 0.02 -0.50 1.12 0.00 -2.21 0.00 0.00 174.62 173.04 1rkq n ALA 119 N 1.41 2.49 -2.22 11.08 0.00 -1.21 -1.06 120.51 131.01 1rkq n ALA 119 Ca -0.23 -0.65 -0.42 0.00 0.00 0.00 0.00 53.44 52.14 1rkq n ALA 119 Cb 0.56 -0.67 -0.03 0.00 0.00 0.00 0.00 19.45 19.31 1rkq n ALA 119 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1rkq s ASN 120 N -1.66 6.87 0.06 0.00 0.02 -1.26 -4.85 114.94 114.11 1rkq s ASN 120 Ca 0.23 2.24 -0.09 0.00 -1.02 0.00 0.00 52.86 54.22 1rkq s ASN 120 Cb 0.16 -2.58 -0.31 0.00 0.02 0.00 0.00 41.25 38.54 1rkq s ASN 120 CO 0.25 -0.64 1.08 0.03 0.02 0.00 0.00 177.10 177.84 1rkq h ARG 121 N 7.03 0.38 -5.29 -0.60 3.08 -2.00 -3.34 114.38 113.63 1rkq h ARG 121 Ca -0.41 -0.64 -0.66 0.00 0.07 0.00 0.00 59.98 58.33 1rkq h ARG 121 Cb 1.20 0.24 -0.16 0.00 0.08 0.00 0.00 29.97 31.34 1rkq h ARG 121 CO 0.86 1.31 0.85 0.16 -1.07 0.00 0.00 179.97 182.08 1rkq s ASP 122 N -7.32 6.49 0.02 7.04 -4.77 -1.26 -5.01 116.67 111.86 1rkq s ASP 122 Ca -0.06 -1.68 -0.30 0.00 -3.30 0.00 0.00 52.55 47.21 1rkq s ASP 122 Cb 0.06 -2.43 -0.05 0.00 -1.09 0.00 0.00 42.92 39.41 1rkq s ASP 122 CO 0.91 -1.23 1.20 -0.63 0.70 0.00 0.00 175.17 176.12 1rkq s ILE 123 N 3.38 4.13 0.62 2.11 1.01 -1.26 -4.96 121.20 126.23 1rkq s ILE 123 Ca 0.32 1.51 -0.19 0.00 0.00 0.00 0.00 60.65 62.29 1rkq s ILE 123 Cb -0.07 -3.97 -0.03 0.00 0.01 0.00 0.00 42.46 38.41 1rkq s ILE 123 CO -0.04 0.07 1.21 -0.24 0.00 0.00 0.00 174.94 175.94 1rkq n SER 124 N 4.39 1.79 -0.28 3.58 2.88 -1.26 -4.88 113.62 119.84 1rkq n SER 124 Ca 0.10 0.84 0.17 0.00 -1.33 0.00 0.00 58.87 58.65 1rkq n SER 124 Cb 0.46 -1.51 0.45 0.00 -0.75 0.00 0.00 64.21 62.86 1rkq n SER 124 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 1rkq h TYR 125 N 0.64 0.71 0.00 0.66 3.20 -1.97 -0.27 116.97 119.94 1rkq h TYR 125 Ca -0.50 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.39 1rkq h TYR 125 Cb 1.34 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 39.40 1rkq h TYR 125 CO 0.40 0.18 -0.06 0.66 -1.64 0.00 0.00 178.16 177.70 1rkq n TYR 126 N -4.59 0.22 0.11 -3.82 4.01 -1.26 -0.43 117.16 111.40 1rkq n TYR 126 Ca 0.21 0.06 -0.23 0.00 -0.16 0.00 0.00 57.90 57.78 1rkq n TYR 126 Cb 0.66 -0.58 -0.15 0.00 -0.31 0.00 0.00 39.34 38.96 1rkq n TYR 126 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 1rkq h THR 127 N 0.00 1.15 -0.54 -0.72 2.02 -1.42 -2.36 112.91 111.04 1rkq h THR 127 Ca 0.00 -2.66 -0.01 0.00 0.77 0.00 0.00 66.41 64.51 1rkq h THR 127 Cb 0.56 2.91 -0.03 0.00 -1.74 0.00 0.00 68.15 69.85 1rkq h THR 127 CO 0.00 0.84 0.29 0.58 0.37 0.00 0.00 175.52 177.59 1rkq h VAL 128 N 0.12 1.19 -0.37 3.16 2.07 -1.20 -1.03 116.25 120.19 1rkq h VAL 128 Ca -0.28 -0.49 0.04 0.00 0.82 0.00 0.00 66.70 66.78 1rkq h VAL 128 Cb 2.12 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 32.38 1rkq h VAL 128 CO 0.23 0.20 0.14 -0.74 0.02 0.00 0.00 177.57 177.42 1rkq h HIS 129 N 0.72 0.24 -0.32 1.57 6.17 -0.79 -0.53 115.15 122.21 1rkq h HIS 129 Ca 0.19 0.02 -0.03 0.00 0.71 0.00 0.00 60.37 61.26 1rkq h HIS 129 Cb 0.07 -0.06 -0.01 0.00 2.52 0.00 0.00 27.41 29.93 1rkq h HIS 129 CO -0.01 0.10 0.09 1.49 0.71 0.00 0.00 177.93 180.31 1rkq h GLU 130 N 0.29 0.51 -0.34 5.26 4.57 -1.12 0.11 114.58 123.87 1rkq h GLU 130 Ca 0.16 -0.12 -0.01 0.00 -1.18 0.00 0.00 59.36 58.22 1rkq h GLU 130 Cb 0.13 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.64 1rkq h GLU 130 CO -0.16 0.57 0.19 1.03 -1.18 0.00 0.00 179.01 179.46 1rkq h SER 131 N 0.37 0.42 0.07 1.04 0.87 -0.94 -1.21 113.55 114.16 1rkq h SER 131 Ca 0.10 -0.08 -0.00 0.00 -1.23 0.00 0.00 61.79 60.58 1rkq h SER 131 Cb 0.28 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.14 1rkq h SER 131 CO -0.00 0.38 -0.04 0.15 -0.53 0.00 0.00 176.83 176.79 1rkq h PHE 132 N 0.42 -0.09 -0.00 2.24 3.57 -0.85 -1.69 116.94 120.53 1rkq h PHE 132 Ca 0.12 -0.00 -0.24 0.00 3.53 0.00 0.00 57.97 61.38 1rkq h PHE 132 Cb 0.05 0.03 0.01 0.00 2.79 0.00 0.00 35.95 38.83 1rkq h PHE 132 CO -0.03 0.47 -0.96 0.28 -2.23 0.00 0.00 178.31 175.83 1rkq h VAL 133 N -0.78 1.36 -0.28 1.41 2.07 -0.84 -2.98 116.25 116.21 1rkq h VAL 133 Ca -0.01 -2.38 0.00 0.00 0.82 0.00 0.00 66.70 65.13 1rkq h VAL 133 Cb 0.60 2.39 0.00 0.00 -1.52 0.00 0.00 31.29 32.76 1rkq h VAL 133 CO 0.02 0.72 0.00 0.00 0.02 0.00 0.00 177.57 178.32 1rkq n ALA 134 N -2.57 2.47 -3.89 1.67 0.00 -0.46 -4.94 120.51 112.80 1rkq n ALA 134 Ca -0.08 -0.60 -0.35 0.00 0.00 0.00 0.00 53.44 52.42 1rkq n ALA 134 Cb 0.84 -1.02 0.02 0.00 0.00 0.00 0.00 19.45 19.29 1rkq n ALA 134 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1rkq n THR 135 N 0.48 -4.14 -4.58 0.00 -2.24 -0.77 -2.20 114.28 100.83 1rkq n THR 135 Ca 0.14 -0.75 -0.24 0.00 -2.27 0.00 0.00 64.05 60.93 1rkq n THR 135 Cb 0.32 -3.24 -0.17 0.00 -2.10 0.00 0.00 70.33 65.15 1rkq n THR 135 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1rkq s ILE 136 N -3.64 1.12 0.57 2.28 2.07 -0.71 -4.69 121.20 118.21 1rkq s ILE 136 Ca 0.36 -0.48 -0.21 0.00 -1.41 0.00 0.00 60.65 58.92 1rkq s ILE 136 Cb -0.16 -1.02 -0.04 0.00 0.13 0.00 0.00 42.46 41.37 1rkq s ILE 136 CO 0.91 0.35 1.32 -2.84 -1.91 0.00 0.00 174.94 172.77 1rkq s PRO 137 N 0.63 3.01 -0.14 3.50 0.02 -1.26 -4.55 135.00 136.21 1rkq s PRO 137 Ca -0.14 2.13 -0.03 0.00 0.02 0.00 0.00 61.00 62.98 1rkq s PRO 137 Cb -0.15 -2.13 -0.03 0.00 