#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xrh s SER 3 N 0.00 4.45 -0.11 -3.46 1.04 -0.84 -4.93 113.70 109.85 1xrh s SER 3 Ca 0.00 -1.28 0.03 0.00 0.48 0.00 0.00 55.95 55.18 1xrh s SER 3 Cb 0.00 0.12 -0.00 0.00 0.10 0.00 0.00 66.02 66.24 1xrh s SER 3 CO 0.00 -0.85 -0.22 -0.75 0.98 0.00 0.00 173.24 172.40 1xrh s LYS 4 N -4.06 3.10 0.16 4.02 2.20 -1.26 -1.53 119.74 122.37 1xrh s LYS 4 Ca 0.30 -0.84 0.09 0.00 -0.36 0.00 0.00 55.97 55.16 1xrh s LYS 4 Cb 0.01 -2.38 -0.04 0.00 -1.51 0.00 0.00 37.83 33.90 1xrh s LYS 4 CO 0.17 0.14 -0.21 -1.50 -0.36 0.00 0.00 175.35 173.60 1xrh s ILE 5 N 0.45 1.97 0.74 5.43 2.07 -0.50 -4.93 121.20 126.43 1xrh s ILE 5 Ca -0.15 -1.89 -0.11 0.00 -1.41 0.00 0.00 60.65 57.09 1xrh s ILE 5 Cb -0.17 -1.89 0.03 0.00 0.13 0.00 0.00 42.46 40.57 1xrh s ILE 5 CO 0.06 -0.20 1.08 -0.94 -1.91 0.00 0.00 174.94 173.03 1xrh s SER 6 N -2.53 5.05 0.16 4.50 1.04 -1.26 -0.61 113.70 120.06 1xrh s SER 6 Ca 0.16 1.35 -0.12 0.00 0.48 0.00 0.00 55.95 57.82 1xrh s SER 6 Cb -0.07 -2.16 0.06 0.00 0.10 0.00 0.00 66.02 63.94 1xrh s SER 6 CO 0.07 -1.62 1.70 0.03 0.98 0.00 0.00 173.24 174.40 1xrh h ARG 7 N -0.85 0.86 -0.80 4.02 3.08 -1.93 -0.78 114.38 117.99 1xrh h ARG 7 Ca -0.46 -0.18 -0.04 0.00 0.07 0.00 0.00 59.98 59.38 1xrh h ARG 7 Cb 1.24 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 31.13 1xrh h ARG 7 CO 0.60 0.77 0.35 0.93 -1.07 0.00 0.00 179.97 181.55 1xrh h GLU 8 N 0.78 1.17 -0.16 0.04 3.07 -1.99 0.14 114.58 117.63 1xrh h GLU 8 Ca 0.18 -0.19 -0.19 0.00 -0.50 0.00 0.00 59.36 58.66 1xrh h GLU 8 Cb 0.26 -0.20 0.00 0.00 -0.84 0.00 0.00 28.75 27.97 1xrh h GLU 8 CO -0.01 0.92 -0.69 1.15 -1.40 0.00 0.00 179.01 178.99 1xrh h THR 9 N 1.15 1.32 -0.02 1.13 2.02 -1.85 -1.76 112.91 114.90 1xrh h THR 9 Ca 0.27 -1.95 -0.00 0.00 0.77 0.00 0.00 66.41 65.50 1xrh h THR 9 Cb 0.17 1.93 -0.00 0.00 -1.74 0.00 0.00 68.15 68.50 1xrh h THR 9 CO -0.03 0.61 0.01 0.25 0.37 0.00 0.00 175.52 176.73 1xrh h LEU 10 N 0.46 0.03 -0.53 2.58 5.85 -0.93 0.21 115.31 122.97 1xrh h LEU 10 Ca -0.02 -0.14 0.11 0.00 0.84 0.00 0.00 57.88 58.66 1xrh h LEU 10 Cb 1.28 -0.01 -0.10 0.00 0.37 0.00 0.00 40.66 42.21 1xrh h LEU 10 CO 0.13 0.16 -0.08 -0.74 -0.34 0.00 0.00 178.44 177.58 1xrh h HIS 11 N -0.11 -0.18 -0.73 1.25 2.76 -0.86 -0.23 115.15 117.04 1xrh h HIS 11 Ca 0.01 0.04 -0.06 0.00 -2.20 0.00 0.00 60.37 58.16 1xrh h HIS 11 Cb 0.14 0.16 -0.03 0.00 1.55 0.00 0.00 27.41 29.24 1xrh h HIS 11 CO -0.03 -0.19 0.24 0.37 -1.30 0.00 0.00 177.93 177.02 1xrh h GLN 12 N 0.04 1.13 -0.40 5.26 5.75 -1.07 0.97 115.11 126.79 1xrh h GLN 12 Ca 0.26 -0.24 -0.02 0.00 -0.15 0.00 0.00 58.65 58.51 1xrh h GLN 12 Cb 0.41 -0.17 -0.02 0.00 1.07 0.00 0.00 27.48 28.77 1xrh h GLN 12 CO -0.51 0.96 0.18 -0.07 -2.65 0.00 0.00 178.83 176.75 1xrh h LEU 13 N 1.08 0.52 -0.24 -2.39 3.38 0.71 -1.44 115.31 116.94 1xrh h LEU 13 Ca 0.24 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 1xrh h LEU 13 Cb 0.29 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1xrh h LEU 13 CO -0.01 0.51 -0.05 0.40 0.09 0.00 0.00 178.44 179.38 1xrh h ILE 14 N 0.50 1.28 -0.27 1.22 2.04 -0.89 -2.48 117.51 118.91 1xrh h ILE 14 Ca 0.14 -1.05 0.06 0.00 1.00 0.00 0.00 64.86 65.01 1xrh h ILE 14 Cb 0.13 1.47 -0.07 0.00 -0.74 0.00 0.00 36.82 37.61 1xrh h ILE 14 CO -0.02 0.33 -0.21 -0.08 0.00 0.00 0.00 178.15 178.17 1xrh h GLU 15 N 0.21 -0.19 -0.37 2.37 4.81 -0.70 -1.06 114.58 119.65 1xrh h GLU 15 Ca 0.06 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 1xrh h GLU 15 Cb 0.51 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.92 1xrh h GLU 15 CO 0.02 -0.13 0.20 -0.91 -0.73 0.00 0.00 179.01 177.47 1xrh h ASN 16 N -0.20 0.47 -0.64 1.04 2.35 -1.27 -1.35 115.58 115.98 1xrh h ASN 16 Ca 0.15 -0.09 0.05 0.00 -0.55 0.00 0.00 56.30 55.86 1xrh h ASN 16 Cb 0.42 -0.12 -0.04 0.00 0.05 0.00 0.00 38.32 38.63 1xrh h ASN 16 CO -0.38 0.43 0.42 0.50 -1.65 0.00 0.00 177.43 176.75 1xrh h LYS 17 N 0.48 0.66 0.00 0.81 1.63 -0.92 0.12 116.57 119.34 1xrh h LYS 17 Ca 0.13 -0.04 -0.13 0.00 -0.85 0.00 0.00 60.65 59.76 1xrh h LYS 17 Cb 0.06 -0.15 -0.02 0.00 -0.60 0.00 0.00 32.23 31.53 1xrh h LYS 17 CO -0.02 0.43 -0.63 -0.07 -3.45 0.00 0.00 179.45 175.71 1xrh h LEU 18 N 0.68 0.00 -0.15 5.20 4.07 -0.80 -2.09 115.31 122.21 1xrh h LEU 18 Ca 0.27 0.00 -0.14 0.00 0.08 0.00 0.00 57.88 58.09 1xrh h LEU 18 Cb 0.21 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.96 1xrh h LEU 18 CO -0.08 0.63 -0.45 0.00 -1.08 0.00 0.00 178.44 177.46 1xrh h GLN 20 N 0.22 0.00 0.00 0.00 4.15 -0.72 -0.95 115.11 117.80 1xrh h GLN 20 Ca -0.01 0.00 -0.10 0.00 0.77 0.00 0.00 58.65 59.31 1xrh h GLN 20 Cb 1.07 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.74 1xrh h GLN 20 CO 0.10 0.00 -0.48 0.00 -1.93 0.00 0.00 178.83 176.51 1xrh h ALA 21 N 1.99 0.77 0.00 3.38 0.00 -0.95 -3.47 119.26 120.98 1xrh h ALA 21 Ca 0.01 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1xrh h ALA 21 Cb 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1xrh h ALA 21 CO -0.00 0.61 0.00 0.41 0.00 0.00 0.00 179.25 180.27 1xrh n GLY 22 N 0.86 0.74 3.76 0.00 0.00 -0.36 -3.75 105.19 106.44 1xrh n GLY 22 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 1xrh n GLY 22 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xrh s LEU 23 N 0.00 3.82 0.62 0.99 1.02 -0.78 -4.89 118.68 119.46 1xrh s LEU 23 Ca 0.00 2.38 -0.17 0.00 0.02 0.00 0.00 54.13 56.36 1xrh s LEU 23 Cb 0.00 -4.43 -0.02 0.00 0.02 0.00 0.00 46.19 41.76 1xrh s LEU 23 CO 0.00 -1.30 1.14 -0.54 0.02 0.00 0.00 176.35 175.66 1xrh s LYS 24 N -3.05 2.97 0.18 1.70 1.02 -1.26 -4.38 119.74 116.91 1xrh s LYS 24 Ca 0.71 1.55 -0.13 0.00 0.02 0.00 0.00 55.97 58.12 1xrh s LYS 24 Cb -0.30 -1.96 0.16 0.00 -0.52 0.00 0.00 37.83 35.21 1xrh s LYS 24 CO 0.35 -1.15 1.74 -0.09 -0.92 0.00 0.00 175.35 175.28 1xrh h ARG 25 N 0.52 0.29 -0.25 1.68 2.43 -1.96 -0.88 114.38 116.23 1xrh h ARG 25 Ca -0.48 -0.02 0.06 0.00 -0.81 0.00 0.00 59.98 58.73 1xrh h ARG 25 Cb 1.26 -0.07 -0.07 0.00 -0.42 0.00 0.00 29.97 30.68 1xrh h ARG 25 CO 0.55 0.19 -0.19 0.93 -1.51 0.00 0.00 179.97 179.94 1xrh h GLU 26 N 0.30 -0.17 -0.75 0.20 4.39 -1.99 0.17 114.58 116.73 1xrh h GLU 26 Ca 0.23 0.01 -0.05 0.00 0.34 0.00 0.00 59.36 59.89 1xrh h GLU 26 Cb 0.27 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.92 1xrh h GLU 26 CO -0.26 -0.12 0.27 0.45 -1.16 0.00 0.00 179.01 178.19 1xrh h HIS 27 N -0.18 1.17 -0.62 4.33 3.86 -1.81 -1.56 115.15 120.34 1xrh h HIS 27 Ca 0.14 -0.10 0.03 0.00 -1.16 0.00 0.00 60.37 59.28 1xrh h HIS 27 Cb 0.39 -0.35 -0.04 0.00 1.06 0.00 0.00 27.41 28.47 1xrh h HIS 27 CO -0.35 0.91 0.38 0.00 0.86 0.00 0.00 177.93 179.73 1xrh h ALA 28 N 1.14 0.81 -0.49 2.45 0.00 -0.31 -0.23 119.26 122.63 1xrh h ALA 28 Ca 0.25 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.15 1xrh h ALA 28 Cb 0.26 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1xrh h ALA 28 CO -0.01 0.12 0.32 0.00 0.00 0.00 0.00 179.25 179.67 1xrh h ALA 29 N 1.28 0.63 0.23 0.00 0.00 -0.34 -0.66 119.26 120.40 1xrh h ALA 29 Ca 0.25 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1xrh h ALA 29 Cb 0.03 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1xrh h ALA 29 CO -0.11 0.05 -0.11 1.15 0.00 0.00 0.00 179.25 180.23 1xrh h THR 30 N 0.65 0.85 -0.95 0.00 2.02 -0.57 -0.11 112.91 114.79 1xrh h THR 30 Ca 0.19 -0.55 0.18 0.00 0.77 0.00 0.00 66.41 67.00 1xrh h THR 30 Cb -0.05 1.16 -0.11 0.00 -1.74 0.00 0.00 68.15 67.41 1xrh h THR 30 CO -0.05 0.12 0.54 0.58 0.37 0.00 0.00 175.52 177.08 1xrh h VAL 31 N -0.59 0.68 -0.57 3.16 2.07 -0.97 0.19 116.25 120.22 1xrh h VAL 31 Ca -0.03 -0.23 -0.04 0.00 0.82 0.00 0.00 66.70 67.22 1xrh h VAL 31 Cb 0.43 -0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.11 1xrh h VAL 31 CO 0.05 0.12 0.20 0.00 0.02 0.00 0.00 177.57 177.97 1xrh h ALA 32 N 1.63 0.74 -0.23 1.67 0.00 -0.90 -1.50 119.26 120.67 1xrh h ALA 32 Ca 0.55 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 1xrh h ALA 32 Cb 0.87 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1xrh h ALA 32 CO -0.40 0.38 0.11 1.49 0.00 0.00 0.00 179.25 180.82 1xrh h GLU 33 N 0.79 0.33 -0.85 0.00 4.81 0.97 -0.90 114.58 119.71 1xrh h GLU 33 Ca 0.19 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.37 1xrh h GLU 33 Cb 0.24 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.52 1xrh h GLU 33 CO -0.01 0.35 0.56 0.28 -0.73 0.00 0.00 179.01 179.45 1xrh h VAL 34 N 0.23 1.22 -0.33 0.32 2.07 -1.24 -0.17 116.25 118.35 1xrh h VAL 34 Ca 0.08 -0.41 -0.11 0.00 0.82 0.00 0.00 66.70 67.08 1xrh h VAL 34 Cb 0.13 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 29.86 1xrh h VAL 34 CO -0.01 0.21 -0.22 -0.07 0.02 0.00 0.00 177.57 177.51 1xrh h LEU 35 N 1.16 0.77 -0.99 2.57 3.38 -1.06 -1.43 115.31 119.71 1xrh h LEU 35 Ca 0.31 -0.43 -0.10 0.00 0.09 0.00 0.00 57.88 57.75 1xrh h LEU 35 Cb -0.13 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.40 1xrh h LEU 35 CO -0.07 1.04 -0.49 -0.37 0.09 0.00 0.00 178.44 178.64 1xrh h VAL 36 N 0.51 1.31 -0.52 1.22 -1.51 -0.78 -2.00 116.25 114.48 1xrh h VAL 36 Ca 0.07 -1.71 -0.04 0.00 -1.23 0.00 0.00 66.70 63.79 1xrh h VAL 36 Cb 0.77 1.93 -0.02 0.00 -2.13 0.00 0.00 31.29 31.84 1xrh h VAL 36 CO 0.06 0.48 0.17 0.22 -1.23 0.00 0.00 177.57 177.27 1xrh h TYR 37 N 0.00 0.83 0.02 5.19 3.20 -0.92 -0.05 116.97 125.23 1xrh h TYR 37 Ca -0.00 -0.08 0.01 0.00 3.14 0.00 0.00 58.73 61.79 1xrh h TYR 37 Cb 0.89 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.91 1xrh h TYR 37 CO 0.00 0.71 -0.06 0.00 -1.64 0.00 0.00 178.16 177.17 1xrh h ALA 38 N 1.03 -0.08 -0.72 1.82 0.00 -0.58 -2.51 119.26 118.21 1xrh h ALA 38 Ca 0.17 0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.12 1xrh h ALA 38 Cb 0.26 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 1xrh h ALA 38 CO -0.01 -0.56 0.44 -0.44 0.00 0.00 0.00 179.25 178.68 1xrh h ASP 39 N -0.12 0.71 -0.12 0.00 3.32 -1.18 -0.76 116.42 118.28 1xrh h ASP 39 Ca 0.02 0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.10 1xrh h ASP 39 Cb 0.15 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 1xrh h ASP 39 CO -0.05 0.48 0.08 0.00 -1.72 0.00 0.00 179.24 178.03 1xrh h ALA 40 N 1.32 2.02 -0.17 3.45 0.00 -0.79 -1.66 119.26 123.43 1xrh h ALA 40 Ca 0.30 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1xrh h ALA 40 Cb 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1xrh h ALA 40 CO -0.13 -0.04 0.00 0.54 0.00 0.00 0.00 179.25 179.62 1xrh n ARG 41 N -4.51 1.65 -0.98 0.00 1.74 -0.68 -2.51 116.66 111.37 1xrh n ARG 41 Ca -0.01 -0.98 0.00 0.00 -0.77 0.00 0.00 57.85 56.10 1xrh n ARG 41 Cb 0.15 -1.36 0.00 0.00 -1.02 0.00 0.00 32.46 30.23 1xrh n ARG 41 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xrh n GLY 42 N 1.07 0.61 2.84 -0.13 0.00 -0.62 -4.58 105.19 104.38 1xrh n GLY 42 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1xrh n GLY 42 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1xrh n ILE 43 N -2.78 4.67 0.27 -0.61 5.41 -0.38 -4.79 119.36 121.16 1xrh n ILE 43 Ca 0.00 -4.71 0.12 0.00 1.00 0.00 0.00 62.75 59.15 1xrh n ILE 43 Cb 0.00 -2.26 0.74 0.00 -0.71 0.00 0.00 