#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 4.94 -0.12 -3.46 0.01 -0.56 -4.94 113.70 109.57 1xrh s SER 3 Ca 0.00 -0.70 0.03 0.00 1.31 0.00 0.00 55.95 56.59 1xrh s SER 3 Cb 0.00 -0.76 0.00 0.00 0.21 0.00 0.00 66.02 65.47 1xrh s SER 3 CO 0.00 -0.41 -0.22 -0.54 0.41 0.00 0.00 173.24 172.48 1xrh s LYS 4 N -3.96 3.08 0.11 12.44 1.02 -1.26 -1.26 119.74 129.91 1xrh s LYS 4 Ca 0.41 -0.85 0.08 0.00 0.02 0.00 0.00 55.97 55.63 1xrh s LYS 4 Cb -0.03 -2.39 -0.04 0.00 -0.52 0.00 0.00 37.83 34.85 1xrh s LYS 4 CO 0.25 0.12 -0.20 -1.50 -0.92 0.00 0.00 175.35 173.10 1xrh s ILE 5 N 0.51 1.67 0.62 2.17 2.07 -0.38 -4.83 121.20 123.03 1xrh s ILE 5 Ca -0.14 -1.58 -0.17 0.00 -1.41 0.00 0.00 60.65 57.35 1xrh s ILE 5 Cb -0.17 -1.56 -0.02 0.00 0.13 0.00 0.00 42.46 40.84 1xrh s ILE 5 CO 0.05 -0.12 1.13 -0.94 -1.91 0.00 0.00 174.94 173.15 1xrh s SER 6 N -2.02 5.28 0.14 4.50 1.04 -1.26 0.83 113.70 122.21 1xrh s SER 6 Ca 0.07 2.10 -0.21 0.00 0.48 0.00 0.00 55.95 58.39 1xrh s SER 6 Cb -0.09 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.46 1xrh s SER 6 CO 0.04 -1.51 1.66 -0.09 0.98 0.00 0.00 173.24 174.32 1xrh h ARG 7 N 0.48 -0.16 -0.65 4.02 2.43 -1.95 -0.25 114.38 118.31 1xrh h ARG 7 Ca -0.48 0.01 0.09 0.00 -0.81 0.00 0.00 59.98 58.79 1xrh h ARG 7 Cb 1.26 0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 30.77 1xrh h ARG 7 CO 0.55 -0.10 0.28 0.93 -1.51 0.00 0.00 179.97 180.11 1xrh h GLU 8 N -0.16 0.46 -0.18 0.20 3.07 -1.99 0.11 114.58 116.09 1xrh h GLU 8 Ca 0.11 -0.03 -0.13 0.00 -0.50 0.00 0.00 59.36 58.81 1xrh h GLU 8 Cb 0.33 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.14 1xrh h GLU 8 CO -0.28 0.31 -0.40 1.15 -1.40 0.00 0.00 179.01 178.39 1xrh h THR 9 N 0.48 1.34 -0.42 1.13 2.02 -1.74 -2.08 112.91 113.64 1xrh h THR 9 Ca 0.32 -1.64 0.00 0.00 0.77 0.00 0.00 66.41 65.87 1xrh h THR 9 Cb 0.38 1.92 -0.02 0.00 -1.74 0.00 0.00 68.15 68.69 1xrh h THR 9 CO -0.29 0.51 0.28 0.25 0.37 0.00 0.00 175.52 176.63 1xrh h LEU 10 N 0.25 0.48 0.21 2.58 5.85 -0.77 0.76 115.31 124.67 1xrh h LEU 10 Ca 0.00 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.72 1xrh h LEU 10 Cb 1.00 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.88 1xrh h LEU 10 CO 0.09 0.35 -0.34 -0.74 -0.34 0.00 0.00 178.44 177.46 1xrh h HIS 11 N 0.56 -0.93 -0.50 1.25 2.76 -0.98 0.27 115.15 117.59 1xrh h HIS 11 Ca 0.15 0.02 0.07 0.00 -2.20 0.00 0.00 60.37 58.41 1xrh h HIS 11 Cb -0.06 0.38 -0.06 0.00 1.55 0.00 0.00 27.41 29.22 1xrh h HIS 11 CO -0.05 -0.46 0.16 0.37 -1.30 0.00 0.00 177.93 176.66 1xrh h GLN 12 N -0.63 0.32 -0.78 5.26 5.75 -1.14 0.12 115.11 124.01 1xrh h GLN 12 Ca 0.01 -0.02 0.06 0.00 -0.15 0.00 0.00 58.65 58.55 1xrh h GLN 12 Cb 0.62 -0.07 -0.06 0.00 1.07 0.00 0.00 27.48 29.03 1xrh h GLN 12 CO -0.14 0.21 0.47 -0.07 -2.65 0.00 0.00 178.83 176.65 1xrh h LEU 13 N 0.33 0.72 -0.12 -2.39 3.38 -0.35 -0.83 115.31 116.05 1xrh h LEU 13 Ca 0.24 0.02 -0.24 0.00 0.09 0.00 0.00 57.88 58.00 1xrh h LEU 13 Cb 0.27 -0.12 0.01 0.00 0.09 0.00 0.00 40.66 40.91 1xrh h LEU 13 CO -0.26 0.46 -0.87 0.40 0.09 0.00 0.00 178.44 178.26 1xrh h ILE 14 N 0.85 1.29 -0.33 1.22 2.04 -0.30 -2.57 117.51 119.71 1xrh h ILE 14 Ca 0.35 -2.08 -0.01 0.00 1.00 0.00 0.00 64.86 64.12 1xrh h ILE 14 Cb 0.19 2.12 -0.02 0.00 -0.74 0.00 0.00 36.82 38.38 1xrh h ILE 14 CO -0.18 0.65 0.17 -0.08 0.00 0.00 0.00 178.15 178.71 1xrh h GLU 15 N 0.47 0.46 -0.43 2.37 4.81 -0.47 -2.02 114.58 119.77 1xrh h GLU 15 Ca -0.08 -0.06 0.02 0.00 -0.13 0.00 0.00 59.36 59.12 1xrh h GLU 15 Cb 1.50 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 30.76 1xrh h GLU 15 CO 0.17 0.40 0.24 -0.91 -0.73 0.00 0.00 179.01 178.19 1xrh h ASN 16 N 0.40 0.38 -0.59 1.04 2.35 -1.19 -0.92 115.58 117.04 1xrh h ASN 16 Ca 0.11 0.01 0.03 0.00 -0.55 0.00 0.00 56.30 55.90 1xrh h ASN 16 Cb 0.08 -0.07 -0.04 0.00 0.05 0.00 0.00 38.32 38.35 1xrh h ASN 16 CO -0.02 0.27 0.36 0.50 -1.65 0.00 0.00 177.43 176.89 1xrh h LYS 17 N 0.49 0.68 -0.01 0.81 1.63 -1.24 -1.04 116.57 117.89 1xrh h LYS 17 Ca 0.18 -0.04 -0.09 0.00 -0.85 0.00 0.00 60.65 59.84 1xrh h LYS 17 Cb 0.04 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 31.50 1xrh h LYS 17 CO -0.10 0.45 -0.44 -0.07 -3.45 0.00 0.00 179.45 175.85 1xrh h LEU 18 N 0.70 0.01 -0.28 5.20 3.38 -0.91 -1.40 115.31 122.01 1xrh h LEU 18 Ca 0.24 -0.00 -0.16 0.00 0.09 0.00 0.00 57.88 58.04 1xrh h LEU 18 Cb 0.04 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1xrh h LEU 18 CO -0.11 0.45 -0.46 0.00 0.09 0.00 0.00 178.44 178.41 1xrh h GLN 20 N 0.57 0.00 0.00 0.00 4.15 -0.93 -1.64 115.11 117.25 1xrh h GLN 20 Ca 0.02 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.44 1xrh h GLN 20 Cb 1.06 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.75 1xrh h GLN 20 CO 0.10 0.18 0.00 0.00 -1.93 0.00 0.00 178.83 177.19 1xrh n ALA 21 N -2.33 2.17 0.00 3.38 0.00 -0.55 -4.92 120.51 118.26 1xrh n ALA 21 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1xrh n ALA 21 Cb 0.29 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.29 1xrh n ALA 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xrh n GLY 22 N 1.08 1.39 3.78 0.00 0.00 -0.62 -3.72 105.19 107.10 1xrh n GLY 22 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 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 4.12 0.44 0.99 1.43 -0.78 -4.86 118.68 120.02 1xrh s LEU 23 Ca 0.00 2.10 -0.25 0.00 -1.03 0.00 0.00 54.13 54.95 1xrh s LEU 23 Cb 0.00 -4.18 -0.08 0.00 0.03 0.00 0.00 46.19 41.95 1xrh s LEU 23 CO 0.00 -0.58 1.41 -0.54 0.23 0.00 0.00 176.35 176.87 1xrh s LYS 24 N -2.52 3.75 0.19 1.70 1.02 -1.26 -4.36 119.74 118.26 1xrh s LYS 24 Ca 0.59 2.38 -0.19 0.00 0.02 0.00 0.00 55.97 58.77 1xrh s LYS 24 Cb -0.24 -2.68 0.15 0.00 -0.52 0.00 0.00 37.83 34.54 1xrh s LYS 24 CO 0.29 -0.75 1.59 -0.09 -0.92 0.00 0.00 175.35 175.47 1xrh h ARG 25 N 2.41 -0.13 -0.95 1.68 9.65 -1.94 -0.09 114.38 125.01 1xrh h ARG 25 Ca -0.51 0.01 0.09 0.00 -1.10 0.00 0.00 59.98 58.47 1xrh h ARG 25 Cb 1.26 0.03 -0.07 0.00 -1.39 0.00 0.00 29.97 29.80 1xrh h ARG 25 CO 0.61 -0.08 0.61 1.49 2.80 0.00 0.00 179.97 185.40 1xrh h GLU 26 N -0.13 0.97 -0.04 0.20 4.81 -1.99 0.11 114.58 118.51 1xrh h GLU 26 Ca 0.25 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.40 1xrh h GLU 26 Cb 0.54 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.70 1xrh h GLU 26 CO -0.67 0.64 -0.06 0.45 -0.73 0.00 0.00 179.01 178.64 1xrh h HIS 27 N 1.00 0.13 -0.80 0.92 3.86 -1.60 -2.87 115.15 115.79 1xrh h HIS 27 Ca 0.44 -0.05 0.12 0.00 -1.16 0.00 0.00 60.37 59.72 1xrh h HIS 27 Cb 0.35 -0.03 -0.06 0.00 1.06 0.00 0.00 27.41 28.74 1xrh h HIS 27 CO -0.00 0.64 0.52 0.00 0.86 0.00 0.00 177.93 179.95 1xrh h ALA 28 N 0.47 1.88 -0.70 2.45 0.00 -0.55 -0.60 119.26 122.21 1xrh h ALA 28 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1xrh h ALA 28 Cb 0.63 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 1xrh h ALA 28 CO 0.01 -0.07 0.15 0.00 0.00 0.00 0.00 179.25 179.34 1xrh h ALA 29 N 1.62 0.94 -0.24 0.00 0.00 -0.73 0.06 119.26 120.91 1xrh h ALA 29 Ca 0.39 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 1xrh h ALA 29 Cb 0.62 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1xrh h ALA 29 CO -0.15 0.67 -0.23 1.15 0.00 0.00 0.00 179.25 180.69 1xrh h THR 30 N 1.07 1.32 -0.42 0.00 2.02 -1.09 -0.47 112.91 115.33 1xrh h THR 30 Ca 0.22 -1.40 0.03 0.00 0.77 0.00 0.00 66.41 66.03 1xrh h THR 30 Cb 0.40 1.69 -0.03 0.00 -1.74 0.00 0.00 68.15 68.46 1xrh h THR 30 CO 0.01 0.43 0.21 0.58 0.37 0.00 0.00 175.52 177.12 1xrh h VAL 31 N 0.28 0.98 -0.86 3.16 2.07 -0.99 -2.05 116.25 118.83 1xrh h VAL 31 Ca 0.04 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 67.39 1xrh h VAL 31 Cb 0.79 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 1xrh h VAL 31 CO 0.06 0.08 0.46 0.00 0.02 0.00 0.00 177.57 178.19 1xrh h ALA 32 N 1.22 1.10 -0.15 1.67 0.00 -0.89 -1.57 119.26 120.64 1xrh h ALA 32 Ca 0.18 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1xrh h ALA 32 Cb 0.08 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1xrh h ALA 32 CO -0.12 0.62 -0.29 1.05 0.00 0.00 0.00 179.25 180.51 1xrh h GLU 33 N 1.20 0.29 -0.19 0.00 4.11 -0.48 -1.41 114.58 118.09 1xrh h GLU 33 Ca 0.30 -0.11 -0.17 0.00 0.07 0.00 0.00 59.36 59.46 1xrh h GLU 33 Cb 0.04 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 1xrh h GLU 33 CO -0.05 0.56 -0.57 0.28 0.07 0.00 0.00 179.01 179.30 1xrh h VAL 34 N 0.25 1.32 -0.13 -1.06 2.07 -1.04 -1.05 116.25 116.61 1xrh h VAL 34 Ca 0.04 -1.82 -0.15 0.00 0.82 0.00 0.00 66.70 65.58 1xrh h VAL 34 Cb 0.65 1.78 -0.01 0.00 -1.52 0.00 0.00 31.29 32.19 1xrh h VAL 34 CO 0.05 0.57 -0.58 -0.07 0.02 0.00 0.00 177.57 177.56 1xrh h LEU 35 N 0.46 0.46 -0.39 2.57 3.38 -1.09 -2.53 115.31 118.18 1xrh h LEU 35 Ca 0.00 -0.25 -0.16 0.00 0.09 0.00 0.00 57.88 57.56 1xrh h LEU 35 Cb 1.13 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 1xrh h LEU 35 CO 0.11 0.94 -0.39 0.58 0.09 0.00 0.00 178.44 179.77 1xrh h VAL 36 N 0.31 1.27 -0.19 1.22 2.07 -1.25 -1.31 116.25 118.36 1xrh h VAL 36 Ca -0.00 -1.56 0.03 0.00 0.82 0.00 0.00 66.70 65.98 1xrh h VAL 36 Cb 1.10 1.38 -0.03 0.00 -1.52 0.00 0.00 31.29 32.23 1xrh h VAL 36 CO 0.10 0.52 0.03 0.22 0.02 0.00 0.00 177.57 178.47 1xrh h TYR 37 N 0.77 0.05 -0.49 1.57 3.20 -1.08 0.91 116.97 121.90 1xrh h TYR 37 Ca 0.06 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.92 1xrh h TYR 37 Cb 0.99 0.01 -0.02 0.00 1.54 0.00 0.00 36.73 39.24 1xrh h TYR 37 CO 0.06 0.01 0.21 0.00 -1.64 0.00 0.00 178.16 176.81 1xrh h ALA 38 N 1.14 0.63 -0.64 1.82 0.00 -1.27 -2.52 119.26 