0.02 0.00 0.00 34.50 32.21 1rkq s PRO 137 CO 0.04 -1.26 -0.04 -1.17 -0.33 0.00 0.00 177.00 174.24 1rkq s LEU 138 N -3.76 3.27 -0.05 -5.54 2.96 -1.26 -1.05 118.68 113.25 1rkq s LEU 138 Ca 0.74 -0.09 0.02 0.00 -0.22 0.00 0.00 54.13 54.58 1rkq s LEU 138 Cb -0.38 -1.78 0.01 0.00 0.50 0.00 0.00 46.19 44.54 1rkq s LEU 138 CO 0.44 0.21 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.87 1rkq s VAL 139 N 0.14 1.04 -0.06 1.68 1.01 0.22 -4.99 120.40 119.45 1rkq s VAL 139 Ca -0.01 -0.44 -0.22 0.00 0.00 0.00 0.00 61.98 61.30 1rkq s VAL 139 Cb -0.14 -0.95 -0.04 0.00 0.00 0.00 0.00 36.38 35.25 1rkq s VAL 139 CO 0.03 0.33 0.66 0.12 0.00 0.00 0.00 175.10 176.24 1rkq s PHE 140 N 0.56 3.60 -0.23 5.22 5.36 -1.26 -1.61 117.98 129.62 1rkq s PHE 140 Ca -0.12 1.21 -0.15 0.00 -0.96 0.00 0.00 56.93 56.92 1rkq s PHE 140 Cb -0.14 -2.75 0.07 0.00 -0.34 0.00 0.00 43.02 39.86 1rkq s PHE 140 CO 0.03 0.15 0.58 0.00 -1.46 0.00 0.00 175.22 174.52 1rkq n GLU 142 N 3.95 1.58 -0.27 0.00 4.71 -1.26 -3.35 120.64 125.99 1rkq n GLU 142 Ca -0.20 0.59 -0.00 0.00 -0.01 0.00 0.00 57.16 57.54 1rkq n GLU 142 Cb 0.57 -2.56 0.12 0.00 -1.01 0.00 0.00 31.44 28.56 1rkq n GLU 142 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1rkq h ALA 143 N 1.26 1.04 0.00 0.62 0.00 -1.93 -0.55 119.26 119.69 1rkq h ALA 143 Ca -0.51 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1rkq h ALA 143 Cb 1.31 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1rkq h ALA 143 CO 0.56 0.14 0.00 -0.85 0.00 0.00 0.00 179.25 179.10 1rkq n GLU 144 N -4.72 0.90 -0.04 0.00 0.00 -1.26 -2.75 120.64 112.78 1rkq n GLU 144 Ca 0.11 0.00 0.06 0.00 0.00 0.00 0.00 57.16 57.33 1rkq n GLU 144 Cb 0.19 -1.50 0.07 0.00 0.00 0.00 0.00 31.44 30.20 1rkq n GLU 144 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1rkq n LYS 145 N -1.03 1.07 -1.84 3.44 5.02 -0.26 -5.00 118.16 119.55 1rkq n LYS 145 Ca 0.22 -1.38 -0.40 0.00 -2.02 0.00 0.00 58.31 54.73 1rkq n LYS 145 Cb 0.12 -1.24 0.01 0.00 -0.02 0.00 0.00 35.03 33.89 1rkq n LYS 145 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1rkq s MET 146 N -0.99 3.93 0.18 1.97 -1.94 -0.91 -4.92 119.30 116.62 1rkq s MET 146 Ca 0.16 2.45 -0.31 0.00 -1.71 0.00 0.00 55.69 56.28 1rkq s MET 146 Cb 0.10 -2.82 -0.10 0.00 2.01 0.00 0.00 34.83 34.02 1rkq s MET 146 CO 0.15 -0.63 1.57 0.34 -0.01 0.00 0.00 175.02 176.44 1rkq s ASP 147 N -0.37 6.56 0.00 3.03 -1.08 -1.26 -4.87 116.67 118.69 1rkq s ASP 147 Ca 0.56 2.66 0.17 0.00 -0.52 0.00 0.00 52.55 55.42 1rkq s ASP 147 Cb -0.44 -2.60 0.76 0.00 -1.46 0.00 0.00 42.92 39.18 1rkq s ASP 147 CO 0.58 -0.83 1.53 -0.81 0.52 0.00 0.00 175.17 176.16 1rkq n PRO 148 N 3.78 0.08 -0.41 4.34 -0.04 -1.26 -1.52 135.00 139.97 1rkq n PRO 148 Ca 0.13 0.19 0.09 0.00 -0.04 0.00 0.00 63.50 63.87 1rkq n PRO 148 Cb 0.38 -1.50 0.29 0.00 -0.04 0.00 0.00 33.50 32.63 1rkq n PRO 148 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1rkq n ASN 149 N -1.43 3.98 -4.70 3.54 5.03 -1.26 -4.66 115.26 115.76 1rkq n ASN 149 Ca 0.05 -2.23 -0.43 0.00 0.87 0.00 0.00 54.58 52.84 1rkq n ASN 149 Cb 0.18 -0.46 -0.02 0.00 -1.02 0.00 0.00 39.78 38.46 1rkq n ASN 149 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.26 175.84 1rkq n THR 150 N 1.03 1.23 -3.01 3.41 -1.04 -0.57 -4.91 114.28 110.42 1rkq n THR 150 Ca 0.22 -0.31 -0.44 0.00 -2.04 0.00 0.00 64.05 61.47 1rkq n THR 150 Cb 0.69 -1.62 -0.03 0.00 -1.82 0.00 0.00 70.33 67.55 1rkq n THR 150 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 1rkq s GLN 151 N -0.80 3.42 -0.96 -2.82 -1.52 -1.26 -4.81 119.66 110.90 1rkq s GLN 151 Ca 0.64 -1.63 -0.24 0.00 -1.95 0.00 0.00 55.36 52.18 1rkq s GLN 151 Cb -0.59 -4.62 0.03 0.00 -0.22 0.00 0.00 33.01 27.61 1rkq s GLN 151 CO 0.53 -1.67 1.51 -0.06 -0.25 0.00 0.00 175.29 175.34 1rkq s PHE 152 N 2.54 2.38 0.14 0.91 0.08 -1.26 -4.29 117.98 118.48 1rkq s PHE 152 Ca 0.25 -0.51 -0.11 0.00 0.12 0.00 0.00 56.93 56.68 1rkq s PHE 152 Cb -0.11 -4.59 -0.06 0.00 -0.57 0.00 0.00 43.02 37.70 1rkq s PHE 152 CO -0.03 -1.94 1.44 -0.07 -0.10 0.00 0.00 175.22 174.52 1rkq h LEU 153 N 13.61 0.97 -7.13 -0.37 3.38 -1.65 0.81 115.31 124.92 1rkq h LEU 153 Ca 0.12 -0.49 -0.04 0.00 0.09 0.00 0.00 57.88 57.56 1rkq h LEU 153 Cb 1.02 -0.28 -0.13 0.00 0.09 0.00 0.00 40.66 41.36 1rkq h LEU 153 CO 1.38 1.29 0.11 -1.59 0.09 0.00 0.00 178.44 179.72 1rkq s LYS 154 N -4.23 1.18 0.28 1.13 -2.85 -1.19 -4.52 119.74 109.54 1rkq s LYS 154 Ca -0.11 -0.48 0.05 0.00 -1.00 0.00 0.00 55.97 54.43 1rkq s LYS 154 Cb 0.11 0.54 -0.06 0.00 -2.06 0.00 0.00 37.83 36.36 1rkq s LYS 154 CO 0.89 -0.49 -0.01 0.14 0.10 0.00 0.00 175.35 175.98 1rkq s VAL 155 N -3.52 1.35 -0.08 1.79 -7.23 -0.64 -1.22 120.40 110.86 1rkq s VAL 155 Ca 0.00 -2.06 -0.09 0.00 -1.81 0.00 0.00 61.98 58.03 1rkq s VAL 155 Cb -0.00 -2.54 0.02 0.00 0.56 0.00 0.00 36.38 34.42 1rkq s VAL 155 CO -0.11 -0.20 0.24 -0.04 -0.31 0.00 0.00 175.10 174.68 1rkq s MET 156 N -3.81 0.33 -0.24 4.82 -1.94 -0.30 -1.19 119.30 116.96 1rkq s MET 156 Ca 0.32 0.25 -0.14 0.00 -1.71 0.00 0.00 55.69 54.41 1rkq s MET 156 Cb 0.06 0.15 -0.04 0.00 2.01 0.00 0.00 34.83 37.01 1rkq s MET 156 CO 0.12 -0.05 0.31 -1.64 -0.01 0.00 0.00 175.02 173.75 1rkq s MET 157 N -0.07 4.09 -0.00 2.03 -1.94 -0.69 -1.68 119.30 121.03 1rkq s MET 157 Ca -0.02 -0.02 0.04 0.00 -1.71 0.00 0.00 55.69 53.99 