39.64 37.42 1xrh n ILE 43 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 176.55 177.00 1xrh h HIS 44 N 5.52 0.00 0.00 1.39 3.86 -1.88 -1.80 115.15 122.23 1xrh h HIS 44 Ca 0.39 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.60 1xrh h HIS 44 Cb 0.58 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.05 1xrh h HIS 44 CO 1.25 0.08 -0.02 0.66 0.86 0.00 0.00 177.93 180.76 1xrh h SER 45 N 0.00 0.00 -0.35 2.45 4.64 -1.95 -1.53 113.55 116.82 1xrh h SER 45 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xrh h SER 45 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1xrh h SER 45 CO 0.01 0.02 0.00 1.41 -0.87 0.00 0.00 176.83 177.40 1xrh n HIS 46 N -3.79 0.54 0.00 4.77 -0.00 -0.68 -4.76 115.22 111.31 1xrh n HIS 46 Ca -0.03 -0.55 0.00 0.00 -0.00 0.00 0.00 57.72 57.15 1xrh n HIS 46 Cb 0.10 -0.06 0.00 0.00 -0.00 0.00 0.00 29.99 30.03 1xrh n HIS 46 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1xrh n GLY 47 N 0.42 1.55 0.30 -1.41 0.00 -0.57 -4.65 105.19 100.82 1xrh n GLY 47 Ca 0.13 -1.45 0.16 0.00 0.00 0.00 0.00 46.02 44.86 1xrh n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xrh h ALA 48 N -1.21 1.32 0.00 4.61 0.00 -1.80 -2.58 119.26 119.60 1xrh h ALA 48 Ca 0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1xrh h ALA 48 Cb 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1xrh h ALA 48 CO 0.00 0.04 -0.00 -0.24 0.00 0.00 0.00 179.25 179.05 1xrh h VAL 49 N 0.00 0.13 0.00 0.00 3.04 -1.93 -1.93 116.25 115.56 1xrh h VAL 49 Ca -0.00 -0.02 0.00 0.00 -1.01 0.00 0.00 66.70 65.67 1xrh h VAL 49 Cb 0.12 1.02 0.00 0.00 -2.01 0.00 0.00 31.29 30.42 1xrh h VAL 49 CO 0.00 0.00 -0.41 0.54 -1.01 0.00 0.00 177.57 176.69 1xrh n ARG 50 N -3.26 0.04 -0.23 4.17 5.12 -0.97 -4.34 116.66 117.18 1xrh n ARG 50 Ca -0.03 0.01 -0.03 0.00 -1.93 0.00 0.00 57.85 55.88 1xrh n ARG 50 Cb 0.08 -1.52 0.08 0.00 -1.16 0.00 0.00 32.46 29.94 1xrh n ARG 50 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 1xrh h VAL 51 N 0.00 1.01 0.04 1.55 2.07 -1.52 -1.63 116.25 117.77 1xrh h VAL 51 Ca 0.00 -0.25 0.03 0.00 0.82 0.00 0.00 66.70 67.30 1xrh h VAL 51 Cb 0.53 0.23 -0.05 0.00 -1.52 0.00 0.00 31.29 30.48 1xrh h VAL 51 CO 0.00 0.13 -0.33 -0.08 0.02 0.00 0.00 177.57 177.31 1xrh h GLU 52 N 0.73 -0.49 -0.56 1.57 4.81 -1.79 0.14 114.58 118.98 1xrh h GLU 52 Ca 0.28 0.03 0.10 0.00 -0.13 0.00 0.00 59.36 59.65 1xrh h GLU 52 Cb 0.12 0.11 -0.08 0.00 0.63 0.00 0.00 28.75 29.53 1xrh h GLU 52 CO -0.15 -0.33 0.09 -0.92 -0.73 0.00 0.00 179.01 176.97 1xrh h TYR 53 N -0.51 0.14 -0.84 0.92 3.20 -1.78 -1.76 116.97 116.34 1xrh h TYR 53 Ca 0.05 0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.93 1xrh h TYR 53 Cb 0.58 0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.83 1xrh h TYR 53 CO -0.33 -0.05 0.45 1.88 -1.64 0.00 0.00 178.16 178.47 1xrh h TYR 54 N 0.22 1.17 0.16 -3.82 0.05 -0.44 -2.37 116.97 111.94 1xrh h TYR 54 Ca 0.29 -0.04 0.01 0.00 0.05 0.00 0.00 58.73 59.04 1xrh h TYR 54 Cb 0.43 -0.37 -0.02 0.00 1.01 0.00 0.00 36.73 37.77 1xrh h TYR 54 CO -0.26 0.82 -0.22 0.00 -1.05 0.00 0.00 178.16 177.45 1xrh h ALA 55 N 1.24 -0.40 0.46 3.88 0.00 0.06 0.14 119.26 124.63 1xrh h ALA 55 Ca 0.29 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1xrh h ALA 55 Cb 0.05 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1xrh h ALA 55 CO -0.04 -0.76 -0.48 1.49 0.00 0.00 0.00 179.25 179.45 1xrh h GLU 56 N -0.44 -0.92 -0.62 0.00 4.81 -1.15 0.64 114.58 116.90 1xrh h GLU 56 Ca 0.01 0.06 0.13 0.00 -0.13 0.00 0.00 59.36 59.43 1xrh h GLU 56 Cb 0.43 0.21 -0.12 0.00 0.63 0.00 0.00 28.75 29.91 1xrh h GLU 56 CO -0.09 -0.61 -0.13 -0.09 -0.73 0.00 0.00 179.01 177.35 1xrh h ARG 57 N -0.95 0.01 0.56 1.92 2.43 -1.34 0.24 114.38 117.24 1xrh h ARG 57 Ca -0.05 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.10 1xrh h ARG 57 Cb 0.84 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.38 1xrh h ARG 57 CO -0.08 0.01 -0.35 0.82 -1.51 0.00 0.00 179.97 178.86 1xrh h ILE 58 N 0.01 0.28 -0.32 1.20 2.04 -0.19 -1.73 117.51 118.80 1xrh h ILE 58 Ca 0.30 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.21 1xrh h ILE 58 Cb 0.47 0.28 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 1xrh h ILE 58 CO -0.62 0.00 0.22 0.77 0.00 0.00 0.00 178.15 178.51 1xrh h SER 59 N -0.86 0.21 -0.10 1.72 4.64 -0.12 -0.86 113.55 118.18 1xrh h SER 59 Ca -0.07 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 1xrh h SER 59 Cb 0.71 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.75 1xrh h SER 59 CO 0.06 0.14 0.00 0.29 -0.87 0.00 0.00 176.83 176.46 1xrh n LYS 60 N -4.48 1.28 0.00 4.77 5.02 0.78 -4.91 118.16 120.62 1xrh n LYS 60 Ca 0.03 -0.43 0.00 0.00 -2.02 0.00 0.00 58.31 55.89 1xrh n LYS 60 Cb 0.22 -1.21 0.00 0.00 -0.02 0.00 0.00 35.03 34.02 1xrh n LYS 60 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xrh n GLY 61 N 0.80 3.03 0.07 0.72 0.00 -0.33 -4.38 105.19 105.11 1xrh n GLY 61 Ca 0.09 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.14 1xrh n GLY 61 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xrh n GLY 62 N -0.54 -0.42 2.86 -0.02 0.00 -0.70 -4.12 105.19 102.25 1xrh n GLY 62 Ca 0.00 0.05 -0.25 0.00 0.00 0.00 0.00 46.02 45.82 1xrh n GLY 62 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xrh s THR 63 N -2.89 0.75 -0.08 2.61 2.01 -1.24 -3.91 115.64 112.89 1xrh s THR 63 Ca -0.01 -0.13 -0.29 0.00 0.31 0.00 0.00 61.69 61.57 1xrh s THR 63 Cb 0.02 -0.82 -0.07 0.00 0.01 0.00 0.00 72.50 71.64 1xrh s THR 63 CO 0.05 0.32 1.96 0.21 -0.69 0.00 0.00 174.62 176.47 1xrh s ASN 64 N 1.70 6.18 0.00 3.53 3.84 -0.79 -4.77 114.94 124.64 1xrh s ASN 64 Ca 0.03 2.27 0.18 0.00 0.21 0.00 0.00 52.86 55.55 1xrh s ASN 64 Cb -0.13 -2.53 0.68 0.00 -0.55 0.00 0.00 41.25 38.72 1xrh s ASN 64 CO -0.06 -1.32 1.49 -2.11 -2.79 0.00 0.00 177.10 172.31 1xrh n ARG 65 N 7.86 1.66 -2.80 0.43 1.85 -1.26 -4.10 116.66 120.30 1xrh n ARG 65 Ca 0.22 -1.00 -0.10 0.00 -1.00 0.00 0.00 57.85 55.97 1xrh n ARG 65 Cb 0.43 -1.35 0.07 0.00 -1.05 0.00 0.00 32.46 30.55 1xrh n ARG 65 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 1xrh n GLU 66 N 0.24 0.98 -2.45 2.89 -0.58 -1.26 -4.51 120.64 115.95 1xrh n GLU 66 Ca 0.15 -2.11 -0.38 0.00 -0.42 0.00 0.00 57.16 54.40 1xrh n GLU 66 Cb 0.29 -1.17 -0.03 0.00 -0.57 0.00 0.00 31.44 29.95 1xrh n GLU 66 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 1xrh s PRO 67 N -0.03 4.19 -0.76 3.49 0.04 -1.26 -5.01 135.00 135.66 1xrh s PRO 67 Ca 0.26 1.67 -0.18 0.00 0.04 0.00 0.00 61.00 62.79 1xrh s PRO 67 Cb 0.29 -2.69 0.14 0.00 0.04 0.00 0.00 34.50 32.28 1xrh s PRO 67 CO -0.08 -0.15 0.85 -1.21 0.04 0.00 0.00 177.00 176.45 1xrh s GLU 68 N -2.27 3.37 0.43 4.56 8.01 -1.26 -5.04 118.70 126.49 1xrh s GLU 68 Ca 0.56 -1.76 -0.23 0.00 0.01 0.00 0.00 54.97 53.54 1xrh s GLU 68 Cb -0.26 -4.51 -0.08 0.00 -4.31 0.00 0.00 34.13 24.96 1xrh s GLU 68 CO 0.33 -1.55 1.08 -0.06 0.01 0.00 0.00 175.26 175.08 1xrh s PHE 69 N 2.01 3.12 -0.18 1.61 0.40 -1.26 -4.53 117.98 119.15 1xrh s PHE 69 Ca 0.20 1.60 -0.05 0.00 -0.60 0.00 0.00 56.93 58.08 1xrh s PHE 69 Cb -0.14 -3.20 0.09 0.00 0.51 0.00 0.00 43.02 40.28 1xrh s PHE 69 CO -0.03 -0.91 0.34 0.50 0.70 0.00 0.00 175.22 175.82 1xrh s ARG 70 N -2.63 0.25 -0.46 0.44 3.52 -0.93 -4.99 118.95 114.16 1xrh s ARG 70 Ca 0.60 0.75 -0.18 0.00 -0.13 0.00 0.00 55.73 56.77 1xrh s ARG 70 Cb -0.23 -0.12 0.04 0.00 -1.56 0.00 0.00 34.95 33.08 1xrh s ARG 70 CO 0.29 -0.39 0.51 -1.17 -0.81 0.00 0.00 175.30 173.74 1xrh s LEU 71 N 2.51 4.99 -0.39 -0.88 2.96 -1.26 0.12 118.68 126.72 1xrh s LEU 71 Ca 0.03 -0.84 -0.18 0.00 -0.22 0.00 0.00 54.13 52.92 1xrh s LEU 71 Cb -0.13 -2.40 0.01 0.00 0.50 0.00 0.00 46.19 44.17 1xrh s LEU 71 CO -0.12 -0.72 0.51 -0.70 -1.32 0.00 0.00 176.35 174.01 1xrh s GLU 72 N 2.29 3.39 -0.77 1.98 2.12 0.59 -4.94 118.70 123.36 1xrh s GLU 72 Ca 0.13 -0.39 -0.22 0.00 0.36 0.00 0.00 54.97 54.85 1xrh s GLU 72 Cb -0.19 -3.88 0.08 0.00 0.26 0.00 0.00 34.13 30.40 1xrh s GLU 72 CO 0.12 -0.78 1.07 -1.21 -0.54 0.00 0.00 175.26 173.92 1xrh s GLU 73 N 2.40 3.28 0.42 4.30 2.02 -1.26 -1.14 118.70 128.72 1xrh s GLU 73 Ca 0.17 -1.06 0.23 0.00 0.02 0.00 0.00 54.97 54.33 1xrh s GLU 73 Cb -0.16 -4.50 0.31 0.00 0.10 0.00 0.00 34.13 29.88 1xrh s GLU 73 CO 0.15 -1.86 1.57 1.79 0.02 0.00 0.00 175.26 176.92 1xrh h THR 74 N 6.01 0.03 -2.56 3.63 1.35 -1.65 -3.48 112.91 116.24 1xrh h THR 74 Ca -0.13 -1.05 0.03 0.00 -0.55 0.00 0.00 66.41 64.71 1xrh h THR 74 Cb 1.05 1.99 -0.00 0.00 -1.73 0.00 0.00 68.15 69.46 1xrh h THR 74 CO 1.19 0.02 0.27 0.61 -0.25 0.00 0.00 175.52 177.36 1xrh n GLY 75 N 1.11 1.11 0.33 5.82 0.00 -0.78 -4.93 105.19 107.85 1xrh n GLY 75 Ca 0.04 -1.15 0.13 0.00 0.00 0.00 0.00 46.02 45.03 1xrh n GLY 75 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1xrh h PRO 76 N 0.00 0.17 0.00 1.61 0.11 -2.00 -3.12 132.00 128.77 1xrh h PRO 76 Ca -0.22 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.79 1xrh h PRO 76 Cb 0.87 -0.04 -0.19 0.00 0.11 0.00 0.00 31.00 31.75 1xrh h PRO 76 CO 0.29 0.11 -0.71 0.00 -0.21 0.00 0.00 178.00 177.48 1xrh s SER 78 N -2.08 -0.07 0.12 0.00 1.04 -1.18 0.27 113.70 111.80 1xrh s SER 78 Ca 0.26 0.12 -0.24 0.00 0.48 0.00 0.00 55.95 56.57 1xrh s SER 78 Cb 0.28 0.20 0.07 0.00 0.10 0.00 0.00 66.02 66.68 1xrh s SER 78 CO -0.09 -0.09 0.63 0.00 0.98 0.00 0.00 173.24 174.66 1xrh s ALA 79 N -0.20 -1.63 -0.08 5.32 0.00 -0.85 -1.58 121.76 122.74 1xrh s ALA 79 Ca -0.03 0.63 0.02 0.00 0.00 0.00 0.00 51.96 52.58 1xrh s ALA 79 Cb -0.02 0.75 0.01 0.00 0.00 0.00 0.00 23.12 23.86 1xrh s ALA 79 CO 0.00 -0.71 -0.15 0.42 0.00 0.00 0.00 175.76 175.32 1xrh s ILE 80 N -3.38 1.36 -0.31 0.00 1.01 -0.29 -1.49 121.20 118.09 1xrh s ILE 80 Ca -0.00 -0.60 -0.13 0.00 0.00 0.00 0.00 60.65 59.91 1xrh s ILE 80 Cb -0.01 -1.23 -0.03 0.00 0.01 0.00 0.00 42.46 41.20 1xrh s ILE 80 CO -0.10 0.41 0.26 -0.22 0.00 0.00 0.00 174.94 175.29 1xrh s LEU 81 N 0.66 4.30 -0.45 2.97 2.96 0.53 -0.30 118.68 129.36 1xrh s LEU 81 Ca -0.14 -0.19 -0.23 0.00 -0.22 0.00 0.00 54.13 53.34 1xrh s LEU 81 Cb -0.16 -2.19 0.02 0.00 0.50 0.00 0.00 46.19 44.36 1xrh s LEU 81 CO 0.04 -0.19 0.80 -1.00 -1.32 0.00 0.00 176.35 174.68 1xrh s HIS 82 N 1.82 2.99 -0.90 5.38 3.76 0.12 -0.88 115.29 127.58 1xrh s HIS 82 Ca 0.08 0.21 0.27 0.00 -0.15 0.00 0.00 55.06 55.47 1xrh s HIS 82 Cb -0.17 -3.68 0.85 0.00 1.11 0.00 0.00 32.58 30.70 1xrh s HIS 82 CO 0.11 -0.98 1.69 0.00 -0.85 0.00 0.00 174.74 174.70 1xrh n ALA 83 N 6.74 2.71 -2.69 -1.40 0.00 -0.05 -2.19 120.51 123.64 1xrh n ALA 83 Ca 0.03 -0.17 -0.16 0.00 0.00 0.00 0.00 53.44 53.14 1xrh n ALA 83 Cb 0.48 -1.34 -0.00 0.00 0.00 0.00 0.00 19.45 18.59 1xrh n ALA 83 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1xrh n ASP 84 N -1.72 -4.09 -1.28 0.00 4.64 -1.18 -0.71 116.55 112.21 1xrh n ASP 84 Ca 0.06 0.02 -0.14 0.00 -1.38 0.00 0.00 54.79 53.35 1xrh n ASP 84 Cb 0.37 -3.43 -0.04 0.00 -1.04 0.00 0.00 41.12 36.98 1xrh n ASP 84 CO 0.00 0.00 0.00 0.59 -0.82 0.00 0.00 177.20 176.97 1xrh n ASN 85 N -1.97 -4.49 -4.47 1.67 3.02 -0.01 -4.64 115.26 104.36 1xrh n ASN 85 Ca -0.12 0.19 -0.28 0.00 -0.03 0.00 0.00 54.58 