118.42 1xrh h ALA 38 Ca 0.09 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1xrh h ALA 38 Cb 0.09 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1xrh h ALA 38 CO -0.12 0.22 0.30 -0.44 0.00 0.00 0.00 179.25 179.21 1xrh h ASP 39 N 0.64 0.85 -0.20 0.00 3.32 -0.97 0.21 116.42 120.28 1xrh h ASP 39 Ca 0.16 -0.14 0.06 0.00 0.02 0.00 0.00 57.03 57.14 1xrh h ASP 39 Cb 0.16 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 1xrh h ASP 39 CO -0.02 0.75 0.16 0.00 -1.72 0.00 0.00 179.24 178.41 1xrh h ALA 40 N 1.13 2.04 -0.11 3.45 0.00 -0.55 -1.35 119.26 123.88 1xrh h ALA 40 Ca 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1xrh h ALA 40 Cb 0.13 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1xrh h ALA 40 CO -0.03 -0.27 0.00 0.54 0.00 0.00 0.00 179.25 179.50 1xrh n ARG 41 N -4.22 2.10 -0.88 0.00 1.74 -0.77 -2.32 116.66 112.30 1xrh n ARG 41 Ca 0.02 -1.62 0.00 0.00 -0.77 0.00 0.00 57.85 55.48 1xrh n ARG 41 Cb 0.30 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.27 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 1.30 0.54 2.69 -0.13 0.00 -0.51 -4.60 105.19 104.49 1xrh n GLY 42 Ca 0.17 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.88 4.49 0.30 -0.61 5.41 0.67 -4.78 119.36 121.96 1xrh n ILE 43 Ca 0.00 -4.05 0.16 0.00 1.00 0.00 0.00 62.75 59.86 1xrh n ILE 43 Cb 0.00 -2.33 0.93 0.00 -0.71 0.00 0.00 39.64 37.53 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 5.38 0.00 0.00 1.39 3.86 -1.88 -0.49 115.15 123.41 1xrh h HIS 44 Ca 0.55 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.74 1xrh h HIS 44 Cb 0.51 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.98 1xrh h HIS 44 CO 1.43 0.01 -0.05 0.66 0.86 0.00 0.00 177.93 180.84 1xrh h SER 45 N 0.00 0.00 -0.20 2.45 4.64 -1.95 -2.50 113.55 115.99 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 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1xrh h SER 45 CO 0.00 0.05 0.00 1.41 -0.87 0.00 0.00 176.83 177.42 1xrh n HIS 46 N -3.37 0.63 -1.11 4.77 -0.00 -0.20 -4.79 115.22 111.15 1xrh n HIS 46 Ca -0.02 -0.84 0.00 0.00 -0.00 0.00 0.00 57.72 56.86 1xrh n HIS 46 Cb 0.19 -0.23 0.00 0.00 -0.00 0.00 0.00 29.99 29.95 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 -0.59 2.62 0.40 -1.41 0.00 -0.94 -4.57 105.19 100.71 1xrh n GLY 47 Ca 0.18 -1.86 0.21 0.00 0.00 0.00 0.00 46.02 44.55 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 -0.55 2.19 0.00 4.61 0.00 -1.82 -1.58 119.26 122.11 1xrh h ALA 48 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1xrh h ALA 48 Cb 0.00 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1xrh h ALA 48 CO 0.00 -0.76 0.06 1.55 0.00 0.00 0.00 179.25 180.10 1xrh n VAL 49 N -3.64 1.10 0.19 0.00 3.14 -1.26 -1.97 118.33 115.90 1xrh n VAL 49 Ca 0.09 0.70 0.11 0.00 -2.96 0.00 0.00 64.34 62.28 1xrh n VAL 49 Cb 0.71 -1.70 0.00 0.00 -1.06 0.00 0.00 33.84 31.80 1xrh n VAL 49 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1xrh n ARG 50 N -2.08 0.54 -0.34 1.45 5.12 -0.60 -4.52 116.66 116.24 1xrh n ARG 50 Ca -0.01 0.07 0.08 0.00 -1.93 0.00 0.00 57.85 56.06 1xrh n ARG 50 Cb 0.09 -1.76 0.24 0.00 -1.16 0.00 0.00 32.46 29.87 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 0.85 -0.31 1.55 2.07 -1.59 -0.91 116.25 117.91 1xrh h VAL 51 Ca 0.00 -0.30 -0.00 0.00 0.82 0.00 0.00 66.70 67.22 1xrh h VAL 51 Cb 0.94 -0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1xrh h VAL 51 CO 0.00 0.16 0.19 -0.08 0.02 0.00 0.00 177.57 177.86 1xrh h GLU 52 N 0.87 0.41 -0.53 1.57 4.81 -1.81 0.47 114.58 120.38 1xrh h GLU 52 Ca 0.49 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.62 1xrh h GLU 52 Cb 0.57 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 1xrh h GLU 52 CO -0.30 0.31 0.08 -0.92 -0.73 0.00 0.00 179.01 177.46 1xrh h TYR 53 N 0.40 0.94 -0.26 0.92 3.20 -1.75 -0.42 116.97 120.00 1xrh h TYR 53 Ca 0.11 -0.13 -0.01 0.00 3.14 0.00 0.00 58.73 61.83 1xrh h TYR 53 Cb 0.00 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.01 1xrh h TYR 53 CO -0.04 0.84 0.10 1.88 -1.64 0.00 0.00 178.16 179.30 1xrh h TYR 54 N 0.76 0.39 -0.95 -3.82 0.05 -0.71 -0.82 116.97 111.88 1xrh h TYR 54 Ca 0.16 -0.03 0.04 0.00 0.05 0.00 0.00 58.73 58.95 1xrh h TYR 54 Cb 0.41 -0.12 -0.06 0.00 1.01 0.00 0.00 36.73 37.98 1xrh h TYR 54 CO 0.03 0.41 0.62 0.00 -1.05 0.00 0.00 178.16 178.17 1xrh h ALA 55 N 0.95 1.41 -0.04 3.88 0.00 0.13 0.31 119.26 125.90 1xrh h ALA 55 Ca 0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1xrh h ALA 55 Cb 0.18 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1xrh h ALA 55 CO -0.01 0.49 -0.00 1.49 0.00 0.00 0.00 179.25 181.22 1xrh h GLU 56 N 1.17 0.07 -0.94 0.00 4.81 -0.71 -0.91 114.58 118.07 1xrh h GLU 56 Ca 0.39 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.59 1xrh h GLU 56 Cb 0.05 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.38 1xrh h GLU 56 CO -0.13 0.37 0.58 -0.09 -0.73 0.00 0.00 179.01 179.01 1xrh h ARG 57 N -0.24 1.27 -0.52 1.92 2.43 -0.65 -1.29 114.38 117.29 1xrh h ARG 57 Ca 0.01 -0.11 -0.07 0.00 -0.81 0.00 0.00 59.98 59.00 1xrh h ARG 57 Cb 0.34 -0.27 -0.02 0.00 -0.42 0.00 0.00 29.97 29.60 1xrh h ARG 57 CO 0.00 0.87 0.03 0.82 -1.51 0.00 0.00 179.97 180.19 1xrh h ILE 58 N 1.29 1.25 -0.48 1.20 2.04 -0.34 -0.26 117.51 122.20 1xrh h ILE 58 Ca 0.34 -1.