#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dxq s ALA 2 N 0.00 3.68 0.00 0.00 0.00 -1.26 -5.02 121.76 119.16 1dxq s ALA 2 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 51.96 51.65 1dxq s ALA 2 Cb 0.00 -2.34 0.00 0.00 0.00 0.00 0.00 23.12 20.78 1dxq s ALA 2 CO 0.00 0.53 0.00 0.54 0.00 0.00 0.00 175.76 176.83 1dxq n ARG 3 N 0.87 0.00 -3.56 0.00 5.12 -1.26 -4.96 116.66 112.87 1dxq n ARG 3 Ca -0.07 0.00 -0.38 0.00 -1.93 0.00 0.00 57.85 55.47 1dxq n ARG 3 Cb 0.52 0.00 -0.06 0.00 -1.16 0.00 0.00 32.46 31.76 1dxq n ARG 3 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 1dxq s ARG 4 N 2.25 3.84 0.01 5.56 0.52 -1.26 0.22 118.95 130.09 1dxq s ARG 4 Ca 0.00 0.32 0.01 0.00 -0.52 0.00 0.00 55.73 55.54 1dxq s ARG 4 Cb 0.00 -3.20 -0.01 0.00 0.52 0.00 0.00 34.95 32.26 1dxq s ARG 4 CO 0.00 0.70 -0.03 0.00 0.02 0.00 0.00 175.30 175.99 1dxq s ALA 5 N -1.09 0.23 -0.11 2.13 0.00 -0.51 0.72 121.76 123.13 1dxq s ALA 5 Ca 0.23 -0.27 -0.01 0.00 0.00 0.00 0.00 51.96 51.92 1dxq s ALA 5 Cb -0.16 -0.00 -0.03 0.00 0.00 0.00 0.00 23.12 22.93 1dxq s ALA 5 CO 0.12 0.00 -0.08 -1.17 0.00 0.00 0.00 175.76 174.64 1dxq s LEU 6 N -0.48 3.07 -0.24 0.00 2.96 0.80 -0.76 118.68 124.02 1dxq s LEU 6 Ca -0.03 -0.14 0.02 0.00 -0.22 0.00 0.00 54.13 53.76 1dxq s LEU 6 Cb -0.04 -1.69 0.05 0.00 0.50 0.00 0.00 46.19 45.01 1dxq s LEU 6 CO -0.00 0.25 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.53 1dxq s ILE 7 N -0.15 2.26 -0.26 6.68 1.01 -0.12 0.10 121.20 130.71 1dxq s ILE 7 Ca 0.02 -1.40 -0.10 0.00 0.00 0.00 0.00 60.65 59.16 1dxq s ILE 7 Cb -0.13 -2.22 -0.05 0.00 0.01 0.00 0.00 42.46 40.07 1dxq s ILE 7 CO 0.03 0.12 0.16 -0.69 0.00 0.00 0.00 174.94 174.56 1dxq s VAL 8 N 1.18 5.13 -0.09 2.92 1.01 0.43 -1.91 120.40 129.07 1dxq s VAL 8 Ca -0.05 0.11 0.01 0.00 0.00 0.00 0.00 61.98 62.05 1dxq s VAL 8 Cb -0.18 -3.43 -0.02 0.00 0.00 0.00 0.00 36.38 32.75 1dxq s VAL 8 CO -0.07 0.29 -0.11 -0.22 0.00 0.00 0.00 175.10 174.99 1dxq s LEU 9 N 1.57 2.86 -0.65 3.92 2.96 -1.16 -0.96 118.68 127.22 1dxq s LEU 9 Ca 0.07 -0.20 0.05 0.00 -0.22 0.00 0.00 54.13 53.82 1dxq s LEU 9 Cb -0.15 -1.62 0.17 0.00 0.50 0.00 0.00 46.19 45.08 1dxq s LEU 9 CO 0.08 0.27 0.47 0.00 -1.32 0.00 0.00 176.35 175.85 1dxq s ALA 10 N -0.25 3.39 -0.28 5.97 0.00 -0.79 -2.23 121.76 127.57 1dxq s ALA 10 Ca 0.02 -3.60 -0.17 0.00 0.00 0.00 0.00 51.96 48.21 1dxq s ALA 10 Cb -0.13 -2.06 0.09 0.00 0.00 0.00 0.00 23.12 21.01 1dxq s ALA 10 CO 0.03 -2.08 0.73 -1.58 0.00 0.00 0.00 175.76 172.86 1dxq s HIS 11 N -1.20 -0.97 0.21 0.00 5.04 -1.26 -4.48 115.29 112.63 1dxq s HIS 11 Ca 0.26 1.99 0.00 0.00 -1.54 0.00 0.00 55.06 55.78 1dxq s HIS 11 Cb -0.03 0.56 0.18 0.00 0.04 0.00 0.00 32.58 33.33 1dxq s HIS 11 CO -0.17 -0.48 1.53 0.66 -2.34 0.00 0.00 174.74 173.94 1dxq h SER 12 N 6.63 0.46 -2.99 9.88 4.64 -1.96 -3.43 113.55 126.78 1dxq h SER 12 Ca -0.30 -0.25 -0.62 0.00 -0.47 0.00 0.00 61.79 60.15 1dxq h SER 12 Cb 1.22 -0.13 -0.07 0.00 -0.31 0.00 0.00 62.40 63.11 1dxq h SER 12 CO 0.15 0.93 -0.30 -1.61 -0.87 0.00 0.00 176.83 175.14 1dxq s GLU 13 N -3.89 3.89 0.00 4.77 0.41 -1.26 -4.95 118.70 117.68 1dxq s GLU 13 Ca -0.06 0.21 0.29 0.00 -0.41 0.00 0.00 54.97 55.00 1dxq s GLU 13 Cb 0.12 -3.27 1.19 0.00 -1.78 0.00 0.00 34.13 30.39 1dxq s GLU 13 CO 0.82 0.59 1.84 1.17 -0.49 0.00 0.00 175.26 179.19 1dxq n LYS 14 N 2.32 0.67 -0.31 1.61 4.81 -1.26 -3.29 118.16 122.70 1dxq n LYS 14 Ca -0.15 -0.24 0.12 0.00 -0.87 0.00 0.00 58.31 57.17 1dxq n LYS 14 Cb 0.53 -1.50 0.29 0.00 0.02 0.00 0.00 35.03 34.37 1dxq n LYS 14 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 1dxq n THR 15 N -0.95 0.83 -2.79 3.15 -2.24 -1.26 -4.80 114.28 106.22 1dxq n THR 15 Ca 0.14 -0.92 -0.26 0.00 -2.27 0.00 0.00 64.05 60.75 1dxq n THR 15 Cb 0.28 0.67 0.01 0.00 -2.10 0.00 0.00 70.33 69.19 1dxq n THR 15 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1dxq s SER 16 N -1.16 6.01 0.29 3.42 1.04 -1.21 -4.97 113.70 117.11 1dxq s SER 16 Ca 0.46 0.64 0.04 0.00 0.48 0.00 0.00 55.95 57.57 1dxq s SER 16 Cb 0.25 -1.91 0.43 0.00 0.10 0.00 0.00 66.02 64.89 1dxq s SER 16 CO 0.33 -0.68 1.72 0.15 0.98 0.00 0.00 173.24 175.74 1dxq h PHE 17 N 0.26 0.45 -0.42 5.02 3.57 -1.93 -1.72 116.94 122.18 1dxq h PHE 17 Ca -0.47 -0.10 0.05 0.00 3.53 0.00 0.00 57.97 60.98 1dxq h PHE 17 Cb 1.23 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.84 1dxq h PHE 17 CO 0.51 0.67 0.28 -0.91 -2.23 0.00 0.00 178.31 176.63 1dxq h ASN 18 N 0.35 0.31 0.09 0.41 2.35 -1.93 0.49 115.58 117.65 1dxq h ASN 18 Ca 0.05 -0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.57 1dxq h ASN 18 Cb 0.71 -0.07 0.01 0.00 0.05 0.00 0.00 38.32 39.02 1dxq h ASN 18 CO 0.05 0.21 -0.86 0.22 -1.65 0.00 0.00 177.43 175.40 1dxq h TYR 19 N 0.36 0.84 0.72 1.19 3.20 -1.59 -2.31 116.97 119.39 1dxq h TYR 19 Ca 0.18 -0.41 -0.03 0.00 3.14 0.00 0.00 58.73 61.61 1dxq h TYR 19 Cb 0.26 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 38.42 1dxq h TYR 19 CO -0.00 1.22 -0.45 0.00 -1.64 0.00 0.00 178.16 177.29 1dxq h ALA 20 N 0.66 -1.15 -0.62 1.82 0.00 -0.33 -0.02 119.26 119.62 1dxq h ALA 20 Ca -0.07 -0.23 0.18 0.00 0.00 0.00 0.00 54.91 54.79 1dxq h ALA 20 Cb 1.48 0.56 -0.02 0.00 0.00 0.00 0.00 17.79 19.81 1dxq h ALA 20 CO 0.16 -1.16 0.68 0.52 0.00 0.00 0.00 179.25 179.45 1dxq h MET 21 N -1.11 0.00 0.16 0.00 2.86 -0.13 0.57 114.93 117.28 1dxq h MET 21 Ca -0.09 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.54 1dxq h MET 21 Cb 0.89 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.55 1dxq h MET 21 CO 0.09 0.00 -0.08 -0.22 1.06 0.00 0.00 176.91 177.76 1dxq h LYS 22 N 0.00 -0.21 -0.71 1.72 3.11 -0.47 -3.01 116.57 117.01 1dxq h LYS 22 Ca 0.30 0.01 0.05 0.00 -2.81 0.00 0.00 60.65 58.20 1dxq h LYS 22 Cb 1.66 0.05 -0.05 0.00 -1.00 0.00 0.00 32.23 32.88 1dxq h LYS 22 CO -0.00 0.12 0.42 0.93 -2.81 0.00 0.00 179.45 178.11 1dxq h GLU 23 N -0.98 0.78 -0.17 1.90 4.39 0.46 -1.91 114.58 119.05 1dxq h GLU 23 Ca -0.02 -0.05 0.04 0.00 0.34 0.00 0.00 59.36 59.68 1dxq h GLU 23 Cb 0.43 -0.18 -0.07 0.00 -0.10 0.00 0.00 28.75 28.83 1dxq h GLU 23 CO 0.04 0.52 -0.44 0.00 -1.16 0.00 0.00 179.01 177.96 1dxq h ALA 24 N 1.33 -0.61 -0.03 3.43 0.00 -1.06 0.41 119.26 122.73 1dxq h ALA 24 Ca 0.30 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.24 1dxq h ALA 24 Cb 0.11 0.83 -0.04 0.00 0.00 0.00 0.00 17.79 18.68 1dxq h ALA 24 CO -0.15 -0.94 -0.22 0.00 0.00 0.00 0.00 179.25 177.94 1dxq h ALA 25 N 0.11 -0.27 -0.07 0.00 0.00 -1.34 0.18 119.26 117.86 1dxq h ALA 25 Ca 0.08 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.03 1dxq h ALA 25 Cb 0.63 0.40 -0.06 0.00 0.00 0.00 0.00 17.79 18.76 1dxq h ALA 25 CO -0.43 -0.71 -0.46 0.28 0.00 0.00 0.00 179.25 177.93 1dxq h VAL 26 N -0.34 0.10 -0.53 0.00 2.07 -0.69 0.20 116.25 117.06 1dxq h VAL 26 Ca 0.07 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.69 1dxq h VAL 26 Cb 0.43 0.10 -0.09 0.00 -1.52 0.00 0.00 31.29 30.22 1dxq h VAL 26 CO -0.22 0.00 -0.01 -0.08 0.02 0.00 0.00 177.57 177.28 1dxq h GLU 27 N -0.56 0.10 0.89 1.57 4.81 0.10 -1.14 114.58 120.36 1dxq h GLU 27 Ca 0.05 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.23 1dxq h GLU 27 Cb 0.66 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 30.02 1dxq h GLU 27 CO -0.38 0.07 -0.45 0.00 -0.73 0.00 0.00 179.01 177.52 1dxq h ALA 28 N 1.48 -1.32 -0.75 2.92 0.00 0.22 -2.46 119.26 119.35 1dxq h ALA 28 Ca 0.27 -0.26 0.14 0.00 0.00 0.00 0.00 54.91 55.05 1dxq h ALA 28 Cb 0.42 0.50 -0.09 0.00 0.00 0.00 0.00 17.79 18.61 1dxq h ALA 28 CO -0.46 -1.24 0.31 -0.07 0.00 0.00 0.00 179.25 177.79 1dxq h LEU 29 N -1.22 0.29 -0.56 0.00 -0.00 -0.47 -1.55 115.31 111.80 1dxq h LEU 29 Ca -0.12 0.11 0.07 0.00 -0.00 0.00 0.00 57.88 57.93 1dxq h LEU 29 Cb 0.94 0.08 -0.06 0.00 -0.00 0.00 0.00 40.66 41.62 1dxq h LEU 29 CO 0.19 0.12 0.25 0.11 -0.00 0.00 0.00 178.44 179.10 1dxq h LYS 30 N 0.45 0.45 -0.99 1.13 1.57 -1.14 -0.55 116.57 117.50 1dxq h LYS 30 Ca 0.41 -0.03 0.07 0.00 -1.87 0.00 0.00 60.65 59.23 1dxq h LYS 30 Cb 0.61 -0.10 -0.07 0.00 0.08 0.00 0.00 32.23 32.75 1dxq h LYS 30 CO -0.39 0.30 0.64 0.87 -0.57 0.00 0.00 179.45 180.30 1dxq h LYS 31 N 0.47 1.10 -0.98 3.15 1.57 -0.79 0.18 116.57 121.27 1dxq h LYS 31 Ca 0.27 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.97 1dxq h LYS 31 Cb 0.25 -0.25 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 1dxq h LYS 31 CO -0.23 0.73 0.01 0.54 -0.57 0.00 0.00 179.45 179.93 1dxq n ARG 32 N -4.51 1.20 -1.37 3.15 5.12 -0.62 -4.83 116.66 114.81 1dxq n ARG 32 Ca 0.16 -0.19 -0.13 0.00 -1.93 0.00 0.00 57.85 55.76 1dxq n ARG 32 Cb 0.21 -1.44 -0.05 0.00 -1.16 0.00 0.00 32.46 30.01 1dxq n ARG 32 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1dxq n GLY 33 N 0.12 1.35 3.84 -0.13 0.00 0.64 -4.99 105.19 106.01 1dxq n GLY 33 Ca 0.02 -0.41 -0.30 0.00 0.00 0.00 0.00 46.02 45.33 1dxq n GLY 33 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1dxq s TRP 34 N -2.45 1.50 -0.27 1.61 0.52 -0.31 -4.81 118.94 114.72 1dxq s TRP 34 Ca 0.00 0.43 0.00 0.00 0.02 0.00 0.00 56.10 56.55 1dxq s TRP 34 Cb 0.00 -3.87 0.08 0.00 -1.15 0.00 0.00 33.47 28.53 1dxq s TRP 34 CO 0.00 -2.86 0.02 -2.00 0.02 0.00 0.00 176.95 172.13 1dxq s GLU 35 N -5.71 1.19 -0.10 4.98 2.12 0.13 -4.57 118.70 116.74 1dxq s GLU 35 Ca 0.72 -1.09 -0.18 0.00 0.36 0.00 0.00 54.97 54.77 1dxq s GLU 35 Cb -0.06 -2.44 -0.04 0.00 0.26 0.00 0.00 34.13 31.84 1dxq s GLU 35 CO 0.53 -0.78 0.50 0.08 -0.54 0.00 0.00 175.26 175.05 1dxq s VAL 36 N 1.44 5.15 -0.03 3.70 1.01 -1.26 -1.42 120.40 128.98 1dxq s VAL 36 Ca 0.03 1.00 0.04 0.00 0.00 0.00 0.00 61.98 63.05 1dxq s VAL 36 Cb -0.18 -3.83 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 1dxq s VAL 36 CO -0.13 0.34 -0.13 -0.76 0.00 0.00 0.00 175.10 174.42 1dxq s LEU 37 N 0.47 2.81 0.04 3.92 1.43 0.06 -4.97 118.68 122.43 1dxq s LEU 37 Ca 0.27 -0.20 0.06 0.00 -1.03 0.00 0.00 54.13 53.22 1dxq s LEU 37 Cb -0.16 -1.60 -0.02 0.00 0.03 0.00 0.00 46.19 44.44 1dxq s LEU 37 CO 0.12 0.33 -0.17 -1.61 0.23 0.00 0.00 176.35 175.24 1dxq s GLU 38 N -0.93 1.10 -0.51 1.70 2.02 -1.26 -0.94 118.70 119.88 1dxq s GLU 38 Ca 0.13 -0.84 0.07 0.00 0.02 0.00 0.00 54.97 54.34 1dxq s GLU 38 Cb -0.11 -1.16 0.24 0.00 0.10 0.00 0.00 34.13 33.20 1dxq s GLU 38 CO 0.02 0.29 0.59 0.43 0.02 0.00 0.00 175.26 176.61 1dxq n SER 39 N 1.84 1.68 -4.56 -0.19 7.64 -0.80 -4.96 113.62 114.27 1dxq n SER 39 Ca -0.18 -2.99 -0.32 0.00 1.01 0.00 0.00 58.87 56.39 1dxq n SER 39 Cb 0.54 -0.65 -0.04 0.00 -1.01 0.00 0.00 64.21 63.05 1dxq n SER 39 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1dxq s ASP 40 N -1.60 5.38 0.19 6.43 -1.08 -1.26 -2.98 116.67 121.75 1dxq s ASP 40 Ca 0.36 -0.46 -0.12 0.00 -0.52 0.00 0.00 52.55 51.81 1dxq s ASP 40 Cb 0.14 -2.55 0.21 0.00 -1.46 0.00 0.00 42.92 39.26 1dxq s ASP 40 CO -0.08 -2.46 1.72 -0.07 0.52 0.00 0.00 175.17 174.79 1dxq h LEU 41 N 16.68 0.04 -0.67 -1.34 3.38 -1.82 0.24 115.31 131.82 1dxq h LEU 41 Ca -0.01 0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1dxq h LEU 41 Cb 1.05 0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.88 1dxq h LEU 41 CO 1.24 0.05 0.35 1.88 0.09 0.00 0.00 178.44 182.04 1dxq h TYR 42 N 0.27 0.94 0.87 1.13 0.05 -1.83 0.22 116.97 118.63 1dxq h TYR 42 Ca 0.26 -0.03 -0.04 0.00 0.05 0.00 0.00 58.73 58.97 1dxq h TYR 42 Cb 0.35 -0.30 0.01 0.00 1.01 0.00 0.00 36.73 37.80 1dxq h TYR 42 CO -0.22 0.69 -0.42 0.00 -1.05 0.00 0.00 178.16 177.16 1dxq h ALA 43 N 1.17 -1.23 0.00 3.88 0.00 -1.66 -1.55 119.26 119.85 1dxq h ALA 43 Ca 0.23 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1dxq h ALA 43 Cb 0.08 0.45 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1dxq h ALA 43 CO -0.03 -1.15 0.24 -1.33 0.00 0.00 0.00 179.25 176.98 1dxq n MET 44 N -5.35 0.08 -2.79 0.00 2.81 0.78 -4.71 117.12 107.95 1dxq n MET 44 Ca -0.14 0.54 -0.21 0.00 -1.81 0.00 0.00 57.70 56.08 1dxq n MET 44 Cb 0.46 -2.01 0.02 0.00 -0.71 0.00 0.00 33.22 30.98 1dxq n MET 44 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1dxq n ASN 45 N -1.96 -5.80 -4.60 7.83 4.05 -0.32 -4.87 115.26 109.58 1dxq n ASN 45 Ca -0.01 -0.19 -0.42 0.00 0.45 0.00 0.00 54.58 54.40 1dxq n ASN 45 Cb 0.26 -4.69 0.00 0.00 1.23 0.00 0.00 39.78 36.58 1dxq n ASN 45 CO 0.00 0.00 0.00 0.33 -3.05 0.00 0.00 177.26 174.54 1dxq n PHE 46 N -4.32 1.22 -3.08 1.20 7.35 -0.08 -4.95 117.46 114.80 1dxq n PHE 46 Ca -0.15 0.60 -0.41 0.00 -0.76 0.00 0.00 57.45 56.73 1dxq n PHE 46 Cb 0.63 -2.24 -0.06 0.00 0.35 0.00 0.00 39.48 38.16 1dxq n PHE 46 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1dxq s ASN 47 N -0.66 6.55 0.05 -2.13 2.47 -1.26 -4.94 114.94 115.02 1dxq s ASN 47 Ca 0.61 0.54 0.00 0.00 0.42 0.00 0.00 52.86 54.43 1dxq s ASN 47 Cb -0.60 -2.34 -0.26 0.00 -1.45 0.00 0.00 41.25 36.59 1dxq s ASN 47 CO 0.58 -0.47 1.03 1.55 -3.72 0.00 0.00 177.10 176.07 1dxq h PRO 48 N 8.10 0.18 -6.68 0.43 0.13 -1.90 -3.45 132.00 128.81 1dxq h PRO 48 Ca -0.26 -0.31 -0.52 0.00 -0.87 0.00 0.00 66.00 64.04 1dxq h PRO 48 Cb 1.12 0.12 0.02 0.00 0.13 0.00 0.00 31.00 32.38 1dxq h PRO 48 CO 0.81 1.07 0.57 0.42 -0.23 0.00 0.00 178.00 180.64 1dxq s ILE 49 N -2.65 3.48 -0.16 -3.56 1.01 -1.26 -4.33 121.20 113.73 1dxq s ILE 49 Ca -0.05 1.26 -0.14 0.00 0.00 0.00 0.00 60.65 61.72 1dxq s ILE 49 Cb 0.08 -3.81 -0.05 0.00 0.01 0.00 0.00 42.46 38.70 1dxq s ILE 49 CO 0.85 0.21 0.31 -0.51 0.00 0.00 0.00 174.94 175.81 1dxq s ILE 50 N -0.15 5.29 0.33 2.92 2.07 -1.26 -5.02 121.20 125.37 1dxq s ILE 50 Ca 0.53 0.59 -0.17 0.00 -1.41 0.00 0.00 60.65 60.18 1dxq s ILE 50 Cb -0.33 -3.65 0.03 0.00 0.13 0.00 0.00 42.46 38.64 1dxq s ILE 50 CO 0.38 0.37 0.72 -0.94 -1.91 0.00 0.00 174.94 173.56 1dxq s SER 51 N 0.53 -0.07 0.00 4.50 1.04 -1.26 -5.01 113.70 113.43 1dxq s SER 51 Ca 0.17 -0.91 0.00 0.00 0.48 0.00 0.00 55.95 55.69 1dxq s SER 51 Cb -0.13 0.77 0.00 0.00 0.10 0.00 0.00 66.02 66.76 1dxq s SER 51 CO 0.05 -1.48 0.26 -2.11 0.98 0.00 0.00 173.24 170.94 1dxq n ARG 52 N -0.49 0.41 0.00 4.02 1.85 -1.26 -1.83 116.66 119.36 1dxq n ARG 52 Ca -0.05 0.00 0.11 0.00 -1.00 0.00 0.00 57.85 56.90 1dxq n ARG 52 Cb 0.60 -1.14 -0.09 0.00 -1.05 0.00 0.00 32.46 30.77 1dxq n ARG 52 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1dxq n ASN 53 N 0.07 0.57 0.00 2.89 4.13 -1.26 -3.92 115.26 117.74 1dxq n ASN 53 Ca 0.00 -0.46 0.07 0.00 1.68 0.00 0.00 54.58 55.88 1dxq n ASN 53 Cb 0.07 1.25 0.35 0.00 -1.54 0.00 0.00 39.78 39.91 1dxq n ASN 53 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1dxq n ASP 54 N -1.87 0.00 -4.54 6.41 8.00 -0.76 -4.68 116.55 119.12 1dxq n ASP 54 Ca 0.01 0.35 -0.32 0.00 0.71 0.00 0.00 54.79 55.54 1dxq n ASP 54 Cb 0.44 -0.43 -0.11 0.00 -0.02 0.00 0.00 41.12 40.99 1dxq n ASP 54 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1dxq s ILE 55 N -2.86 3.30 0.11 0.53 1.09 -1.25 0.57 121.20 122.69 1dxq s ILE 55 Ca 0.10 -0.90 0.05 0.00 -1.10 0.00 0.00 60.65 58.80 1dxq s ILE 55 Cb 0.10 -2.41 -0.04 0.00 -1.06 0.00 0.00 42.46 39.05 1dxq s ILE 55 CO 0.27 0.40 0.01 -0.89 -0.10 0.00 0.00 174.94 174.62 1dxq s THR 56 N -0.94 3.98 0.00 2.92 2.01 0.94 -4.84 115.64 119.71 1dxq s THR 56 Ca 0.16 -1.08 0.00 0.00 0.31 0.00 0.00 61.69 61.08 1dxq s THR 56 Cb -0.11 -2.92 0.00 0.00 0.01 0.00 0.00 72.50 69.48 1dxq s THR 56 CO 0.06 0.07 0.00 0.61 -0.69 0.00 0.00 174.62 174.66 1dxq n GLY 57 N 0.39 -1.05 3.68 4.40 0.00 -1.26 -4.81 105.19 106.53 1dxq n GLY 57 Ca -0.10 -1.16 -0.47 0.00 0.00 0.00 0.00 46.02 44.28 1dxq n GLY 57 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1dxq n GLU 58 N -0.60 2.25 0.00 1.61 -0.00 -1.26 -4.87 120.64 117.77 1dxq n GLU 58 Ca 0.00 0.82 0.00 0.00 -0.00 0.00 0.00 57.16 57.98 1dxq n GLU 58 Cb 0.00 -2.66 0.00 0.00 -0.00 0.00 0.00 31.44 28.78 1dxq n GLU 58 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.13 177.02 1dxq n LEU 59 N 5.99 0.90 0.00 -1.84 -0.00 -1.26 -4.92 117.00 115.87 1dxq n LEU 59 Ca 0.21 -0.45 0.00 0.00 -0.00 0.00 0.00 56.01 55.77 1dxq n LEU 59 Cb 0.30 -0.38 0.00 0.00 -0.00 0.00 0.00 43.42 43.35 1dxq n LEU 59 CO 0.70 0.21 0.00 1.17 -0.00 0.00 0.00 177.39 179.47 1dxq n LYS 60 N 0.17 0.00 -3.85 1.96 4.81 -1.26 -3.48 118.16 116.51 1dxq n LYS 60 Ca 0.00 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 57.13 1dxq n LYS 60 Cb 0.21 0.00 -0.11 0.00 0.02 0.00 0.00 35.03 35.14 1dxq n LYS 60 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1dxq s ASP 61 N -4.00 4.95 -0.04 3.14 2.15 -1.26 -4.91 116.67 116.71 1dxq s ASP 61 Ca 0.00 -3.54 0.01 0.00 0.43 0.00 0.00 52.55 49.45 1dxq s ASP 61 Cb 0.00 -1.71 0.09 0.00 -0.30 0.00 0.00 42.92 41.00 1dxq s ASP 61 CO 0.00 -0.16 0.83 -1.54 -0.17 0.00 0.00 175.17 174.13 1dxq n SER 62 N 2.45 2.18 0.00 -0.34 3.41 -1.23 -3.66 113.62 116.43 1dxq n SER 62 Ca 0.15 -2.14 0.00 0.00 -0.26 0.00 0.00 58.87 56.62 1dxq n SER 62 Cb 0.35 -0.53 0.00 0.00 -0.26 0.00 0.00 64.21 63.77 1dxq n SER 62 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1dxq n LYS 63 N 0.17 0.00 -2.47 4.33 3.00 -1.26 -4.61 118.16 117.31 1dxq n LYS 63 Ca 0.05 0.04 -0.41 0.00 -0.00 0.00 0.00 58.31 57.99 1dxq n LYS 63 Cb 0.48 -0.50 0.01 0.00 0.00 0.00 0.00 35.03 35.02 1dxq n LYS 63 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 1dxq n ASN 64 N -2.36 7.55 -4.61 3.14 5.15 -1.25 -5.01 115.26 117.86 1dxq n ASN 64 Ca 0.00 -3.55 -0.51 0.00 -0.60 0.00 0.00 54.58 49.92 1dxq n ASN 64 Cb 0.00 -1.22 -0.06 0.00 -0.53 0.00 0.00 39.78 37.98 1dxq n ASN 64 CO 0.00 0.00 0.00 0.33 1.40 0.00 0.00 177.26 178.99 1dxq n PHE 65 N 0.39 1.68 -3.73 1.20 7.35 -1.24 -4.98 117.46 118.13 1dxq n PHE 65 Ca 0.51 0.56 -0.24 0.00 -0.76 0.00 0.00 57.45 57.51 1dxq n PHE 65 Cb 0.26 -2.38 -0.17 0.00 0.35 0.00 0.00 39.48 37.54 1dxq n PHE 65 CO 0.00 0.00 0.00 -0.65 -0.76 0.00 0.00 176.76 175.35 1dxq s GLN 66 N 0.58 0.49 0.21 -4.13 -0.21 -1.26 -5.06 119.66 110.27 1dxq s GLN 66 Ca 0.83 -0.05 -0.08 0.00 0.02 0.00 0.00 55.36 56.08 1dxq s GLN 66 Cb -0.89 -1.38 0.16 0.00 1.00 0.00 0.00 33.01 31.90 1dxq s GLN 66 CO 0.45 -0.45 1.81 -0.92 -2.12 0.00 0.00 175.29 174.05 1dxq h TYR 67 N 8.33 1.14 -0.20 0.91 5.03 -1.97 -1.60 116.97 128.60 1dxq h TYR 67 Ca -0.17 -0.05 0.03 0.00 2.58 0.00 0.00 58.73 61.11 1dxq h TYR 67 Cb 1.13 -0.35 -0.03 0.00 1.55 0.00 0.00 36.73 39.02 1dxq h TYR 67 CO 0.38 0.83 0.03 -1.35 -1.32 0.00 0.00 178.16 176.73 1dxq h PRO 68 N 1.12 0.11 -0.04 1.82 0.11 -2.00 -1.53 132.00 131.60 1dxq h PRO 68 Ca 0.27 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.35 1dxq h PRO 68 Cb 0.12 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.20 1dxq h PRO 68 CO -0.03 0.07 -0.07 0.66 -0.21 0.00 0.00 178.00 178.42 1dxq h SER 69 N 0.11 0.13 -0.64 -2.05 4.64 -2.00 -2.75 113.55 110.99 1dxq h SER 69 Ca 0.09 -0.56 0.14 0.00 -0.47 0.00 0.00 61.79 61.00 1dxq h SER 69 Cb 0.09 -0.04 -0.04 0.00 -0.31 0.00 0.00 62.40 62.11 1dxq h SER 69 CO -0.13 0.66 0.44 -0.33 -0.87 0.00 0.00 176.83 176.61 1dxq h GLU 70 N -0.41 0.24 0.12 4.77 4.39 -1.27 -2.49 114.58 119.94 1dxq h GLU 70 Ca 0.00 -0.01 -0.28 0.00 0.34 0.00 0.00 59.36 59.40 1dxq h GLU 70 Cb 0.64 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 29.23 1dxq h GLU 70 CO 0.02 0.16 -1.45 0.66 -1.16 0.00 0.00 179.01 177.23 1dxq h SER 71 N 0.24 0.40 0.38 1.42 4.64 -1.29 -2.50 113.55 116.84 1dxq h SER 71 Ca 0.31 -0.86 -0.03 0.00 -0.47 0.00 0.00 61.79 60.74 1dxq h SER 71 Cb 0.88 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 62.83 1dxq h SER 71 CO -0.07 1.64 -0.13 0.77 -0.87 0.00 0.00 176.83 178.17 1dxq h SER 72 N -0.26 0.00 0.24 4.97 4.64 -1.40 0.21 113.55 121.95 1dxq h SER 72 Ca -0.31 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 60.69 1dxq h SER 72 Cb 1.79 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 63.92 1dxq h SER 72 CO 0.07 0.13 -1.42 0.25 -0.87 0.00 0.00 176.83 174.99 1dxq h LEU 73 N 0.00 0.83 -1.54 5.97 7.12 -1.56 -2.81 115.31 123.31 1dxq h LEU 73 Ca -0.00 -0.92 -0.04 0.00 0.13 0.00 0.00 57.88 57.05 1dxq h LEU 73 Cb 0.35 -0.27 -0.01 0.00 -0.53 0.00 0.00 40.66 40.20 1dxq h LEU 73 CO 0.02 1.69 -0.15 0.00 -0.13 0.00 0.00 178.44 179.86 1dxq h ALA 74 N 0.15 1.62 0.62 1.25 0.00 -0.85 -0.26 119.26 121.78 1dxq h ALA 74 Ca -0.25 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.45 1dxq h ALA 74 Cb 2.12 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 19.86 1dxq h ALA 74 CO 0.27 0.28 -0.30 -0.92 0.00 0.00 0.00 179.25 178.58 1dxq h TYR 75 N 0.10 -0.77 -0.59 0.00 3.20 -0.57 0.72 116.97 119.06 1dxq h TYR 75 Ca 0.02 -0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.89 1dxq h TYR 75 Cb 0.34 0.25 -0.03 0.00 1.54 0.00 0.00 36.73 38.83 1dxq h TYR 75 CO 0.00 -0.43 0.39 0.87 -1.64 0.00 0.00 178.16 177.35 1dxq h LYS 76 N -1.02 0.72 -0.12 1.82 1.57 -1.30 0.20 116.57 118.44 1dxq h LYS 76 Ca -0.08 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 1dxq h LYS 76 Cb 0.68 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.83 1dxq h LYS 76 CO 0.14 0.48 0.00 0.39 -0.57 0.00 0.00 179.45 179.89 1dxq n GLU 77 N -4.46 1.33 -2.06 3.15 1.02 -0.13 -4.89 120.64 114.60 1dxq n GLU 77 Ca 0.06 -0.50 -0.15 0.00 -0.02 0.00 0.00 57.16 56.55 1dxq n GLU 77 Cb 0.09 -1.19 -0.03 0.00 -0.02 0.00 0.00 31.44 30.30 1dxq n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1dxq n GLY 78 N 0.80 0.20 2.25 0.62 0.00 0.70 -4.85 105.19 104.90 1dxq n GLY 78 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 1dxq n GLY 78 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dxq n ARG 79 N -2.54 2.80 -3.65 1.61 1.74 0.24 -4.99 116.66 111.86 1dxq n ARG 79 Ca -0.17 -3.41 -0.34 0.00 -0.77 0.00 0.00 57.85 53.16 1dxq n ARG 79 Cb 0.58 -2.27 -0.05 0.00 -1.02 0.00 0.00 32.46 29.70 1dxq n ARG 79 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1dxq s LEU 80 N -3.75 4.34 0.23 0.55 1.43 -1.23 -0.04 118.68 120.21 1dxq s LEU 80 Ca 0.62 0.68 -0.29 0.00 -1.03 0.00 0.00 54.13 54.11 1dxq s LEU 80 Cb 0.49 -2.95 -0.15 0.00 0.03 0.00 0.00 46.19 43.61 1dxq s LEU 80 CO 0.00 0.17 0.88 -0.24 0.23 0.00 0.00 176.35 177.40 1dxq n SER 81 N 0.82 0.46 0.02 2.29 2.88 0.19 -4.74 113.62 115.53 1dxq n SER 81 Ca -0.08 1.16 0.09 0.00 -1.33 0.00 0.00 58.87 58.71 1dxq n SER 81 Cb 0.52 -1.16 0.51 0.00 -0.75 0.00 0.00 64.21 63.33 1dxq n SER 81 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1dxq h PRO 82 N 1.91 0.35 0.00 -1.46 0.13 -1.95 -1.89 132.00 129.10 1dxq h PRO 82 Ca -0.37 -0.02 -0.09 0.00 -0.87 0.00 0.00 66.00 64.65 1dxq h PRO 82 Cb 1.37 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.41 1dxq h PRO 82 CO 0.61 0.23 -0.44 0.38 -0.23 0.00 0.00 178.00 178.56 1dxq h ASP 83 N 0.36 0.00 0.54 1.44 2.03 -1.99 -1.01 116.42 117.79 1dxq h ASP 83 Ca 0.18 0.00 -0.26 0.00 -0.73 0.00 0.00 57.03 56.22 1dxq h ASP 83 Cb 0.25 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 38.75 1dxq h ASP 83 CO -0.04 0.44 -1.16 0.40 -1.03 0.00 0.00 179.24 177.85 1dxq h ILE 84 N 0.00 1.46 -0.09 4.15 2.04 -1.72 -3.22 117.51 120.13 1dxq h ILE 84 Ca -0.00 -2.87 -0.01 0.00 1.00 0.00 0.00 64.86 62.97 1dxq h ILE 84 Cb 0.97 2.79 -0.00 0.00 -0.74 0.00 0.00 36.82 39.84 1dxq h ILE 84 CO 0.06 0.84 0.00 0.58 0.00 0.00 0.00 178.15 179.63 1dxq h VAL 85 N 0.12 1.24 -0.91 1.67 2.07 -1.16 -2.67 116.25 116.62 1dxq h VAL 85 Ca -0.12 -0.77 0.18 0.00 0.82 0.00 0.00 66.70 66.81 1dxq h VAL 85 Cb 1.86 1.58 -0.17 0.00 -1.52 0.00 0.00 31.29 33.04 1dxq h VAL 85 CO 0.19 0.22 -0.24 0.00 0.02 0.00 0.00 177.57 177.76 1dxq n ALA 86 N -2.28 0.19 0.02 1.67 0.00 -0.40 0.40 120.51 120.11 1dxq n ALA 86 Ca -0.06 0.99 -0.12 0.00 0.00 0.00 0.00 53.44 54.24 1dxq n ALA 86 Cb 0.19 -0.58 -0.08 0.00 0.00 0.00 0.00 19.45 18.98 1dxq n ALA 86 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1dxq h GLU 87 N 0.00 -0.01 -0.91 0.00 4.39 -1.52 -2.88 114.58 113.64 1dxq h GLU 87 Ca 0.43 0.00 0.22 0.00 0.34 0.00 0.00 59.36 60.35 1dxq h GLU 87 Cb 0.65 0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 29.18 1dxq h GLU 87 CO -0.93 0.19 0.43 0.45 -1.16 0.00 0.00 179.01 177.99 1dxq h HIS 88 N -0.21 0.72 -0.47 4.33 3.86 0.28 0.55 115.15 124.23 1dxq h HIS 88 Ca -0.00 0.04 -0.03 0.00 -1.16 0.00 0.00 60.37 59.22 1dxq h HIS 88 Cb 0.20 -0.18 -0.02 0.00 1.06 0.00 0.00 27.41 28.47 1dxq h HIS 88 CO -0.01 -0.01 0.18 0.87 0.86 0.00 0.00 177.93 179.82 1dxq h LYS 89 N 0.44 0.66 0.17 2.45 1.57 -0.92 0.25 116.57 121.20 1dxq h LYS 89 Ca 0.57 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 59.25 1dxq h LYS 89 Cb 1.07 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.26 1dxq h LYS 89 CO -0.51 0.55 -0.08 0.87 -0.57 0.00 0.00 179.45 179.71 1dxq h LYS 90 N 0.66 -0.22 -0.61 3.15 1.57 0.17 -2.94 116.57 118.36 1dxq h LYS 90 Ca 0.16 0.02 0.09 0.00 -1.87 0.00 0.00 60.65 59.05 1dxq h LYS 90 Cb 0.14 0.05 -0.07 0.00 0.08 0.00 0.00 32.23 32.43 1dxq h LYS 90 CO -0.02 0.16 0.23 -0.07 -0.57 0.00 0.00 179.45 179.19 1dxq h LEU 91 N -0.68 0.24 -1.71 2.94 3.38 -0.76 0.75 115.31 119.48 1dxq h LEU 91 Ca -0.02 0.07 0.07 0.00 0.09 0.00 0.00 57.88 58.09 1dxq h LEU 91 Cb 0.49 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 1dxq h LEU 91 CO 0.04 0.15 0.31 -0.08 0.09 0.00 0.00 178.44 178.95 1dxq h GLU 92 N 0.42 0.34 0.06 1.13 4.81 -0.99 -2.91 114.58 117.45 1dxq h GLU 92 Ca 0.30 -0.02 -0.32 0.00 -0.13 0.00 0.00 59.36 59.19 1dxq h GLU 92 Cb 0.36 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.63 1dxq h GLU 92 CO -0.30 0.22 -1.78 0.00 -0.73 0.00 0.00 179.01 176.43 1dxq h ALA 93 N 1.76 0.57 -2.88 2.92 0.00 -1.00 -3.47 119.26 117.15 1dxq h ALA 93 Ca 0.20 -1.38 -0.53 0.00 0.00 0.00 0.00 54.91 53.20 1dxq h ALA 93 Cb 0.36 0.53 0.08 0.00 0.00 0.00 0.00 17.79 18.76 1dxq h ALA 93 CO -0.05 1.42 0.71 0.00 0.00 0.00 0.00 179.25 181.34 1dxq s ALA 94 N -2.59 3.55 -0.19 0.00 0.00 0.12 -4.57 121.76 118.09 1dxq s ALA 94 Ca -0.12 1.39 0.18 0.00 0.00 0.00 0.00 51.96 53.41 1dxq s ALA 94 Cb 0.07 -3.54 -0.25 0.00 0.00 0.00 0.00 23.12 19.40 1dxq s ALA 94 CO 0.81 -0.81 0.12 -0.25 0.00 0.00 0.00 175.76 175.63 1dxq n ASP 95 N 0.93 0.07 -3.89 0.00 8.00 0.22 -4.88 116.55 117.00 1dxq n ASP 95 Ca 0.02 0.03 -0.26 0.00 0.71 0.00 0.00 54.79 55.29 1dxq n ASP 95 Cb 0.40 0.94 -0.17 0.00 -0.02 0.00 0.00 41.12 42.27 1dxq n ASP 95 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1dxq s LEU 96 N -5.52 1.11 -0.21 0.64 2.96 -1.12 -1.01 118.68 115.53 1dxq s LEU 96 Ca -0.10 -0.25 -0.05 0.00 -0.22 0.00 0.00 54.13 53.51 1dxq s LEU 96 Cb 0.06 -0.75 -0.02 0.00 0.50 0.00 0.00 46.19 45.98 1dxq s LEU 96 CO 0.83 -0.12 0.01 -0.69 -1.32 0.00 0.00 176.35 175.06 1dxq s VAL 97 N 1.65 3.94 -0.14 1.68 1.01 0.49 -0.14 120.40 128.89 1dxq s VAL 97 Ca 0.03 -0.31 -0.00 0.00 0.00 0.00 0.00 61.98 61.70 1dxq s VAL 97 Cb -0.13 -2.80 -0.01 0.00 0.00 0.00 0.00 36.38 33.45 1dxq s VAL 97 CO -0.06 0.41 -0.14 -0.63 0.00 0.00 0.00 175.10 174.68 1dxq s ILE 98 N 1.17 2.93 -0.25 2.22 1.01 0.11 -2.53 121.20 125.86 1dxq s ILE 98 Ca 0.03 -0.70 -0.06 0.00 0.00 0.00 0.00 60.65 59.93 1dxq s ILE 98 Cb -0.14 -2.23 -0.01 0.00 0.01 0.00 0.00 42.46 40.09 1dxq s ILE 98 CO 0.01 0.52 0.03 -0.36 0.00 0.00 0.00 174.94 175.14 1dxq s PHE 99 N 0.51 3.06 -0.21 3.97 0.08 -0.94 -0.42 117.98 124.04 1dxq s PHE 99 Ca -0.09 -0.85 -0.05 0.00 0.12 0.00 0.00 56.93 56.06 1dxq s PHE 99 Cb -0.16 -2.19 -0.02 0.00 -0.57 0.00 0.00 43.02 40.08 1dxq s PHE 99 CO 0.04 -0.52 -0.00 -1.14 -0.10 0.00 0.00 175.22 173.50 1dxq s GLN 100 N 1.51 3.59 -0.10 0.44 2.00 -0.13 -0.22 119.66 126.74 1dxq s GLN 100 Ca 0.05 -0.53 -0.31 0.00 -2.00 0.00 0.00 55.36 52.56 1dxq s GLN 100 Cb -0.16 -3.08 0.12 0.00 0.80 0.00 0.00 33.01 30.69 1dxq s GLN 100 CO 0.00 -0.03 1.02 -0.59 -0.50 0.00 0.00 175.29 175.20 1dxq s PHE 101 N 1.10 -0.27 -0.06 1.67 -0.12 -0.60 -1.88 117.98 117.82 1dxq s PHE 101 Ca 0.02 0.23 -0.22 0.00 -0.05 0.00 0.00 56.93 56.91 1dxq s PHE 101 Cb -0.14 0.52 -0.04 0.00 -0.63 0.00 0.00 43.02 42.72 1dxq s PHE 101 CO 0.01 -0.39 0.65 -1.25 -0.05 0.00 0.00 175.22 174.20 1dxq s PRO 102 N -2.52 4.41 0.11 1.99 0.04 -1.26 -1.49 135.00 136.27 1dxq s PRO 102 Ca 0.06 0.80 -0.33 0.00 0.04 0.00 0.00 61.00 61.56 1dxq s PRO 102 Cb -0.01 -3.42 -0.13 0.00 0.04 0.00 0.00 34.50 30.98 1dxq s PRO 102 CO -0.06 0.14 1.72 -0.11 0.04 0.00 0.00 177.00 178.73 1dxq n LEU 103 N 3.53 