1rkq s MET 157 Cb -0.02 -3.58 -0.01 0.00 2.01 0.00 0.00 34.83 33.23 1rkq s MET 157 CO 0.01 -0.08 -0.14 0.96 -0.01 0.00 0.00 175.02 175.76 1rkq s ILE 158 N 1.46 1.11 0.00 2.53 -0.00 -0.77 -0.84 121.20 124.69 1rkq s ILE 158 Ca 0.14 -0.65 -0.29 0.00 -0.00 0.00 0.00 60.65 59.85 1rkq s ILE 158 Cb -0.15 -0.93 0.11 0.00 -0.00 0.00 0.00 42.46 41.48 1rkq s ILE 158 CO 0.08 0.27 1.26 -0.62 -0.00 0.00 0.00 174.94 175.93 1rkq s ASP 159 N -0.44 -0.03 0.41 4.36 -1.08 -0.95 -3.20 116.67 115.75 1rkq s ASP 159 Ca 0.05 -0.21 -0.24 0.00 -0.52 0.00 0.00 52.55 51.62 1rkq s ASP 159 Cb -0.06 0.19 -0.11 0.00 -1.46 0.00 0.00 42.92 41.48 1rkq s ASP 159 CO -0.00 -0.36 0.98 -0.62 0.52 0.00 0.00 175.17 175.68 1rkq n GLU 160 N -0.69 1.29 -0.19 4.34 -0.58 -1.26 -4.40 120.64 119.15 1rkq n GLU 160 Ca -0.03 0.46 0.00 0.00 -0.42 0.00 0.00 57.16 57.18 1rkq n GLU 160 Cb 0.61 -1.99 0.10 0.00 -0.57 0.00 0.00 31.44 29.59 1rkq n GLU 160 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 1rkq h PRO 161 N 1.52 0.15 -0.75 3.49 0.11 -1.93 0.82 132.00 135.41 1rkq h PRO 161 Ca -0.44 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.68 1rkq h PRO 161 Cb 1.34 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.38 1rkq h PRO 161 CO 0.57 0.10 0.50 0.00 -0.21 0.00 0.00 178.00 178.95 1rkq h ALA 162 N 1.52 1.47 -0.37 -0.75 0.00 -1.90 0.16 119.26 119.40 1rkq h ALA 162 Ca 0.31 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 55.02 1rkq h ALA 162 Cb 0.49 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1rkq h ALA 162 CO -0.48 0.48 -0.36 0.82 0.00 0.00 0.00 179.25 179.71 1rkq h ILE 163 N 1.01 1.28 -0.28 0.00 1.08 -1.27 -2.69 117.51 116.63 1rkq h ILE 163 Ca 0.28 -1.54 -0.16 0.00 -0.39 0.00 0.00 64.86 63.06 1rkq h ILE 163 Cb -0.10 1.42 -0.01 0.00 -3.07 0.00 0.00 36.82 35.07 1rkq h ILE 163 CO -0.06 0.51 -0.46 0.25 -0.69 0.00 0.00 178.15 177.70 1rkq h LEU 164 N 0.70 0.79 -0.79 1.44 5.85 -0.60 -1.33 115.31 121.37 1rkq h LEU 164 Ca 0.06 -0.38 -0.12 0.00 0.84 0.00 0.00 57.88 58.27 1rkq h LEU 164 Cb 0.96 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 1rkq h LEU 164 CO 0.09 1.12 -0.44 0.44 -0.34 0.00 0.00 178.44 179.32 1rkq h ASP 165 N 0.58 0.40 -0.43 1.25 3.32 -0.76 0.14 116.42 120.92 1rkq h ASP 165 Ca 0.03 -0.18 -0.01 0.00 0.02 0.00 0.00 57.03 56.89 1rkq h ASP 165 Cb 1.02 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.44 1rkq h ASP 165 CO 0.10 0.79 0.22 -0.61 -1.72 0.00 0.00 179.24 178.01 1rkq h GLN 166 N 0.31 0.61 -0.59 3.56 4.15 -1.34 -1.94 115.11 119.88 1rkq h GLN 166 Ca 0.02 -0.08 -0.04 0.00 0.77 0.00 0.00 58.65 59.32 1rkq h GLN 166 Cb 0.90 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 28.45 1rkq h GLN 166 CO 0.07 0.52 0.23 0.00 -1.93 0.00 0.00 178.83 177.72 1rkq h ALA 167 N 1.06 0.77 -0.97 3.38 0.00 -0.72 -2.96 119.26 119.83 1rkq h ALA 167 Ca 0.15 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1rkq h ALA 167 Cb 0.10 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.61 1rkq h ALA 167 CO -0.02 0.39 0.64 0.82 0.00 0.00 0.00 179.25 181.08 1rkq h ILE 168 N 0.82 1.24 0.00 0.00 2.04 -0.44 -1.52 117.51 119.65 1rkq h ILE 168 Ca 0.20 -0.45 -0.03 0.00 1.00 0.00 0.00 64.86 65.58 1rkq h ILE 168 Cb 0.21 -0.18 -0.00 0.00 -0.74 0.00 0.00 36.82 36.11 1rkq h ILE 168 CO -0.01 0.24 -0.13 0.00 0.00 0.00 0.00 178.15 178.24 1rkq h ALA 169 N 1.36 1.38 0.00 1.87 0.00 -1.20 -2.14 119.26 120.54 1rkq h ALA 169 Ca 0.36 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1rkq h ALA 169 Cb -0.13 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1rkq h ALA 169 CO -0.08 0.17 -0.35 0.54 0.00 0.00 0.00 179.25 179.53 1rkq n ARG 170 N -3.80 0.00 -2.42 0.00 1.74 -0.61 -4.87 116.66 106.71 1rkq n ARG 170 Ca -0.02 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.64 1rkq n ARG 170 Cb 0.24 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.14 1rkq n ARG 170 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1rkq s ILE 171 N -3.00 4.06 0.56 0.55 1.01 -0.81 -5.00 121.20 118.58 1rkq s ILE 171 Ca 0.12 1.47 -0.21 0.00 0.00 0.00 0.00 60.65 62.03 1rkq s ILE 171 Cb 0.18 -3.94 -0.04 0.00 0.01 0.00 0.00 42.46 38.66 1rkq s ILE 171 CO 0.65 0.09 1.28 -2.84 0.00 0.00 0.00 174.94 174.11 1rkq s PRO 172 N 1.30 3.11 0.59 2.79 0.02 -1.26 -4.91 135.00 136.65 1rkq s PRO 172 Ca 0.58 2.02 0.30 0.00 0.02 0.00 0.00 61.00 63.93 1rkq s PRO 172 Cb -0.29 -2.13 1.81 0.00 0.02 0.00 0.00 34.50 33.91 1rkq s PRO 172 CO 0.28 -1.15 2.24 0.37 -0.33 0.00 0.00 177.00 178.41 1rkq h GLN 173 N 1.27 0.00 -0.99 5.54 5.75 -1.98 -1.79 115.11 122.92 1rkq h GLN 173 Ca -0.51 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.00 1rkq h GLN 173 Cb 1.30 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 29.80 1rkq h GLN 173 CO 0.57 0.01 0.64 0.93 -2.65 0.00 0.00 178.83 178.33 1rkq h GLU 174 N 0.00 1.32 -0.67 1.69 3.07 -1.99 -1.85 114.58 116.15 1rkq h GLU 174 Ca -0.00 -0.09 -0.07 0.00 -0.50 0.00 0.00 59.36 58.70 1rkq h GLU 174 Cb 0.04 -0.29 -0.03 0.00 -0.84 0.00 0.00 28.75 27.63 1rkq h GLU 174 CO 0.00 0.89 0.14 0.28 -1.40 0.00 0.00 179.01 178.92 1rkq h VAL 175 N 1.35 1.26 0.00 3.13 2.07 -1.69 -1.77 116.25 120.61 1rkq h VAL 175 Ca 0.36 -0.98 0.00 0.00 0.82 0.00 0.00 66.70 66.90 1rkq h VAL 175 Cb -0.13 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 1rkq h VAL 175 CO -0.07 0.37 0.00 