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.12 1xrh h ILE 58 Cb -0.08 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 1xrh h ILE 58 CO -0.07 0.36 -0.02 0.28 0.00 0.00 0.00 178.15 178.70 1xrh h SER 59 N 0.80 0.78 -0.24 1.72 0.02 -0.25 -2.74 113.55 113.64 1xrh h SER 59 Ca 0.16 -0.20 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 1xrh h SER 59 Cb 0.44 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.77 1xrh h SER 59 CO 0.02 0.86 0.00 0.29 -1.14 0.00 0.00 176.83 176.86 1xrh n LYS 60 N -4.20 1.78 -1.07 3.45 5.02 -0.58 -4.92 118.16 117.64 1xrh n LYS 60 Ca 0.02 -0.96 -0.02 0.00 -2.02 0.00 0.00 58.31 55.33 1xrh n LYS 60 Cb 0.32 -1.34 -0.01 0.00 -0.02 0.00 0.00 35.03 33.98 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 0.74 0.50 0.20 0.72 0.00 -1.03 -4.17 105.19 102.15 1xrh n GLY 61 Ca 0.09 -0.18 0.12 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.54 -0.56 2.79 -0.02 0.00 -0.14 -4.53 105.19 101.19 1xrh n GLY 62 Ca -0.02 -0.26 -0.20 0.00 0.00 0.00 0.00 46.02 45.54 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 -1.96 0.24 -0.34 2.61 2.01 -1.24 -3.74 115.64 113.22 1xrh s THR 63 Ca 0.37 0.12 -0.29 0.00 0.31 0.00 0.00 61.69 62.20 1xrh s THR 63 Cb 0.18 -0.37 -0.00 0.00 0.01 0.00 0.00 72.50 72.32 1xrh s THR 63 CO 0.29 0.20 1.48 0.21 -0.69 0.00 0.00 174.62 176.11 1xrh s ASN 64 N 1.47 6.36 0.00 3.53 3.84 -0.32 -4.76 114.94 125.05 1xrh s ASN 64 Ca -0.03 1.13 0.28 0.00 0.21 0.00 0.00 52.86 54.45 1xrh s ASN 64 Cb -0.13 -2.54 1.40 0.00 -0.55 0.00 0.00 41.25 39.44 1xrh s ASN 64 CO -0.03 -1.36 1.97 -2.11 -2.79 0.00 0.00 177.10 172.79 1xrh n ARG 65 N 7.88 0.35 -2.75 0.43 1.85 -1.26 -3.87 116.66 119.28 1xrh n ARG 65 Ca 0.17 0.02 -0.15 0.00 -1.00 0.00 0.00 57.85 56.89 1xrh n ARG 65 Cb 0.47 -1.50 0.01 0.00 -1.05 0.00 0.00 32.46 30.39 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 -1.32 1.68 -1.82 2.89 1.02 -1.26 -4.56 120.64 117.27 1xrh n GLU 66 Ca 0.13 -3.63 -0.41 0.00 -0.02 0.00 0.00 57.16 53.23 1xrh n GLU 66 Cb 0.24 -1.59 -0.01 0.00 -0.02 0.00 0.00 31.44 30.06 1xrh n GLU 66 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1xrh s PRO 67 N -3.08 4.13 -0.97 3.49 0.04 -1.25 -4.93 135.00 132.42 1xrh s PRO 67 Ca 0.35 2.55 -0.12 0.00 0.04 0.00 0.00 61.00 63.82 1xrh s PRO 67 Cb 0.41 -2.99 0.24 0.00 0.04 0.00 0.00 34.50 32.21 1xrh s PRO 67 CO -0.04 -0.53 0.94 -1.21 0.04 0.00 0.00 177.00 176.20 1xrh s GLU 68 N -1.72 3.88 0.30 4.56 2.02 -1.26 -5.02 118.70 121.46 1xrh s GLU 68 Ca 0.55 -2.79 -0.29 0.00 0.02 0.00 0.00 54.97 52.45 1xrh s GLU 68 Cb -0.46 -4.51 -0.10 0.00 0.10 0.00 0.00 34.13 29.15 1xrh s GLU 68 CO 0.59 -1.29 1.42 -0.06 0.02 0.00 0.00 175.26 175.94 1xrh s PHE 69 N -0.39 2.93 -0.06 1.61 0.40 -1.26 -4.66 117.98 116.55 1xrh s PHE 69 Ca 0.25 1.14 -0.01 0.00 -0.60 0.00 0.00 56.93 57.71 1xrh s PHE 69 Cb -0.10 -3.84 0.03 0.00 0.51 0.00 0.00 43.02 39.62 1xrh s PHE 69 CO -0.08 -2.57 0.00 0.50 0.70 0.00 0.00 175.22 173.77 1xrh s ARG 70 N -1.10 0.51 -0.39 0.44 3.52 -1.00 -4.98 118.95 115.96 1xrh s ARG 70 Ca 0.55 0.12 -0.16 0.00 -0.13 0.00 0.00 55.73 56.11 1xrh s ARG 70 Cb -0.43 -0.85 0.01 0.00 -1.56 0.00 0.00 34.95 32.12 1xrh s ARG 70 CO 0.50 -0.27 0.39 -1.17 -0.81 0.00 0.00 175.30 173.94 1xrh s LEU 71 N 1.81 4.76 -0.43 -0.88 2.96 -1.26 -0.75 118.68 124.89 1xrh s LEU 71 Ca 0.02 -0.57 -0.16 0.00 -0.22 0.00 0.00 54.13 53.20 1xrh s LEU 71 Cb -0.13 -2.33 0.03 0.00 0.50 0.00 0.00 46.19 44.27 1xrh s LEU 71 CO -0.04 -0.48 0.39 -0.70 -1.32 0.00 0.00 176.35 174.20 1xrh s GLU 72 N 2.02 3.02 -0.18 1.98 2.12 0.11 -4.98 118.70 122.79 1xrh s GLU 72 Ca 0.11 -1.00 -0.25 0.00 0.36 0.00 0.00 54.97 54.19 1xrh s GLU 72 Cb -0.17 -4.02 -0.01 0.00 0.26 0.00 0.00 34.13 30.19 1xrh s GLU 72 CO 0.12 -0.88 0.84 -1.21 -0.54 0.00 0.00 175.26 173.60 1xrh s GLU 73 N 1.89 4.29 0.00 4.30 2.02 -1.26 -1.71 118.70 128.22 1xrh s GLU 73 Ca 0.08 1.02 0.10 0.00 0.02 0.00 0.00 54.97 56.18 1xrh s GLU 73 Cb -0.19 -3.58 -0.05 0.00 0.10 0.00 0.00 34.13 30.40 1xrh s GLU 73 CO 0.11 -0.35 0.51 0.25 0.02 0.00 0.00 175.26 175.79 1xrh n THR 74 N 4.80 0.00 -3.76 3.63 -2.24 -0.71 -4.99 114.28 111.01 1xrh n THR 74 Ca 0.05 -0.34 -0.03 0.00 -2.27 0.00 0.00 64.05 61.46 1xrh n THR 74 Cb 0.49 1.06 -0.01 0.00 -2.10 0.00 0.00 70.33 69.76 1xrh