3.48 -3.79 -3.56 7.94 0.25 -4.63 117.00 120.23 1dxq n LEU 103 Ca -0.03 1.04 -0.25 0.00 -1.11 0.00 0.00 56.01 55.65 1dxq n LEU 103 Cb 0.51 -1.46 -0.17 0.00 0.53 0.00 0.00 43.42 42.83 1dxq n LEU 103 CO 0.46 -0.08 -0.39 -1.10 -1.11 0.00 0.00 177.39 175.17 1dxq s GLN 104 N 2.02 0.80 -1.24 1.96 -0.21 -0.33 -4.74 119.66 117.91 1dxq s GLN 104 Ca 0.82 -0.12 -0.07 0.00 0.02 0.00 0.00 55.36 56.01 1dxq s GLN 104 Cb -0.62 -1.43 -0.01 0.00 1.00 0.00 0.00 33.01 31.95 1dxq s GLN 104 CO 0.40 -0.40 0.71 0.91 -2.12 0.00 0.00 175.29 174.79 1dxq n TRP 105 N 5.08 -1.93 -1.43 0.91 5.03 -1.26 -1.36 117.44 122.47 1dxq n TRP 105 Ca -0.09 0.71 -0.16 0.00 3.03 0.00 0.00 57.50 61.00 1dxq n TRP 105 Cb 0.49 -3.98 -0.07 0.00 -1.03 0.00 0.00 31.31 26.72 1dxq n TRP 105 CO 0.00 0.00 0.00 1.19 -0.03 0.00 0.00 177.69 178.85 1dxq n PHE 106 N -4.16 -0.12 -2.50 -5.99 3.01 -1.26 -4.86 117.46 101.58 1dxq n PHE 106 Ca -0.22 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.24 1dxq n PHE 106 Cb 0.65 -2.97 0.00 0.00 -0.01 0.00 0.00 39.48 37.15 1dxq n PHE 106 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1dxq n GLY 107 N -0.18 3.71 3.86 1.37 0.00 -0.47 -4.92 105.19 108.57 1dxq n GLY 107 Ca -0.16 -1.04 -0.31 0.00 0.00 0.00 0.00 46.02 44.51 1dxq n GLY 107 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dxq s VAL 108 N -2.29 4.67 0.42 1.61 0.11 -1.26 -1.19 120.40 122.46 1dxq s VAL 108 Ca 0.00 0.91 -0.26 0.00 -2.93 0.00 0.00 61.98 59.70 1dxq s VAL 108 Cb 0.00 -3.70 -0.08 0.00 -1.53 0.00 0.00 36.38 31.07 1dxq s VAL 108 CO 0.00 -0.50 1.31 -2.84 -3.33 0.00 0.00 175.10 169.74 1dxq s PRO 109 N -3.71 3.90 0.22 1.54 0.02 -1.26 -4.72 135.00 130.99 1dxq s PRO 109 Ca 0.55 2.16 -0.16 0.00 0.02 0.00 0.00 61.00 63.56 1dxq s PRO 109 Cb -0.10 -2.71 0.24 0.00 0.02 0.00 0.00 34.50 31.95 1dxq s PRO 109 CO 0.28 -0.55 1.57 0.00 -0.33 0.00 0.00 177.00 177.97 1dxq h ALA 110 N 2.56 0.22 -0.48 -1.55 0.00 -1.96 0.68 119.26 118.74 1dxq h ALA 110 Ca -0.50 0.26 0.05 0.00 0.00 0.00 0.00 54.91 54.72 1dxq h ALA 110 Cb 1.25 0.83 -0.03 0.00 0.00 0.00 0.00 17.79 19.85 1dxq h ALA 110 CO 0.62 -0.57 0.32 0.97 0.00 0.00 0.00 179.25 180.59 1dxq h ILE 111 N -0.05 0.99 -0.01 0.00 2.10 -1.96 -1.52 117.51 117.06 1dxq h ILE 111 Ca 0.33 -0.15 -0.02 0.00 1.08 0.00 0.00 64.86 66.10 1dxq h ILE 111 Cb 0.59 0.51 0.00 0.00 -1.09 0.00 0.00 36.82 36.83 1dxq h ILE 111 CO -0.86 0.08 -0.06 0.25 -1.08 0.00 0.00 178.15 176.48 1dxq h LEU 112 N 0.44 0.07 -0.64 2.19 6.46 -0.11 -2.92 115.31 120.80 1dxq h LEU 112 Ca 0.20 -0.68 0.13 0.00 -0.12 0.00 0.00 57.88 57.42 1dxq h LEU 112 Cb 0.24 -0.02 -0.12 0.00 -0.73 0.00 0.00 40.66 40.03 1dxq h LEU 112 CO -0.05 0.74 -0.13 0.50 -0.62 0.00 0.00 178.44 178.88 1dxq h LYS 113 N -0.58 0.02 -0.93 1.25 1.63 -0.32 0.15 116.57 117.78 1dxq h LYS 113 Ca -0.00 -0.00 0.13 0.00 -0.85 0.00 0.00 60.65 59.92 1dxq h LYS 113 Cb 0.74 -0.00 -0.09 0.00 -0.60 0.00 0.00 32.23 32.28 1dxq h LYS 113 CO 0.01 0.01 0.55 0.78 -3.45 0.00 0.00 179.45 177.35 1dxq h GLY 114 N 0.02 1.51 0.96 5.01 0.00 -1.30 0.21 103.07 109.49 1dxq h GLY 114 Ca 0.31 -0.35 0.02 0.00 0.00 0.00 0.00 47.33 47.31 1dxq h GLY 114 CO -0.64 0.09 0.62 -0.25 0.00 0.00 0.00 176.54 176.36 1dxq h TRP 115 N 0.84 1.17 0.87 5.60 7.01 -0.54 0.20 115.95 131.10 1dxq h TRP 115 Ca 0.47 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 61.46 1dxq h TRP 115 Cb 0.54 -0.39 0.01 0.00 -2.10 0.00 0.00 29.16 27.21 1dxq h TRP 115 CO -0.04 0.71 -0.42 0.74 -2.79 0.00 0.00 178.44 176.65 1dxq h PHE 116 N 1.24 -1.08 -0.36 2.65 0.04 0.03 0.58 116.94 120.03 1dxq h PHE 116 Ca 0.36 -0.03 0.10 0.00 2.80 0.00 0.00 57.97 61.20 1dxq h PHE 116 Cb -0.09 0.36 -0.01 0.00 2.20 0.00 0.00 35.95 38.40 1dxq h PHE 116 CO -0.01 -0.67 0.34 0.93 -0.60 0.00 0.00 178.31 178.31 1dxq h GLU 117 N -1.27 0.00 0.00 1.51 5.08 -0.59 -1.66 114.58 117.66 1dxq h GLU 117 Ca -0.12 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 57.90 1dxq h GLU 117 Cb 0.90 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.09 1dxq h GLU 117 CO 0.20 0.00 -2.30 0.54 -1.00 0.00 0.00 179.01 176.44 1dxq n ARG 118 N -3.91 0.58 -0.03 2.33 1.74 0.66 -4.71 116.66 113.32 1dxq n ARG 118 Ca 0.06 0.13 -0.15 0.00 -0.77 0.00 0.00 57.85 57.12 1dxq n ARG 118 Cb 0.51 -1.46 -0.12 0.00 -1.02 0.00 0.00 32.46 30.37 1dxq n ARG 118 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1dxq h VAL 119 N 0.00 1.62 -0.55 1.55 2.07 0.25 -3.39 116.25 117.80 1dxq h VAL 119 Ca -0.51 -2.12 -0.45 0.00 0.82 0.00 0.00 66.70 64.44 1dxq h VAL 119 Cb 1.80 3.01 -0.05 0.00 -1.52 0.00 0.00 31.29 34.53 1dxq h VAL 119 CO -0.08 0.57 1.47 0.18 0.02 0.00 0.00 177.57 179.73 1dxq n LEU 120 N -4.51 3.70 -4.79 2.57 4.77 -0.63 -4.86 117.00 113.24 1dxq n LEU 120 Ca -0.10 -3.40 -0.36 0.00 -0.03 0.00 0.00 56.01 52.11 1dxq n LEU 120 Cb 0.52 -1.72 -0.06 0.00 -2.33 0.00 0.00 43.42 39.83 1dxq n LEU 120 CO 0.38 -1.17 0.58 -0.69 -1.33 0.00 0.00 177.39 175.16 1dxq s VAL 121 N 8.79 4.34 0.22 4.08 1.01 -1.26 -4.80 120.40 132.78 1dxq s VAL 121 Ca 0.64 1.62 -0.30 0.00 0.00 0.00 0.00 61.98 63.94 1dxq s VAL 121 Cb 0.01 -3.93 -0.09 0.00 0.00 0.00 0.00 36.38 32.37 1dxq s VAL 121 CO 0.12 0.12 1.37 0.00 0.00 0.00 0.00 175.10 176.71 1dxq s ALA 122 N -1.64 3.57 0.00 5.51 0.00 -1.26 0.49 121.76 128.43 1dxq s ALA 122 Ca 0.49 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.66 1dxq s ALA 122 Cb -0.17 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.43 1dxq s ALA 122 CO 0.22 -0.63 0.00 0.41 0.00 0.00 0.00 175.76 175.76 1dxq n GLY 123 N 2.30 2.86 0.57 0.00 0.00 0.55 -4.43 105.19 107.05 1dxq n GLY 123 Ca 0.06 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.03 1dxq n GLY 123 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1dxq n PHE 124 N -0.62 0.00 0.07 1.61 7.35 -0.78 -4.79 117.46 120.31 1dxq n PHE 124 Ca 0.00 0.00 -0.09 0.00 -0.76 0.00 0.00 57.45 56.60 1dxq n PHE 124 Cb 0.00 -0.28 -0.11 0.00 0.35 0.00 0.00 39.48 39.44 1dxq n PHE 124 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1dxq h ALA 125 N -0.50 0.32 -2.45 3.13 0.00 -0.26 -3.45 119.26 116.05 1dxq h ALA 125 Ca -0.04 -0.88 0.15 0.00 0.00 0.00 0.00 54.91 54.13 1dxq h ALA 125 Cb 0.60 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 18.19 1dxq h ALA 125 CO -0.03 1.15 0.44 1.52 0.00 0.00 0.00 179.25 182.33 1dxq s TYR 126 N -2.75 -0.17 -0.23 0.00 1.13 -1.24 -4.40 117.35 109.68 1dxq s TYR 126 Ca -0.01 -0.14 -0.23 0.00 -1.41 0.00 0.00 57.07 55.29 1dxq s TYR 126 Cb 0.09 0.64 0.06 0.00 -1.10 0.00 0.00 41.96 41.65 1dxq s TYR 126 CO 0.83 -0.86 0.65 0.99 -2.51 0.00 0.00 175.55 174.65 1dxq s THR 127 N -3.38 0.00 0.59 -3.49 2.01 -0.98 -0.33 115.64 110.07 1dxq s THR 127 Ca 0.11 -0.01 0.29 0.00 0.31 0.00 0.00 61.69 62.39 1dxq s THR 127 Cb -0.02 -0.90 0.38 0.00 0.01 0.00 0.00 72.50 71.97 1dxq s THR 127 CO 0.01 -0.00 1.88 1.88 -0.69 0.00 0.00 174.62 177.70 1dxq h TYR 128 N 5.00 0.00 0.19 4.92 -1.99 -2.01 0.64 116.97 123.71 1dxq h TYR 128 Ca -0.28 0.00 -0.25 0.00 2.00 0.00 0.00 58.73 60.19 1dxq h TYR 128 Cb 1.16 0.00 0.03 0.00 2.00 0.00 0.00 36.73 39.92 1dxq h TYR 128 CO 0.39 0.00 -1.11 0.00 -0.00 0.00 0.00 178.16 177.44 1dxq h ALA 129 N 1.43 -0.12 -2.83 3.88 0.00 -1.98 -3.40 119.26 116.25 1dxq h ALA 129 Ca 0.23 -0.78 -0.75 0.00 0.00 0.00 0.00 54.91 53.61 1dxq h ALA 129 Cb 1.24 0.14 -0.31 0.00 0.00 0.00 0.00 17.79 18.86 1dxq h ALA 129 CO -0.00 0.52 0.05 0.00 0.00 0.00 0.00 179.25 179.82 1dxq s ALA 130 N -2.50 4.21 0.27 0.00 0.00 0.22 -4.97 121.76 118.99 1dxq s ALA 130 Ca -0.12 -3.60 0.11 0.00 0.00 0.00 0.00 51.96 48.35 1dxq s ALA 130 Cb 0.02 -3.18 -0.05 0.00 0.00 0.00 0.00 23.12 19.92 1dxq s ALA 130 CO 0.88 -2.19 -0.15 -1.64 0.00 0.00 0.00 175.76 172.66 1dxq s MET 131 N -0.69 1.83 0.00 0.00 -1.94 -1.14 -2.30 119.30 115.05 1dxq s MET 131 Ca 0.24 -1.66 0.00 0.00 -1.71 0.00 0.00 55.69 52.56 1dxq s MET 131 Cb -0.11 -1.88 0.00 0.00 2.01 0.00 0.00 34.83 34.85 1dxq s MET 131 CO -0.09 0.35 0.00 0.66 -0.01 0.00 0.00 175.02 175.93 1dxq n TYR 132 N -0.61 0.00 0.00 -0.03 4.02 0.12 -0.27 117.16 120.38 1dxq n TYR 132 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.83 1dxq n TYR 132 Cb 0.59 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.91 1dxq n TYR 132 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 176.86 175.45 1dxq n ASP 133 N 1.22 0.00 -0.12 7.72 5.68 -1.26 0.15 116.55 129.94 1dxq n ASP 133 Ca 0.00 0.00 0.03 0.00 -0.50 0.00 0.00 54.79 54.32 1dxq n ASP 133 Cb 0.00 0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 39.98 1dxq n ASP 133 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1dxq n ASN 134 N -0.66 0.85 -4.47 -1.12 3.02 0.63 -4.96 115.26 108.54 1dxq n ASN 134 Ca 0.00 -0.93 -0.36 0.00 -0.03 0.00 0.00 54.58 53.27 1dxq n ASN 134 Cb 0.00 0.52 0.08 0.00 -0.61 0.00 0.00 39.78 39.77 1dxq n ASN 134 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1dxq n GLY 135 N 0.75 -1.48 0.26 7.41 0.00 0.40 -4.36 105.19 108.18 1dxq n GLY 135 Ca 0.02 -0.42 0.07 0.00 0.00 0.00 0.00 46.02 45.69 1dxq n GLY 135 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1dxq h PRO 136 N -0.50 0.08 -0.42 1.61 0.11 -1.66 -2.87 132.00 128.33 1dxq h PRO 136 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1dxq h PRO 136 Cb 1.34 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.43 1dxq h PRO 136 CO 0.42 0.09 0.00 1.19 -0.21 0.00 0.00 178.00 179.49 1dxq n PHE 137 N -4.48 