0.11 0.02 0.00 0.00 177.57 178.00 1rkq h LYS 176 N 1.01 0.00 0.19 1.57 1.57 -1.50 -1.24 116.57 118.17 1rkq h LYS 176 Ca 0.21 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.63 1rkq h LYS 176 Cb 0.39 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.71 1rkq h LYS 176 CO 0.01 0.00 -1.76 1.49 -0.57 0.00 0.00 179.45 178.62 1rkq h GLU 177 N 0.00 0.40 -0.03 3.15 4.81 -1.13 -3.37 114.58 118.41 1rkq h GLU 177 Ca 0.00 -0.68 -0.15 0.00 -0.13 0.00 0.00 59.36 58.39 1rkq h GLU 177 Cb 0.37 0.25 -0.02 0.00 0.63 0.00 0.00 28.75 29.99 1rkq h GLU 177 CO 0.00 1.33 -0.68 -0.22 -0.73 0.00 0.00 179.01 178.71 1rkq h LYS 178 N 0.11 0.13 -4.90 1.92 3.64 -0.86 -3.47 116.57 113.14 1rkq h LYS 178 Ca -0.35 -0.10 -0.31 0.00 -1.27 0.00 0.00 60.65 58.62 1rkq h LYS 178 Cb 2.10 0.02 -0.15 0.00 -0.41 0.00 0.00 32.23 33.80 1rkq h LYS 178 CO 0.18 0.76 -0.68 0.71 -2.27 0.00 0.00 179.45 178.15 1rkq s TYR 179 N -3.55 1.26 -0.29 1.91 2.02 -0.51 -4.18 117.35 114.00 1rkq s TYR 179 Ca -0.02 -0.93 -0.29 0.00 -0.37 0.00 0.00 57.07 55.45 1rkq s TYR 179 Cb 0.12 -0.70 0.00 0.00 -0.40 0.00 0.00 41.96 40.98 1rkq s TYR 179 CO 0.79 -0.11 1.25 0.99 -1.57 0.00 0.00 175.55 176.90 1rkq s THR 180 N -3.53 4.24 -0.31 -0.71 2.01 -0.34 -4.60 115.64 112.39 1rkq s THR 180 Ca 0.22 1.41 -0.00 0.00 0.31 0.00 0.00 61.69 63.62 1rkq s THR 180 Cb 0.05 -4.21 0.10 0.00 0.01 0.00 0.00 72.50 68.45 1rkq s THR 180 CO 0.03 -0.45 0.09 -0.69 -0.69 0.00 0.00 174.62 172.91 1rkq s VAL 181 N 4.14 0.99 -0.03 3.82 1.01 -1.26 -1.48 120.40 127.59 1rkq s VAL 181 Ca 0.54 -1.46 -0.02 0.00 0.00 0.00 0.00 61.98 61.04 1rkq s VAL 181 Cb -0.16 -1.74 0.02 0.00 0.00 0.00 0.00 36.38 34.50 1rkq s VAL 181 CO 0.21 -0.65 0.06 -0.76 0.00 0.00 0.00 175.10 173.96 1rkq s LEU 182 N 1.56 1.49 0.43 3.92 1.43 -0.54 -4.98 118.68 121.99 1rkq s LEU 182 Ca 0.09 0.12 -0.22 0.00 -1.03 0.00 0.00 54.13 53.09 1rkq s LEU 182 Cb -0.17 0.16 -0.09 0.00 0.03 0.00 0.00 46.19 46.12 1rkq s LEU 182 CO -0.23 -0.06 1.04 -0.54 0.23 0.00 0.00 176.35 176.78 1rkq s LYS 183 N 0.41 4.04 0.00 1.70 1.02 -1.26 -0.57 119.74 125.07 1rkq s LYS 183 Ca -0.03 1.43 0.00 0.00 0.02 0.00 0.00 55.97 57.39 1rkq s LYS 183 Cb -0.05 -2.35 0.00 0.00 -0.52 0.00 0.00 37.83 34.91 1rkq s LYS 183 CO -0.01 -0.24 0.38 -1.13 -0.92 0.00 0.00 175.35 173.43 1rkq n SER 184 N -0.44 0.77 -3.66 2.83 3.41 -0.65 -1.25 113.62 114.63 1rkq n SER 184 Ca 0.07 -0.88 0.00 0.00 -0.26 0.00 0.00 58.87 57.79 1rkq n SER 184 Cb 0.51 0.24 -0.01 0.00 -0.26 0.00 0.00 64.21 64.70 1rkq n SER 184 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rkq s ALA 185 N -0.26 -2.07 0.42 7.33 0.00 -1.23 -4.83 121.76 121.12 1rkq s ALA 185 Ca 0.00 0.50 0.35 0.00 0.00 0.00 0.00 51.96 52.81 1rkq s ALA 185 Cb 0.00 0.46 1.77 0.00 0.00 0.00 0.00 23.12 25.35 1rkq s ALA 185 CO 0.00 -1.06 2.15 -1.35 0.00 0.00 0.00 175.76 175.51 1rkq h PRO 186 N 2.00 0.00 -0.07 0.00 0.11 -1.97 -2.81 132.00 129.26 1rkq h PRO 186 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1rkq h PRO 186 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1rkq h PRO 186 CO 0.28 0.04 0.00 2.48 -0.21 0.00 0.00 178.00 180.59 1rkq n TYR 187 N -3.31 0.09 -4.29 0.65 0.18 -1.26 -4.34 117.16 104.89 1rkq n TYR 187 Ca -0.02 -0.17 -0.26 0.00 1.88 0.00 0.00 57.90 59.34 1rkq n TYR 187 Cb 0.20 -0.01 -0.17 0.00 -0.38 0.00 0.00 39.34 38.98 1rkq n TYR 187 CO 0.00 0.00 0.00 -0.06 -2.08 0.00 0.00 176.86 174.72 1rkq s PHE 188 N -0.70 1.54 -0.25 -3.48 0.08 -1.06 -2.24 117.98 111.88 1rkq s PHE 188 Ca 0.10 -0.68 -0.03 0.00 0.12 0.00 0.00 56.93 56.44 1rkq s PHE 188 Cb 0.06 -1.18 0.01 0.00 -0.57 0.00 0.00 43.02 41.34 1rkq s PHE 188 CO 0.09 -0.40 -0.03 -1.17 -0.10 0.00 0.00 175.22 173.60 1rkq s LEU 189 N 1.13 3.22 -0.00 -0.37 2.96 -0.02 -1.64 118.68 123.96 1rkq s LEU 189 Ca -0.06 -0.70 -0.24 0.00 -0.22 0.00 0.00 54.13 52.91 1rkq s LEU 189 Cb -0.14 -1.72 -0.05 0.00 0.50 0.00 0.00 46.19 44.77 1rkq s LEU 189 CO -0.02 -0.11 0.73 -1.61 -1.32 0.00 0.00 176.35 174.02 1rkq s GLU 190 N 1.40 4.45 -0.08 1.98 0.41 0.26 -1.71 118.70 125.42 1rkq s GLU 190 Ca 0.02 0.97 0.01 0.00 -0.41 0.00 0.00 54.97 55.55 1rkq s GLU 190 Cb -0.16 -3.39 0.02 0.00 -1.78 0.00 0.00 34.13 28.82 1rkq s GLU 190 CO -0.03 0.21 -0.07 0.42 -0.49 0.00 0.00 175.26 175.30 1rkq s ILE 191 N 0.26 0.88 0.24 -1.63 1.01 -0.33 -1.47 121.20 120.16 1rkq s ILE 191 Ca 0.38 -0.26 -0.00 0.00 0.00 0.00 0.00 60.65 60.76 1rkq s ILE 191 Cb -0.19 -0.89 0.00 0.00 0.01 0.00 0.00 42.46 41.39 1rkq s ILE 191 CO 0.21 0.32 0.31 0.00 0.00 0.00 0.00 174.94 175.78 1rkq n LEU 192 N 4.46 0.00 -4.75 2.97 -0.00 -0.55 -1.61 117.00 117.51 1rkq n LEU 192 Ca -0.17 -2.01 -0.40 0.00 -0.00 0.00 0.00 56.01 53.43 1rkq n LEU 192 Cb 0.51 1.65 0.01 0.00 -0.00 0.00 0.00 43.42 45.59 1rkq n LEU 192 CO 0.20 -0.44 1.05 -0.67 -0.00 0.00 0.00 177.39 177.53 1rkq n ASP 193 N -1.84 3.29 0.20 1.45 -0.08 -1.26 -1.20 116.55 117.11 1rkq n ASP 193 Ca 0.01 1.15 0.14 0.00 -1.51 0.00 0.00 54.79 54.58 1rkq n ASP 193 Cb 0.41 -1.59 0.68 0.00 2.34 0.00 0.00 41.12 42.96 1rkq n ASP 193 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 1rkq h LYS 194 N 2.42 0.00 0.00 -0.67 1.63 -1.86 -2.09 116.57 115.99 1rkq h LYS 194 Ca -0.50 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.30 1rkq h LYS 194 Cb 1.27 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.90 