n THR 74 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1xrh s GLY 75 N -1.63 -0.21 0.50 3.38 0.00 -1.16 -4.93 107.32 103.28 1xrh s GLY 75 Ca 0.06 0.13 0.21 0.00 0.00 0.00 0.00 44.72 45.12 1xrh s GLY 75 CO 0.32 0.33 2.00 -0.56 0.00 0.00 0.00 173.10 175.19 1xrh h PRO 76 N 2.00 0.12 0.00 2.90 0.13 -2.00 -3.01 132.00 132.14 1xrh h PRO 76 Ca -0.25 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1xrh h PRO 76 Cb 1.23 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 1xrh h PRO 76 CO 0.27 0.08 -0.16 0.00 -0.23 0.00 0.00 178.00 177.97 1xrh s SER 78 N -2.58 0.28 -0.10 0.00 1.04 -1.14 -0.63 113.70 110.57 1xrh s SER 78 Ca 0.27 -0.63 -0.32 0.00 0.48 0.00 0.00 55.95 55.76 1xrh s SER 78 Cb 0.25 0.17 0.12 0.00 0.10 0.00 0.00 66.02 66.66 1xrh s SER 78 CO 0.01 -0.45 1.08 0.00 0.98 0.00 0.00 173.24 174.86 1xrh s ALA 79 N -2.46 -1.97 -0.07 5.32 0.00 -0.90 -1.74 121.76 119.94 1xrh s ALA 79 Ca -0.06 1.27 0.03 0.00 0.00 0.00 0.00 51.96 53.20 1xrh s ALA 79 Cb -0.02 0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.25 1xrh s ALA 79 CO -0.04 -0.67 -0.17 0.42 0.00 0.00 0.00 175.76 175.30 1xrh s ILE 80 N -2.73 1.48 -0.35 0.00 1.01 -0.69 0.09 121.20 120.01 1xrh s ILE 80 Ca 0.08 -0.70 -0.11 0.00 0.00 0.00 0.00 60.65 59.92 1xrh s ILE 80 Cb -0.01 -1.30 0.01 0.00 0.01 0.00 0.00 42.46 41.17 1xrh s ILE 80 CO -0.06 0.43 0.20 -0.22 0.00 0.00 0.00 174.94 175.28 1xrh s LEU 81 N 0.39 4.49 -0.55 2.97 2.96 0.32 0.08 118.68 129.34 1xrh s LEU 81 Ca -0.13 -0.75 -0.26 0.00 -0.22 0.00 0.00 54.13 52.78 1xrh s LEU 81 Cb -0.15 -2.04 0.03 0.00 0.50 0.00 0.00 46.19 44.54 1xrh s LEU 81 CO 0.05 -0.30 1.05 -1.00 -1.32 0.00 0.00 176.35 174.82 1xrh s HIS 82 N 1.60 2.74 -1.19 5.38 3.76 0.08 -1.58 115.29 126.08 1xrh s HIS 82 Ca 0.04 0.24 0.29 0.00 -0.15 0.00 0.00 55.06 55.48 1xrh s HIS 82 Cb -0.18 -4.25 1.30 0.00 1.11 0.00 0.00 32.58 30.56 1xrh s HIS 82 CO 0.07 -1.41 1.95 0.00 -0.85 0.00 0.00 174.74 174.50 1xrh n ALA 83 N 7.83 2.47 -3.01 -1.40 0.00 -0.35 -2.36 120.51 123.69 1xrh n ALA 83 Ca 0.05 -0.14 -0.18 0.00 0.00 0.00 0.00 53.44 53.18 1xrh n ALA 83 Cb 0.48 -1.45 -0.00 0.00 0.00 0.00 0.00 19.45 18.48 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 -1.39 -3.62 -2.60 0.00 4.64 -1.17 -0.39 116.55 112.01 1xrh n ASP 84 Ca 0.10 -0.14 -0.21 0.00 -1.38 0.00 0.00 54.79 53.16 1xrh n ASP 84 Cb 0.30 -3.04 0.01 0.00 -1.04 0.00 0.00 41.12 37.36 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 -2.08 -5.85 -4.68 1.67 3.02 0.94 -4.65 115.26 103.63 1xrh n ASN 85 Ca -0.06 -0.15 -0.29 0.00 -0.03 0.00 0.00 54.58 54.05 1xrh n ASN 85 Cb 0.56 -4.77 0.17 0.00 -0.61 0.00 0.00 39.78 35.14 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 -3.08 1.03 0.18 5.41 0.00 0.47 -1.18 121.76 124.59 1xrh s ALA 86 Ca 0.15 -0.27 -0.33 0.00 0.00 0.00 0.00 51.96 51.51 1xrh s ALA 86 Cb -0.07 -3.14 -0.14 0.00 0.00 0.00 0.00 23.12 19.77 1xrh s ALA 86 CO 0.19 -2.77 1.53 0.00 0.00 0.00 0.00 175.76 174.71 1xrh n ALA 87 N -4.15 1.29 -0.30 0.00 0.00 -1.26 -1.82 120.51 114.28 1xrh n ALA 87 Ca 0.06 0.44 0.06 0.00 0.00 0.00 0.00 53.44 53.99 1xrh n ALA 87 Cb 0.56 -2.33 0.21 0.00 0.00 0.00 0.00 19.45 17.90 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 5.48 1.39 1.07 0.00 0.00 -1.64 0.12 103.07 109.48 1xrh h GLY 88 Ca -0.45 -0.29 0.05 0.00 0.00 0.00 0.00 47.33 46.64 1xrh h GLY 88 CO 0.85 0.03 0.51 1.46 0.00 0.00 0.00 176.54 179.39 1xrh h GLN 89 N 0.71 0.88 -0.01 4.80 7.50 -1.72 -0.29 115.11 126.99 1xrh h GLN 89 Ca 0.45 -0.05 -0.00 0.00 0.50 0.00 0.00 58.65 59.54 1xrh h GLN 89 Cb 0.56 -0.20 -0.00 0.00 0.05 0.00 0.00 27.48 27.89 1xrh h GLN 89 CO -0.32 0.58 -0.01 0.28 -1.50 0.00 0.00 178.83 177.86 1xrh h VAL 90 N 0.91 1.41 0.42 -0.54 2.07 -1.34 -2.41 116.25 116.76 1xrh h VAL 90 Ca 0.32 -1.21 -0.02 0.00 0.82 0.00 0.00 66.70 66.61 1xrh h VAL 90 Cb 0.12 2.21 0.00 0.00 -1.52 0.00 0.00 31.29 32.10 1xrh h VAL 90 CO -0.10 0.32 -0.22 0.00 0.02 0.00 0.00 177.57 177.58 1xrh h ALA 91 N 0.49 -0.60 -0.14 1.67 0.00 -1.14 -3.12 119.26 116.44 1xrh h ALA 91 Ca 0.00 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 54.82 1xrh h ALA 91 Cb 0.52 0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.53 1xrh h ALA 91 CO 0.00 -0.84 -0.11 0.00 0.00 0.00 0.00 179.25 178.31 1xrh h ALA 92 N -0.03 -0.00 0.00 0.00 0.00 -1.15 -0.59 119.26 117.50 1xrh h ALA 92 Ca -0.05 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1xrh h ALA 92 Cb 0.47 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1xrh h ALA 92 CO 0.08 -0.55 0.00 1.17 0.00 0.00 0.00 179.25 179.94 1xrh n LYS 93 N -5.25 0.00 -0.77 0.00 4.81 -0.91 -4.63 118.16 111.41 1xrh n LYS 93 Ca -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.41 1xrh n LYS 93 Cb 0.17 -1.33 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 0.84 