0.57 0.27 0.65 3.72 -0.95 -4.49 117.46 112.74 1dxq n PHE 137 Ca -0.02 -0.27 0.09 0.00 -0.05 0.00 0.00 57.45 57.20 1dxq n PHE 137 Cb 0.12 -0.02 0.50 0.00 -0.94 0.00 0.00 39.48 39.13 1dxq n PHE 137 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 1dxq h GLN 138 N 2.30 0.00 0.00 -1.08 3.07 -1.38 0.50 115.11 118.52 1dxq h GLN 138 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1dxq h GLN 138 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.14 1dxq h GLN 138 CO 0.02 0.00 -0.71 0.09 0.09 0.00 0.00 178.83 178.32 1dxq n ASN 139 N -2.50 0.65 -4.93 0.06 5.03 -1.26 -4.70 115.26 107.62 1dxq n ASN 139 Ca -0.01 -0.43 -0.29 0.00 0.87 0.00 0.00 54.58 54.72 1dxq n ASN 139 Cb 0.48 0.53 -0.04 0.00 -1.02 0.00 0.00 39.78 39.74 1dxq n ASN 139 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1dxq s LYS 140 N -3.03 3.47 0.07 3.52 1.02 0.18 -4.98 119.74 119.98 1dxq s LYS 140 Ca 0.09 -0.46 0.09 0.00 0.02 0.00 0.00 55.97 55.71 1dxq s LYS 140 Cb 0.17 -2.96 -0.03 0.00 -0.52 0.00 0.00 37.83 34.48 1dxq s LYS 140 CO 0.76 0.53 -0.24 0.15 -0.92 0.00 0.00 175.35 175.63 1dxq s LYS 141 N -2.93 1.76 0.04 1.68 1.02 -0.18 -2.20 119.74 118.92 1dxq s LYS 141 Ca 0.36 -1.15 -0.02 0.00 0.02 0.00 0.00 55.97 55.18 1dxq s LYS 141 Cb -0.12 -2.01 -0.03 0.00 -0.52 0.00 0.00 37.83 35.15 1dxq s LYS 141 CO 0.28 0.50 0.01 -0.08 -0.92 0.00 0.00 175.35 175.14 1dxq s THR 142 N -0.92 0.16 0.10 2.17 -1.32 -0.03 -0.38 115.64 115.43 1dxq s THR 142 Ca 0.13 -1.35 -0.13 0.00 -1.21 0.00 0.00 61.69 59.14 1dxq s THR 142 Cb -0.10 -0.98 0.02 0.00 -1.51 0.00 0.00 72.50 69.92 1dxq s THR 142 CO 0.04 -0.74 0.30 -1.48 -2.21 0.00 0.00 174.62 170.53 1dxq s LEU 143 N -2.29 0.87 -0.17 9.08 0.05 -1.05 -0.61 118.68 124.56 1dxq s LEU 143 Ca -0.03 -0.45 -0.02 0.00 0.05 0.00 0.00 54.13 53.68 1dxq s LEU 143 Cb 0.00 1.46 -0.01 0.00 -2.05 0.00 0.00 46.19 45.59 1dxq s LEU 143 CO -0.06 -0.78 -0.08 -0.76 -0.55 0.00 0.00 176.35 174.11 1dxq s LEU 144 N -2.77 2.84 -0.36 1.48 1.43 -1.26 -2.21 118.68 117.84 1dxq s LEU 144 Ca 0.03 -0.34 -0.07 0.00 -1.03 0.00 0.00 54.13 52.72 1dxq s LEU 144 Cb 0.03 -1.68 0.04 0.00 0.03 0.00 0.00 46.19 44.61 1dxq s LEU 144 CO -0.11 0.08 0.14 -0.55 0.23 0.00 0.00 176.35 176.15 1dxq s SER 145 N 0.85 5.41 0.14 2.29 0.15 0.69 0.56 113.70 123.78 1dxq s SER 145 Ca -0.02 -1.20 0.08 0.00 0.70 0.00 0.00 55.95 55.51 1dxq s SER 145 Cb -0.15 -1.90 -0.04 0.00 -1.71 0.00 0.00 66.02 62.22 1dxq s SER 145 CO 0.01 -0.37 -0.11 -0.63 1.20 0.00 0.00 173.24 173.34 1dxq s ILE 146 N 1.42 3.24 -0.15 6.45 1.01 0.15 -1.56 121.20 131.76 1dxq s ILE 146 Ca -0.00 -1.46 0.01 0.00 0.00 0.00 0.00 60.65 59.20 1dxq s ILE 146 Cb -0.20 -2.55 0.02 0.00 0.01 0.00 0.00 42.46 39.74 1dxq s ILE 146 CO 0.03 0.01 -0.18 -0.89 0.00 0.00 0.00 174.94 173.91 1dxq s THR 147 N -1.42 1.87 0.04 2.92 2.01 -0.56 -1.84 115.64 118.67 1dxq s THR 147 Ca 0.22 -0.84 0.04 0.00 0.31 0.00 0.00 61.69 61.43 1dxq s THR 147 Cb -0.10 -1.69 -0.04 0.00 0.01 0.00 0.00 72.50 70.68 1dxq s THR 147 CO 0.14 0.51 -0.03 0.28 -0.69 0.00 0.00 174.62 174.82 1dxq s THR 148 N 1.17 3.84 -0.05 -0.82 -1.32 -0.17 0.87 115.64 119.16 1dxq s THR 148 Ca 0.00 -0.87 -0.17 0.00 -1.21 0.00 0.00 61.69 59.44 1dxq s THR 148 Cb -0.14 -2.75 -0.31 0.00 -1.51 0.00 0.00 72.50 67.79 1dxq s THR 148 CO -0.08 0.26 0.79 1.23 -2.21 0.00 0.00 174.62 174.61 1dxq h GLY 149 N 4.01 0.40 -0.90 6.08 0.00 -1.88 0.49 103.07 111.26 1dxq h GLY 149 Ca -0.48 -1.03 -0.42 0.00 0.00 0.00 0.00 47.33 45.40 1dxq h GLY 149 CO 0.56 0.90 0.14 -0.32 0.00 0.00 0.00 176.54 177.82 1dxq s GLY 150 N -4.72 1.58 0.25 4.60 0.00 -1.26 -3.98 107.32 103.79 1dxq s GLY 150 Ca -0.15 -0.89 -0.02 0.00 0.00 0.00 0.00 44.72 43.66 1dxq s GLY 150 CO 0.84 -0.03 0.47 -1.35 0.00 0.00 0.00 173.10 173.03 1dxq s SER 151 N -3.85 6.41 0.29 1.64 1.04 -1.26 -1.77 113.70 116.19 1dxq s SER 151 Ca 0.70 0.54 0.03 0.00 0.48 0.00 0.00 55.95 57.71 1dxq s SER 151 Cb -0.11 -2.07 0.69 0.00 0.10 0.00 0.00 66.02 64.64 1dxq s SER 151 CO 0.56 -0.13 1.73 1.23 0.98 0.00 0.00 173.24 177.62 1dxq h GLY 152 N 1.77 1.57 0.99 7.32 0.00 -1.96 0.16 103.07 112.92 1dxq h GLY 152 Ca -0.48 -0.24 0.03 0.00 0.00 0.00 0.00 47.33 46.65 1dxq h GLY 152 CO 0.67 -0.17 0.60 1.48 0.00 0.00 0.00 176.54 179.12 1dxq h SER 153 N 0.54 0.99 -0.24 0.19 4.64 -1.97 -1.89 113.55 115.80 1dxq h SER 153 Ca 0.54 -0.01 0.07 0.00 -0.47 0.00 0.00 61.79 61.92 1dxq h SER 153 Cb 0.94 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.79 1dxq h SER 153 CO -0.45 0.68 0.30 0.24 -0.87 0.00 0.00 176.83 176.73 1dxq h MET 154 N 1.15 0.00 -0.02 4.77 2.07 -1.35 -0.85 114.93 120.70 1dxq h MET 154 Ca 0.36 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.99 1dxq h MET 154 Cb 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 29.73 1dxq h MET 154 CO -0.11 0.00 -0.16 0.66 1.07 0.00 0.00 176.91 178.37 1dxq n TYR 155 N -3.64 0.00 -0.82 -0.22 4.02 -0.72 -1.93 117.16 113.85 1dxq n TYR 155 Ca 0.03 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.64 1dxq n TYR 155 Cb 0.43 0.00 0.22 0.00 -0.02 0.00 0.00 39.34 39.96 1dxq n TYR 155 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 1dxq s SER 156 N -1.94 1.70 0.42 7.72 1.04 -0.32 -2.35 113.70 119.96 1dxq s SER 156 Ca 0.21 1.39 0.11 0.00 0.48 0.00 0.00 55.95 58.14 1dxq s SER 156 Cb 0.17 -2.12 0.94 0.00 0.10 0.00 0.00 66.02 65.11 1dxq s SER 156 CO 0.36 -3.74 2.00 -0.07 0.98 0.00 0.00 173.24 172.78 1dxq h LEU 157 N -2.31 0.44 -3.55 2.42 3.38 -1.88 0.22 115.31 114.03 1dxq h LEU 157 Ca -0.58 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.31 1dxq h LEU 157 Cb 1.33 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 41.94 1dxq h LEU 157 CO 0.53 0.28 0.10 0.00 0.09 0.00 0.00 178.44 179.45 1dxq n GLN 158 N -4.47 4.39 -2.86 1.13 3.00 -1.26 -4.64 117.38 112.67 1dxq n GLN 158 Ca 0.08 -3.03 -0.23 0.00 -0.01 0.00 0.00 57.00 53.80 1dxq n GLN 158 Cb 0.25 -2.23 0.02 0.00 0.00 0.00 0.00 30.24 28.27 1dxq n GLN 158 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 1dxq s GLY 159 N -0.82 1.59 0.10 1.08 0.00 0.07 -5.02 107.32 104.32 1dxq s GLY 159 Ca 0.53 -1.02 -0.32 0.00 0.00 0.00 0.00 44.72 43.92 1dxq s GLY 159 CO 0.15 -0.82 1.60 -2.08 0.00 0.00 0.00 173.10 171.95 1dxq h VAL 160 N 0.28 0.23 0.00 1.40 2.07 -1.79 -3.04 116.25 115.40 1dxq h VAL 160 Ca -0.46 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.03 1dxq h VAL 160 Cb 1.26 0.23 -0.00 0.00 -1.52 0.00 0.00 31.29 31.25 1dxq h VAL 160 CO 0.57 0.00 -0.15 0.45 0.02 0.00 0.00 177.57 178.47 1dxq h HIS 161 N -0.76 0.00 0.00 1.57 3.86 -1.73 -3.50 115.15 114.59 1dxq h HIS 161 Ca -0.03 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.18 1dxq h HIS 161 Cb 0.69 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.16 1dxq h HIS 161 CO -0.22 0.15 0.00 0.41 0.86 0.00 0.00 177.93 179.13 1dxq n GLY 162 N -0.20 0.70 3.47 2.45 0.00 -1.15 -4.97 105.19 105.49 1dxq n GLY 162 Ca -0.01 -1.86 -0.62 0.00 0.00 0.00 0.00 46.02 43.53 1dxq n GLY 162 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1dxq n ASP 163 N -0.56 0.93 0.14 1.61 -0.08 -1.23 -4.46 116.55 112.90 1dxq n ASP 163 Ca 0.00 1.11 0.02 0.00 -1.51 0.00 0.00 54.79 54.41 1dxq n ASP 163 Cb 0.00 -0.83 0.36 0.00 2.34 0.00 0.00 41.12 42.99 1dxq n ASP 163 CO 0.00 0.00 0.00 -0.03 0.12 0.00 0.00 177.20 177.29 1dxq h MET 164 N 4.34 0.14 -0.94 -0.67 1.85 -1.78 -2.88 114.93 115.00 1dxq h MET 164 Ca -0.42 -0.04 0.07 0.00 -0.61 0.00 0.00 59.70 58.69 1dxq h MET 164 Cb 1.29 -0.01 -0.06 0.00 0.43 0.00 0.00 31.60 33.25 1dxq h MET 164 CO 0.86 0.40 0.61 -0.91 -0.40 0.00 0.00 176.91 177.47 1dxq h ASN 165 N 0.13 0.95 -0.34 1.39 2.35 -1.88 -1.64 115.58 116.53 1dxq h ASN 165 Ca 0.02 0.01 0.02 0.00 -0.55 0.00 0.00 56.30 55.80 1dxq h ASN 165 Cb 0.54 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.69 1dxq h ASN 165 CO 0.04 0.61 0.18 0.58 -1.65 0.00 0.00 177.43 177.18 1dxq h VAL 166 N 1.07 1.00 -0.55 2.81 2.07 -1.88 -1.80 116.25 118.97 1dxq h VAL 166 Ca 0.40 -0.13 0.03 0.00 0.82 0.00 0.00 66.70 67.83 1dxq h VAL 166 Cb 0.19 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 30.52 1dxq h VAL 166 CO -0.15 0.07 0.31 0.40 0.02 0.00 0.00 177.57 178.22 1dxq h ILE 167 N 0.37 1.02 -0.15 4.57 2.04 -1.39 -2.93 117.51 121.03 1dxq h ILE 167 Ca 0.14 -0.21 -0.15 0.00 1.00 0.00 0.00 64.86 65.64 1dxq h ILE 167 Cb 0.04 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 1dxq h ILE 167 CO -0.09 0.11 -0.55 -0.07 0.00 0.00 0.00 178.15 177.55 1dxq h LEU 168 N 0.61 0.50 -0.94 1.44 3.38 -1.23 -3.36 115.31 115.71 1dxq h LEU 168 Ca 0.23 -0.27 0.12 0.00 0.09 0.00 0.00 57.88 58.06 1dxq h LEU 168 Cb 0.07 -0.14 -0.14 0.00 0.09 0.00 0.00 40.66 40.54 1dxq h LEU 168 CO -0.12 0.95 -0.44 1.87 0.09 0.00 0.00 178.44 180.79 1dxq n TRP 169 N -3.94 -0.13 -0.20 1.13 -0.00 -0.69 -0.24 117.44 113.37 1dxq n TRP 169 Ca -0.03 1.17 0.12 0.00 -0.00 0.00 0.00 57.50 58.76 1dxq n TRP 169 Cb 0.60 -0.75 0.42 0.00 -0.00 0.00 0.00 31.31 31.58 1dxq n TRP 169 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 177.69 176.34 1dxq h PRO 170 N 0.00 0.58 0.03 5.87 0.11 -1.71 0.12 132.00 137.00 1dxq h PRO 170 Ca 0.26 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 66.28 1dxq h PRO 170 Cb 0.50 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.48 1dxq h PRO 170 CO -0.92 0.38 -0.31 0.82 -0.21 0.00 0.00 178.00 177.76 1dxq h ILE 171 N 0.59 1.64 -0.07 4.15 2.04 -0.91 -2.63 117.51 122.32 1dxq h ILE 171 Ca 0.37 -2.37 -0.08 0.00 1.00 0.00 0.00 64.86 63.79 1dxq h ILE 171 Cb 0.63 3.23 0.00 0.00 -0.74 0.00 0.00 36.82 39.95 1dxq h ILE 171 CO -0.14 0.61 -0.26 1.56 0.00 0.00 0.00 178.15 179.92 1dxq h GLN 172 N -0.86 0.30 0.14 2.37 4.20 -0.38 -2.52 115.11 118.37 1dxq h GLN 172 Ca -0.07 -0.23 -0.35 0.00 0.06 0.00 0.00 58.65 58.07 1dxq h GLN 172 Cb 1.17 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.99 1dxq h GLN 172 CO 0.01 0.86 -1.82 1.03 -0.67 0.00 0.00 178.83 178.24 1dxq h SER 173 N -0.19 0.48 -0.69 1.46 0.87 -0.98 0.45 113.55 114.94 1dxq h SER 173 Ca -0.01 -0.93 -0.07 0.00 -1.23 0.00 0.00 61.79 59.55 1dxq h SER 173 Cb 0.89 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 62.67 1dxq h SER 173 CO 0.05 1.80 0.15 1.23 -0.53 0.00 0.00 176.83 179.54 1dxq h GLY 174 N 0.75 1.20 0.00 5.77 0.00 -1.10 -2.11 103.07 107.58 1dxq h GLY 174 Ca -0.38 -0.76 -0.22 0.00 0.00 0.00 0.00 47.33 45.97 1dxq h GLY 174 CO 0.11 0.71 -1.63 1.39 0.00 0.00 0.00 176.54 177.12 1dxq n ILE 175 N -4.25 1.03 -0.04 2.60 5.41 -0.97 -4.41 119.36 118.75 1dxq n ILE 175 Ca 0.05 -0.12 -0.14 0.00 1.00 0.00 0.00 62.75 63.54 1dxq n ILE 175 Cb 0.27 -1.80 -0.11 0.00 -0.71 0.00 0.00 39.64 37.28 1dxq n ILE 175 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1dxq h LEU 176 N -0.60 0.07 -0.49 1.39 3.38 -1.52 -2.73 115.31 114.81 1dxq h LEU 176 Ca -0.33 -0.70 -0.04 0.00 0.09 0.00 0.00 57.88 56.90 1dxq h LEU 176 Cb 1.19 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.90 1dxq h LEU 176 CO -0.20 0.76 0.14 -0.09 0.09 0.00 0.00 178.44 179.14 1dxq h ARG 177 N -0.61 0.78 -0.54 1.13 9.65 -0.13 -1.86 114.38 122.80 1dxq h ARG 177 Ca -0.01 -0.18 0.10 0.00 -1.10 0.00 0.00 59.98 58.80 1dxq h ARG 177 Cb 0.76 -0.11 -0.11 0.00 -1.39 0.00 0.00 29.97 29.13 1dxq h ARG 177 CO 0.01 0.74 -0.26 0.35 2.80 0.00 0.00 179.97 183.61 1dxq h PHE 178 N 0.67 -0.68 0.00 2.20 3.57 -1.44 0.47 116.94 121.72 1dxq h PHE 178 Ca 0.16 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.72 1dxq h PHE 178 Cb 0.30 0.38 0.00 0.00 2.79 0.00 0.00 35.95 39.42 1dxq h PHE 178 CO 0.02 -0.34 0.00 0.00 -2.23 0.00 0.00 178.31 175.76 1dxq n GLY 180 N -0.04 2.28 3.33 0.00 0.00 0.15 -2.25 105.19 108.67 1dxq n GLY 180 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 1dxq n GLY 180 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1dxq n PHE 181 N -0.23 -2.10 -3.50 1.61 3.72 -0.72 -2.93 117.46 113.30 1dxq n PHE 181 Ca 0.00 0.27 -0.42 0.00 -0.05 0.00 0.00 57.45 57.25 1dxq n PHE 181 Cb 0.00 -1.76 -0.10 0.00 -0.94 0.00 0.00 39.48 36.67 1dxq n PHE 181 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1dxq s GLN 182 N -2.50 3.10 -0.36 -1.08 -1.52 -0.94 -4.50 119.66 111.86 1dxq s GLN 182 Ca 0.58 -0.92 -0.22 0.00 -1.95 0.00 0.00 55.36 52.85 1dxq s GLN 182 Cb -0.31 -3.89 0.01 0.00 -0.22 0.00 0.00 33.01 28.60 1dxq s GLN 182 CO 0.66 -0.65 0.73 0.08 -0.25 0.00 0.00 175.29 175.85 1dxq s VAL 183 N 1.67 4.79 0.72 1.09 1.01 -1.26 -0.85 120.40 127.57 1dxq s VAL 183 Ca 0.05 0.75 -0.07 0.00 0.00 0.00 0.00 61.98 62.71 1dxq s VAL 183 Cb -0.19 -4.16 0.06 0.00 0.00 0.00 0.00 36.38 32.09 1dxq s VAL 183 CO 0.10 -0.40 1.04 -0.76 0.00 0.00 0.00 175.10 175.07 1dxq s LEU 184 N 2.96 2.78 0.24 3.92 1.43 0.21 0.54 118.68 130.76 1dxq s LEU 184 Ca 0.29 0.52 -0.31 0.00 -1.03 0.00 0.00 54.13 53.60 1dxq s LEU 184 Cb -0.14 -3.15 -0.12 0.00 0.03 0.00 0.00 46.19 42.81 1dxq s LEU 184 CO 0.16 -1.63 1.60 -0.62 0.23 0.00 0.00 176.35 176.09 1dxq n GLU 185 N -2.98 2.52 -2.36 1.70 1.02 -1.26 -4.67 120.64 114.61 1dxq n GLU 185 Ca 0.08 0.90 -0.41 0.00 -0.02 0.00 0.00 57.16 57.71 1dxq n GLU 185 Cb 0.60 -2.68 -0.04 0.00 -0.02 0.00 0.00 31.44 29.31 1dxq n GLU 185 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1dxq s PRO 186 N 0.22 4.53 -0.78 3.49 0.04 -1.26 -4.67 135.00 136.57 1dxq s PRO 186 Ca 0.70 1.93 -0.23 0.00 0.04 0.00 0.00 61.00 63.44 1dxq s PRO 186 Cb -0.55 -3.17 0.07 0.00 0.04 0.00 0.00 34.50 30.88 1dxq s PRO 186 CO 0.42 0.04 1.13 -1.14 0.04 0.00 0.00 177.00 177.49 1dxq s GLN 187 N -1.22 3.29 -0.30 4.56 2.00 0.19 -4.97 119.66 123.21 1dxq s GLN 187 Ca 0.48 -0.93 -0.14 0.00 -2.00 0.00 0.00 55.36 52.76 1dxq s GLN 187 Cb -0.34 -4.52 -0.03 0.00 0.80 0.00 0.00 33.01 28.92 1dxq s GLN 187 CO 0.43 -1.94 0.34 -0.51 -0.50 0.00 0.00 175.29 173.11 1dxq s LEU 188 N 4.29 4.16 -0.31 3.68 1.43 -1.26 -0.67 118.68 129.99 1dxq s LEU 188 Ca 0.30 0.06 0.01 0.00 -1.03 0.00 0.00 54.13 53.48 1dxq s LEU 188 Cb -0.10 -2.34 0.07 0.00 0.03 0.00 0.00 46.19 43.85 1dxq s LEU 188 CO 0.04 -0.21 0.01 -0.69 0.23 0.00 0.00 176.35 175.73 1dxq s VAL 189 N 2.00 2.59 0.08 -1.59 1.01 -0.76 -5.01 120.40 118.72 1dxq s VAL 189 Ca 0.12 -1.81 -0.19 0.00 0.00 0.00 0.00 61.98 60.10 1dxq s VAL 189 Cb -0.16 -2.65 -0.07 0.00 0.00 0.00 0.00 36.38 33.50 1dxq s VAL 189 CO 0.11 -0.30 0.58 -0.31 0.00 0.00 0.00 175.10 175.18 1dxq s TYR 190 N 1.10 3.80 -0.04 5.22 2.02 -1.26 -1.00 117.35 127.19 1dxq s TYR 190 Ca -0.00 1.28 -0.03 0.00 -0.37 0.00 0.00 57.07 57.95 1dxq s TYR 190 Cb -0.20 -2.51 0.01 0.00 -0.40 0.00 0.00 41.96 38.86 1dxq s TYR 190 CO -0.05 0.58 0.06 -1.13 -1.57 0.00 0.00 175.55 173.44 1dxq n SER 191 N 1.65 -4.22 -0.17 2.29 3.41 0.17 -4.82 113.62 111.94 1dxq n SER 191 Ca -0.10 0.21 0.13 0.00 -0.26 0.00 0.00 58.87 58.85 1dxq n SER 191 Cb 0.51 -1.03 0.31 0.00 -0.26 0.00 0.00 64.21 63.73 1dxq n SER 191 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1dxq n ILE 192 N 0.87 0.00 0.74 -1.33 5.41 -1.25 -2.77 119.36 121.04 1dxq n ILE 192 Ca -0.01 -0.09 0.13 0.00 1.00 0.00 0.00 62.75 63.78 1dxq n ILE 192 Cb 0.34 0.39 0.49 0.00 -0.71 0.00 0.00 39.64 40.16 1dxq n ILE 192 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1dxq n GLY 193 N 1.40 -1.51 0.04 7.39 0.00 -1.26 -3.48 105.19 107.77 1dxq n GLY 193 Ca 0.10 -0.05 -0.03 0.00 0.00 0.00 0.00 46.02 46.04 1dxq n GLY 193 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1dxq n HIS 194 N -1.87 0.00 -1.99 1.61 8.25 -1.20 -4.99 115.22 115.03 1dxq n HIS 194 Ca 0.06 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.11 1dxq n HIS 194 Cb 0.35 -0.38 -0.01 0.00 1.12 0.00 0.00 29.99 31.07 1dxq n HIS 194 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1dxq s THR 195 N -2.27 2.46 0.92 1.59 -4.23 -1.11 -5.00 115.64 108.00 1dxq s THR 195 Ca -0.04 0.45 -0.13 0.00 -1.18 0.00 0.00 61.69 60.79 1dxq s THR 195 Cb 0.03 -3.28 0.14 0.00 1.34 0.00 0.00 72.50 70.73 1dxq s THR 195 CO 0.35 0.10 1.16 -2.16 -0.54 0.00 0.00 174.62 173.52 1dxq s PRO 196 N -2.00 1.06 0.25 3.99 0.04 -1.26 -4.86 135.00 132.23 1dxq s PRO 196 Ca 0.52 0.19 -0.03 0.00 0.04 0.00 0.00 61.00 61.73 1dxq s PRO 196 Cb -0.42 -1.84 0.49 0.00 0.04 0.00 0.00 34.50 32.77 1dxq s PRO 196 CO 0.56 -2.23 1.75 -1.35 0.04 0.00 0.00 177.00 175.77 1dxq h PRO 197 N -1.52 0.53 0.00 0.56 0.11 -1.97 -2.80 132.00 126.91 1dxq h PRO 197 Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1dxq h PRO 197 Cb 1.32 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1dxq h PRO 197 CO 0.59 0.35 0.00 -0.25 -0.21 0.00 0.00 178.00 178.48 1dxq n ASP 198 N -4.93 0.00 -0.26 -2.05 9.92 -1.26 -2.84 116.55 115.13 1dxq n ASP 198 Ca 0.15 0.76 0.10 0.00 -0.53 0.00 0.00 54.79 55.27 1dxq n ASP 198 Cb 0.41 -0.26 0.21 0.00 -0.64 0.00 0.00 41.12 40.85 1dxq n ASP 198 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1dxq n ALA 199 N -1.44 0.36 -0.30 2.24 0.00 -1.19 0.97 120.51 121.14 1dxq n ALA 199 Ca 0.00 0.81 0.04 0.00 0.00 0.00 0.00 53.44 54.29 1dxq n ALA 199 Cb 0.00 -0.58 0.18 0.00 0.00 0.00 0.00 19.45 19.05 1dxq n ALA 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1dxq h ARG 200 N 0.00 0.78 0.15 0.00 3.08 -1.41 0.50 114.38 117.47 1dxq h ARG 200 Ca 0.45 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.44 1dxq h ARG 200 Cb 0.90 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.77 1dxq h ARG 200 CO -0.72 0.52 -0.07 0.52 -1.07 0.00 0.00 179.97 179.15 1dxq h MET 201 N 0.80 -0.19 -0.59 0.04 2.86 0.76 -1.79 114.93 116.82 1dxq h MET 201 Ca 0.41 0.01 0.15 0.00 -2.06 0.00 0.00 59.70 58.21 1dxq h MET 201 Cb 0.39 0.04 -0.03 0.00 0.06 0.00 0.00 31.60 32.07 1dxq h MET 201 CO -0.26 0.18 0.41 1.96 1.06 0.00 0.00 176.91 180.27 1dxq h GLN 202 N -0.60 0.14 -0.39 1.72 1.08 -0.79 0.32 115.11 116.59 1dxq h GLN 202 Ca -0.02 -0.01 -0.11 0.00 -1.45 0.00 0.00 58.65 57.06 1dxq h GLN 202 Cb 0.46 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.85 1dxq h GLN 202 CO 0.03 0.09 -0.19 0.82 -0.95 0.00 0.00 178.83 178.63 1dxq h ILE 203 N 0.15 1.28 -0.09 2.54 2.04 0.16 0.20 117.51 123.80 1dxq h ILE 203 Ca 0.28 -1.33 -0.10 0.00 1.00 0.00 0.00 64.86 64.71 1dxq h ILE 203 Cb 0.92 1.30 -0.01 0.00 -0.74 0.00 0.00 36.82 38.28 1dxq h ILE 203 CO -0.04 0.44 -0.41 -0.07 0.00 0.00 0.00 178.15 178.08 1dxq h LEU 204 N 0.63 0.19 -0.13 1.44 3.38 0.21 -0.82 115.31 120.21 1dxq h LEU 204 Ca 0.09 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 1dxq h LEU 204 Cb 0.75 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1dxq h LEU 204 CO 0.06 0.59 -0.25 -0.33 0.09 0.00 0.00 178.44 178.59 1dxq h GLU 205 N 0.16 0.41 -0.55 1.13 4.39 -0.20 -1.76 114.58 118.15 1dxq h GLU 205 Ca 0.01 -0.26 0.04 0.00 0.34 0.00 0.00 59.36 59.50 1dxq h GLU 205 Cb 0.79 0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 29.43 1dxq h GLU 205 CO 0.06 0.86 0.29 0.78 -1.16 0.00 0.00 179.01 179.84 1dxq h GLY 