1rkq h LYS 194 CO 0.61 0.00 0.00 0.54 -3.45 0.00 0.00 179.45 177.15 1rkq n ARG 195 N -2.51 0.23 -4.18 1.90 1.74 -1.26 -4.75 116.66 107.83 1rkq n ARG 195 Ca -0.00 0.30 -0.16 0.00 -0.77 0.00 0.00 57.85 57.21 1rkq n ARG 195 Cb 0.14 -1.83 -0.13 0.00 -1.02 0.00 0.00 32.46 29.62 1rkq n ARG 195 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1rkq s VAL 196 N -3.19 0.77 0.12 1.55 -7.23 -0.78 -4.92 120.40 106.72 1rkq s VAL 196 Ca 0.08 -0.94 -0.08 0.00 -1.81 0.00 0.00 61.98 59.23 1rkq s VAL 196 Cb 0.11 -0.75 0.03 0.00 0.56 0.00 0.00 36.38 36.33 1rkq s VAL 196 CO 0.52 -0.16 0.40 -0.46 -0.31 0.00 0.00 175.10 175.08 1rkq n ASN 197 N 1.82 -0.86 0.18 4.85 0.23 -1.25 -4.71 115.26 115.52 1rkq n ASN 197 Ca -0.19 -1.52 0.03 0.00 -0.53 0.00 0.00 54.58 52.36 1rkq n ASN 197 Cb 0.55 1.41 0.34 0.00 -2.08 0.00 0.00 39.78 40.00 1rkq n ASN 197 CO 0.00 0.00 0.00 0.11 -0.93 0.00 0.00 177.26 176.44 1rkq h LYS 198 N 0.00 0.00 -0.34 -3.83 1.57 -1.75 -1.94 116.57 110.28 1rkq h LYS 198 Ca -0.13 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.59 1rkq h LYS 198 Cb 0.52 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 1rkq h LYS 198 CO 0.17 0.41 -0.04 0.78 -0.57 0.00 0.00 179.45 180.20 1rkq h GLY 199 N 1.40 0.67 1.22 3.86 0.00 -1.90 -1.22 103.07 107.11 1rkq h GLY 199 Ca -0.00 -0.53 -0.03 0.00 0.00 0.00 0.00 47.33 46.77 1rkq h GLY 199 CO 0.05 0.48 0.31 -0.91 0.00 0.00 0.00 176.54 176.47 1rkq h THR 200 N 0.42 1.23 -0.46 4.70 1.35 -1.88 -0.92 112.91 117.34 1rkq h THR 200 Ca 0.09 -0.68 -0.03 0.00 -0.55 0.00 0.00 66.41 65.24 1rkq h THR 200 Cb 0.52 0.37 -0.02 0.00 -1.73 0.00 0.00 68.15 67.29 1rkq h THR 200 CO 0.03 0.28 0.17 1.23 -0.25 0.00 0.00 175.52 176.98 1rkq h GLY 201 N 1.06 0.74 0.83 5.82 0.00 -1.09 0.82 103.07 111.24 1rkq h GLY 201 Ca 0.24 -0.41 -0.04 0.00 0.00 0.00 0.00 47.33 47.12 1rkq h GLY 201 CO -0.03 0.38 -0.00 -2.08 0.00 0.00 0.00 176.54 174.82 1rkq h VAL 202 N 0.59 1.26 -0.81 4.60 2.07 -1.08 -2.32 116.25 120.56 1rkq h VAL 202 Ca 0.15 -0.89 0.00 0.00 0.82 0.00 0.00 66.70 66.78 1rkq h VAL 202 Cb 0.21 1.41 -0.04 0.00 -1.52 0.00 0.00 31.29 31.35 1rkq h VAL 202 CO -0.01 0.28 0.52 0.50 0.02 0.00 0.00 177.57 178.87 1rkq h LYS 203 N 0.15 1.07 -0.08 1.57 3.64 -1.11 -0.48 116.57 121.34 1rkq h LYS 203 Ca 0.06 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1rkq h LYS 203 Cb 0.41 -0.24 -0.00 0.00 -0.41 0.00 0.00 32.23 31.99 1rkq h LYS 203 CO 0.01 0.72 0.05 0.66 -2.27 0.00 0.00 179.45 178.62 1rkq h SER 204 N 1.10 0.09 -0.41 4.20 4.64 -0.47 0.58 113.55 123.28 1rkq h SER 204 Ca 0.29 -0.03 -0.14 0.00 -0.47 0.00 0.00 61.79 61.44 1rkq h SER 204 Cb -0.10 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 61.96 1rkq h SER 204 CO -0.06 0.10 -0.27 0.25 -0.87 0.00 0.00 176.83 175.98 1rkq h LEU 205 N 0.07 0.96 -0.79 5.97 5.85 -1.19 -2.28 115.31 123.90 1rkq h LEU 205 Ca 0.03 -0.38 -0.03 0.00 0.84 0.00 0.00 57.88 58.33 1rkq h LEU 205 Cb 0.02 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.75 1rkq h LEU 205 CO -0.01 1.17 0.39 0.00 -0.34 0.00 0.00 178.44 179.65 1rkq h ALA 206 N 0.89 1.02 -0.34 1.25 0.00 -0.75 -1.69 119.26 119.66 1rkq h ALA 206 Ca 0.09 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.73 1rkq h ALA 206 Cb 0.84 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1rkq h ALA 206 CO 0.07 0.58 -0.30 -0.44 0.00 0.00 0.00 179.25 179.17 1rkq h ASP 207 N 1.12 0.73 -0.75 0.00 3.32 -0.87 0.29 116.42 120.28 1rkq h ASP 207 Ca 0.27 -0.29 0.05 0.00 0.02 0.00 0.00 57.03 57.08 1rkq h ASP 207 Cb 0.11 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 39.40 1rkq h ASP 207 CO -0.04 0.99 0.45 0.58 -1.72 0.00 0.00 179.24 179.50 1rkq h VAL 208 N 0.61 1.04 -0.02 -1.35 2.07 -0.77 -2.99 116.25 114.84 1rkq h VAL 208 Ca 0.07 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.30 1rkq h VAL 208 Cb 0.81 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.70 1rkq h VAL 208 CO 0.07 0.16 0.00 0.18 0.02 0.00 0.00 177.57 177.99 1rkq n LEU 209 N -4.68 1.60 -1.67 2.57 4.77 -0.70 -4.96 117.00 113.92 1rkq n LEU 209 Ca 0.09 -0.54 -0.13 0.00 -0.03 0.00 0.00 56.01 55.41 1rkq n LEU 209 Cb 0.14 -0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.24 1rkq n LEU 209 CO 0.31 0.27 -0.07 0.61 -1.33 0.00 0.00 177.39 177.19 1rkq n GLY 210 N 1.18 -0.07 3.55 -0.72 0.00 -0.47 -5.02 105.19 103.65 1rkq n GLY 210 Ca 0.19 -0.30 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 1rkq n GLY 210 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rkq s ILE 211 N -2.79 4.35 0.48 -0.61 1.01 -0.03 -5.04 121.20 118.58 1rkq s ILE 211 Ca 0.10 -0.19 -0.17 0.00 0.00 0.00 0.00 60.65 60.40 1rkq s ILE 211 Cb -0.05 -2.95 -0.08 0.00 0.01 0.00 0.00 42.46 39.39 1rkq s ILE 211 CO 0.13 0.46 0.95 -0.54 0.00 0.00 0.00 174.94 175.94 1rkq s LYS 212 N 0.50 3.98 0.36 2.79 1.02 -1.26 -4.43 119.74 122.71 1rkq s LYS 212 Ca 0.00 0.93 0.15 0.00 0.02 0.00 0.00 55.97 57.07 1rkq s LYS 212 Cb -0.13 -2.18 1.04 0.00 -0.52 0.00 0.00 37.83 36.03 1rkq s LYS 212 CO 0.02 -0.19 1.73 -1.35 -0.92 0.00 0.00 175.35 174.64 1rkq h PRO 213 N 1.18 0.43 -0.26 -1.68 0.11 -1.96 -0.05 132.00 129.77 1rkq h PRO 213 Ca -0.47 -0.03 0.08 0.00 0.11 0.00 0.00 66.00 65.69 1rkq h PRO 213 Cb 1.18 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1rkq h PRO 213 CO 0.62 0.28 0.20 1.49 -0.21 0.00 0.00 178.00 