0.00 1.79 3.14 0.00 -0.23 -4.75 105.19 105.98 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 -0.15 0.00 -0.29 1.61 1.02 -1.26 -0.71 120.64 120.87 1xrh n GLU 97 Ca 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.09 1xrh n GLU 97 Cb 0.00 0.00 0.10 0.00 -0.02 0.00 0.00 31.44 31.52 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 1.18 -0.80 -0.32 2.76 -1.96 -0.88 115.15 115.14 1xrh h HIS 98 Ca 0.00 -0.07 -0.02 0.00 -2.20 0.00 0.00 60.37 58.08 1xrh h HIS 98 Cb 0.00 -0.36 -0.04 0.00 1.55 0.00 0.00 27.41 28.56 1xrh h HIS 98 CO 0.00 0.87 0.41 0.00 -1.30 0.00 0.00 177.93 177.90 1xrh h ALA 99 N 1.24 1.02 -0.21 5.26 0.00 -1.33 0.15 119.26 125.40 1xrh h ALA 99 Ca 0.27 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1xrh h ALA 99 Cb 0.15 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1xrh h ALA 99 CO -0.03 0.56 0.03 0.82 0.00 0.00 0.00 179.25 180.63 1xrh h ILE 100 N 1.12 1.23 -0.12 0.00 2.04 -1.66 0.06 117.51 120.17 1xrh h ILE 100 Ca 0.28 -0.76 0.04 0.00 1.00 0.00 0.00 64.86 65.42 1xrh h ILE 100 Cb 0.08 1.33 -0.04 0.00 -0.74 0.00 0.00 36.82 37.45 1xrh h ILE 100 CO -0.04 0.24 -0.13 0.50 0.00 0.00 0.00 178.15 178.72 1xrh h LYS 101 N 0.14 -0.15 -0.72 2.37 3.64 -0.87 0.15 116.57 121.12 1xrh h LYS 101 Ca 0.06 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.48 1xrh h LYS 101 Cb 0.33 0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.13 1xrh h LYS 101 CO 0.00 -0.10 0.45 1.15 -2.27 0.00 0.00 179.45 178.69 1xrh h THR 102 N -0.16 1.10 0.00 1.00 2.02 -0.58 -2.40 112.91 113.89 1xrh h THR 102 Ca 0.09 -0.30 -0.11 0.00 0.77 0.00 0.00 66.41 66.86 1xrh h THR 102 Cb 0.28 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 66.81 1xrh h THR 102 CO -0.22 0.16 -0.50 0.00 0.37 0.00 0.00 175.52 175.33 1xrh h ALA 103 N 1.31 1.07 -0.46 6.16 0.00 -0.51 0.51 119.26 127.34 1xrh h ALA 103 Ca 0.29 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1xrh h ALA 103 Cb 0.02 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1xrh h ALA 103 CO -0.11 0.63 0.28 0.37 0.00 0.00 0.00 179.25 180.42 1xrh h GLN 104 N 0.00 0.63 0.05 0.00 5.75 -0.52 0.23 115.11 121.26 1xrh h GLN 104 Ca -0.01 -0.06 -0.09 0.00 -0.15 0.00 0.00 58.65 58.35 1xrh h GLN 104 Cb 0.95 -0.13 0.01 0.00 1.07 0.00 0.00 27.48 29.37 1xrh h GLN 104 CO 0.07 0.47 -0.39 0.37 -2.65 0.00 0.00 178.83 176.69 1xrh h GLN 105 N 0.62 0.11 -0.19 1.69 5.75 -1.14 -3.40 115.11 118.55 1xrh h GLN 105 Ca 0.17 -0.19 0.00 0.00 -0.15 0.00 0.00 58.65 58.48 1xrh h GLN 105 Cb -0.00 0.07 0.00 0.00 1.07 0.00 0.00 27.48 28.62 1xrh h GLN 105 CO -0.03 1.09 0.00 0.09 -2.65 0.00 0.00 178.83 177.33 1xrh n ASN 106 N -4.41 2.81 0.00 -0.69 3.02 0.18 -5.01 115.26 111.16 1xrh n ASN 106 Ca -0.13 -1.83 0.00 0.00 -0.03 0.00 0.00 54.58 52.59 1xrh n ASN 106 Cb 0.62 -0.12 0.00 0.00 -0.61 0.00 0.00 39.78 39.68 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 1.05 2.95 3.21 7.41 0.00 0.80 -4.96 105.19 115.67 1xrh n GLY 107 Ca 0.13 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.04 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 -1.41 0.10 -0.27 1.61 1.01 -1.26 -0.88 120.40 119.30 1xrh s VAL 108 Ca 0.00 -0.79 -0.19 0.00 0.00 0.00 0.00 61.98 61.00 1xrh s VAL 108 Cb 0.00 -0.92 0.07 0.00 0.00 0.00 0.00 36.38 35.53 1xrh s VAL 108 CO 0.00 -0.44 0.67 0.00 0.00 0.00 0.00 175.10 175.34 1xrh s ALA 109 N -2.55 -1.76 -0.24 5.51 0.00 -0.69 -4.16 121.76 117.87 1xrh s ALA 109 Ca -0.05 2.18 0.02 0.00 0.00 0.00 0.00 51.96 54.11 1xrh s ALA 109 Cb -0.01 -1.28 0.06 0.00 0.00 0.00 0.00 23.12 21.89 1xrh s ALA 109 CO -0.04 -0.35 -0.09 0.08 0.00 0.00 0.00 175.76 175.36 1xrh s VAL 110 N 1.11 1.87 -0.12 0.00 1.01 0.20 -1.23 120.40 123.24 1xrh s VAL 110 Ca -0.06 -1.42 0.02 0.00 0.00 0.00 0.00 61.98 60.53 1xrh s VAL 110 Cb -0.05 -2.04 0.01 0.00 0.00 0.00 0.00 36.38 34.30 1xrh s VAL 110 CO -0.11 -0.04 -0.18 -0.69 0.00 0.00 0.00 175.10 174.08 1xrh s VAL 111 N 1.24 1.76 0.13 2.92 1.01 0.56 -2.12 120.40 125.89 1xrh s VAL 111 Ca -0.07 -0.80 -0.06 0.00 0.00 0.00 0.00 61.98 61.06 1xrh s VAL 111 Cb -0.19 -1.58 -0.06 0.00 0.00 0.00 0.00 36.38 34.55 1xrh s VAL 111 CO -0.06 0.49 0.38 -0.83 0.00 0.00 0.00 175.10 175.08 1xrh s GLY 112 N 0.94 2.25 -0.29 4.51 0.00 0.11 0.52 107.32 115.37 1xrh s GLY 112 Ca -0.06 -0.53 -0.01 0.00 0.00 0.00 0.00 44.72 44.13 1xrh s GLY 112 CO -0.02 -0.42 -0.03 -0.42 0.00 0.00 0.00 173.10 172.21 1xrh s ILE 113 N -1.61 2.79 -0.27 0.90 -1.09 0.12 -0.52 121.20 121.51 1xrh s ILE 113 Ca 0.39 -1.43 -0.08 0.00 -2.23 0.00 0.00 60.65 57.30 1xrh s ILE 113 Cb -0.12 -2.61 -0.02 0.00 -1.58 0.00 0.00 42.46 38.13 1xrh s ILE 113 CO 0.23 -0.08 0.11 -0.55 -1.23 0.00 0.00 174.94 173.42 1xrh s SER 114 N 1.22 5.34 -0.01 3.58 0.15 -0.61 -1.63 113.70 121.75 1xrh s SER 114 Ca -0.06 -0.32 -0.01 0.00 0.70 