54.34 1xrh n ASN 85 Cb 0.60 -3.39 0.24 0.00 -0.61 0.00 0.00 39.78 36.61 1xrh n ASN 85 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xrh s ALA 86 N -2.59 -0.19 0.15 5.41 0.00 0.11 -1.88 121.76 122.77 1xrh s ALA 86 Ca 0.00 -0.28 -0.33 0.00 0.00 0.00 0.00 51.96 51.35 1xrh s ALA 86 Cb 0.00 -3.18 -0.12 0.00 0.00 0.00 0.00 23.12 19.82 1xrh s ALA 86 CO 0.00 -3.67 1.71 0.00 0.00 0.00 0.00 175.76 173.80 1xrh n ALA 87 N -4.79 2.00 -0.20 0.00 0.00 -1.26 -2.16 120.51 114.09 1xrh n ALA 87 Ca 0.04 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.87 1xrh n ALA 87 Cb 0.56 -2.48 0.11 0.00 0.00 0.00 0.00 19.45 17.64 1xrh n ALA 87 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1xrh h GLY 88 N 7.12 0.83 0.61 0.00 0.00 -1.55 -1.28 103.07 108.79 1xrh h GLY 88 Ca -0.45 -0.09 0.09 0.00 0.00 0.00 0.00 47.33 46.88 1xrh h GLY 88 CO 0.93 -0.05 0.60 1.46 0.00 0.00 0.00 176.54 179.48 1xrh h GLN 89 N 0.36 0.99 0.23 4.80 7.50 -1.72 0.33 115.11 127.60 1xrh h GLN 89 Ca 0.31 -0.06 -0.01 0.00 0.50 0.00 0.00 58.65 59.39 1xrh h GLN 89 Cb 0.41 -0.22 0.00 0.00 0.05 0.00 0.00 27.48 27.72 1xrh h GLN 89 CO -0.34 0.66 -0.11 0.28 -1.50 0.00 0.00 178.83 177.82 1xrh h VAL 90 N 1.02 0.84 -0.22 -0.54 2.07 -1.66 -1.61 116.25 116.16 1xrh h VAL 90 Ca 0.44 -0.57 0.01 0.00 0.82 0.00 0.00 66.70 67.40 1xrh h VAL 90 Cb 0.31 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 1xrh h VAL 90 CO -0.22 0.12 0.13 0.00 0.02 0.00 0.00 177.57 177.62 1xrh h ALA 91 N 0.08 0.27 -0.83 1.67 0.00 -0.83 -2.73 119.26 116.88 1xrh h ALA 91 Ca -0.03 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1xrh h ALA 91 Cb 0.44 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 1xrh h ALA 91 CO 0.05 -0.28 0.48 0.00 0.00 0.00 0.00 179.25 179.50 1xrh h ALA 92 N 1.10 1.06 0.00 0.00 0.00 -0.98 -1.24 119.26 119.20 1xrh h ALA 92 Ca 0.09 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1xrh h ALA 92 Cb -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.45 1xrh h ALA 92 CO -0.04 0.55 0.00 1.17 0.00 0.00 0.00 179.25 180.93 1xrh n LYS 93 N -4.41 0.13 -0.80 0.00 4.81 -0.61 -4.57 118.16 112.71 1xrh n LYS 93 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.52 1xrh n LYS 93 Cb 0.08 -1.24 0.00 0.00 0.02 0.00 0.00 35.03 33.89 1xrh n LYS 93 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1xrh n GLY 95 N 0.67 -0.09 1.11 3.14 0.00 -0.47 -4.68 105.19 104.87 1xrh n GLY 95 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1xrh n GLY 95 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1xrh n GLU 97 N -0.63 0.00 -0.04 1.61 1.02 -1.26 -0.62 120.64 120.72 1xrh n GLU 97 Ca 0.00 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 56.98 1xrh n GLU 97 Cb 0.09 0.00 -0.07 0.00 -0.02 0.00 0.00 31.44 31.44 1xrh n GLU 97 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1xrh h HIS 98 N 0.00 0.82 -0.41 -0.32 2.76 -1.95 -2.52 115.15 113.52 1xrh h HIS 98 Ca 0.00 -0.34 0.08 0.00 -2.20 0.00 0.00 60.37 57.91 1xrh h HIS 98 Cb 0.00 -0.14 -0.07 0.00 1.55 0.00 0.00 27.41 28.76 1xrh h HIS 98 CO 0.00 1.12 -0.01 0.00 -1.30 0.00 0.00 177.93 177.74 1xrh h ALA 99 N 0.54 0.36 -0.53 5.26 0.00 -1.26 0.20 119.26 123.83 1xrh h ALA 99 Ca -0.02 0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.06 1xrh h ALA 99 Cb 1.15 0.22 -0.05 0.00 0.00 0.00 0.00 17.79 19.11 1xrh h ALA 99 CO 0.11 -0.40 0.27 0.82 0.00 0.00 0.00 179.25 180.05 1xrh h ILE 100 N 0.09 0.95 -0.47 0.00 2.04 -1.80 0.24 117.51 118.55 1xrh h ILE 100 Ca 0.20 -0.18 -0.00 0.00 1.00 0.00 0.00 64.86 65.88 1xrh h ILE 100 Cb 0.29 0.39 -0.02 0.00 -0.74 0.00 0.00 36.82 36.74 1xrh h ILE 100 CO -0.35 0.09 0.29 0.50 0.00 0.00 0.00 178.15 178.68 1xrh h LYS 101 N 0.52 0.63 0.42 2.37 3.64 -0.91 -0.86 116.57 122.39 1xrh h LYS 101 Ca 0.24 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.54 1xrh h LYS 101 Cb 0.15 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 1xrh h LYS 101 CO -0.17 0.46 -0.20 1.15 -2.27 0.00 0.00 179.45 178.42 1xrh h THR 102 N 0.63 0.59 0.00 1.00 2.02 0.10 -2.94 112.91 114.30 1xrh h THR 102 Ca 0.17 -0.04 -0.01 0.00 0.77 0.00 0.00 66.41 67.30 1xrh h THR 102 Cb -0.01 0.61 -0.00 0.00 -1.74 0.00 0.00 68.15 67.00 1xrh h THR 102 CO -0.03 0.01 -0.05 0.00 0.37 0.00 0.00 175.52 175.82 1xrh h ALA 103 N -0.02 1.12 -0.28 6.16 0.00 -0.42 0.20 119.26 126.02 1xrh h ALA 103 Ca -0.06 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 1xrh h ALA 103 Cb 0.45 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1xrh h ALA 103 CO 0.10 0.06 -0.26 0.37 0.00 0.00 0.00 179.25 179.52 1xrh h GLN 104 N 0.00 0.67 0.00 0.00 5.75 -0.98 0.41 115.11 120.96 1xrh h GLN 104 Ca -0.00 -0.35 -0.09 0.00 -0.15 0.00 0.00 58.65 58.07 1xrh h GLN 104 Cb 0.28 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.82 1xrh h GLN 104 CO 0.01 0.95 -0.51 0.37 -2.65 0.00 0.00 178.83 177.00 1xrh h GLN 105 N 0.40 0.00 -0.29 1.69 4.15 -1.39 -3.40 115.11 116.27 1xrh h GLN 105 Ca 0.05 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.47 1xrh h GLN 105 Cb 0.82 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.51 1xrh h GLN 105 CO 0.07 0.82 0.00 0.09 -1.93 0.00 0.00 178.83 177.88 1xrh n ASN 106 N -4.56 2.85 0.00 -0.69 3.02 0.68 -4.97 115.26 111.58 1xrh n ASN 106 Ca -0.17 -1.90 0.00 0.00 -0.03 0.00 0.00 54.58 52.48 1xrh n ASN 106 Cb 0.49 -0.19 0.00 0.00 -0.61 0.00 0.00 39.78 39.47 1xrh n ASN 106 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xrh n GLY 107 N 1.38 2.78 3.12 7.41 0.00 0.14 -4.95 105.19 115.07 1xrh n GLY 107 Ca 0.18 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.11 1xrh n GLY 107 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xrh s VAL 108 N -0.65 0.16 -0.28 1.61 1.01 -1.25 -0.51 120.40 120.49 1xrh s VAL 108 Ca 0.00 -1.33 -0.21 0.00 0.00 0.00 0.00 61.98 60.45 1xrh s VAL 108 Cb 0.00 -1.17 0.08 0.00 0.00 0.00 0.00 36.38 35.29 1xrh s VAL 108 CO 0.00 -0.73 0.72 0.00 0.00 0.00 0.00 175.10 175.09 1xrh s ALA 109 N -3.26 -1.84 -0.15 5.51 0.00 -0.44 -3.83 121.76 117.74 1xrh s ALA 109 Ca 0.01 2.22 -0.00 0.00 0.00 0.00 0.00 51.96 54.18 1xrh s ALA 109 Cb 0.03 -1.32 0.03 0.00 0.00 0.00 0.00 23.12 21.86 1xrh s ALA 109 CO -0.08 -0.36 -0.09 0.08 0.00 0.00 0.00 175.76 175.32 1xrh s VAL 110 N 0.99 1.27 -0.12 0.00 1.01 0.14 -0.87 120.40 122.82 1xrh s VAL 110 Ca -0.05 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.37 1xrh s VAL 110 Cb -0.05 -1.31 0.02 0.00 0.00 0.00 0.00 36.38 35.04 1xrh s VAL 110 CO -0.09 0.30 -0.10 -0.69 0.00 0.00 0.00 175.10 174.51 1xrh s VAL 111 N 1.59 1.20 0.11 2.92 1.01 -0.51 -2.00 120.40 124.71 1xrh s VAL 111 Ca 0.03 -0.41 -0.09 0.00 0.00 0.00 0.00 61.98 61.51 1xrh s VAL 111 Cb -0.14 -1.17 -0.06 0.00 0.00 0.00 0.00 36.38 35.01 1xrh s VAL 111 CO -0.09 0.39 0.41 -0.83 0.00 0.00 0.00 175.10 174.99 1xrh s GLY 112 N 1.53 2.32 -0.29 4.51 0.00 -0.56 -0.97 107.32 113.85 1xrh s GLY 112 Ca 0.03 -0.40 -0.01 0.00 0.00 0.00 0.00 44.72 44.33 1xrh s GLY 112 CO -0.07 -0.22 -0.02 -0.42 0.00 0.00 0.00 173.10 172.37 1xrh s ILE 113 N -1.50 2.93 -0.22 0.90 -1.09 0.87 -0.34 121.20 122.75 1xrh s ILE 113 Ca 0.36 -1.34 -0.05 0.00 -2.23 0.00 0.00 60.65 57.39 1xrh s ILE 113 Cb -0.13 -2.66 -0.02 0.00 -1.58 0.00 0.00 42.46 38.07 1xrh s ILE 113 CO 0.20 -0.06 0.01 -0.55 -1.23 0.00 0.00 174.94 173.31 1xrh s SER 114 N 1.26 4.79 -0.01 3.58 0.15 -0.05 -1.02 113.70 122.39 1xrh s SER 114 Ca -0.05 -0.24 -0.01 0.00 0.70 0.00 0.00 55.95 56.35 1xrh s SER 114 Cb -0.19 -1.83 0.00 0.00 -1.71 0.00 0.00 66.02 62.29 1xrh s SER 114 CO -0.02 0.02 0.02 0.54 1.20 0.00 0.00 173.24 175.00 1xrh n ARG 115 N 4.53 -2.20 -4.50 5.44 1.74 -0.70 -0.87 116.66 120.09 1xrh n ARG 115 Ca -0.17 1.89 -0.31 0.00 -0.77 0.00 0.00 57.85 58.49 1xrh n ARG 115 Cb 0.51 -2.39 -0.06 0.00 -1.02 0.00 0.00 32.46 29.50 1xrh n ARG 115 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1xrh s GLY 117 N -0.26 2.81 0.15 -0.13 0.00 -0.92 -0.83 107.32 108.14 1xrh s GLY 117 Ca -0.02 -0.75 -0.33 0.00 0.00 0.00 0.00 44.72 43.62 1xrh s GLY 117 CO 0.06 -2.12 1.06 1.57 0.00 0.00 0.00 173.10 173.67 1xrh n HIS 118 N -1.39 0.97 0.32 1.90 -0.00 -1.26 -3.34 115.22 112.42 1xrh n HIS 118 Ca -0.13 0.77 0.09 0.00 0.46 0.00 0.00 57.72 58.91 1xrh n HIS 118 Cb 0.66 -2.21 0.15 0.00 -0.12 0.00 0.00 29.99 28.47 1xrh n HIS 118 CO 0.00 0.00 0.00 -1.13 0.46 0.00 0.00 176.34 175.67 1xrh n SER 119 N 1.92 2.94 0.00 0.26 3.41 -1.26 -3.26 113.62 117.62 1xrh n SER 119 Ca 0.16 -1.86 0.00 0.00 -0.26 0.00 0.00 58.87 56.91 1xrh n SER 119 Cb 0.22 -0.16 0.00 0.00 -0.26 0.00 0.00 64.21 64.02 1xrh n SER 119 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xrh n GLY 120 N 1.08 -1.70 3.58 5.00 0.00 -1.26 -4.16 105.19 107.73 1xrh n GLY 120 Ca 0.14 -1.50 -0.41 0.00 0.00 0.00 0.00 46.02 44.25 1xrh n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xrh s ALA 121 N -1.24 2.61 -1.71 4.61 0.00 -1.26 -4.85 121.76 119.92 1xrh s ALA 121 Ca 0.00 0.01 0.10 0.00 0.00 0.00 0.00 51.96 52.07 1xrh s ALA 121 Cb 0.00 -4.11 0.55 0.00 0.00 0.00 0.00 23.12 19.55 1xrh s ALA 121 CO 0.00 -3.08 1.12 0.44 0.00 0.00 0.00 175.76 174.24 1xrh n ILE 122 N 7.40 0.39 0.24 0.00 -5.35 -1.26 -1.77 119.36 119.01 1xrh n ILE 122 Ca 0.23 0.10 0.10 0.00 -0.27 0.00 0.00 62.75 62.91 1xrh n ILE 122 Cb 0.49 -0.94 0.61 0.00 -1.74 0.00 0.00 39.64 38.05 1xrh n ILE 122 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 1xrh h SER 123 N 0.00 0.00 -0.64 7.28 0.02 -1.92 -2.85 113.55 115.44 1xrh h SER 123 Ca 0.00 0.00 0.05 0.00 -0.84 0.00 0.00 61.79 61.00 1xrh h SER 123 Cb 0.05 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.54 1xrh h SER 123 CO 0.00 0.18 0.36 0.22 -1.14 0.00 0.00 176.83 176.46 1xrh h TYR 124 N 0.00 0.67 -0.56 3.45 3.20 -1.74 0.33 116.97 122.32 1xrh h TYR 124 Ca -0.00 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 61.78 1xrh h TYR 124 Cb 0.46 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.50 1xrh h TYR 124 CO 0.00 0.34 -0.10 0.74 -1.64 0.00 0.00 178.16 177.51 1xrh h PHE 125 N 0.69 1.17 -0.00 -3.82 -1.00 -1.72 -2.10 116.94 110.16 1xrh h PHE 125 Ca 0.28 -0.24 -0.15 0.00 2.81 0.00 0.00 57.97 60.67 1xrh h PHE 125 Cb 0.13 -0.29 -0.02 0.00 3.61 0.00 0.00 35.95 39.38 1xrh h PHE 125 CO -0.07 1.07 -0.72 -0.39 -1.61 0.00 0.00 178.31 176.59 1xrh h VAL 126 N 0.93 1.51 -0.17 -0.55 -1.51 -1.54 -2.44 116.25 112.49 1xrh h VAL 126 Ca 0.15 -2.44 -0.02 0.00 -1.23 0.00 0.00 66.70 63.15 1xrh h VAL 126 Cb 0.67 2.32 -0.01 0.00 -2.13 0.00 0.00 31.29 32.14 1xrh h VAL 126 CO 0.05 0.70 0.00 -0.61 -1.23 0.00 0.00 177.57 176.48 1xrh h GLN 127 N 0.01 0.23 0.16 5.19 -0.00 -0.73 -2.09 115.11 117.89 1xrh h GLN 127 Ca -0.01 -0.03 -0.01 0.00 -0.00 0.00 0.00 58.65 58.60 1xrh h GLN 127 Cb 1.27 -0.04 0.00 0.00 0.00 0.00 0.00 27.48 28.71 1xrh h GLN 127 CO 0.09 0.26 -0.08 1.96 0.00 0.00 0.00 178.83 181.06 1xrh h GLN 128 N 0.23 -0.21 -0.42 1.69 4.20 -0.88 -1.11 115.11 118.62 1xrh h GLN 128 Ca 0.06 0.01 -0.05 0.00 0.06 0.00 0.00 58.65 58.73 1xrh h GLN 128 Cb 0.16 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.96 1xrh h GLN 128 CO 0.00 -0.13 0.04 0.00 -0.67 0.00 0.00 178.83 178.07 1xrh h ALA 129 N 0.62 1.28 -0.02 3.87 0.00 -1.44 -2.58 119.26 120.99 1xrh h ALA 129 Ca -0.02 -0.21 -0.14 0.00 0.00 0.00 0.00 54.91 54.54 1xrh h ALA 129 Cb 0.17 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1xrh h ALA 129 CO 0.04 0.49 -0.64 0.00 0.00 0.00 0.00 179.25 179.14 1xrh h ALA 130 N 1.42 0.88 -0.11 0.00 0.00 -1.16 -1.18 119.26 119.11 1xrh h ALA 130 Ca 0.14 -0.58 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 1xrh h ALA 130 Cb 0.33 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1xrh h ALA 130 CO 0.01 0.78 -0.00 0.00 0.00 0.00 0.00 179.25 180.03 1xrh h ARG 131 N 0.07 0.16 -0.02 0.00 3.08 -0.89 0.47 114.38 117.26 1xrh h ARG 131 Ca -0.01 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1xrh h ARG 131 Cb 1.15 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.16 1xrh h ARG 131 CO 0.09 0.18 0.00 0.00 -1.07 0.00 0.00 179.97 179.17 1xrh n ALA 132 N -2.51 2.57 -1.07 0.04 0.00 -0.60 -4.90 120.51 114.05 1xrh n ALA 132 Ca -0.01 -0.12 -0.02 0.00 0.00 0.00 0.00 53.44 53.29 1xrh n ALA 132 Cb 0.15 -1.20 -0.01 0.00 0.00 0.00 0.00 19.45 18.38 1xrh n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xrh n GLY 133 N 0.74 0.58 3.67 0.00 0.00 0.17 -5.05 105.19 105.29 1xrh n GLY 133 Ca 0.10 -0.67 -0.25 0.00 0.00 0.00 0.00 46.02 45.19 1xrh n GLY 133 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xrh s PHE 134 N -2.05 2.56 0.01 1.61 2.99 -0.55 -4.57 117.98 117.99 1xrh s PHE 134 Ca 0.00 -0.55 -0.23 0.00 0.00 0.00 0.00 56.93 56.15 1xrh s PHE 134 Cb 0.00 -1.74 -0.05 0.00 0.00 0.00 0.00 43.02 41.23 1xrh s PHE 134 CO 0.00 0.36 0.69 0.42 -0.00 0.00 0.00 175.22 176.69 1xrh s ILE 135 N -2.60 4.84 -0.03 0.64 1.01 0.09 -3.37 121.20 121.79 1xrh s ILE 135 Ca 0.37 1.46 0.05 0.00 0.00 0.00 0.00 60.65 62.53 1xrh s ILE 135 Cb 0.04 -4.03 -0.01 0.00 0.01 0.00 0.00 42.46 38.47 1xrh s ILE 135 CO 0.20 0.37 -0.18 -0.83 0.00 0.00 0.00 174.94 174.50 1xrh s GLY 136 N 0.00 0.94 0.04 6.18 0.00 0.27 -1.72 107.32 113.03 1xrh s GLY 136 Ca 0.35 -0.76 0.05 0.00 0.00 0.00 0.00 44.72 44.36 1xrh s GLY 136 CO 0.20 -0.52 -0.14 -0.42 0.00 0.00 0.00 173.10 172.22 1xrh s ILE 137 N -0.20 1.08 0.23 0.90 1.01 -0.51 -0.95 121.20 122.76 1xrh s ILE 137 Ca 0.02 -1.01 -0.18 0.00 0.00 0.00 0.00 60.65 59.48 1xrh s ILE 137 Cb -0.09 -0.99 0.02 0.00 0.01 0.00 0.00 42.46 41.41 1xrh s ILE 137 CO 0.01 -0.02 0.58 -0.55 0.00 0.00 0.00 174.94 174.96 1xrh s SER 138 N -1.17 -0.24 0.00 3.58 0.15 -0.74 -1.39 113.70 113.90 1xrh s SER 138 Ca 0.01 -0.59 0.00 0.00 0.70 0.00 0.00 55.95 56.07 1xrh s SER 138 Cb -0.08 0.63 0.00 0.00 -1.71 0.00 0.00 66.02 64.86 1xrh s SER 138 CO 0.01 -1.16 0.00 0.00 1.20 0.00 0.00 173.24 173.29 1xrh s GLN 141 N -2.00 2.77 0.18 0.00 -0.21 -1.03 -3.45 119.66 115.93 1xrh s GLN 141 Ca 0.00 0.67 -0.11 0.00 0.02 0.00 0.00 55.36 55.93 1xrh s GLN 141 Cb 0.00 -1.99 0.00 0.00 1.00 0.00 0.00 33.01 32.02 1xrh s GLN 141 CO 0.00 -1.14 0.37 0.45 -2.12 0.00 0.00 175.29 172.84 1xrh s SER 142 N -4.07 -0.05 -0.05 5.90 0.15 -1.26 -4.85 113.70 109.47 1xrh s SER 142 Ca 0.58 -0.79 -0.36 0.00 0.70 0.00 0.00 55.95 56.09 1xrh s SER 142 Cb -0.13 0.49 -0.14 0.00 -1.71 0.00 0.00 66.02 64.54 1xrh s SER 142 CO 0.54 -0.96 1.71 0.47 1.20 0.00 0.00 173.24 176.19 1xrh n ASP 143 N -0.27 2.90 -4.52 5.45 10.43 -1.26 -4.04 116.55 125.24 1xrh n ASP 143 Ca -0.07 1.04 -0.47 0.00 2.57 0.00 0.00 54.79 57.86 1xrh n ASP 143 Cb 0.63 -1.31 -0.02 0.00 1.84 0.00 0.00 41.12 42.25 1xrh n ASP 143 CO 0.00 0.00 0.00 -2.65 -1.07 0.00 0.00 177.20 173.48 1xrh n PRO 144 N 5.09 0.81 -1.47 -0.24 -0.02 -1.26 -4.28 135.00 133.63 1xrh n PRO 144 Ca 0.22 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 1xrh n PRO 144 Cb 0.24 -1.53 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 1xrh n PRO 144 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1xrh n VAL 146 N 0.28 -1.87 -3.03 -1.45 0.31 -0.71 -4.91 118.33 106.95 1xrh n VAL 146 Ca 0.13 0.86 -0.32 0.00 -0.01 0.00 0.00 64.34 65.01 1xrh n VAL 146 Cb 0.28 -1.15 -0.06 0.00 -0.91 0.00 0.00 33.84 32.01 1xrh n VAL 146 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 1xrh s VAL 147 N -2.15 4.66 1.03 2.52 -7.23 -1.09 -1.18 120.40 116.97 1xrh s VAL 147 Ca 0.00 0.96 -0.11 0.00 -1.81 0.00 0.00 61.98 61.02 1xrh s VAL 147 Cb 0.00 -3.63 0.21 0.00 0.56 0.00 0.00 36.38 33.52 1xrh s VAL 147 CO 0.00 -0.27 1.08 -2.84 -0.31 0.00 0.00 175.10 172.76 1xrh s PRO 148 N -3.18 0.12 0.20 4.82 0.02 -1.25 -4.54 135.00 131.19 1xrh s PRO 148 Ca 0.55 1.15 -0.32 0.00 0.02 0.00 0.00 61.00 62.40 1xrh s PRO 148 Cb -0.10 -1.65 -0.11 0.00 0.02 0.00 0.00 34.50 32.65 1xrh s PRO 148 CO 0.20 -3.12 1.68 0.12 -0.33 0.00 0.00 177.00 175.55 1xrh s PHE 149 N -2.59 2.94 -0.92 6.54 5.36 -1.26 -1.69 117.98 126.36 1xrh s PHE 149 Ca 0.67 0.44 0.00 0.00 -0.96 0.00 0.00 56.93 57.08 1xrh s PHE 149 Cb -0.23 -4.08 0.00 0.00 -0.34 0.00 0.00 43.02 38.37 1xrh s PHE 149 CO 0.61 -4.05 0.00 0.41 -1.46 0.00 0.00 175.22 170.73 1xrh n GLY 150 N 3.82 1.01 2.50 13.12 0.00 -1.26 -5.02 105.19 119.36 1xrh n GLY 150 Ca 0.15 -0.37 -0.21 0.00 0.00 0.00 0.00 46.02 45.59 1xrh n GLY 150 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xrh n GLY 151 N -1.38 3.50 0.00 -0.02 0.00 -0.68 -5.08 105.19 101.53 1xrh n GLY 151 Ca -0.09 -2.30 0.00 0.00 0.00 0.00 0.00 46.02 43.63 1xrh n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xrh n ALA 152 N -2.00 0.88 -2.54 4.61 0.00 -1.26 -4.40 120.51 115.80 1xrh n ALA 152 Ca -0.14 -0.40 -0.29 0.00 0.00 0.00 0.00 53.44 52.61 1xrh n ALA 152 Cb 0.43 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.78 1xrh n ALA 152 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1xrh s GLU 153 N -0.09 1.97 0.36 0.00 2.02 -1.26 -4.32 118.70 117.38 1xrh s GLU 153 Ca 0.00 -1.17 -0.19 0.00 0.02 0.00 0.00 54.97 53.63 1xrh s GLU 153 Cb 0.00 -2.18 -0.10 0.00 0.10 0.00 0.00 34.13 31.95 1xrh s GLU 153 CO 0.00 0.47 0.85 0.96 0.02 0.00 0.00 175.26 177.56 1xrh s ILE 154 N -1.36 4.49 0.00 -1.63 -4.36 -1.26 -3.93 121.20 113.15 1xrh s ILE 154 Ca 0.21 1.31 0.00 0.00 -0.26 0.00 0.00 60.65 61.92 1xrh s ILE 154 Cb -0.10 -3.67 0.00 0.00 1.25 0.00 0.00 42.46 39.94 1xrh s ILE 154 CO 0.13 -0.17 0.00 0.00 0.24 0.00 0.00 174.94 175.13 1xrh n TYR 155 N -0.29 0.00 -1.91 1.37 9.36 -0.33 -4.84 117.16 120.52 1xrh n TYR 155 Ca 0.04 0.00 -0.29 0.00 3.32 0.00 0.00 57.90 60.97 1xrh n TYR 155 Cb 0.53 0.13 0.07 0.00 -0.63 0.00 0.00 39.34 39.43 1xrh n TYR 155 CO 0.00 0.00 0.00 0.71 0.22 0.00 0.00 176.86 177.79 1xrh s TYR 156 N -0.28 3.13 0.46 2.98 4.12 -1.22 -2.31 117.35 124.23 1xrh s TYR 156 Ca 0.00 0.88 0.06 0.00 0.02 0.00 0.00 57.07 58.02 1xrh s TYR 156 Cb 0.00 -3.27 0.08 0.00 -1.52 0.00 0.00 41.96 37.25 1xrh s TYR 156 CO 0.00 -1.46 0.63 0.41 0.02 0.00 0.00 175.55 175.15 1xrh n GLY 157 N -3.14 1.68 0.30 0.71 0.00 -1.26 -1.74 105.19 101.74 1xrh n GLY 157 Ca 0.07 -2.16 0.00 0.00 0.00 0.00 0.00 46.02 43.93 1xrh n GLY 157 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xrh n THR 158 N -2.06 0.00 0.00 2.61 -2.24 -1.26 -4.81 114.28 106.52 1xrh n THR 158 Ca 0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 1xrh n THR 158 Cb 0.45 -0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.38 1xrh n THR 158 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1xrh n ASN 159 N -0.19 0.00 -4.90 3.42 5.03 -1.26 -2.48 115.26 114.88 1xrh n ASN 159 Ca 0.00 0.00 -0.29 0.00 0.87 0.00 0.00 54.58 55.16 1xrh n ASN 159 Cb 0.15 0.00 0.02 0.00 -1.02 0.00 0.00 39.78 38.93 1xrh n ASN 159 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 1xrh s PRO 160 N 0.00 3.25 -0.06 3.52 0.05 -1.22 -3.45 135.00 137.08 1xrh s PRO 160 Ca 0.00 0.33 -0.04 0.00 0.05 0.00 0.00 61.00 61.34 1xrh s PRO 160 Cb 0.00 -2.20 0.02 0.00 0.05 0.00 0.00 34.50 32.37 1xrh s PRO 160 CO 0.00 -0.60 0.14 -1.17 0.05 0.00 0.00 177.00 175.42 1xrh s LEU 161 N -5.05 1.16 0.21 -3.56 2.96 -1.26 -2.64 118.68 110.50 1xrh s LEU 161 Ca 0.53 0.29 0.01 0.00 -0.22 0.00 0.00 54.13 54.75 1xrh s LEU 161 Cb -0.11 0.44 -0.05 0.00 0.50 0.00 0.00 46.19 46.97 1xrh s LEU 161 CO 0.49 -0.09 0.05 0.00 -1.32 0.00 0.00 176.35 175.48 1xrh s ALA 162 N 0.53 1.50 -0.22 5.97 0.00 0.29 -4.57 121.76 125.26 1xrh s ALA 162 Ca -0.04 -1.72 -0.26 0.00 0.00 0.00 0.00 51.96 49.95 1xrh s ALA 162 Cb -0.05 0.82 0.07 0.00 0.00 0.00 0.00 23.12 23.96 1xrh s ALA 162 CO -0.02 -0.40 0.70 0.12 0.00 0.00 0.00 175.76 176.15 1xrh s PHE 163 N -3.74 -0.75 -0.02 0.00 5.36 -0.18 -1.79 117.98 116.87 1xrh s PHE 163 Ca 0.31 1.72 -0.20 0.00 -0.96 0.00 0.00 56.93 57.80 1xrh s PHE 163 Cb 0.07 0.29 0.04 0.00 -0.34 0.00 0.00 43.02 43.08 1xrh s PHE 163 CO 0.09 -0.42 0.42 0.00 -1.46 0.00 0.00 175.22 173.84 1xrh s ALA 164 N 0.03 -1.07 -0.05 11.12 0.00 -0.12 0.08 121.76 131.74 1xrh s ALA 164 Ca -0.02 0.61 -0.07 0.00 0.00 0.00 0.00 51.96 52.47 1xrh s ALA 164 Cb -0.04 0.06 0.01 0.00 0.00 0.00 0.00 23.12 23.16 1xrh s ALA 164 CO 0.03 -0.30 0.18 0.00 0.00 0.00 0.00 175.76 175.68 1xrh s ALA 165 N -1.32 -0.45 0.15 0.00 0.00 -0.65 -0.56 121.76 118.93 1xrh s ALA 165 Ca -0.13 0.36 -0.30 0.00 0.00 0.00 0.00 51.96 51.90 1xrh s ALA 165 Cb -0.04 -0.19 -0.07 0.00 0.00 0.00 0.00 23.12 22.82 1xrh s ALA 165 CO 0.06 -0.13 1.06 -1.25 0.00 0.00 0.00 175.76 175.50 1xrh s PRO 166 N -0.34 4.62 0.00 0.00 0.04 -1.26 -1.54 135.00 136.52 1xrh s PRO 166 Ca -0.04 1.64 0.00 0.00 0.04 0.00 0.00 61.00 62.63 1xrh s PRO 166 Cb -0.03 -3.31 0.00 0.00 0.04 0.00 0.00 34.50 31.20 1xrh s PRO 166 CO 0.01 0.10 0.00 0.41 0.04 0.00 0.00 177.00 177.56 1xrh n GLY 167 N 2.18 4.24 3.80 0.56 0.00 -0.53 -4.22 105.19 111.21 1xrh n GLY 167 Ca 0.03 -2.03 -0.33 0.00 0.00 0.00 0.00 46.02 43.69 1xrh n GLY 167 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xrh s GLU 168 N 2.26 3.44 7.47 1.61 2.02 -1.15 -4.57 118.70 129.77 1xrh s GLU 168 Ca 0.00 1.31 0.00 0.00 0.02 0.00 0.00 54.97 56.30 1xrh s GLU 168 Cb 0.00 -2.04 0.00 0.00 0.10 0.00 0.00 34.13 32.19 1xrh s GLU 168 CO 0.00 -0.73 0.00 0.41 0.02 0.00 0.00 175.26 174.96 1xrh n GLY 169 N -0.59 2.75 1.01 -1.39 0.00 -1.26 -1.44 105.19 104.27 1xrh n GLY 169 Ca 0.09 -0.25 0.10 0.00 0.00 0.00 0.00 46.02 45.96 1xrh n GLY 169 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1xrh n ASP 170 N 5.84 3.24 -4.77 1.61 3.85 -1.26 -4.99 116.55 120.07 1xrh n ASP 170 Ca 0.00 -1.93 -0.40 0.00 -0.71 0.00 0.00 54.79 51.75 1xrh n ASP 170 Cb 0.00 -0.23 0.00 0.00 -1.35 0.00 0.00 41.12 39.54 1xrh n ASP 170 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 1xrh s GLU 171 N -1.33 3.96 -0.05 0.11 2.02 -0.52 -4.95 118.70 117.94 1xrh s GLU 171 Ca 0.34 2.31 -0.03 0.00 0.02 0.00 0.00 54.97 57.61 1xrh s GLU 171 Cb 0.20 -2.80 0.02 0.00 0.10 0.00 0.00 34.13 31.65 1xrh s GLU 171 CO 0.27 -0.56 0.11 0.42 0.02 0.00 0.00 175.26 175.53 1xrh s ILE 172 N -1.20 -0.02 -0.42 -1.63 1.01 -1.26 -1.45 121.20 116.22 1xrh s ILE 172 Ca 0.56 0.08 -0.15 0.00 0.00 0.00 0.00 60.65 61.15 1xrh s ILE 172 Cb -0.41 -0.18 0.03 0.00 0.01 0.00 0.00 42.46 41.91 1xrh s ILE 172 CO 0.54 0.03 0.31 -0.22 0.00 0.00 0.00 174.94 175.60 1xrh s LEU 173 N 0.53 5.15 -0.18 2.97 2.96 -0.59 -4.95 118.68 124.59 1xrh s LEU 173 Ca -0.04 -0.96 -0.02 0.00 -0.22 0.00 0.00 54.13 52.89 1xrh s LEU 173 Cb -0.06 -2.16 -0.01 0.00 0.50 0.00 0.00 46.19 44.47 1xrh s LEU 173 CO -0.02 -0.47 -0.09 -0.89 -1.32 0.00 0.00 176.35 173.56 1xrh s THR 174 N 1.67 3.14 -0.10 3.68 2.01 -1.26 -1.63 115.64 123.15 1xrh s THR 174 Ca 0.05 -0.60 0.04 0.00 0.31 0.00 0.00 61.69 61.49 1xrh s THR 174 Cb -0.20 -2.38 0.00 0.00 0.01 0.00 0.00 72.50 69.94 1xrh s THR 174 CO 0.09 0.48 -0.22 0.12 -0.69 0.00 0.00 174.62 174.40 1xrh s PHE 175 N 0.99 2.40 0.31 4.92 5.36 0.11 -3.66 117.98 128.41 1xrh s PHE 175 Ca -0.01 -1.00 0.03 0.00 -0.96 0.00 0.00 56.93 54.99 1xrh s PHE 175 Cb -0.15 -1.62 -0.04 0.00 -0.34 0.00 0.00 43.02 40.87 1xrh s PHE 175 CO -0.01 -0.42 0.14 0.34 -1.46 0.00 0.00 175.22 173.81 1xrh s ASP 176 N 0.44 1.68 0.32 6.13 3.68 -1.26 -1.01 116.67 126.64 1xrh s ASP 176 Ca -0.17 -1.53 0.10 0.00 2.13 0.00 0.00 52.55 53.08 1xrh s ASP 176 Cb -0.17 0.33 -0.05 0.00 -1.45 0.00 0.00 42.92 41.57 1xrh s ASP 176 CO 0.07 -0.85 -0.09 0.00 0.13 0.00 0.00 175.17 174.44 1xrh s ALA 178 N -3.57 2.99 -2.19 3.66 0.00 -1.26 -5.03 121.76 116.36 1xrh s ALA 178 Ca 0.35 -1.94 0.27 0.00 0.00 0.00 0.00 51.96 50.63 1xrh s ALA 178 Cb 0.05 -0.28 0.86 0.00 0.00 0.00 0.00 23.12 23.75 1xrh s ALA 178 CO 0.16 0.16 1.63 0.25 0.00 0.00 0.00 175.76 177.96 1xrh n THR 179 N -0.80 0.00 -4.00 0.00 -2.24 -1.03 -4.88 114.28 101.33 1xrh n THR 179 Ca -0.05 -0.21 -0.21 0.00 -2.27 0.00 0.00 64.05 61.31 1xrh n THR 179 Cb 0.62 0.52 -0.03 0.00 -2.10 0.00 0.00 70.33 69.34 1xrh n THR 179 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1xrh s THR 180 N -2.23 4.93 0.28 4.28 -4.23 -1.26 -0.42 115.64 116.99 1xrh s THR 180 Ca 0.31 -1.13 -0.02 0.00 -1.18 0.00 0.00 61.69 59.67 1xrh s THR 180 Cb 0.20 -3.69 0.17 0.00 1.34 0.00 0.00 72.50 70.53 1xrh s THR 180 CO 0.42 -0.33 1.85 0.58 -0.54 0.00 0.00 174.62 176.60 1xrh h VAL 181 N 1.26 1.22 -3.96 2.29 2.07 -1.76 -3.41 116.25 113.97 1xrh h VAL 181 Ca -0.51 -0.74 -0.12 0.00 0.82 0.00 0.00 66.70 66.16 1xrh h VAL 181 Cb 1.23 0.52 -0.11 0.00 -1.52 0.00 0.00 31.29 31.41 1xrh h VAL 181 CO 0.61 0.29 -0.29 -1.58 0.02 0.00 0.00 177.57 176.61 1xrh s GLN 182 N -5.37 1.40 0.18 1.57 2.00 -1.26 -5.02 119.66 113.16 1xrh s GLN 182 Ca -0.10 -1.35 -0.08 0.00 -2.00 0.00 0.00 55.36 51.82 1xrh s GLN 182 Cb 0.16 0.40 -0.07 0.00 0.80 0.00 0.00 33.01 34.30 1xrh s GLN 182 CO 0.80 -0.54 0.48 0.00 -0.50 0.00 0.00 175.29 175.53 1xrh s ALA 183 N -4.05 3.66 0.47 1.58 0.00 -1.26 -4.95 121.76 117.20 1xrh s ALA 183 Ca 0.27 -0.37 0.14 0.00 0.00 0.00 0.00 51.96 52.00 1xrh s ALA 183 Cb 0.02 -2.32 1.10 0.00 0.00 0.00 0.00 23.12 21.91 1xrh s ALA 183 CO 0.09 0.56 2.07 2.35 0.00 0.00 0.00 175.76 180.83 1xrh h TRP 184 N 2.81 0.26 -0.35 0.00 2.91 -2.02 -1.76 115.95 117.81 1xrh h TRP 184 Ca -0.47 0.01 0.06 0.00 1.13 0.00 0.00 58.89 59.62 1xrh h TRP 184 Cb 1.17 -0.09 -0.02 0.00 -0.51 0.00 0.00 29.16 29.72 1xrh h TRP 184 CO 0.62 0.15 0.24 0.78 -1.03 0.00 0.00 178.44 179.20 1xrh h GLY 185 N 0.27 0.28 2.00 2.65 0.00 -1.99 0.58 103.07 106.86 1xrh h GLY 185 Ca 0.14 -0.09 -0.13 0.00 0.00 0.00 0.00 47.33 47.25 1xrh h GLY 185 CO -0.03 0.07 -0.60 0.50 0.00 0.00 0.00 176.54 176.48 1xrh h LYS 186 N 0.23 0.00 -0.01 4.80 1.79 -1.72 -0.54 116.57 121.11 1xrh h LYS 186 Ca 0.16 0.00 -0.20 0.00 -2.18 0.00 0.00 60.65 58.42 1xrh h LYS 186 Cb 0.33 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.97 1xrh h LYS 186 CO -0.03 0.60 -0.87 0.28 -1.08 0.00 0.00 179.45 178.36 1xrh h VAL 187 N 0.00 1.44 -0.16 0.50 2.07 -0.99 -1.48 116.25 117.63 1xrh h VAL 187 Ca -0.01 -2.46 -0.17 0.00 0.82 0.00 0.00 66.70 64.88 1xrh h VAL 187 Cb 1.12 2.38 -0.01 0.00 -1.52 0.00 0.00 31.29 33.26 1xrh h VAL 187 CO 0.08 0.73 -0.59 -0.07 0.02 0.00 0.00 177.57 177.74 1xrh h LEU 188 N 0.18 0.59 0.37 2.57 3.38 -0.89 -2.25 115.31 119.26 1xrh h LEU 188 Ca -0.05 -0.33 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 1xrh h LEU 188 Cb 1.48 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 42.07 1xrh h LEU 188 CO 0.14 1.05 -0.18 0.44 0.09 0.00 0.00 178.44 179.98 1xrh h ASP 189 N 0.39 -0.42 -0.94 -0.43 3.45 -1.03 -2.21 116.42 115.24 1xrh h ASP 189 Ca -0.00 -0.08 0.21 0.00 0.43 0.00 0.00 57.03 57.58 1xrh h ASP 189 Cb 1.14 0.11 -0.12 0.00 -0.56 0.00 0.00 39.33 39.90 1xrh h ASP 189 CO 0.11 -0.17 0.50 0.00 -1.57 0.00 0.00 179.24 178.11 1xrh h ALA 190 N -0.10 1.54 -0.14 3.45 0.00 -1.29 0.14 119.26 122.87 1xrh h ALA 190 Ca -0.05 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1xrh h ALA 190 Cb 0.48 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1xrh h ALA 190 CO 0.08 -0.22 0.06 0.00 0.00 0.00 0.00 179.25 179.18 1xrh h ARG 191 N 0.56 0.20 -0.15 0.00 3.08 -1.05 -1.56 114.38 115.46 1xrh h ARG 191 Ca 0.57 -0.03 -0.15 0.00 0.07 0.00 0.00 59.98 60.44 1xrh h ARG 191 Cb 0.99 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.00 1xrh h ARG 191 CO -0.45 0.25 -0.53 0.66 -1.07 0.00 0.00 179.97 178.83 1xrh h SER 192 N 0.09 0.47 -0.14 7.04 4.64 -0.59 -2.21 113.55 122.86 1xrh h SER 192 Ca 0.05 -0.24 -0.00 0.00 -0.47 0.00 0.00 61.79 61.12 1xrh h SER 192 Cb 0.12 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 62.08 1xrh h SER 192 CO -0.01 0.91 0.00 0.54 -0.87 0.00 0.00 176.83 177.41 1xrh n ARG 193 N -3.95 1.92 -0.87 4.77 1.74 0.35 -5.12 116.66 115.50 1xrh n ARG 193 Ca -0.03 -0.74 0.00 0.00 -0.77 0.00 0.00 57.85 56.31 1xrh n ARG 193 Cb 0.58 -1.68 0.00 0.00 -1.02 0.00 0.00 32.46 30.34 1xrh n ARG 193 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1xrh n ASN 194 N 0.15 -1.19 -4.81 0.55 5.15 -0.60 -4.97 115.26 109.54 1xrh n ASN 194 Ca 0.07 0.09 -0.22 0.00 -0.60 0.00 0.00 54.58 53.92 1xrh n ASN 194 Cb 0.48 -0.27 -0.05 0.00 -0.53 0.00 0.00 39.78 39.41 1xrh n ASN 194 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1xrh s SER 196 N -0.13 5.08 0.12 1.20 0.15 -1.26 -5.05 113.70 113.81 1xrh s SER 196 Ca 0.00 -0.57 0.04 0.00 0.70 0.00 0.00 55.95 56.11 1xrh s SER 196 Cb 0.00 -0.92 -0.04 0.00 -1.71 0.00 0.00 66.02 63.35 1xrh s SER 196 CO 0.00 -0.30 -0.09 0.27 1.20 0.00 0.00 173.24 174.31 1xrh s ILE 197 N -2.33 0.99 0.38 6.45 -4.36 0.12 -4.98 121.20 117.47 1xrh s ILE 197 Ca 0.39 -1.90 -0.27 0.00 -0.26 0.00 0.00 60.65 58.62 1xrh s ILE 197 Cb -0.05 -1.65 -0.11 0.00 1.25 0.00 0.00 42.46 41.90 1xrh s ILE 197 CO 0.25 -0.71 1.27 -2.65 0.24 0.00 0.00 174.94 173.34 1xrh n PRO 198 N 0.08 2.02 0.00 0.37 -0.02 -1.26 -4.31 135.00 131.87 1xrh n PRO 198 Ca -0.13 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1xrh n PRO 198 Cb 0.60 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 1xrh n PRO 198 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1xrh n ASP 199 N 0.48 0.37 0.00 2.55 5.75 -1.26 -2.69 116.55 121.75 1xrh n ASP 199 Ca 0.06 -0.75 0.00 0.00 -0.01 0.00 0.00 54.79 54.08 1xrh n ASP 199 Cb 0.38 -0.18 0.00 0.00 -1.03 0.00 0.00 41.12 40.28 1xrh n ASP 199 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1xrh n THR 200 N 0.30 0.00 0.06 2.12 -2.24 -1.26 -4.74 114.28 108.51 1xrh n THR 200 Ca 0.00 -0.22 -0.03 0.00 -2.27 0.00 0.00 64.05 61.53 1xrh n THR 200 Cb 0.09 0.74 -0.01 0.00 -2.10 0.00 0.00 70.33 69.05 1xrh n THR 200 CO 0.00 0.00 0.00 -0.50 -0.57 0.00 0.00 175.07 174.00 1xrh h TRP 201 N 0.00 -0.18 -2.57 4.78 4.06 -1.85 -3.45 115.95 116.75 1xrh h TRP 201 Ca 0.00 -0.00 -0.51 0.00 2.06 0.00 0.00 58.89 60.44 1xrh h TRP 201 Cb 0.00 0.06 -0.14 0.00 -1.00 0.00 0.00 29.16 28.08 1xrh h TRP 201 CO 0.00 -0.11 -0.65 0.00 -3.56 0.00 0.00 178.44 174.12 1xrh s ALA 202 N -3.32 2.45 0.25 1.49 0.00 -1.26 -2.05 121.76 119.33 1xrh s ALA 202 Ca -0.03 -1.98 0.11 0.00 0.00 0.00 0.00 51.96 50.06 1xrh s ALA 202 Cb 0.00 0.28 -0.05 0.00 0.00 0.00 0.00 23.12 23.36 1xrh s ALA 202 CO 0.08 -0.12 -0.18 0.08 0.00 0.00 0.00 175.76 175.62 1xrh s VAL 203 N -3.03 2.59 0.07 0.00 1.01 0.16 -2.29 120.40 118.91 1xrh s VAL 203 Ca 0.32 -2.23 0.00 0.00 0.00 0.00 0.00 61.98 60.07 1xrh s VAL 203 Cb 0.05 -2.33 0.01 0.00 0.00 0.00 0.00 36.38 34.12 1xrh s VAL 203 CO 0.13 -0.32 0.10 -0.90 0.00 0.00 0.00 175.10 174.12 1xrh n ASP 204 N -0.41 0.14 0.26 3.32 5.68 -0.24 0.32 116.55 125.62 1xrh n ASP 204 Ca -0.07 -1.12 0.13 0.00 -0.50 0.00 0.00 54.79 53.24 1xrh n ASP 204 Cb 0.59 -0.06 0.81 0.00 -1.14 0.00 0.00 41.12 41.31 1xrh n ASP 204 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 1xrh h LYS 205 N 0.00 0.00 -0.36 0.11 2.10 -1.88 -0.95 116.57 115.60 1xrh h LYS 205 Ca -0.03 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.62 1xrh h LYS 205 Cb 0.12 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.45 1xrh h LYS 205 CO 0.04 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.58 1xrh n ASN 206 N -4.09 2.94 -0.20 7.07 5.03 -1.26 -4.71 115.26 120.05 1xrh n ASN 206 Ca -0.02 -1.92 0.00 0.00 0.87 0.00 0.00 54.58 53.51 1xrh n ASN 206 Cb 0.14 -0.23 0.00 0.00 -1.02 0.00 0.00 39.78 38.67 1xrh n ASN 206 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1xrh n GLY 207 N 1.40 0.64 3.34 7.41 0.00 -0.36 -4.61 105.19 113.02 1xrh n GLY 207 Ca 0.18 -0.78 -0.32 0.00 0.00 0.00 0.00 46.02 45.11 1xrh n GLY 207 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xrh s VAL 208 N -2.40 2.47 0.26 1.61 1.01 -1.26 -4.83 120.40 117.25 1xrh s VAL 208 Ca 0.00 -0.92 -0.30 0.00 0.00 0.00 0.00 61.98 60.76 1xrh s VAL 208 Cb 0.00 -1.93 -0.10 0.00 0.00 0.00 0.00 36.38 34.35 1xrh s VAL 208 CO 0.00 0.57 1.38 -2.16 0.00 0.00 0.00 175.10 174.90 1xrh s PRO 209 N -0.31 4.31 0.15 2.72 0.04 -1.26 -1.08 135.00 139.57 1xrh s PRO 209 Ca 0.01 2.23 0.06 0.00 0.04 0.00 0.00 61.00 63.34 1xrh s PRO 209 Cb -0.13 -3.12 -0.04 0.00 0.04 0.00 0.00 34.50 31.25 1xrh s PRO 209 CO 0.02 -0.34 -0.13 0.95 0.04 0.00 0.00 177.00 177.55 1xrh s THR 210 N -0.23 1.37 -2.40 1.26 -4.23 -0.97 -4.92 115.64 105.53 1xrh s THR 210 Ca 0.56 -1.92 0.23 0.00 -1.18 0.00 0.00 61.69 59.38 1xrh s THR 210 Cb -0.40 -1.73 0.07 0.00 1.34 0.00 0.00 72.50 71.78 1xrh s THR 210 CO 0.44 -0.55 1.14 0.35 -0.54 0.00 0.00 174.62 175.47 1xrh n THR 211 N 0.14 0.00 -3.60 3.99 -2.24 -1.26 -4.49 114.28 106.81 1xrh n THR 211 Ca -0.12 -0.37 -0.39 0.00 -2.27 0.00 0.00 64.05 60.90 1xrh n THR 211 Cb 0.59 1.36 -0.11 0.00 -2.10 0.00 0.00 70.33 70.06 1xrh n THR 211 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1xrh s ASP 212 N -2.23 5.79 0.55 3.42 3.68 -1.26 -0.70 116.67 125.91 1xrh s ASP 212 Ca 0.22 -0.42 0.26 0.00 2.13 0.00 0.00 52.55 54.74 1xrh s ASP 212 Cb 0.19 -2.07 1.58 0.00 -1.45 0.00 0.00 42.92 41.17 1xrh s ASP 212 CO 0.45 -0.19 2.17 1.55 0.13 0.00 0.00 175.17 179.28 1xrh h PRO 213 N 8.40 0.00 -0.23 4.34 0.13 -1.91 -2.69 132.00 140.05 1xrh h PRO 213 Ca -0.32 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.65 1xrh h PRO 213 Cb 1.16 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 1xrh h PRO 213 CO 0.61 0.05 -0.51 0.74 -0.23 0.00 0.00 178.00 178.66 1xrh h PHE 214 N 0.00 0.80 0.00 1.56 -1.00 -1.93 -2.66 116.94 113.71 1xrh h PHE 214 Ca -0.00 -0.27 0.00 0.00 2.81 0.00 0.00 57.97 60.51 1xrh h PHE 214 Cb 0.12 -0.16 0.00 0.00 3.61 0.00 0.00 35.95 39.52 1xrh h PHE 214 CO 0.00 1.02 0.00 0.00 -1.61 0.00 0.00 178.31 177.72 1xrh n ALA 215 N -2.53 2.60 -2.08 2.45 0.00 -1.02 -4.84 120.51 115.10 1xrh n ALA 215 Ca -0.03 -0.19 -0.41 0.00 0.00 0.00 0.00 53.44 52.81 1xrh n ALA 215 Cb 0.59 -1.48 -0.04 0.00 0.00 0.00 0.00 19.45 18.52 1xrh n ALA 215 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1xrh s VAL 216 N -2.00 3.85 -0.00 0.00 1.01 -1.01 -4.16 120.40 118.09 1xrh s VAL 216 Ca 0.44 1.58 0.01 0.00 0.00 0.00 0.00 61.98 64.01 1xrh s VAL 216 Cb 0.20 -4.01 -0.01 0.00 0.00 0.00 0.00 36.38 32.56 1xrh s VAL 216 CO 0.34 0.27 0.01 1.57 0.00 0.00 0.00 175.10 177.29 1xrh n HIS 217 N 2.44 0.00 -3.54 5.22 -0.00 0.15 -4.94 115.22 114.55 1xrh n HIS 217 Ca 0.03 0.00 -0.11 0.00 0.46 0.00 0.00 57.72 58.10 1xrh n HIS 217 Cb 0.46 -0.02 -0.03 0.00 -0.12 0.00 0.00 29.99 30.28 1xrh n HIS 217 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1xrh s ALA 218 N -2.03 -1.39 0.56 1.57 0.00 -0.52 -4.98 121.76 114.98 1xrh s ALA 218 Ca -0.00 0.24 -0.04 0.00 0.00 0.00 0.00 51.96 52.16 1xrh s ALA 218 Cb 0.00 0.86 0.01 0.00 0.00 0.00 0.00 23.12 23.99 1xrh s ALA 218 CO 0.02 -0.79 0.84 -0.51 0.00 0.00 0.00 175.76 175.32 1xrh s LEU 219 N -2.79 3.29 0.02 0.00 1.43 -1.26 0.36 118.68 119.74 1xrh s LEU 219 Ca 0.03 0.49 0.03 0.00 -1.03 0.00 0.00 54.13 53.65 1xrh s LEU 219 Cb -0.01 -3.32 -0.04 0.00 0.03 0.00 0.00 46.19 42.85 1xrh s LEU 219 CO -0.09 -1.04 -0.02 -0.76 0.23 0.00 0.00 176.35 174.67 1xrh s LEU 220 N -4.88 3.40 0.36 1.79 1.43 -0.87 -2.66 118.68 117.24 1xrh s LEU 220 Ca 0.54 -0.10 -0.26 0.00 -1.03 0.00 0.00 54.13 53.28 1xrh s LEU 220 Cb -0.10 -2.00 -0.09 0.00 0.03 0.00 0.00 46.19 44.02 1xrh s LEU 220 CO 0.42 0.25 1.05 -2.16 0.23 0.00 0.00 176.35 176.15 1xrh s PRO 221 N -1.72 4.35 0.40 1.29 0.04 -1.26 -2.80 135.00 135.29 1xrh s PRO 221 Ca 0.20 1.58 -0.26 0.00 0.04 0.00 0.00 61.00 62.56 1xrh s PRO 221 Cb -0.11 -2.76 -0.09 0.00 0.04 0.00 0.00 34.50 31.58 1xrh s PRO 221 CO 0.12 0.01 1.24 0.00 0.04 0.00 0.00 177.00 178.40 1xrh s ALA 222 N -1.50 3.23 -1.49 8.56 0.00 0.43 -3.08 121.76 127.91 1xrh s ALA 222 Ca 0.53 1.10 -0.05 0.00 0.00 0.00 0.00 51.96 53.54 1xrh s ALA 222 Cb -0.25 -3.43 0.04 0.00 0.00 0.00 0.00 23.12 19.48 1xrh s ALA 222 CO 0.31 -0.66 0.54 0.00 0.00 0.00 0.00 175.76 175.95 1xrh n ALA 223 N 0.17 -1.78 -0.31 0.00 0.00 -1.26 -0.57 120.51 116.76 1xrh n ALA 223 Ca 0.04 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1xrh n ALA 223 Cb 0.45 -2.16 0.00 0.00 0.00 0.00 0.00 19.45 17.74 1xrh n ALA 223 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xrh n GLY 224 N -1.83 2.81 0.32 0.00 0.00 -1.18 -1.45 105.19 103.87 1xrh n GLY 224 Ca -0.19 0.28 0.19 0.00 0.00 0.00 0.00 46.02 46.29 1xrh n GLY 224 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1xrh h PRO 225 N 0.00 0.00 -0.17 1.61 0.11 -1.90 -2.78 132.00 128.86 1xrh h PRO 225 Ca 0.00 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.03 1xrh h PRO 225 Cb 0.00 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.11 1xrh h PRO 225 CO 0.00 0.00 -0.19 0.87 -0.21 0.00 0.00 178.00 178.47 1xrh h LYS 226 N 0.00 0.43 -0.07 1.05 1.57 -1.45 -1.83 116.57 116.27 1xrh h LYS 226 Ca 0.01 -0.23 -0.11 0.00 -1.87 0.00 0.00 60.65 58.44 1xrh h LYS 226 Cb 0.08 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 1xrh h LYS 226 CO -0.00 0.80 -0.47 0.78 -0.57 0.00 0.00 179.45 179.99 1xrh h GLY 227 N 0.08 0.19 0.52 3.86 0.00 -0.59 -1.89 103.07 105.25 1xrh h GLY 227 Ca 0.03 -0.19 0.01 0.00 0.00 0.00 0.00 47.33 47.17 1xrh h GLY 227 CO 0.05 0.18 -0.32 -1.82 0.00 0.00 0.00 176.54 174.63 1xrh h TYR 228 N 0.14 -0.85 -0.91 5.60 3.20 -1.46 -2.59 116.97 120.09 1xrh h TYR 228 Ca 0.01 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 1xrh h TYR 228 Cb 0.89 0.35 -0.04 0.00 1.54 0.00 0.00 36.73 39.47 1xrh h TYR 228 CO 0.01 -0.43 0.54 0.78 -1.64 0.00 0.00 178.16 177.42 1xrh h GLY 229 N -0.58 1.32 -6.17 1.82 0.00 -1.00 -3.50 103.07 94.95 1xrh h GLY 229 Ca 0.01 -0.55 -0.58 0.00 0.00 0.00 0.00 47.33 46.21 1xrh h GLY 229 CO -0.14 0.53 1.32 1.04 0.00 0.00 0.00 176.54 179.29 1xrh n LEU 230 N -4.38 3.53 0.00 3.11 4.77 -0.74 -5.02 117.00 118.26 1xrh n LEU 230 Ca 0.10 0.62 0.00 0.00 -0.03 0.00 0.00 56.01 56.69 1xrh n LEU 230 Cb 0.06 -1.48 0.00 0.00 -2.33 0.00 0.00 43.42 39.66 1xrh n LEU 230 CO 0.38 -0.25 0.00 -0.38 -1.33 0.00 0.00 177.39 175.81 1xrh n ILE 234 N 6.43 0.00 -0.35 -0.08 5.41 -1.26 -5.00 119.36 124.51 1xrh n ILE 234 Ca 0.26 0.00 0.03 0.00 1.00 0.00 0.00 62.75 64.04 1xrh n ILE 234 Cb 0.39 0.00 0.17 0.00 -0.71 0.00 0.00 39.64 39.49 1xrh n ILE 234 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 1xrh h ASP 235 N 1.17 0.95 0.35 4.38 1.82 -1.94 -0.23 116.42 122.91 1xrh h ASP 235 Ca 0.00 0.02 -0.02 0.00 -0.39 0.00 0.00 57.03 56.64 1xrh h ASP 235 Cb 0.00 -0.18 0.00 0.00 0.68 0.00 0.00 39.33 39.83 1xrh h ASP 235 CO 0.00 0.59 -0.17 0.58 -1.61 0.00 0.00 179.24 178.63 1xrh h VAL 236 N 1.07 0.64 -0.98 2.25 2.07 -1.95 -1.46 116.25 117.90 1xrh h VAL 236 Ca 0.42 -0.48 0.09 0.00 0.82 0.00 0.00 66.70 67.55 1xrh h VAL 236 Cb 0.22 0.88 -0.07 0.00 -1.52 0.00 0.00 31.29 30.79 1xrh h VAL 236 CO -0.19 0.09 0.63 -0.07 0.02 0.00 0.00 177.57 178.05 1xrh h LEU 237 N -0.75 0.96 -3.06 2.57 3.38 -1.88 -0.39 115.31 116.15 1xrh h LEU 237 Ca -0.05 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1xrh h LEU 237 Cb 0.51 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1xrh h LEU 237 CO 0.08 0.58 0.00 -1.54 0.09 0.00 0.00 178.44 177.65 1xrh n SER 238 N -4.54 2.70 0.00 -0.43 3.41 -0.13 -4.54 113.62 110.09 1xrh n SER 238 Ca 0.16 -3.04 0.00 0.00 -0.26 0.00 0.00 58.87 55.74 1xrh n SER 238 Cb 0.25 -0.44 0.00 0.00 -0.26 0.00 0.00 64.21 63.76 1xrh n SER 238 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xrh n GLY 239 N -1.18 -0.11 0.30 5.00 0.00 -0.60 -3.82 105.19 104.77 1xrh n GLY 239 Ca 0.17 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.13 1xrh n GLY 239 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1xrh h VAL 240 N 0.00 1.22 -0.06 1.61 2.07 -1.17 0.14 116.25 120.06 1xrh h VAL 240 Ca 0.00 -0.53 -0.00 0.00 0.82 0.00 0.00 66.70 66.98 1xrh h VAL 240 Cb 0.00 0.25 -0.00 0.00 -1.52 0.00 0.00 31.29 30.02 1xrh h VAL 240 CO 0.00 0.24 0.02 0.25 0.02 0.00 0.00 177.57 178.10 1xrh h LEU 241 N 0.99 0.07 -2.24 2.57 5.85 -1.31 -1.57 115.31 119.68 1xrh h LEU 241 Ca 0.26 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.97 1xrh h LEU 241 Cb 0.02 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.03 1xrh h LEU 241 CO -0.04 0.07 0.00 0.18 -0.34 0.00 0.00 178.44 178.30 1xrh n LEU 242 N -4.51 3.25 -1.68 2.25 4.77 -1.04 -4.96 117.00 115.07 1xrh n LEU 242 Ca -0.02 -1.42 -0.11 0.00 -0.03 0.00 0.00 56.01 54.44 1xrh n LEU 242 Cb 0.10 -0.19 0.02 0.00 -2.33 0.00 0.00 43.42 41.03 1xrh n LEU 242 CO 0.34 0.68 0.05 0.61 -1.33 0.00 0.00 177.39 177.74 1xrh n GLY 243 N 1.35 0.19 3.86 -0.72 0.00 -0.59 -5.04 105.19 104.24 1xrh n GLY 243 Ca 0.17 -0.32 -0.21 0.00 0.00 0.00 0.00 46.02 45.66 1xrh n GLY 243 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xrh s LEU 244 N -3.56 3.56 0.56 0.99 1.43 0.43 -5.01 118.68 117.08 1xrh s LEU 244 Ca 0.19 -0.54 -0.19 0.00 -1.03 0.00 0.00 54.13 52.56 1xrh s LEU 244 Cb -0.09 -2.18 -0.07 0.00 0.03 0.00 0.00 46.19 43.89 1xrh s LEU 244 CO 0.24 -0.41 0.84 -2.65 0.23 0.00 0.00 176.35 174.60 1xrh n PRO 245 N -1.40 0.84 -4.11 1.29 -0.02 -1.26 -4.41 135.00 125.93 1xrh n PRO 245 Ca -0.01 0.32 -0.10 0.00 -2.02 0.00 0.00 63.50 61.70 1xrh n PRO 245 Cb 0.60 -2.00 -0.09 0.00 -0.02 0.00 0.00 33.50 31.98 1xrh n PRO 245 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1xrh s PHE 246 N -1.54 0.76 0.00 6.00 -0.12 -1.26 -4.56 117.98 117.26 1xrh s PHE 246 Ca 0.72 -1.13 0.00 0.00 -0.05 0.00 0.00 56.93 56.47 1xrh s PHE 246 Cb -0.45 -0.38 0.00 0.00 -0.63 0.00 0.00 43.02 41.56 1xrh s PHE 246 CO 0.51 -0.57 0.00 0.41 -0.05 0.00 0.00 175.22 175.52 1xrh n GLY 247 N -0.12 2.86 0.00 1.99 0.00 -1.26 -1.42 105.19 107.23 1xrh n GLY 247 Ca -0.06 -0.37 0.04 0.00 0.00 0.00 0.00 46.02 45.62 1xrh n GLY 247 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1xrh n ARG 248 N 13.82 0.08 -0.07 1.61 1.85 -0.98 -2.84 116.66 130.15 1xrh n ARG 248 Ca 0.00 0.25 -0.15 0.00 -1.00 0.00 0.00 57.85 56.95 1xrh n ARG 248 Cb 0.00 -1.50 -0.06 0.00 -1.05 0.00 0.00 32.46 29.85 1xrh n ARG 248 CO 0.00 0.00 0.00 1.96 -0.01 0.00 0.00 177.63 179.58 1xrh h GLN 249 N 0.00 0.72 -6.03 2.89 4.20 -1.53 -3.46 115.11 111.89 1xrh h GLN 249 Ca 0.00 -0.47 -0.71 0.00 0.06 0.00 0.00 58.65 57.53 1xrh h GLN 249 Cb 0.08 0.06 0.09 0.00 0.30 0.00 0.00 27.48 28.00 1xrh h GLN 249 CO 0.00 1.09 -0.26 0.28 -0.67 0.00 0.00 178.83 179.27 1xrh n VAL 250 N -4.15 1.22 -2.27 -0.54 0.31 -1.13 -4.85 118.33 106.91 1xrh n VAL 250 Ca -0.05 -0.31 -0.37 0.00 -0.01 0.00 0.00 64.34 63.60 1xrh n VAL 250 Cb 0.57 -0.07 -0.01 0.00 -0.91 0.00 0.00 33.84 33.42 1xrh n VAL 250 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1xrh s SER 251 N -0.57 6.25 0.00 4.52 1.04 -1.26 -4.40 113.70 119.28 1xrh s SER 251 Ca 0.74 2.31 0.00 0.00 0.48 0.00 0.00 55.95 59.48 1xrh s SER 251 Cb -1.04 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 62.48 1xrh s SER 251 CO 0.56 -0.86 0.00 -1.20 0.98 0.00 0.00 173.24 172.72 1xrh n SER 252 N -0.37 0.00 -0.54 7.02 7.64 -1.26 -4.27 113.62 121.83 1xrh n SER 252 Ca 0.07 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.95 1xrh n SER 252 Cb 0.48 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.68 1xrh n SER 252 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1xrh n TYR 254 N 0.00 0.00 -0.06 1.43 4.02 -1.26 -4.56 117.16 116.73 1xrh n TYR 254 Ca 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 57.90 57.85 1xrh n TYR 254 Cb 0.00 -0.01 -0.03 0.00 -0.02 0.00 0.00 39.34 39.27 1xrh n TYR 254 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 1xrh h ASP 255 N 0.45 0.00 -2.27 7.72 3.45 -1.99 -3.45 116.42 120.34 1xrh h ASP 255 Ca 0.00 -0.25 -0.37 0.00 0.43 0.00 0.00 57.03 56.83 1xrh h ASP 255 Cb 0.00 0.00 -0.34 0.00 -0.56 0.00 0.00 39.33 38.43 1xrh h ASP 255 CO 0.00 0.66 -0.67 -0.62 -1.57 0.00 0.00 179.24 177.04 1xrh s ASP 256 N -5.75 2.04 0.62 6.45 3.68 -1.26 -4.99 116.67 117.46 1xrh s ASP 256 Ca -0.06 -0.92 0.41 0.00 2.13 0.00 0.00 52.55 54.10 1xrh s ASP 256 Cb -0.00 0.33 2.23 0.00 -1.45 0.00 0.00 42.92 44.02 1xrh s ASP 256 CO 0.19 -0.39 2.26 -0.07 0.13 0.00 0.00 175.17 177.29 1xrh h LEU 257 N 8.21 0.00 0.00 -1.34 -0.00 -1.95 -1.47 115.31 118.76 1xrh h LEU 257 Ca -0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.75 1xrh h LEU 257 Cb 1.06 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.72 1xrh h LEU 257 CO 0.35 0.00 -0.37 0.45 -0.00 0.00 0.00 178.44 178.87 1xrh h HIS 258 N 0.00 0.00 -2.61 1.13 3.86 -1.89 -2.35 115.15 113.29 1xrh h HIS 258 Ca 0.00 0.00 -0.56 0.00 -1.16 0.00 0.00 60.37 58.65 1xrh h HIS 258 Cb 0.04 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 28.44 1xrh h HIS 258 CO 0.00 0.00 -0.57 0.00 0.86 0.00 0.00 177.93 178.22 1xrh s ALA 259 N -3.21 3.50 0.36 2.45 0.00 -0.55 -2.70 121.76 121.61 1xrh s ALA 259 Ca 0.06 -1.30 -0.27 0.00 0.00 0.00 0.00 51.96 50.45 1xrh s ALA 259 Cb 0.10 -1.27 -0.09 0.00 0.00 0.00 0.00 23.12 21.85 1xrh s ALA 259 CO 0.69 0.44 1.24 0.20 0.00 0.00 0.00 175.76 