180.38 1rkq h GLU 214 N 0.44 0.00 -0.61 1.05 4.57 -1.93 0.62 114.58 118.72 1rkq h GLU 214 Ca 0.65 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.83 1rkq h GLU 214 Cb 1.49 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.08 1rkq h GLU 214 CO -0.42 0.00 0.00 0.39 -1.18 0.00 0.00 179.01 177.80 1rkq n GLU 215 N -4.36 2.90 -5.14 1.92 1.02 -0.03 -4.59 120.64 112.36 1rkq n GLU 215 Ca 0.03 -1.94 -0.32 0.00 -0.02 0.00 0.00 57.16 54.92 1rkq n GLU 215 Cb 0.35 -1.71 -0.15 0.00 -0.02 0.00 0.00 31.44 29.91 1rkq n GLU 215 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1rkq s ILE 216 N -1.77 2.44 -0.10 -3.67 1.01 -0.72 -0.24 121.20 118.15 1rkq s ILE 216 Ca 0.35 -0.95 0.00 0.00 0.00 0.00 0.00 60.65 60.05 1rkq s ILE 216 Cb 0.23 -1.90 -0.03 0.00 0.01 0.00 0.00 42.46 40.77 1rkq s ILE 216 CO 0.16 0.58 -0.09 -0.32 0.00 0.00 0.00 174.94 175.28 1rkq s MET 217 N -0.51 3.03 -0.01 2.79 -2.45 -0.32 -1.83 119.30 119.99 1rkq s MET 217 Ca 0.07 -0.59 0.05 0.00 -1.25 0.00 0.00 55.69 53.96 1rkq s MET 217 Cb -0.11 -2.63 -0.01 0.00 1.25 0.00 0.00 34.83 33.32 1rkq s MET 217 CO 0.01 0.48 -0.15 0.00 1.05 0.00 0.00 175.02 176.41 1rkq s ALA 218 N -0.33 1.29 -0.11 4.11 0.00 -0.25 -0.80 121.76 125.67 1rkq s ALA 218 Ca 0.04 -0.69 0.01 0.00 0.00 0.00 0.00 51.96 51.32 1rkq s ALA 218 Cb -0.13 -0.31 0.02 0.00 0.00 0.00 0.00 23.12 22.70 1rkq s ALA 218 CO 0.02 0.31 -0.11 0.42 0.00 0.00 0.00 175.76 176.40 1rkq s ILE 219 N -0.42 1.24 0.11 0.00 1.01 -0.14 -0.74 121.20 122.26 1rkq s ILE 219 Ca 0.06 -0.46 -0.04 0.00 0.00 0.00 0.00 60.65 60.21 1rkq s ILE 219 Cb -0.06 -1.18 0.02 0.00 0.01 0.00 0.00 42.46 41.24 1rkq s ILE 219 CO -0.00 0.40 0.22 0.61 0.00 0.00 0.00 174.94 176.16 1rkq n GLY 220 N 4.49 1.85 0.00 6.18 0.00 -0.63 -1.47 105.19 115.61 1rkq n GLY 220 Ca -0.17 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.72 1rkq n GLY 220 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1rkq n ASP 221 N -1.26 0.00 -4.20 1.61 5.75 -1.26 -2.42 116.55 114.78 1rkq n ASP 221 Ca -0.02 0.00 -0.24 0.00 -0.01 0.00 0.00 54.79 54.52 1rkq n ASP 221 Cb 0.17 0.00 -0.09 0.00 -1.03 0.00 0.00 41.12 40.17 1rkq n ASP 221 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 1rkq s GLN 222 N -0.38 1.85 0.42 0.11 -1.52 -1.26 -1.83 119.66 117.05 1rkq s GLN 222 Ca 0.00 -2.10 0.13 0.00 -1.95 0.00 0.00 55.36 51.43 1rkq s GLN 222 Cb 0.00 -0.64 0.98 0.00 -0.22 0.00 0.00 33.01 33.13 1rkq s GLN 222 CO 0.00 -0.41 1.97 1.49 -0.25 0.00 0.00 175.29 178.08 1rkq h GLU 223 N 1.89 0.46 0.00 2.91 4.81 -1.87 -0.58 114.58 122.19 1rkq h GLU 223 Ca -0.37 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.84 1rkq h GLU 223 Cb 1.27 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.54 1rkq h GLU 223 CO 0.59 0.30 0.00 0.27 -0.73 0.00 0.00 179.01 179.45 1rkq n ASN 224 N -4.48 0.00 -0.00 1.04 6.94 -0.38 -2.37 115.26 116.00 1rkq n ASN 224 Ca 0.11 -1.27 0.08 0.00 -0.02 0.00 0.00 54.58 53.47 1rkq n ASN 224 Cb 0.37 0.00 -0.10 0.00 -2.36 0.00 0.00 39.78 37.68 1rkq n ASN 224 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 1rkq n ASP 225 N -0.68 0.92 -0.11 0.53 8.00 -0.23 -4.54 116.55 120.44 1rkq n ASP 225 Ca 0.07 -0.58 -0.06 0.00 0.71 0.00 0.00 54.79 54.93 1rkq n ASP 225 Cb 0.03 1.25 0.02 0.00 -0.02 0.00 0.00 41.12 42.40 1rkq n ASP 225 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1rkq h ILE 226 N 0.00 0.88 -0.53 0.53 2.04 -1.54 -2.05 117.51 116.83 1rkq h ILE 226 Ca 0.00 -0.10 -0.08 0.00 1.00 0.00 0.00 64.86 65.69 1rkq h ILE 226 Cb 0.50 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 1rkq h ILE 226 CO 0.00 0.05 0.02 0.00 0.00 0.00 0.00 178.15 178.22 1rkq h ALA 227 N 1.25 1.03 -0.18 1.87 0.00 -1.83 -0.28 119.26 121.12 1rkq h ALA 227 Ca 0.17 -0.27 -0.12 0.00 0.00 0.00 0.00 54.91 54.69 1rkq h ALA 227 Cb 0.16 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1rkq h ALA 227 CO -0.18 0.60 -0.40 0.00 0.00 0.00 0.00 179.25 179.27 1rkq h MET 228 N 0.83 0.42 -0.20 0.00 -0.00 -1.80 -1.96 114.93 112.22 1rkq h MET 228 Ca 0.16 -0.20 -0.08 0.00 -0.00 0.00 0.00 59.70 59.58 1rkq h MET 228 Cb 0.46 -0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.05 1rkq h MET 228 CO 0.02 0.75 -0.22 0.82 -0.00 0.00 0.00 176.91 178.28 1rkq h ILE 229 N 0.35 1.24 -0.18 -0.10 2.04 -0.91 -1.62 117.51 118.33 1rkq h ILE 229 Ca 0.03 -1.14 -0.22 0.00 1.00 0.00 0.00 64.86 64.54 1rkq h ILE 229 Cb 0.85 1.34 0.01 0.00 -0.74 0.00 0.00 36.82 38.28 1rkq h ILE 229 CO 0.07 0.36 -0.73 -0.33 0.00 0.00 0.00 178.15 177.52 1rkq h GLU 230 N 0.33 0.81 -0.46 2.37 5.08 -0.97 -3.28 114.58 118.46 1rkq h GLU 230 Ca 0.05 -0.63 -0.08 0.00 -1.00 0.00 0.00 59.36 57.71 1rkq h GLU 230 Cb 0.58 0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.93 1rkq h GLU 230 CO 0.04 1.24 -0.01 -0.92 -1.00 0.00 0.00 179.01 178.37 1rkq h TYR 231 N 0.57 0.89 -4.11 4.33 3.20 -1.18 -3.45 116.97 117.22 1rkq h TYR 231 Ca -0.04 -0.16 -0.55 0.00 3.14 0.00 0.00 58.73 61.13 1rkq h TYR 231 Cb 1.35 -0.23 0.14 0.00 1.54 0.00 0.00 36.73 39.53 1rkq h TYR 231 CO 0.08 0.86 0.50 0.00 -1.64 0.00 0.00 178.16 177.96 1rkq s ALA 232 N -5.00 2.43 0.31 1.82 0.00 -0.62 -4.84 121.76 115.86 1rkq s ALA 232 Ca -0.13 1.13 0.03 0.00 0.00 0.00 0.00 51.96 53.00 1rkq s ALA 232 Cb 0.11 -3.51 0.50 0.00 0.00 0.00 0.00 23.12 20.22 1rkq s ALA 232 CO 0.81 -1.44 1.79 0.78 0.00 0.00 