0.00 0.00 55.95 56.26 1xrh s SER 114 Cb -0.20 -1.96 0.00 0.00 -1.71 0.00 0.00 66.02 62.15 1xrh s SER 114 CO -0.02 -0.09 0.02 0.54 1.20 0.00 0.00 173.24 174.88 1xrh n ARG 115 N 4.95 -2.44 -1.61 5.44 1.74 -0.45 -1.21 116.66 123.08 1xrh n ARG 115 Ca -0.15 2.04 -0.04 0.00 -0.77 0.00 0.00 57.85 58.93 1xrh n ARG 115 Cb 0.51 -2.58 0.00 0.00 -1.02 0.00 0.00 32.46 29.37 1xrh n ARG 115 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xrh n GLY 117 N 0.86 2.53 3.68 -0.13 0.00 -0.75 -0.04 105.19 111.34 1xrh n GLY 117 Ca -0.03 -2.17 -0.45 0.00 0.00 0.00 0.00 46.02 43.37 1xrh n GLY 117 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1xrh n HIS 118 N -0.92 2.46 0.34 1.61 -0.00 -1.26 -3.70 115.22 113.75 1xrh n HIS 118 Ca 0.01 0.03 0.10 0.00 0.46 0.00 0.00 57.72 58.32 1xrh n HIS 118 Cb 0.10 -2.65 0.26 0.00 -0.12 0.00 0.00 29.99 27.58 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 5.02 3.01 0.00 0.26 3.41 -1.26 -3.54 113.62 120.51 1xrh n SER 119 Ca 0.18 -1.96 0.00 0.00 -0.26 0.00 0.00 58.87 56.84 1xrh n SER 119 Cb 0.33 -0.31 0.00 0.00 -0.26 0.00 0.00 64.21 63.97 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 1.41 -0.55 3.56 5.00 0.00 -1.26 -4.13 105.19 109.23 1xrh n GLY 120 Ca 0.19 -1.30 -0.42 0.00 0.00 0.00 0.00 46.02 44.49 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 -1.21 2.99 -0.95 4.61 0.00 -1.26 -4.89 121.76 121.05 1xrh s ALA 121 Ca 0.00 -0.98 0.07 0.00 0.00 0.00 0.00 51.96 51.05 1xrh s ALA 121 Cb 0.00 -4.02 0.30 0.00 0.00 0.00 0.00 23.12 19.41 1xrh s ALA 121 CO 0.00 -2.71 1.22 0.44 0.00 0.00 0.00 175.76 174.71 1xrh n ILE 122 N 6.54 1.56 0.30 0.00 -5.35 -1.26 -1.53 119.36 119.62 1xrh n ILE 122 Ca 0.06 0.41 0.15 0.00 -0.27 0.00 0.00 62.75 63.11 1xrh n ILE 122 Cb 0.49 -1.31 0.71 0.00 -1.74 0.00 0.00 39.64 37.78 1xrh n ILE 122 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 1xrh h SER 123 N 0.00 0.00 -0.49 7.28 4.64 -1.92 -2.69 113.55 120.37 1xrh h SER 123 Ca 0.00 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.33 1xrh h SER 123 Cb 0.10 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.16 1xrh h SER 123 CO 0.00 0.00 0.31 0.22 -0.87 0.00 0.00 176.83 176.49 1xrh h TYR 124 N 0.00 0.58 -0.34 4.77 3.20 -1.69 -1.46 116.97 122.03 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 0.24 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.31 1xrh h TYR 124 CO 0.00 0.35 -0.20 0.74 -1.64 0.00 0.00 178.16 177.41 1xrh h PHE 125 N 0.62 0.86 -0.15 -3.82 -1.00 -1.71 -2.31 116.94 109.44 1xrh h PHE 125 Ca 0.19 -0.22 -0.08 0.00 2.81 0.00 0.00 57.97 60.67 1xrh h PHE 125 Cb -0.03 -0.19 -0.01 0.00 3.61 0.00 0.00 35.95 39.33 1xrh h PHE 125 CO -0.05 0.96 -0.26 -0.39 -1.61 0.00 0.00 178.31 176.95 1xrh h VAL 126 N 0.51 1.25 -0.18 -0.55 -1.51 -1.57 -1.19 116.25 113.00 1xrh h VAL 126 Ca 0.07 -1.17 -0.03 0.00 -1.23 0.00 0.00 66.70 64.34 1xrh h VAL 126 Cb 0.75 1.43 -0.01 0.00 -2.13 0.00 0.00 31.29 31.33 1xrh h VAL 126 CO 0.06 0.36 -0.04 1.56 -1.23 0.00 0.00 177.57 178.28 1xrh h GLN 127 N 0.25 0.27 0.11 5.19 4.20 -1.14 0.10 115.11 124.08 1xrh h GLN 127 Ca 0.04 -0.05 0.01 0.00 0.06 0.00 0.00 58.65 58.71 1xrh h GLN 127 Cb 0.60 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.32 1xrh h GLN 127 CO 0.04 0.33 -0.12 1.96 -0.67 0.00 0.00 178.83 180.37 1xrh h GLN 128 N 0.26 -0.26 -0.50 1.46 4.20 -0.65 0.34 115.11 119.98 1xrh h GLN 128 Ca 0.06 0.02 0.07 0.00 0.06 0.00 0.00 58.65 58.86 1xrh h GLN 128 Cb 0.25 0.06 -0.06 0.00 0.30 0.00 0.00 27.48 28.03 1xrh h GLN 128 CO 0.01 -0.17 0.16 0.00 -0.67 0.00 0.00 178.83 178.16 1xrh h ALA 129 N 0.60 0.60 -0.38 3.87 0.00 -0.68 -2.04 119.26 121.24 1xrh h ALA 129 Ca 0.01 0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 1xrh h ALA 129 Cb 0.26 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1xrh h ALA 129 CO -0.05 -0.23 -0.11 0.00 0.00 0.00 0.00 179.25 178.86 1xrh h ALA 130 N 1.34 1.10 0.00 0.00 0.00 -0.29 -0.39 119.26 121.03 1xrh h ALA 130 Ca 0.24 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1xrh h ALA 130 Cb 0.27 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1xrh h ALA 130 CO -0.26 0.56 -0.02 0.00 0.00 0.00 0.00 179.25 179.53 1xrh h ARG 131 N 0.61 0.00 -0.36 0.00 3.08 0.36 -0.31 114.38 117.76 1xrh h ARG 131 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.16 1xrh h ARG 131 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 1xrh h ARG 131 CO 0.03 0.02 0.00 0.00 -1.07 0.00 0.00 179.97 178.95 1xrh n ALA 132 N -2.12 2.45 -0.51 0.04 0.00 -0.40 -4.90 120.51 115.08 1xrh n ALA 132 Ca -0.02 -0.81 0.00 0.00 0.00 0.00 0.00 53.44 52.62 1xrh n ALA 132 Cb 0.18 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.65 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 1.32 0.75 3.61 0.00 0.00 -0.13 -5.06 105.19 105.68 1xrh n GLY 