178.33 1xrh s GLY 260 N -3.25 2.96 0.18 0.00 0.00 -1.25 -4.54 107.32 101.42 1xrh s GLY 260 Ca 0.31 1.12 -0.09 0.00 0.00 0.00 0.00 44.72 46.06 1xrh s GLY 260 CO 0.23 1.71 1.62 3.21 0.00 0.00 0.00 173.10 179.87 1xrh h ARG 261 N 3.10 1.03 -1.02 2.90 2.47 -1.91 -3.47 114.38 117.48 1xrh h ARG 261 Ca -0.49 -0.36 -0.30 0.00 -1.26 0.00 0.00 59.98 57.57 1xrh h ARG 261 Cb 1.23 -0.07 -0.09 0.00 -1.65 0.00 0.00 29.97 29.38 1xrh h ARG 261 CO 0.64 1.05 -0.29 0.09 0.56 0.00 0.00 179.97 182.02 1xrh n ASN 262 N -4.15 -4.67 -4.75 7.04 3.02 -1.26 -4.49 115.26 105.99 1xrh n ASN 262 Ca 0.02 0.27 -0.33 0.00 -0.03 0.00 0.00 54.58 54.51 1xrh n ASN 262 Cb 0.39 -3.54 0.07 0.00 -0.61 0.00 0.00 39.78 36.09 1xrh n ASN 262 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1xrh s LEU 263 N -3.51 3.27 0.11 3.41 1.43 -1.26 -4.31 118.68 117.82 1xrh s LEU 263 Ca 0.00 2.04 0.09 0.00 -1.03 0.00 0.00 54.13 55.24 1xrh s LEU 263 Cb 0.00 -4.55 -0.04 0.00 0.03 0.00 0.00 46.19 41.63 1xrh s LEU 263 CO 0.00 -1.92 -0.23 -0.83 0.23 0.00 0.00 176.35 173.60 1xrh s GLY 264 N -2.64 1.35 0.05 -3.19 0.00 -1.25 -1.73 107.32 99.91 1xrh s GLY 264 Ca 0.67 -1.31 0.02 0.00 0.00 0.00 0.00 44.72 44.10 1xrh s GLY 264 CO 0.46 -1.30 -0.07 1.62 0.00 0.00 0.00 173.10 173.81 1xrh s GLN 265 N -1.91 0.54 -0.04 2.90 0.74 -0.19 -2.45 119.66 119.25 1xrh s GLN 265 Ca 0.09 -0.81 0.03 0.00 0.05 0.00 0.00 55.36 54.72 1xrh s GLN 265 Cb -0.10 -0.24 0.00 0.00 1.10 0.00 0.00 33.01 33.78 1xrh s GLN 265 CO 0.05 0.03 -0.12 -1.17 -0.55 0.00 0.00 175.29 173.53 1xrh s LEU 266 N -1.74 1.81 -0.08 3.68 2.96 -1.26 -0.09 118.68 123.96 1xrh s LEU 266 Ca -0.08 -0.26 0.01 0.00 -0.22 0.00 0.00 54.13 53.58 1xrh s LEU 266 Cb -0.08 -0.73 -0.03 0.00 0.50 0.00 0.00 46.19 45.86 1xrh s LEU 266 CO -0.00 0.09 -0.10 -1.00 -1.32 0.00 0.00 176.35 174.02 1xrh s HIS 267 N 0.20 2.85 -0.05 5.38 3.76 -0.15 -4.26 115.29 123.02 1xrh s HIS 267 Ca -0.05 -0.20 0.04 0.00 -0.15 0.00 0.00 55.06 54.71 1xrh s HIS 267 Cb -0.10 -1.74 -0.00 0.00 1.11 0.00 0.00 32.58 31.85 1xrh s HIS 267 CO 0.01 0.14 -0.18 0.42 -0.85 0.00 0.00 174.74 174.29 1xrh s ILE 268 N -0.43 1.49 -0.02 0.60 1.01 -0.48 -1.42 121.20 121.95 1xrh s ILE 268 Ca 0.06 -0.73 0.02 0.00 0.00 0.00 0.00 60.65 60.00 1xrh s ILE 268 Cb -0.12 -1.29 0.00 0.00 0.01 0.00 0.00 42.46 41.06 1xrh s ILE 268 CO 0.02 0.43 -0.07 -0.69 0.00 0.00 0.00 174.94 174.63 1xrh s VAL 269 N 0.17 0.65 -0.08 2.92 1.01 -0.05 -1.42 120.40 123.61 1xrh s VAL 269 Ca -0.07 -0.30 0.02 0.00 0.00 0.00 0.00 61.98 61.63 1xrh s VAL 269 Cb -0.13 -0.59 0.01 0.00 0.00 0.00 0.00 36.38 35.67 1xrh s VAL 269 CO 0.03 0.21 -0.15 -0.63 0.00 0.00 0.00 175.10 174.57 1xrh s ILE 270 N 0.19 1.34 -0.47 2.22 1.01 -0.70 -1.33 121.20 123.45 1xrh s ILE 270 Ca -0.03 -0.59 -0.20 0.00 0.00 0.00 0.00 60.65 59.83 1xrh s ILE 270 Cb -0.07 -1.21 0.04 0.00 0.01 0.00 0.00 42.46 41.22 1xrh s ILE 270 CO 0.00 0.40 0.66 0.21 0.00 0.00 0.00 174.94 176.22 1xrh s ASN 271 N 0.68 6.29 0.34 3.58 3.84 0.34 -0.73 114.94 129.28 1xrh s ASN 271 Ca -0.14 -0.55 0.14 0.00 0.21 0.00 0.00 52.86 52.53 1xrh s ASN 271 Cb -0.16 -2.32 1.07 0.00 -0.55 0.00 0.00 41.25 39.29 1xrh s ASN 271 CO 0.04 -0.86 1.67 -0.65 -2.79 0.00 0.00 177.10 174.51 1xrh h PRO 272 N 8.96 0.35 0.00 0.43 0.11 -1.87 0.08 132.00 140.05 1xrh h PRO 272 Ca -0.26 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1xrh h PRO 272 Cb 1.09 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1xrh h PRO 272 CO 0.93 0.23 0.10 -0.91 -0.21 0.00 0.00 178.00 178.15 1xrh h ASN 273 N 0.36 0.00 0.25 -2.05 2.35 -1.92 0.14 115.58 114.70 1xrh h ASN 273 Ca 0.72 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.47 1xrh h ASN 273 Cb 1.63 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.00 1xrh h ASN 273 CO -0.58 0.00 -0.17 0.49 -1.65 0.00 0.00 177.43 175.51 1xrh n PHE 274 N -2.49 0.00 0.00 1.19 3.01 0.01 -4.22 117.46 114.96 1xrh n PHE 274 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.44 1xrh n PHE 274 Cb 0.14 -0.13 0.00 0.00 -0.01 0.00 0.00 39.48 39.49 1xrh n PHE 274 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 1xrh n PHE 275 N -0.67 0.00 -3.88 1.38 3.01 0.38 -5.11 117.46 112.58 1xrh n PHE 275 Ca 0.14 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.60 1xrh n PHE 275 Cb 0.32 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.79 1xrh n PHE 275 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1xrh n SER 276 N -1.54 -0.11 -4.66 4.37 3.41 -0.64 -5.11 113.62 109.33 1xrh n SER 276 Ca 0.00 -1.02 -0.42 0.00 -0.26 0.00 0.00 58.87 57.17 1xrh n SER 276 Cb 0.14 0.17 -0.03 0.00 -0.26 0.00 0.00 64.21 64.23 1xrh n SER 276 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1xrh s SER 277 N -1.26 6.66 0.42 4.04 0.15 -1.26 -3.90 113.70 118.54 1xrh s SER 277 Ca 0.03 2.25 0.23 0.00 0.70 0.00 0.00 55.95 59.16 1xrh s SER 277 Cb -0.00 -2.53 0.66 0.00 -1.71 0.00 0.00 66.02 62.44 1xrh s SER 277 CO -0.00 -0.93 1.71 0.77 1.20 0.00 0.00 173.24 176.00 1xrh h SER 278 N 9.53 0.00 -0.01 5.45 4.64 -1.92 -1.24 113.55 129.99 1xrh h SER 278 Ca -0.40 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1xrh h SER 278 Cb 1.18 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1xrh h SER 278 CO 0.95 0.22 -0.00 -0.08 -0.87 0.00 0.00 176.83 177.05 1xrh h GLU 279 N 0.00 0.02 -0.46 4.77 4.57 -1.99 -2.09 114.58 119.41 1xrh h GLU 279 Ca -0.00 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.15 1xrh h GLU 279 Cb 0.92 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.48 1xrh h GLU 279 CO 0.03 0.34 0.19 -0.07 -1.18 0.00 0.00 179.01 178.32 1xrh h LEU 280 N -0.30 0.58 -0.09 1.64 3.38 -1.94 -2.54 115.31 116.04 1xrh h LEU 280 Ca 0.00 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1xrh h LEU 280 Cb 0.33 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 1xrh h LEU 280 CO 0.00 0.52 0.05 0.15 0.09 0.00 0.00 178.44 179.25 1xrh h PHE 281 N 0.64 0.13 -0.72 1.13 3.57 -0.95 0.90 116.94 121.63 1xrh h PHE 281 Ca 0.16 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.60 1xrh h PHE 281 Cb 0.12 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.79 1xrh h PHE 281 CO 0.01 0.19 0.24 0.00 -2.23 0.00 0.00 178.31 176.52 1xrh h ARG 282 N 0.03 1.10 -0.79 1.11 3.08 -1.26 -1.14 114.38 116.51 1xrh h ARG 282 Ca 0.03 -0.22 -0.03 0.00 0.07 0.00 0.00 59.98 59.83 1xrh h ARG 282 Cb 0.11 -0.17 -0.04 0.00 0.08 0.00 0.00 29.97 29.96 1xrh h ARG 282 CO -0.00 0.92 0.38 1.96 -1.07 0.00 0.00 179.97 182.16 1xrh h GLN 283 N 1.06 1.14 -0.08 0.04 4.20 -1.26 -1.50 115.11 118.71 1xrh h GLN 283 Ca 0.24 -0.17 -0.14 0.00 0.06 0.00 0.00 58.65 58.64 1xrh h GLN 283 Cb 0.27 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 1xrh h GLN 283 CO -0.01 0.88 -0.58 0.45 -0.67 0.00 0.00 178.83 178.90 1xrh h HIS 284 N 1.12 0.31 -0.42 2.96 3.86 -0.11 -1.10 115.15 121.77 1xrh h HIS 284 Ca 0.27 -0.12 -0.07 0.00 -1.16 0.00 0.00 60.37 59.30 1xrh h HIS 284 Cb 0.12 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 28.51 1xrh h HIS 284 CO 0.01 0.77 -0.02 -0.07 0.86 0.00 0.00 177.93 179.48 1xrh h LEU 285 N 0.19 0.66 -0.50 2.43 4.07 -0.81 0.30 115.31 121.65 1xrh h LEU 285 Ca -0.00 -0.15 -0.16 0.00 0.08 0.00 0.00 57.88 57.65 1xrh h LEU 285 Cb 1.07 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 42.63 1xrh h LEU 285 CO 0.09 0.74 -0.50 0.28 -1.08 0.00 0.00 178.44 177.97 1xrh h SER 286 N 0.64 0.71 -0.07 -0.43 0.02 -1.00 -3.01 113.55 110.41 1xrh h SER 286 Ca 0.13 -0.36 -0.01 0.00 -0.84 0.00 0.00 61.79 60.71 1xrh h SER 286 Cb 0.43 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 62.77 1xrh h SER 286 CO 0.02 1.09 0.02 -0.61 -1.14 0.00 0.00 176.83 176.21 1xrh h GLN 287 N 0.51 0.10 -0.27 3.45 4.15 -0.83 0.29 115.11 122.51 1xrh h GLN 287 Ca 0.02 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1xrh h GLN 287 Cb 1.05 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.73 1xrh h GLN 287 CO 0.10 0.27 0.00 2.41 -1.93 0.00 0.00 178.83 179.68 1xrh n THR 288 N -4.93 0.00 0.00 2.39 -1.04 0.10 -0.31 114.28 110.49 1xrh n THR 288 Ca -0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.95 1xrh n THR 288 Cb 0.13 -0.05 0.00 0.00 -1.82 0.00 0.00 70.33 68.59 1xrh n THR 288 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1xrh n ARG 290 N 0.37 0.00 -0.22 -2.82 5.12 0.09 -0.97 116.66 118.22 1xrh n ARG 290 Ca 0.00 0.00 -0.07 0.00 -1.93 0.00 0.00 57.85 55.85 1xrh n ARG 290 Cb 0.00 0.00 0.04 0.00 -1.16 0.00 0.00 32.46 31.34 1xrh n ARG 290 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 1xrh h GLU 291 N 0.00 0.91 -0.60 5.56 5.08 -0.93 -2.42 114.58 122.17 1xrh h GLU 291 Ca 0.00 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.20 1xrh h GLU 291 Cb 0.00 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.06 1xrh h GLU 291 CO 0.00 0.73 0.28 -0.07 -1.00 0.00 0.00 179.01 178.95 1xrh h LEU 292 N 0.87 0.77 -1.55 1.33 3.38 -1.28 -1.37 115.31 117.45 1xrh h LEU 292 Ca 0.22 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 58.07 1xrh h LEU 292 Cb 0.12 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1xrh h LEU 292 CO -0.03 0.67 -0.17 0.78 0.09 0.00 0.00 178.44 179.78 1xrh h ASN 293 N 0.85 0.00 0.13 -0.43 -0.26 -1.60 -2.43 115.58 111.84 1xrh h ASN 293 Ca 0.21 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.95 1xrh h ASN 293 Cb 0.11 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.37 1xrh h ASN 293 CO -0.03 0.17 -0.07 0.00 -1.06 0.00 0.00 177.43 176.44 1xrh n ALA 294 N -2.25 2.73 -1.82 -0.83 0.00 -0.53 -4.34 120.51 113.47 1xrh n ALA 294 Ca -0.01 -0.35 -0.41 0.00 0.00 0.00 0.00 53.44 52.67 1xrh n ALA 294 Cb 0.33 -1.26 -0.03 0.00 0.00 0.00 0.00 19.45 18.49 1xrh n ALA 294 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1xrh s ILE 295 N -2.21 3.05 0.16 0.00 1.01 -0.92 -4.92 121.20 117.38 1xrh s ILE 295 Ca 0.35 1.01 -0.32 0.00 0.00 0.00 0.00 60.65 61.69 1xrh s ILE 295 Cb 0.21 -3.64 -0.11 0.00 0.01 0.00 0.00 42.46 38.92 1xrh s ILE 295 CO 0.41 0.22 1.78 0.41 0.00 0.00 0.00 174.94 177.76 1xrh n THR 296 N 1.35 0.20 -2.45 2.92 -1.04 -1.26 -4.31 114.28 109.68 1xrh n THR 296 Ca 0.01 -0.04 -0.34 0.00 -2.04 0.00 0.00 64.05 61.65 1xrh n THR 296 Cb 0.43 -2.05 -0.03 0.00 -1.82 0.00 0.00 70.33 66.86 1xrh n THR 296 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1xrh s PRO 297 N 2.01 3.72 0.57 -2.82 0.04 -1.26 -4.95 135.00 132.31 1xrh s PRO 297 Ca 0.79 1.31 -0.12 0.00 0.04 0.00 0.00 61.00 63.02 1xrh s PRO 297 Cb -0.50 -2.09 -0.05 0.00 0.04 0.00 0.00 34.50 31.90 1xrh s PRO 297 CO 0.35 -0.49 0.99 0.00 0.04 0.00 0.00 177.00 177.89 1xrh s ALA 298 N -2.10 3.12 0.19 8.56 0.00 -1.26 -4.93 121.76 125.34 1xrh s ALA 298 Ca 0.66 -0.03 -0.32 0.00 0.00 0.00 0.00 51.96 52.27 1xrh s ALA 298 Cb -0.16 -3.05 -0.15 0.00 0.00 0.00 0.00 23.12 19.77 1xrh s ALA 298 CO 0.23 -0.49 1.26 -2.30 0.00 0.00 0.00 175.76 174.47 1xrh n PRO 299 N -2.27 1.49 0.00 0.00 -0.02 -1.26 -1.40 135.00 131.54 1xrh n PRO 299 Ca 0.06 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1xrh n PRO 299 Cb 0.54 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 1xrh n PRO 299 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xrh n GLY 300 N 2.12 