0.00 175.76 177.71 1rkq h GLY 233 N 0.65 0.53 -7.71 0.00 0.00 -0.20 -3.36 103.07 92.98 1rkq h GLY 233 Ca -0.51 -0.38 -0.66 0.00 0.00 0.00 0.00 47.33 45.79 1rkq h GLY 233 CO 0.54 0.35 -0.74 0.14 0.00 0.00 0.00 176.54 176.82 1rkq s VAL 234 N -4.70 2.15 -0.21 4.60 1.01 -0.76 -5.00 120.40 117.49 1rkq s VAL 234 Ca -0.07 -2.07 -0.08 0.00 0.00 0.00 0.00 61.98 59.76 1rkq s VAL 234 Cb 0.14 -2.50 -0.04 0.00 0.00 0.00 0.00 36.38 33.99 1rkq s VAL 234 CO 0.78 -0.44 0.08 -0.83 0.00 0.00 0.00 175.10 174.69 1rkq s GLY 235 N 1.01 1.88 -0.08 4.51 0.00 -1.26 -1.09 107.32 112.29 1rkq s GLY 235 Ca 0.05 -0.87 0.05 0.00 0.00 0.00 0.00 44.72 43.94 1rkq s GLY 235 CO -0.08 0.24 -0.23 0.14 0.00 0.00 0.00 173.10 173.17 1rkq s VAL 236 N 0.83 1.97 -0.16 1.40 1.01 0.08 0.23 120.40 125.76 1rkq s VAL 236 Ca 0.04 -0.99 -0.03 0.00 0.00 0.00 0.00 61.98 61.00 1rkq s VAL 236 Cb -0.13 -1.69 -0.02 0.00 0.00 0.00 0.00 36.38 34.54 1rkq s VAL 236 CO 0.02 0.54 -0.06 0.00 0.00 0.00 0.00 175.10 175.60 1rkq s ALA 237 N 0.13 2.86 0.89 5.51 0.00 -0.74 -1.61 121.76 128.81 1rkq s ALA 237 Ca -0.12 -0.90 -0.11 0.00 0.00 0.00 0.00 51.96 50.83 1rkq s ALA 237 Cb -0.16 -1.49 0.13 0.00 0.00 0.00 0.00 23.12 21.61 1rkq s ALA 237 CO 0.06 0.10 1.15 0.14 0.00 0.00 0.00 175.76 177.22 1rkq s VAL 238 N 0.57 2.10 0.05 0.00 -7.23 -1.01 -1.27 120.40 113.60 1rkq s VAL 238 Ca -0.04 0.03 0.33 0.00 -1.81 0.00 0.00 61.98 60.49 1rkq s VAL 238 Cb -0.15 -2.13 0.38 0.00 0.56 0.00 0.00 36.38 35.04 1rkq s VAL 238 CO 0.03 -0.04 1.97 -0.78 -0.31 0.00 0.00 175.10 175.96 1rkq h ASP 239 N -1.70 0.00 -0.32 4.85 3.58 -1.10 -1.35 116.42 120.38 1rkq h ASP 239 Ca -0.44 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.01 1rkq h ASP 239 Cb 1.27 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.32 1rkq h ASP 239 CO 0.42 0.00 0.00 -0.46 -2.88 0.00 0.00 179.24 176.32 1rkq n ASN 240 N -2.98 1.88 -4.77 2.28 6.94 -1.26 -4.90 115.26 112.44 1rkq n ASN 240 Ca 0.01 -2.04 -0.35 0.00 -0.02 0.00 0.00 54.58 52.17 1rkq n ASN 240 Cb 0.29 -0.25 0.01 0.00 -2.36 0.00 0.00 39.78 37.47 1rkq n ASN 240 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1rkq s ALA 241 N -1.59 2.64 0.80 -2.53 0.00 -0.51 -4.99 121.76 115.58 1rkq s ALA 241 Ca 0.22 0.87 -0.12 0.00 0.00 0.00 0.00 51.96 52.92 1rkq s ALA 241 Cb 0.12 -3.38 0.08 0.00 0.00 0.00 0.00 23.12 19.93 1rkq s ALA 241 CO 0.14 -0.90 1.15 0.96 0.00 0.00 0.00 175.76 177.11 1rkq s ILE 242 N -1.75 2.52 0.37 0.00 -4.36 -0.76 -4.83 121.20 112.39 1rkq s ILE 242 Ca 0.74 0.21 0.07 0.00 -0.26 0.00 0.00 60.65 61.40 1rkq s ILE 242 Cb -0.26 -2.56 0.30 0.00 1.25 0.00 0.00 42.46 41.20 1rkq s ILE 242 CO 0.29 -0.19 1.95 -0.65 0.24 0.00 0.00 174.94 176.58 1rkq h PRO 243 N -1.00 0.69 0.00 0.37 0.11 -1.95 -1.50 132.00 128.72 1rkq h PRO 243 Ca -0.45 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 1rkq h PRO 243 Cb 1.27 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1rkq h PRO 243 CO 0.48 0.46 -0.09 0.66 -0.21 0.00 0.00 178.00 179.29 1rkq h SER 244 N 0.71 0.00 0.30 -2.05 4.64 -1.97 -0.71 113.55 114.46 1rkq h SER 244 Ca 0.33 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 61.31 1rkq h SER 244 Cb 0.35 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.43 1rkq h SER 244 CO -0.11 0.09 -1.69 0.58 -0.87 0.00 0.00 176.83 174.82 1rkq h VAL 245 N 0.00 0.98 -0.48 0.95 2.07 -1.63 -3.24 116.25 114.90 1rkq h VAL 245 Ca -0.00 -2.61 -0.03 0.00 0.82 0.00 0.00 66.70 64.88 1rkq h VAL 245 Cb 0.48 2.72 -0.02 0.00 -1.52 0.00 0.00 31.29 32.95 1rkq h VAL 245 CO 0.01 0.83 0.19 0.11 0.02 0.00 0.00 177.57 178.73 1rkq h LYS 246 N 0.08 0.68 -0.61 1.57 1.57 -1.05 -2.73 116.57 116.09 1rkq h LYS 246 Ca -0.31 -0.10 0.05 0.00 -1.87 0.00 0.00 60.65 58.43 1rkq h LYS 246 Cb 2.06 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 34.21 1rkq h LYS 246 CO 0.16 0.57 0.41 0.93 -0.57 0.00 0.00 179.45 180.94 1rkq h GLU 247 N 0.68 0.61 -0.01 3.15 4.39 -1.16 -2.54 114.58 119.69 1rkq h GLU 247 Ca 0.16 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.83 1rkq h GLU 247 Cb 0.14 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1rkq h GLU 247 CO -0.02 0.40 -0.36 1.33 -1.16 0.00 0.00 179.01 179.21 1rkq n VAL 248 N -4.47 0.00 -2.81 3.13 0.24 -1.05 -4.95 118.33 108.41 1rkq n VAL 248 Ca 0.08 -0.23 -0.34 0.00 -2.04 0.00 0.00 64.34 61.81 1rkq n VAL 248 Cb 0.21 0.97 -0.07 0.00 -1.47 0.00 0.00 33.84 33.49 1rkq n VAL 248 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1rkq s ALA 249 N -2.43 3.09 0.22 2.33 0.00 -0.96 -4.74 121.76 119.26 1rkq s ALA 249 Ca 0.22 0.44 0.09 0.00 0.00 0.00 0.00 51.96 52.70 1rkq s ALA 249 Cb 0.19 -3.16 0.15 0.00 0.00 0.00 0.00 23.12 20.29 1rkq s ALA 249 CO 0.53 0.14 1.49 -0.91 0.00 0.00 0.00 175.76 177.01 1rkq h ASN 250 N 2.26 0.02 -3.59 0.00 2.35 -0.54 -3.46 115.58 112.62 1rkq h ASN 250 Ca -0.48 -0.02 -0.19 0.00 -0.55 0.00 0.00 56.30 55.06 1rkq h ASN 250 Cb 1.18 -0.01 -0.28 0.00 0.05 0.00 0.00 38.32 39.27 1rkq h ASN 250 CO 0.62 0.77 -0.49 0.12 -1.65 0.00 0.00 177.43 176.80 1rkq s PHE 251 N -3.30 -0.26 -0.33 1.19 5.36 -1.06 -5.02 117.98 114.56 1rkq s PHE 251 Ca -0.01 0.64 -0.10 0.00 -0.96 0.00 0.00 56.93 56.50 1rkq s PHE 251 Cb 0.12 0.05 0.00 0.00 -0.34 0.00 0.00 43.02 42.85 1rkq s PHE 251 CO 0.79 -0.16 0.18 0.08 -1.46 0.00 0.00 175.22 174.64 1rkq s VAL 252 N 0.66 4.66 0.10 