206 N 0.00 0.78 0.38 -3.84 0.00 -0.39 -0.22 103.07 99.79 1dxq h GLY 206 Ca 0.01 -0.21 -0.00 0.00 0.00 0.00 0.00 47.33 47.13 1dxq h GLY 206 CO 0.06 0.14 -0.51 -0.25 0.00 0.00 0.00 176.54 175.98 1dxq h TRP 207 N 0.57 -1.42 -0.45 5.60 -0.00 -1.09 0.21 115.95 119.37 1dxq h TRP 207 Ca 0.24 0.02 0.09 0.00 -0.00 0.00 0.00 58.89 59.24 1dxq h TRP 207 Cb 0.12 0.57 -0.10 0.00 -0.00 0.00 0.00 29.16 29.76 1dxq h TRP 207 CO -0.09 -0.64 -0.30 0.87 -0.00 0.00 0.00 178.44 178.28 1dxq h LYS 208 N -0.90 -0.20 -0.67 2.65 1.57 -0.91 -1.55 116.57 116.56 1dxq h LYS 208 Ca -0.04 0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1dxq h LYS 208 Cb 0.83 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.15 1dxq h LYS 208 CO -0.15 -0.13 0.44 -0.22 -0.57 0.00 0.00 179.45 178.83 1dxq h LYS 209 N -0.20 0.88 0.00 3.15 3.64 -0.68 -2.16 116.57 121.20 1dxq h LYS 209 Ca 0.20 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.52 1dxq h LYS 209 Cb 0.52 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 32.15 1dxq h LYS 209 CO -0.57 0.58 -0.01 -0.09 -2.27 0.00 0.00 179.45 177.10 1dxq h ARG 210 N 0.90 0.00 0.00 1.90 2.43 0.38 -1.47 114.38 118.53 1dxq h ARG 210 Ca 0.25 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.42 1dxq h ARG 210 Cb -0.09 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.46 1dxq h ARG 210 CO -0.06 0.01 0.00 -0.07 -1.51 0.00 0.00 179.97 178.34 1dxq h LEU 211 N 0.00 0.00 -1.14 3.80 3.38 -0.73 -2.99 115.31 117.62 1dxq h LEU 211 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1dxq h LEU 211 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1dxq h LEU 211 CO 0.00 0.00 0.00 -0.33 0.09 0.00 0.00 178.44 178.20 1dxq h GLU 212 N 0.00 0.00 0.00 1.13 5.08 -1.23 -3.13 114.58 116.43 1dxq h GLU 212 Ca 0.00 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.22 1dxq h GLU 212 Cb 0.71 0.00 -0.30 0.00 0.50 0.00 0.00 28.75 29.66 1dxq h GLU 212 CO 0.00 0.00 -0.91 0.25 -1.00 0.00 0.00 179.01 177.35 1dxq n THR 213 N -2.35 0.00 -0.10 1.13 -2.24 -1.16 -4.90 114.28 104.67 1dxq n THR 213 Ca 0.00 -0.76 -0.09 0.00 -2.27 0.00 0.00 64.05 60.93 1dxq n THR 213 Cb 0.15 0.88 -0.01 0.00 -2.10 0.00 0.00 70.33 69.25 1dxq n THR 213 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 1dxq h VAL 214 N 6.97 1.10 0.00 2.28 -1.51 -1.47 -2.57 116.25 121.05 1dxq h VAL 214 Ca -0.18 -0.21 0.00 0.00 -1.23 0.00 0.00 66.70 65.07 1dxq h VAL 214 Cb 1.78 0.64 0.00 0.00 -2.13 0.00 0.00 31.29 31.58 1dxq h VAL 214 CO 0.07 0.10 0.03 1.87 -1.23 0.00 0.00 177.57 178.41 1dxq n TRP 215 N -4.84 0.53 0.63 5.19 -0.00 -1.26 -1.87 117.44 115.82 1dxq n TRP 215 Ca -0.01 0.28 0.08 0.00 -0.00 0.00 0.00 57.50 57.85 1dxq n TRP 215 Cb 0.04 -0.92 0.08 0.00 -0.00 0.00 0.00 31.31 30.51 1dxq n TRP 215 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 177.69 178.08 1dxq n GLU 216 N -2.05 1.45 -1.89 5.87 4.71 -0.97 -5.01 120.64 122.76 1dxq n GLU 216 Ca -0.01 -1.57 -0.31 0.00 -0.01 0.00 0.00 57.16 55.26 1dxq n GLU 216 Cb 0.05 -1.33 0.01 0.00 -1.01 0.00 0.00 31.44 29.16 1dxq n GLU 216 CO 0.00 0.00 0.00 -1.21 0.09 0.00 0.00 177.13 176.01 1dxq s GLU 217 N -1.38 3.60 0.15 3.49 2.02 -0.78 -5.04 118.70 120.75 1dxq s GLU 217 Ca 0.21 0.74 -0.16 0.00 0.02 0.00 0.00 54.97 55.78 1dxq s GLU 217 Cb 0.14 -2.09 -0.07 0.00 0.10 0.00 0.00 34.13 32.22 1dxq s GLU 217 CO 0.21 -0.56 0.58 0.95 0.02 0.00 0.00 175.26 176.46 1dxq s THR 218 N -3.17 4.80 0.89 3.63 -4.23 -1.26 -5.07 115.64 111.22 1dxq s THR 218 Ca 0.55 0.95 -0.12 0.00 -1.18 0.00 0.00 61.69 61.89 1dxq s THR 218 Cb -0.11 -3.78 0.12 0.00 1.34 0.00 0.00 72.50 70.08 1dxq s THR 218 CO 0.54 0.28 1.14 -2.16 -0.54 0.00 0.00 174.62 173.88 1dxq s PRO 219 N -1.84 1.32 0.67 3.99 0.04 -1.26 -4.59 135.00 133.32 1dxq s PRO 219 Ca 0.37 0.30 -0.14 0.00 0.04 0.00 0.00 61.00 61.58 1dxq s PRO 219 Cb -0.16 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.52 1dxq s PRO 219 CO 0.19 -2.07 1.08 -0.51 0.04 0.00 0.00 177.00 175.73 1dxq s LEU 220 N -5.96 3.31 -0.30 -3.56 1.43 0.19 -4.59 118.68 109.20 1dxq s LEU 220 Ca 0.63 1.84 -0.19 0.00 -1.03 0.00 0.00 54.13 55.38 1dxq s LEU 220 Cb -0.14 -4.53 -0.01 0.00 0.03 0.00 0.00 46.19 41.53 1dxq s LEU 220 CO 0.53 -1.53 0.57 -0.47 0.23 0.00 0.00 176.35 175.68 1dxq s TYR 221 N -2.61 3.22 0.04 0.29 5.04 -1.26 -4.80 117.35 117.26 1dxq s TYR 221 Ca 0.63 0.51 0.08 0.00 -2.44 0.00 0.00 57.07 55.85 1dxq s TYR 221 Cb -0.17 -2.89 -0.03 0.00 0.35 0.00 0.00 41.96 39.22 1dxq s TYR 221 CO 0.45 -0.43 -0.22 -0.06 -1.34 0.00 0.00 175.55 173.95 1dxq s PHE 222 N 2.47 2.44 0.06 4.97 0.08 -1.26 -4.87 117.98 121.86 1dxq s PHE 222 Ca 0.22 -0.33 -0.31 0.00 0.12 0.00 0.00 56.93 56.63 1dxq s PHE 222 Cb -0.15 -1.43 -0.10 0.00 -0.57 0.00 0.00 43.02 40.77 1dxq s PHE 222 CO 0.11 0.18 1.93 0.00 -0.10 0.00 0.00 175.22 177.35 1dxq n ALA 223 N 1.70 1.76 -1.76 5.36 0.00 -1.26 -4.92 120.51 121.39 1dxq n ALA 223 Ca -0.17 0.25 -0.39 0.00 0.00 0.00 0.00 53.44 53.13 1dxq n ALA 223 Cb 0.52 -2.65 0.01 0.00 0.00 0.00 0.00 19.45 17.33 1dxq n ALA 223 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1dxq s PRO 224 N 3.91 3.66 0.55 0.00 0.02 -1.26 -4.90 135.00 136.97 1dxq s PRO 224 Ca 0.87 2.20 0.24 0.00 0.02 0.00 0.00 61.00 64.33 1dxq s PRO 224 Cb -0.46 -2.56 1.45 0.00 0.02 0.00 0.00 34.50 32.95 1dxq s PRO 224 CO 0.41 -0.76 2.08 0.77 -0.33 0.00 0.00 177.00 179.17 1dxq h SER 225 N 2.20 0.00 -0.76 2.53 0.02 -1.95 -2.26 113.55 113.33 1dxq h SER 225 Ca -0.50 0.00 0.22 0.00 -0.84 0.00 0.00 61.79 60.67 1dxq h SER 225 Cb 1.26 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.77 1dxq h SER 225 CO 0.61 0.00 0.57 0.28 -1.14 0.00 0.00 176.83 177.15 1dxq h SER 226 N 0.00 0.00 0.05 3.07 0.02 -2.02 0.34 113.55 115.01 1dxq h SER 226 Ca 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1dxq h SER 226 Cb 0.52 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.06 1dxq h SER 226 CO -0.00 0.00 0.00 0.18 -1.14 0.00 0.00 176.83 175.87 1dxq n LEU 227 N -4.19 0.00 -4.25 5.07 4.77 -0.85 -4.80 117.00 112.75 1dxq n LEU 227 Ca 0.15 0.05 -0.20 0.00 -0.03 0.00 0.00 56.01 55.98 1dxq n LEU 227 Cb 0.85 -0.05 -0.12 0.00 -2.33 0.00 0.00 43.42 41.77 1dxq n LEU 227 CO 0.37 -0.03 -0.47 -0.36 -1.33 0.00 0.00 177.39 175.57 1dxq s PHE 228 N -2.11 1.53 -1.16 -1.77 0.40 0.12 0.12 117.98 115.11 1dxq s PHE 228 Ca 0.22 -0.48 -0.14 0.00 -0.60 0.00 0.00 56.93 55.93 1dxq s PHE 228 Cb 0.11 -0.82 0.18 0.00 0.51 0.00 0.00 43.02 43.01 1dxq s PHE 228 CO 0.19 0.17 1.35 -0.51 0.70 0.00 0.00 175.22 177.13 1dxq s ASP 229 N -2.20 7.06 -0.99 1.36 1.01 -0.46 -4.84 116.67 117.60 1dxq s ASP 229 Ca 0.07 -2.98 -0.23 0.00 0.71 0.00 0.00 52.55 50.12 1dxq s ASP 229 Cb -0.07 -2.37 -0.12 0.00 1.01 0.00 0.00 42.92 41.36 1dxq s ASP 229 CO 0.04 -0.71 1.92 0.18 0.21 0.00 0.00 175.17 176.81 1dxq n LEU 230 N 5.30 3.40 -3.66 1.23 4.77 -1.26 -2.92 117.00 123.87 1dxq n LEU 230 Ca 0.33 -3.02 -0.15 0.00 -0.03 0.00 0.00 56.01 53.15 1dxq n LEU 230 Cb 0.43 -1.46 -0.08 0.00 -2.33 0.00 0.00 43.42 39.98 1dxq n LEU 230 CO 0.58 -1.27 0.24 0.54 -1.33 0.00 0.00 177.39 176.15 1dxq s ASN 231 N 5.92 -0.52 0.00 -1.43 2.20 -1.26 -4.97 114.94 114.88 1dxq s ASN 231 Ca 0.64 0.81 0.02 0.00 -0.94 0.00 0.00 52.86 53.39 1dxq s ASN 231 Cb 0.06 0.82 0.09 0.00 -2.00 0.00 0.00 41.25 40.22 1dxq s ASN 231 CO 0.14 -0.34 0.89 0.49 -2.94 0.00 0.00 177.10 175.34 1dxq n PHE 232 N 2.03 0.00 0.04 1.54 3.72 -1.26 -1.26 117.46 122.27 1dxq n PHE 232 Ca -0.16 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.21 1dxq n PHE 232 Cb 0.56 -0.32 -0.01 0.00 -0.94 0.00 0.00 39.48 38.78 1dxq n PHE 232 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 1dxq h GLN 233 N 0.00 -0.14 0.00 -1.08 5.75 -1.95 -3.35 115.11 114.35 1dxq h GLN 233 Ca 0.00 0.01 -0.04 0.00 -0.15 0.00 0.00 58.65 58.47 1dxq h GLN 233 Cb 0.02 0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.60 1dxq h GLN 233 CO 0.00 -0.09 -0.20 0.00 -2.65 0.00 0.00 178.83 175.89 1dxq h ALA 234 N -1.53 1.11 0.00 3.38 0.00 -1.72 -3.47 119.26 117.03 1dxq h ALA 234 Ca -0.01 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1dxq h ALA 234 Cb 0.11 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1dxq h ALA 234 CO 0.02 0.25 0.00 0.41 0.00 0.00 0.00 179.25 179.93 1dxq n GLY 235 N -0.15 0.68 3.48 0.00 0.00 -0.39 -4.18 105.19 104.64 1dxq n GLY 235 Ca -0.01 -0.57 -0.19 0.00 0.00 0.00 0.00 46.02 45.25 1dxq n GLY 235 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1dxq n PHE 236 N -2.52 -2.16 -4.09 1.61 3.01 -1.14 -4.98 117.46 107.19 1dxq n PHE 236 Ca 0.00 0.86 -0.22 0.00 1.01 0.00 0.00 57.45 59.10 1dxq n PHE 236 Cb 0.00 -4.57 -0.04 0.00 -0.01 0.00 0.00 39.48 34.86 1dxq n PHE 236 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1dxq s LEU 237 N -6.24 3.89 0.01 4.37 1.43 -1.25 -4.82 118.68 116.07 1dxq s LEU 237 Ca 0.13 -0.20 -0.30 0.00 -1.03 0.00 0.00 54.13 52.73 1dxq s LEU 237 Cb -0.02 -2.42 -0.07 0.00 0.03 0.00 0.00 46.19 43.70 1dxq s LEU 237 CO 0.76 -0.04 1.77 -0.22 0.23 0.00 0.00 176.35 178.85 1dxq s LEU 238 N -3.85 4.37 0.20 1.79 0.20 -1.26 -1.36 118.68 118.78 1dxq s LEU 238 Ca 0.33 2.46 -0.31 0.00 0.69 0.00 0.00 54.13 57.30 1dxq s LEU 238 Cb -0.08 -3.54 -0.16 0.00 -0.43 0.00 0.00 46.19 41.98 1dxq s LEU 238 CO 0.25 -0.97 1.06 0.23 -0.29 0.00 0.00 176.35 176.64 1dxq n MET 239 N 6.88 1.06 -0.30 1.98 2.81 0.12 -4.62 117.12 125.05 1dxq n MET 239 Ca 0.18 0.37 0.13 0.00 -1.81 0.00 0.00 57.70 56.58 1dxq n MET 239 Cb 0.41 -1.79 0.30 0.00 -0.71 0.00 0.00 33.22 31.44 1dxq n MET 239 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 1dxq h LYS 240 N 2.77 0.27 0.61 0.03 1.57 -1.90 0.18 116.57 120.10 1dxq h LYS 240 Ca -0.41 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.33 1dxq h LYS 240 Cb 1.35 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.61 1dxq h LYS 240 CO 0.66 0.18 -0.31 0.93 -0.57 0.00 0.00 179.45 180.34 1dxq h GLU 241 N 0.28 -0.82 -0.86 3.15 3.07 -1.98 0.18 114.58 117.60 1dxq h GLU 241 Ca 0.56 0.06 0.14 0.00 -0.50 0.00 0.00 59.36 59.61 1dxq h GLU 241 Cb 1.11 0.19 -0.07 0.00 -0.84 0.00 0.00 28.75 29.14 1dxq h GLU 241 CO -0.61 -0.54 0.56 0.28 -1.40 0.00 0.00 179.01 177.30 1dxq h VAL 242 N -0.85 0.85 -0.17 3.13 2.07 -1.46 0.31 116.25 120.13 1dxq h VAL 242 Ca -0.08 -0.23 -0.03 0.00 0.82 0.00 0.00 66.70 67.18 1dxq h VAL 242 Cb 0.66 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 1dxq h VAL 242 CO 0.13 0.12 -0.01 1.56 0.02 0.00 0.00 177.57 179.39 1dxq h GLN 243 N 0.66 0.31 -0.16 1.57 4.20 -0.32 -0.29 115.11 121.08 1dxq h GLN 243 Ca 0.43 -0.10 0.02 0.00 0.06 0.00 0.00 58.65 59.05 1dxq h GLN 243 Cb 0.70 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.41 1dxq h GLN 243 CO -0.18 0.54 -0.30 1.49 -0.67 0.00 0.00 178.83 179.71 1dxq h GLU 244 N 0.05 -0.24 0.12 1.46 4.57 0.26 -1.63 114.58 119.18 1dxq h GLU 244 Ca 0.05 0.02 0.02 0.00 -1.18 0.00 0.00 59.36 58.26 1dxq h GLU 244 Cb 0.40 0.05 -0.04 0.00 -0.16 0.00 0.00 28.75 29.01 1dxq h GLU 244 CO 0.01 -0.16 -0.28 0.93 -1.18 0.00 0.00 179.01 178.32 1dxq h GLU 245 N -0.25 -0.48 0.00 1.92 5.08 -0.84 -2.02 114.58 117.99 1dxq h GLU 245 Ca 0.03 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1dxq h GLU 245 Cb 0.34 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1dxq h GLU 245 CO -0.29 -0.32 0.57 1.96 -1.00 0.00 0.00 179.01 179.93 1dxq h GLN 246 N -0.50 0.00 -0.25 2.33 1.08 -0.66 0.18 115.11 117.29 1dxq h GLN 246 Ca 0.03 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.23 1dxq h GLN 246 Cb 0.53 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.95 1dxq h GLN 246 CO -0.16 0.00 0.14 -0.22 -0.95 0.00 0.00 178.83 177.63 1dxq h LYS 247 N 0.00 0.33 -0.00 1.46 3.64 -0.52 -1.38 116.57 120.10 1dxq h LYS 247 Ca 0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1dxq h LYS 247 Cb 1.14 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1dxq h LYS 247 CO 0.00 0.24 -0.02 1.63 -2.27 0.00 0.00 179.45 179.03 1dxq n LYS 248 N -4.47 0.55 -3.35 1.90 5.02 0.62 -4.82 118.16 113.60 1dxq n LYS 248 Ca 0.01 -0.04 -0.38 0.00 -2.02 0.00 0.00 58.31 55.87 1dxq n LYS 248 Cb 0.09 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.54 1dxq n LYS 248 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1dxq s ASN 249 N -2.48 6.79 0.10 4.39 3.84 -0.52 -4.98 114.94 122.07 1dxq s ASN 249 Ca 0.31 0.94 0.03 0.00 0.21 0.00 0.00 52.86 54.35 1dxq s ASN 249 Cb 0.20 -2.29 -0.24 0.00 -0.55 0.00 0.00 41.25 38.37 1dxq s ASN 249 CO 0.45 0.13 1.20 0.50 -2.79 0.00 0.00 177.10 176.60 1dxq h LYS 250 N 5.79 0.10 -6.14 0.43 3.64 -1.87 -3.46 116.57 115.06 1dxq h LYS 250 Ca -0.45 -0.17 -0.51 0.00 -1.27 0.00 0.00 60.65 58.24 1dxq h LYS 250 Cb 1.20 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 33.06 1dxq h LYS 250 CO 0.70 1.07 -0.42 -0.06 -2.27 0.00 0.00 179.45 178.46 1dxq s PHE 251 N -2.68 3.48 0.32 1.91 0.08 -1.26 -3.91 117.98 115.91 1dxq s PHE 251 Ca -0.01 0.13 -0.05 0.00 0.12 0.00 0.00 56.93 57.11 1dxq s PHE 251 Cb 0.09 -1.68 0.07 0.00 -0.57 0.00 0.00 43.02 40.93 1dxq s PHE 251 CO 0.84 0.45 0.44 0.41 -0.10 0.00 0.00 175.22 177.26 1dxq n GLY 252 N -0.88 -1.21 0.05 4.36 0.00 -0.47 -4.89 105.19 102.16 1dxq n GLY 252 Ca -0.07 -1.69 -0.04 0.00 0.00 0.00 0.00 46.02 44.22 1dxq n GLY 252 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1dxq n LEU 253 N 0.00 1.34 -4.42 0.99 4.77 -0.28 -4.54 117.00 114.86 1dxq n LEU 253 Ca 0.06 0.51 -0.22 0.00 -0.03 0.00 0.00 56.01 56.33 1dxq n LEU 253 Cb 0.19 -0.77 -0.09 0.00 -2.33 0.00 0.00 43.42 40.43 1dxq n LEU 253 CO 0.14 -0.47 -0.20 -0.94 -1.33 0.00 0.00 177.39 174.59 1dxq s SER 254 N -5.18 2.19 0.18 -1.43 1.04 -1.16 -4.75 113.70 104.59 1dxq s SER 254 Ca -0.12 -1.61 -0.14 0.00 0.48 0.00 0.00 55.95 54.56 1dxq s SER 254 Cb 0.02 0.41 0.15 0.00 0.10 0.00 0.00 66.02 66.70 1dxq s SER 254 CO 0.17 -0.89 1.70 0.58 0.98 0.00 0.00 173.24 175.78 1dxq h VAL 255 N 2.01 0.70 0.00 5.02 2.07 -1.95 -1.86 116.25 122.23 1dxq h VAL 255 Ca -0.34 -0.05 -0.10 0.00 0.82 0.00 0.00 66.70 67.02 1dxq h VAL 255 Cb 1.26 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 1dxq h VAL 255 CO 0.54 0.03 -0.49 1.23 0.02 0.00 0.00 177.57 178.90 1dxq h GLY 256 N 0.16 0.00 -5.60 2.17 0.00 -1.97 -3.24 103.07 94.59 1dxq h GLY 256 Ca 0.22 0.00 -0.70 0.00 0.00 0.00 0.00 47.33 46.85 1dxq h GLY 256 CO -0.34 0.00 0.26 1.42 0.00 0.00 0.00 176.54 177.88 1dxq n HIS 257 N -3.56 3.33 0.80 5.60 -0.00 -0.76 -4.68 115.22 115.94 1dxq n HIS 257 Ca -0.00 -3.12 0.13 0.00 -0.00 0.00 0.00 57.72 54.73 1dxq n HIS 257 Cb 0.59 -0.83 0.51 0.00 -0.00 0.00 0.00 29.99 30.26 1dxq n HIS 257 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95 1dxq n HIS 258 N -0.22 0.26 -2.84 4.41 1.44 -0.83 -1.13 115.22 116.30 1dxq n HIS 258 Ca 0.41 0.08 -0.11 0.00 -2.01 0.00 0.00 57.72 56.09 1dxq n HIS 258 Cb 0.34 -0.63 -0.01 0.00 0.12 0.00 0.00 29.99 29.81 1dxq n HIS 258 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 1dxq n LEU 259 N -1.72 -0.61 0.00 2.39 4.77 -1.26 0.94 117.00 121.51 1dxq n LEU 259 Ca 0.06 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 1dxq n LEU 259 Cb 0.32 -1.51 0.00 0.00 -2.33 0.00 0.00 43.42 39.90 1dxq n LEU 259 CO 0.25 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.93 1dxq n GLY 260 N -0.74 2.25 1.73 -0.72 0.00 -1.26 -4.99 105.19 101.45 1dxq n GLY 260 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.89 1dxq n GLY 260 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dxq n LYS 261 N -2.00 0.24 -2.37 1.61 5.02 0.27 -5.04 118.16 115.89 1dxq n LYS 261 Ca 0.00 -1.19 -0.41 0.00 -2.02 0.00 0.00 58.31 54.69 1dxq n LYS 261 Cb 0.00 -0.31 -0.03 0.00 -0.02 0.00 0.00 35.03 34.66 1dxq n LYS 261 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1dxq s SER 262 N -2.83 7.09 -0.03 4.39 1.04 -1.25 -4.65 113.70 117.46 1dxq s SER 262 Ca 0.30 2.26 -0.30 0.00 0.48 0.00 0.00 55.95 58.69 1dxq s SER 262 Cb -0.02 -2.61 -0.04 0.00 0.10 0.00 0.00 66.02 63.45 1dxq s SER 262 CO 0.20 -0.36 1.25 -0.63 0.98 0.00 0.00 173.24 174.68 1dxq s ILE 263 N -0.22 4.09 0.00 -1.02 1.01 -1.26 -1.37 121.20 122.43 1dxq s ILE 263 Ca 0.52 1.44 0.00 0.00 0.00 0.00 0.00 60.65 62.61 1dxq s ILE 263 Cb -0.33 -3.92 0.00 0.00 0.01 0.00 0.00 42.46 38.22 1dxq s ILE 263 CO 0.38 0.01 0.00 -2.65 0.00 0.00 0.00 174.94 172.68 1dxq n PRO 264 N 5.10 0.00 0.00 2.79 -0.02 -1.26 -4.95 135.00 136.66 1dxq n PRO 264 Ca 0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 1dxq n PRO 264 Cb 0.46 -0.09 0.00 0.00 -0.02 0.00 0.00 33.50 33.85 1dxq n PRO 264 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1dxq n ALA 265 N -0.79 0.00 -1.08 3.55 0.00 -1.26 -4.95 120.51 115.98 1dxq n ALA 265 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 1dxq n ALA 265 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.30 1dxq n ALA 265 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1dxq n ASP 266 N 0.00 5.53 -0.11 0.00 8.00 -1.26 -4.47 116.55 124.25 1dxq n ASP 266 Ca 0.00 -2.58 0.19 0.00 0.71 0.00 0.00 54.79 53.11 1dxq n ASP 266 Cb 0.00 -1.40 0.60 0.00 -0.02 0.00 0.00 41.12 40.30 1dxq n ASP 266 CO 0.00 0.00 0.00 -1.13 -0.39 0.00 0.00 177.20 175.68 1dxq h ASN 267 N 3.08 0.20 0.00 -2.24 -0.73 -1.93 0.84 115.58 114.80 1dxq h ASN 267 Ca 0.24 0.01 0.00 0.00 1.87 0.00 0.00 56.30 58.43 1dxq h ASN 267 Cb 1.37 -0.03 0.00 0.00 0.27 0.00 0.00 38.32 39.93 1dxq h ASN 267 CO 0.37 0.10 -1.01 0.00 -0.37 0.00 0.00 177.43 176.52 1dxq n GLN 268 N -4.42 0.63 -0.07 6.67 1.13 -1.26 -4.30 117.38 115.75 1dxq n GLN 268 Ca 0.13 -0.02 -0.09 0.00 -1.94 0.00 0.00 57.00 55.08 1dxq n GLN 268 Cb 0.62 -1.42 -0.08 0.00 0.11 0.00 0.00 30.24 29.47 1dxq n GLN 268 CO 0.00 0.00 0.00 -0.89 -1.44 0.00 0.00 177.06 174.73 1dxq n ILE 269 N -1.53 0.90 -4.89 5.09 5.41 -0.24 -4.63 119.36 119.47 1dxq n ILE 269 Ca 0.03 -0.42 -0.27 0.00 1.00 0.00 0.00 62.75 63.09 1dxq n ILE 269 Cb 0.32 -0.92 -0.16 0.00 -0.71 0.00 0.00 39.64 38.17 1dxq n ILE 269 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 1dxq s LYS 270 N -2.32 1.95 -0.45 0.38 2.20 0.28 -4.38 119.74 117.41 1dxq s LYS 270 Ca -0.16 -0.64 -0.23 0.00 -0.36 0.00 0.00 55.97 54.58 1dxq s LYS 270 Cb 0.05 -1.66 0.03 0.00 -1.51 0.00 0.00 37.83 34.74 1dxq s LYS 270 CO 0.42 0.23 0.75 0.00 -0.36 0.00 0.00 175.35 176.40 1dxq s ALA 271 N 0.10 3.30 0.00 3.13 0.00 -1.26 -4.48 121.76 122.55 1dxq s ALA 271 Ca -0.06 -1.05 0.00 0.00 0.00 0.00 0.00 51.96 50.85 1dxq s ALA 271 Cb -0.13 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.56 1dxq s ALA 271 CO 0.03 -1.90 0.00 -2.13 0.00 0.00 0.00 175.76 171.76 1dxq n ARG 272 N 6.62 -1.31 0.00 0.00 3.00 -1.26 -4.92 116.66 118.79 1dxq n ARG 272 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.86 1dxq n ARG 272 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.94 1dxq n ARG 272 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26