2.62 3.80 -1.23 0.00 -1.26 -5.05 105.19 106.19 1xrh n GLY 300 Ca 0.14 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 1xrh n GLY 300 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xrh s PHE 301 N -2.54 3.12 -0.08 1.61 0.40 -0.49 -5.00 117.98 115.00 1xrh s PHE 301 Ca 0.00 -0.05 0.19 0.00 -0.60 0.00 0.00 56.93 56.47 1xrh s PHE 301 Cb 0.00 -1.47 -0.29 0.00 0.51 0.00 0.00 43.02 41.77 1xrh s PHE 301 CO 0.00 0.52 0.33 0.09 0.70 0.00 0.00 175.22 176.86 1xrh n ASN 302 N -0.60 0.32 -3.51 1.36 3.02 -1.26 -4.71 115.26 109.87 1xrh n ASN 302 Ca -0.08 0.00 -0.09 0.00 -0.03 0.00 0.00 54.58 54.38 1xrh n ASN 302 Cb 0.56 1.64 -0.02 0.00 -0.61 0.00 0.00 39.78 41.35 1xrh n ASN 302 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1xrh s GLN 303 N -3.13 1.03 -0.21 3.52 0.74 -1.26 -4.90 119.66 115.46 1xrh s GLN 303 Ca -0.08 -0.41 -0.12 0.00 0.05 0.00 0.00 55.36 54.80 1xrh s GLN 303 Cb 0.11 0.46 -0.05 0.00 1.10 0.00 0.00 33.01 34.63 1xrh s GLN 303 CO 0.83 -0.46 0.22 0.08 -0.55 0.00 0.00 175.29 175.42 1xrh s VAL 304 N -3.37 5.33 0.02 1.34 1.01 -1.26 -4.93 120.40 118.54 1xrh s VAL 304 Ca 0.04 0.36 -0.01 0.00 0.00 0.00 0.00 61.98 62.37 1xrh s VAL 304 Cb -0.01 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.77 1xrh s VAL 304 CO -0.09 0.36 0.17 -0.31 0.00 0.00 0.00 175.10 175.23 1xrh s TYR 305 N 0.81 3.48 0.79 5.22 4.12 -1.26 -3.98 117.35 126.53 1xrh s TYR 305 Ca 0.12 0.28 -0.12 0.00 0.02 0.00 0.00 57.07 57.37 1xrh s TYR 305 Cb -0.13 -1.78 0.07 0.00 -1.52 0.00 0.00 41.96 38.60 1xrh s TYR 305 CO 0.03 0.61 1.16 1.52 0.02 0.00 0.00 175.55 178.89 1xrh s TYR 306 N -1.38 3.01 0.28 2.71 -0.85 -1.26 -4.90 117.35 114.96 1xrh s TYR 306 Ca 0.30 0.79 -0.30 0.00 -0.52 0.00 0.00 57.07 57.33 1xrh s TYR 306 Cb -0.13 -3.42 -0.11 0.00 0.38 0.00 0.00 41.96 38.68 1xrh s TYR 306 CO 0.22 -1.67 1.53 -2.14 -1.52 0.00 0.00 175.55 171.96 1xrh s PRO 307 N -5.53 4.18 0.00 -3.49 0.02 -1.26 -2.05 135.00 126.86 1xrh s PRO 307 Ca 0.61 2.46 0.00 0.00 0.02 0.00 0.00 61.00 64.10 1xrh s PRO 307 Cb -0.11 -3.06 0.00 0.00 0.02 0.00 0.00 34.50 31.35 1xrh s PRO 307 CO 0.49 -0.54 0.00 0.41 -0.33 0.00 0.00 177.00 177.03 1xrh n GLY 308 N 2.12 1.25 0.17 0.52 0.00 -1.24 -4.30 105.19 103.71 1xrh n GLY 308 Ca 0.07 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.05 1xrh n GLY 308 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1xrh h GLN 309 N 2.50 0.12 -0.57 1.61 4.15 -1.72 -1.09 115.11 120.12 1xrh h GLN 309 Ca 0.00 -0.01 0.11 0.00 0.77 0.00 0.00 58.65 59.53 1xrh h GLN 309 Cb 0.00 -0.03 -0.10 0.00 0.21 0.00 0.00 27.48 27.57 1xrh h GLN 309 CO 0.00 0.08 -0.01 0.22 -1.93 0.00 0.00 178.83 177.18 1xrh h ASP 310 N 0.12 -0.28 -0.20 -0.69 1.82 -1.91 0.22 116.42 115.50 1xrh h ASP 310 Ca 0.20 0.14 -0.06 0.00 -0.39 0.00 0.00 57.03 56.92 1xrh h ASP 310 Cb 0.29 0.26 -0.02 0.00 0.68 0.00 0.00 39.33 40.53 1xrh h ASP 310 CO -0.33 -0.11 -0.06 1.56 -1.61 0.00 0.00 179.24 178.69 1xrh h GLN 311 N 0.10 0.54 -0.30 0.28 4.20 -1.65 -1.62 115.11 116.66 1xrh h GLN 311 Ca 0.29 -0.14 -0.02 0.00 0.06 0.00 0.00 58.65 58.84 1xrh h GLN 311 Cb 0.46 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 1xrh h GLN 311 CO -0.49 0.61 0.10 -0.44 -0.67 0.00 0.00 178.83 177.94 1xrh h ASP 312 N 0.51 0.43 0.01 1.46 3.45 0.22 -0.07 116.42 122.43 1xrh h ASP 312 Ca 0.10 -0.19 0.00 0.00 0.43 0.00 0.00 57.03 57.37 1xrh h ASP 312 Cb 0.42 -0.11 -0.00 0.00 -0.56 0.00 0.00 39.33 39.08 1xrh h ASP 312 CO 0.02 0.51 -0.01 0.40 -1.57 0.00 0.00 179.24 178.59 1xrh h ILE 313 N 0.33 0.98 -0.64 0.35 2.04 -0.15 -1.25 117.51 119.17 1xrh h ILE 313 Ca 0.10 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.96 1xrh h ILE 313 Cb 0.23 0.98 -0.03 0.00 -0.74 0.00 0.00 36.82 37.25 1xrh h ILE 313 CO -0.00 0.00 0.39 0.11 0.00 0.00 0.00 178.15 178.65 1xrh h LYS 314 N -0.02 0.86 -0.86 2.37 1.57 -1.17 -1.82 116.57 117.50 1xrh h LYS 314 Ca 0.00 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 1xrh h LYS 314 Cb 0.02 -0.19 -0.04 0.00 0.08 0.00 0.00 32.23 32.11 1xrh h LYS 314 CO -0.00 0.60 0.45 0.37 -0.57 0.00 0.00 179.45 180.30 1xrh h GLN 315 N 0.88 1.21 -0.06 3.15 4.15 -0.42 -0.76 115.11 123.26 1xrh h GLN 315 Ca 0.23 -0.15 -0.17 0.00 0.77 0.00 0.00 58.65 59.33 1xrh h GLN 315 Cb -0.04 -0.23 -0.01 0.00 0.21 0.00 0.00 27.48 27.41 1xrh h GLN 315 CO -0.04 0.90 -0.72 0.00 -1.93 0.00 0.00 178.83 177.04 1xrh h ARG 316 N 1.21 0.30 -0.01 1.69 3.08 -0.50 -2.64 114.38 117.52 1xrh h ARG 316 Ca 0.30 -0.25 -0.08 0.00 0.07 0.00 0.00 59.98 60.02 1xrh h ARG 316 Cb 0.06 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 1xrh h ARG 316 CO -0.04 0.89 -0.38 0.87 -1.07 0.00 0.00 179.97 180.24 1xrh h LYS 317 N 0.20 0.01 -0.03 0.04 1.79 -0.83 -2.46 116.57 115.29 1xrh h LYS 317 Ca -0.02 -0.01 -0.08 0.00 -2.18 0.00 0.00 60.65 58.36 1xrh h LYS 317 Cb 1.28 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.92 1xrh h LYS 317 CO 0.12 0.39 -0.34 0.00 -1.08 0.00 0.00 179.45 178.54 1xrh h ALA 318 N 1.61 1.37 0.00 3.86 0.00 -0.87 0.61 119.26 125.84 1xrh h ALA 318 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1xrh h ALA 318 Cb 0.68 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1xrh h ALA 318 CO 0.05 0.46 0.00 0.00 0.00 0.00 0.00 179.25 179.76 1xrh h ALA 319 N 1.60 1.00 0.00 0.00 0.00 -1.10 -2.18 119.26 118.59 1xrh h ALA 319 Ca 0.01 0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.67 1xrh h ALA 319 Cb 0.63 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 1xrh h ALA 319 CO 0.05 0.00 -1.74 0.28 0.00 0.00 0.00 179.25 177.84 1xrh n VAL 320 N -3.06 1.21 1.11 0.00 0.31 -0.18 -4.77 118.33 112.96 1xrh n VAL 320 Ca 0.00 -0.14 0.12 0.00 -0.01 0.00 0.00 64.34 64.31 1xrh n VAL 320 Cb 0.29 -1.88 0.22 0.00 -0.91 0.00 0.00 33.84 31.55 1xrh n VAL 320 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1xrh n GLU 321 N -4.00 0.62 0.00 5.55 1.02 0.20 -5.07 120.64 118.96 1xrh n GLU 321 Ca -0.32 -0.42 0.00 0.00 -0.02 0.00 0.00 57.16 56.40 1xrh n GLU 321 Cb 0.67 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.60 1xrh n GLU 321 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xrh n GLY 322 N 1.41 -2.29 3.42 0.62 0.00 -0.82 -4.77 105.19 102.77 1xrh n GLY 322 Ca 0.09 -1.95 -0.32 0.00 0.00 0.00 0.00 46.02 43.84 1xrh n GLY 322 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xrh s ILE 323 N -0.24 2.81 0.14 -0.61 1.01 0.22 -4.25 121.20 120.29 1xrh s ILE 323 Ca 0.00 -0.81 -0.29 0.00 0.00 0.00 0.00 60.65 59.55 1xrh s ILE 323 Cb 0.00 -2.09 -0.07 0.00 0.01 0.00 0.00 42.46 40.32 1xrh s ILE 323 CO 0.00 0.58 0.93 -0.70 0.00 0.00 0.00 174.94 175.75 1xrh s GLU 324 N -0.56 4.71 -0.02 2.79 2.12 -1.26 -1.41 118.70 125.07 1xrh s GLU 324 Ca 0.08 1.41 0.01 0.00 0.36 0.00 0.00 54.97 56.83 1xrh s GLU 324 Cb -0.11 -3.34 0.01 0.00 0.26 0.00 0.00 34.13 30.94 1xrh s GLU 324 CO 0.01 0.32 -0.04 -1.50 -0.54 0.00 0.00 175.26 173.51 1xrh s ILE 325 N -0.37 0.39 0.24 -3.70 2.07 -0.58 -4.97 121.20 114.29 1xrh s ILE 325 Ca 0.44 -0.13 -0.30 0.00 -1.41 0.00 0.00 60.65 59.25 1xrh s ILE 325 Cb -0.24 -0.38 -0.09 0.00 0.13 0.00 0.00 42.46 41.88 1xrh s ILE 325 CO 0.29 0.15 1.14 -0.69 -1.91 0.00 0.00 174.94 173.92 1xrh s VAL 326 N 0.36 3.51 0.28 4.00 1.01 -1.26 -1.98 120.40 126.32 1xrh s VAL 326 Ca -0.04 1.41 0.02 0.00 0.00 0.00 0.00 61.98 63.37 1xrh s VAL 326 Cb -0.08 -3.90 0.27 0.00 0.00 0.00 0.00 36.38 32.68 1xrh s VAL 326 CO -0.00 0.29 1.77 -2.24 0.00 0.00 0.00 175.10 174.92 1xrh h ASP 327 N 4.37 0.66 -0.79 3.32 2.03 -1.95 -0.33 116.42 123.72 1xrh h ASP 327 Ca -0.46 0.09 0.13 0.00 -0.73 0.00 0.00 57.03 56.06 1xrh h ASP 327 Cb 1.21 -0.02 -0.14 0.00 -0.83 0.00 0.00 39.33 39.56 1xrh h ASP 327 CO 0.70 0.26 -0.37 -0.78 -1.03 0.00 0.00 179.24 178.02 1xrh h ASP 328 N 0.70 -1.33 -0.25 4.15 -0.00 -1.99 1.17 116.42 118.88 1xrh h ASP 328 Ca 0.51 0.27 -0.13 0.00 -0.00 0.00 0.00 57.03 57.68 1xrh h ASP 328 Cb 0.74 0.68 -0.00 0.00 -0.00 0.00 0.00 39.33 40.75 1xrh h ASP 328 CO -0.37 -0.30 -0.37 0.40 -0.00 0.00 0.00 179.24 178.61 1xrh h ILE 329 N -0.08 1.31 -0.71 2.25 2.04 -1.49 -1.81 117.51 119.01 1xrh h ILE 329 Ca 0.28 -1.57 0.01 0.00 1.00 0.00 0.00 64.86 64.59 1xrh h ILE 329 Cb 0.57 1.72 -0.04 0.00 -0.74 0.00 0.00 36.82 38.33 1xrh h ILE 329 CO -0.84 0.50 0.47 0.22 0.00 0.00 0.00 178.15 178.50 1xrh h TYR 330 N 0.40 0.89 -0.27 1.37 3.20 -0.12 0.28 116.97 122.73 1xrh h TYR 330 Ca 0.02 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 1xrh h TYR 330 Cb 0.96 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.92 1xrh h TYR 330 CO 0.08 0.55 0.13 0.37 -1.64 0.00 0.00 178.16 177.65 1xrh h GLN 331 N 0.95 0.38 -0.88 1.82 5.75 0.14 -1.99 115.11 121.29 1xrh h GLN 331 Ca 0.27 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.70 1xrh h GLN 331 Cb -0.09 -0.07 -0.04 0.00 1.07 0.00 0.00 27.48 28.35 1xrh h GLN 331 CO -0.06 0.38 0.52 -0.92 -2.65 0.00 0.00 178.83 176.09 1xrh h TYR 332 N 0.30 1.18 -0.20 3.99 3.20 -0.43 -1.89 116.97 123.12 1xrh h TYR 332 Ca 0.09 -0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.83 1xrh h TYR 332 Cb 0.12 -0.38 -0.01 0.00 1.54 0.00 0.00 36.73 37.99 1xrh h TYR 332 CO -0.02 0.80 -0.38 -0.07 -1.64 0.00 0.00 178.16 176.85 1xrh h LEU 333 N 1.22 0.46 0.00 2.82 3.38 -0.06 -2.97 115.31 120.17 1xrh h LEU 333 Ca 0.32 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1xrh h LEU 333 Cb -0.02 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.60 1xrh h LEU 333 CO -0.06 0.80 -0.22 0.16 0.09 0.00 0.00 178.44 179.21 1xrh h ILE 334 N 0.37 0.00 -3.63 1.22 3.07 -1.23 -3.46 117.51 113.85 1xrh h ILE 334 Ca 0.04 -0.97 -0.43 0.00 1.55 0.00 0.00 64.86 65.05 1xrh h ILE 334 Cb 0.84 1.86 0.18 0.00 -0.27 0.00 0.00 36.82 39.42 1xrh h ILE 334 CO 0.07 0.00 0.14 -0.94 -1.05 0.00 0.00 178.15 176.37 1xrh s SER 335 N -5.93 1.56 0.00 2.16 1.04 -0.72 -4.98 113.70 106.82 1xrh s SER 335 Ca 0.06 0.92 0.23 0.00 0.48 0.00 0.00 55.95 57.64 1xrh s SER 335 Cb 0.06 -1.39 0.06 0.00 0.10 0.00 0.00 66.02 64.85 1xrh s SER 335 CO 0.69 -3.76 1.12 0.47 0.98 0.00 0.00 173.24 172.74 1xrh n ASP 336 N -4.56 1.62 -4.76 7.02 8.00 -1.26 -4.98 116.55 117.63 1xrh n ASP 336 Ca 0.09 -1.28 -0.35 0.00 0.71 0.00 0.00 54.79 53.96 1xrh n ASP 336 Cb 0.58 0.55 0.02 0.00 -0.02 0.00 0.00 41.12 42.25 1xrh n ASP 336 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xrh s ALA 337 N -2.62 2.61 -0.18 2.24 0.00 -1.26 -4.97 121.76 117.57 1xrh s ALA 337 Ca 0.17 0.88 0.15 0.00 0.00 0.00 0.00 51.96 53.15 1xrh s ALA 337 Cb 0.18 -3.39 -0.24 0.00 0.00 0.00 0.00 23.12 19.66 1xrh s ALA 337 CO 0.64 -0.98 0.14 1.28 0.00 0.00 0.00 175.76 176.83 1xrh n LEU 338 N -1.53 0.47 -3.37 0.00 4.77 -1.26 -4.98 117.00 111.10 1xrh n LEU 338 Ca 0.12 0.05 0.02 0.00 -0.03 0.00 0.00 56.01 56.18 1xrh n LEU 338 Cb 0.50 0.28 -0.05 0.00 -2.33 0.00 0.00 43.42 41.83 1xrh n LEU 338 CO 0.44 0.53 0.82 -0.72 -1.33 0.00 0.00 177.39 177.13 1xrh s TYR 339 N -2.51 -0.30 -2.48 -1.77 -0.85 -1.26 -4.38 117.35 103.79 1xrh s TYR 339 Ca -0.12 0.54 0.20 0.00 -0.52 0.00 0.00 57.07 57.17 1xrh s TYR 339 Cb 0.07 0.18 0.16 0.00 0.38 0.00 0.00 41.96 42.74 1xrh s TYR 339 CO 0.81 -0.15 1.13 0.27 -1.52 0.00 0.00 175.55 176.08