3.12 1.01 -1.26 -1.79 120.40 126.90 1rkq s VAL 252 Ca -0.05 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.39 1rkq s VAL 252 Cb -0.06 -3.45 0.02 0.00 0.00 0.00 0.00 36.38 32.89 1rkq s VAL 252 CO -0.04 -0.04 0.14 1.07 0.00 0.00 0.00 175.10 176.24 1rkq n THR 253 N 5.00 0.00 -1.08 3.92 5.66 -0.40 -4.92 114.28 122.46 1rkq n THR 253 Ca -0.13 -0.23 -0.29 0.00 -3.05 0.00 0.00 64.05 60.35 1rkq n THR 253 Cb 0.48 -1.28 0.21 0.00 -1.55 0.00 0.00 70.33 68.19 1rkq n THR 253 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 1rkq s LYS 254 N -2.74 -0.35 0.99 1.09 -0.14 -1.26 -2.18 119.74 115.15 1rkq s LYS 254 Ca 0.09 0.31 -0.12 0.00 -1.36 0.00 0.00 55.97 54.89 1rkq s LYS 254 Cb -0.01 -1.66 0.18 0.00 -1.68 0.00 0.00 37.83 34.66 1rkq s LYS 254 CO 0.06 -3.21 1.09 -1.54 -0.76 0.00 0.00 175.35 170.99 1rkq s SER 255 N -3.54 2.66 0.38 2.83 1.04 -1.26 -2.46 113.70 113.35 1rkq s SER 255 Ca 0.68 1.30 0.05 0.00 0.48 0.00 0.00 55.95 58.45 1rkq s SER 255 Cb -0.16 -1.97 0.76 0.00 0.10 0.00 0.00 66.02 64.75 1rkq s SER 255 CO 0.58 -3.13 2.02 -0.55 0.98 0.00 0.00 173.24 173.14 1rkq h ASN 256 N -1.89 0.55 -0.06 7.02 -1.07 -1.82 -0.41 115.58 117.90 1rkq h ASN 256 Ca -0.54 -0.02 -0.05 0.00 0.07 0.00 0.00 56.30 55.76 1rkq h ASN 256 Cb 1.32 -0.14 -0.01 0.00 -2.07 0.00 0.00 38.32 37.42 1rkq h ASN 256 CO 0.56 0.42 -0.09 -0.07 0.07 0.00 0.00 177.43 178.33 1rkq h LEU 257 N 0.64 0.30 -3.74 6.14 3.38 -1.91 -2.55 115.31 117.57 1rkq h LEU 257 Ca 0.17 -0.06 -0.23 0.00 0.09 0.00 0.00 57.88 57.85 1rkq h LEU 257 Cb -0.03 -0.08 -0.14 0.00 0.09 0.00 0.00 40.66 40.51 1rkq h LEU 257 CO -0.03 0.43 0.28 -0.62 0.09 0.00 0.00 178.44 178.59 1rkq n GLU 258 N -4.28 3.57 -3.26 1.13 1.02 -0.60 -4.96 120.64 113.25 1rkq n GLU 258 Ca -0.00 -3.09 -0.17 0.00 -0.02 0.00 0.00 57.16 53.88 1rkq n GLU 258 Cb 0.26 -2.20 0.06 0.00 -0.02 0.00 0.00 31.44 29.54 1rkq n GLU 258 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1rkq n ASP 259 N -0.26 -4.78 -0.04 1.62 8.00 -0.96 -4.71 116.55 115.41 1rkq n ASP 259 Ca 0.42 -0.40 0.13 0.00 0.71 0.00 0.00 54.79 55.65 1rkq n ASP 259 Cb 1.39 -3.79 0.54 0.00 -0.02 0.00 0.00 41.12 39.23 1rkq n ASP 259 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 1rkq h GLY 260 N -1.89 0.45 0.98 0.44 0.00 -1.21 -0.37 103.07 101.48 1rkq h GLY 260 Ca -0.41 -0.13 -0.05 0.00 0.00 0.00 0.00 47.33 46.73 1rkq h GLY 260 CO 0.40 0.08 0.14 -2.08 0.00 0.00 0.00 176.54 175.08 1rkq h VAL 261 N 0.32 1.24 -0.50 4.60 2.07 -1.84 -1.68 116.25 120.46 1rkq h VAL 261 Ca 0.25 -0.83 -0.10 0.00 0.82 0.00 0.00 66.70 66.84 1rkq h VAL 261 Cb 0.56 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.10 1rkq h VAL 261 CO -0.06 0.30 -0.08 0.00 0.02 0.00 0.00 177.57 177.75 1rkq h ALA 262 N 1.01 0.92 -0.28 1.67 0.00 -1.40 -1.88 119.26 119.29 1rkq h ALA 262 Ca 0.16 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 1rkq h ALA 262 Cb 0.32 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1rkq h ALA 262 CO -0.00 0.63 -0.08 0.35 0.00 0.00 0.00 179.25 180.15 1rkq h PHE 263 N 0.81 0.48 -0.18 0.00 3.57 -1.14 0.51 116.94 121.00 1rkq h PHE 263 Ca 0.14 -0.06 -0.21 0.00 3.53 0.00 0.00 57.97 61.37 1rkq h PHE 263 Cb 0.60 -0.13 0.01 0.00 2.79 0.00 0.00 35.95 39.21 1rkq h PHE 263 CO 0.04 0.54 -0.72 0.00 -2.23 0.00 0.00 178.31 175.93 1rkq h ALA 264 N 1.49 0.38 -0.59 2.41 0.00 -1.06 -1.53 119.26 120.35 1rkq h ALA 264 Ca 0.09 -0.58 -0.05 0.00 0.00 0.00 0.00 54.91 54.37 1rkq h ALA 264 Cb 0.42 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1rkq h ALA 264 CO 0.02 0.69 0.17 0.82 0.00 0.00 0.00 179.25 180.95 1rkq h ILE 265 N 0.55 1.23 -0.26 0.00 2.04 -0.99 -1.82 117.51 118.26 1rkq h ILE 265 Ca -0.04 -0.81 -0.06 0.00 1.00 0.00 0.00 64.86 64.96 1rkq h ILE 265 Cb 1.34 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 38.01 1rkq h ILE 265 CO 0.15 0.31 -0.07 -0.33 0.00 0.00 0.00 178.15 178.20 1rkq h GLU 266 N 0.87 0.51 -0.14 2.37 5.08 -0.65 -0.87 114.58 121.76 1rkq h GLU 266 Ca 0.19 -0.20 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1rkq h GLU 266 Cb 0.27 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1rkq h GLU 266 CO -0.01 0.74 0.08 -0.22 -1.00 0.00 0.00 179.01 178.60 1rkq h LYS 267 N 0.26 0.18 0.00 2.33 3.64 -1.08 -1.33 116.57 120.57 1rkq h LYS 267 Ca 0.07 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1rkq h LYS 267 Cb 0.55 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 1rkq h LYS 267 CO 0.03 0.16 -1.61 0.66 -2.27 0.00 0.00 179.45 176.42 1rkq n TYR 268 N -4.97 0.01 0.05 1.91 4.01 -0.70 -4.59 117.16 112.87 1rkq n TYR 268 Ca -0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.70 1rkq n TYR 268 Cb 0.05 -0.32 0.00 0.00 -0.31 0.00 0.00 39.34 38.76 1rkq n TYR 268 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1rkq n VAL 269 N -1.98 1.06 0.13 -0.72 0.31 -0.42 -4.65 118.33 112.06 1rkq n VAL 269 Ca -0.01 0.35 0.00 0.00 -0.01 0.00 0.00 64.34 64.67 1rkq n VAL 269 Cb 0.48 -1.56 0.12 0.00 -0.91 0.00 0.00 33.84 31.97 1rkq n VAL 269 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1rkq h LEU 270 N 0.00 0.00 -1.88 7.52 3.38 -1.26 -3.50 115.31 119.57 1rkq h LEU 270 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1rkq h LEU 270 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1rkq h LEU 270 CO 0.00 0.62 0.00 0.59 0.09 0.00 0.00 178.44 179.74