133 Ca 0.18 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.09 2.51 0.14 1.61 2.99 -0.29 -4.57 117.98 118.27 1xrh s PHE 134 Ca 0.00 -0.45 -0.27 0.00 0.00 0.00 0.00 56.93 56.21 1xrh s PHE 134 Cb 0.00 -1.45 -0.07 0.00 0.00 0.00 0.00 43.02 41.50 1xrh s PHE 134 CO 0.00 0.51 0.86 0.42 -0.00 0.00 0.00 175.22 177.01 1xrh s ILE 135 N -2.54 4.42 0.01 0.64 1.01 -0.25 -2.63 121.20 121.87 1xrh s ILE 135 Ca 0.34 1.87 0.05 0.00 0.00 0.00 0.00 60.65 62.91 1xrh s ILE 135 Cb 0.00 -4.22 -0.02 0.00 0.01 0.00 0.00 42.46 38.23 1xrh s ILE 135 CO 0.19 0.43 -0.16 -0.83 0.00 0.00 0.00 174.94 174.56 1xrh s GLY 136 N -0.59 0.85 0.00 6.18 0.00 -0.21 -1.46 107.32 112.10 1xrh s GLY 136 Ca 0.40 -0.80 0.00 0.00 0.00 0.00 0.00 44.72 44.32 1xrh s GLY 136 CO 0.28 -0.72 -0.00 -0.42 0.00 0.00 0.00 173.10 172.23 1xrh s ILE 137 N -0.60 0.03 0.26 0.90 1.01 -0.11 -0.94 121.20 121.75 1xrh s ILE 137 Ca 0.05 -0.07 -0.15 0.00 0.00 0.00 0.00 60.65 60.48 1xrh s ILE 137 Cb -0.07 -0.04 0.00 0.00 0.01 0.00 0.00 42.46 42.36 1xrh s ILE 137 CO 0.00 -0.02 0.55 -0.55 0.00 0.00 0.00 174.94 174.92 1xrh s SER 138 N -0.10 -0.14 0.00 3.58 0.15 -0.27 -1.06 113.70 115.87 1xrh s SER 138 Ca -0.01 -0.83 0.00 0.00 0.70 0.00 0.00 55.95 55.81 1xrh s SER 138 Cb -0.01 0.63 0.00 0.00 -1.71 0.00 0.00 66.02 64.93 1xrh s SER 138 CO -0.00 -1.20 0.00 0.00 1.20 0.00 0.00 173.24 173.24 1xrh s GLN 141 N -2.00 2.00 0.27 0.00 -0.21 -1.14 -3.47 119.66 115.10 1xrh s GLN 141 Ca 0.00 -0.34 -0.19 0.00 0.02 0.00 0.00 55.36 54.85 1xrh s GLN 141 Cb 0.00 -2.15 0.02 0.00 1.00 0.00 0.00 33.01 31.87 1xrh s GLN 141 CO 0.00 -1.37 0.65 0.45 -2.12 0.00 0.00 175.29 172.90 1xrh s SER 142 N -4.57 -0.23 -0.06 5.90 0.15 -1.26 -4.83 113.70 108.79 1xrh s SER 142 Ca 0.62 -0.66 -0.40 0.00 0.70 0.00 0.00 55.95 56.21 1xrh s SER 142 Cb -0.10 0.69 -0.18 0.00 -1.71 0.00 0.00 66.02 64.72 1xrh s SER 142 CO 0.45 -1.28 1.29 0.47 1.20 0.00 0.00 173.24 175.38 1xrh n ASP 143 N -0.43 0.92 -4.67 5.45 10.43 -1.26 -4.00 116.55 122.99 1xrh n ASP 143 Ca -0.04 1.14 -0.43 0.00 2.57 0.00 0.00 54.79 58.03 1xrh n ASP 143 Cb 0.60 -1.03 -0.00 0.00 1.84 0.00 0.00 41.12 42.53 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 2.51 1.88 -1.23 -0.24 -0.02 -1.26 -3.77 135.00 132.88 1xrh n PRO 144 Ca 0.21 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.36 1xrh n PRO 144 Cb 0.10 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 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 0.18 -1.49 -2.97 -1.45 0.31 0.67 -4.87 118.33 108.72 1xrh n VAL 146 Ca 0.06 0.68 -0.40 0.00 -0.01 0.00 0.00 64.34 64.68 1xrh n VAL 146 Cb 0.36 -0.94 -0.06 0.00 -0.91 0.00 0.00 33.84 32.29 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 -2.99 4.48 0.88 2.52 -7.23 -1.04 -0.93 120.40 116.09 1xrh s VAL 147 Ca 0.00 1.71 -0.11 0.00 -1.81 0.00 0.00 61.98 61.76 1xrh s VAL 147 Cb 0.00 -4.14 0.12 0.00 0.56 0.00 0.00 36.38 32.92 1xrh s VAL 147 CO 0.00 0.46 1.09 -2.16 -0.31 0.00 0.00 175.10 174.19 1xrh s PRO 148 N -0.76 1.37 0.14 4.82 0.04 -1.26 -4.47 135.00 134.88 1xrh s PRO 148 Ca 0.37 0.97 -0.35 0.00 0.04 0.00 0.00 61.00 62.04 1xrh s PRO 148 Cb -0.22 -1.81 -0.15 0.00 0.04 0.00 0.00 34.50 32.36 1xrh s PRO 148 CO 0.26 -2.20 1.49 0.34 0.04 0.00 0.00 177.00 176.92 1xrh n PHE 149 N -3.88 2.00 -0.97 0.56 7.35 -1.26 -0.71 117.46 120.56 1xrh n PHE 149 Ca 0.08 0.40 0.00 0.00 -0.76 0.00 0.00 57.45 57.17 1xrh n PHE 149 Cb 0.54 -2.47 0.00 0.00 0.35 0.00 0.00 39.48 37.91 1xrh n PHE 149 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1xrh n GLY 150 N 3.05 0.79 3.82 7.13 0.00 -1.26 -5.03 105.19 113.69 1xrh n GLY 150 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 1xrh n GLY 150 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xrh s GLY 151 N -2.00 2.21 0.00 -0.02 0.00 0.11 -5.06 107.32 102.57 1xrh s GLY 151 Ca 0.00 -1.97 0.01 0.00 0.00 0.00 0.00 44.72 42.75 1xrh s GLY 151 CO 0.00 -1.78 0.28 0.00 0.00 0.00 0.00 173.10 171.59 1xrh n ALA 152 N -1.42 2.30 -2.56 3.20 0.00 -1.26 -4.70 120.51 116.06 1xrh n ALA 152 Ca 0.02 -0.26 -0.33 0.00 0.00 0.00 0.00 53.44 52.87 1xrh n ALA 152 Cb 0.63 -0.03 -0.11 0.00 0.00 0.00 0.00 19.45 19.93 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 -0.60 2.59 0.62 0.00 2.02 -1.26 -4.43 118.70 117.64 1xrh s GLU 153 Ca 0.01 -0.67 -0.16 0.00 0.02 0.00 0.00 54.97 54.17 1xrh s GLU 153 Cb 0.01 -2.50 -0.02 0.00 0.10 0.00 0.00 34.13 31.72 1xrh s GLU 153 CO 0.03 0.63 1.10 0.96 0.02 0.00 0.00 175.26 177.99 1xrh s ILE 154 N -0.88 3.33 0.00 -1.63 -4.36 -1.26 -4.12 121.20 112.28 1xrh s ILE 154 Ca 0.14 0.66 0.00 0.00 -0.26 0.00 0.00 60.65 61.20 1xrh s ILE 154 Cb -0.11 -3.19 0.00 0.00 1.25 0.00 0.00 42.46 40.41 1xrh s ILE 154 CO 0.04 -0.34 0.00 0.00 0.24 0.00 0.00 174.94 174.88 1xrh n TYR 155 N -2.10 -0.21 -2.12 1.37 9.36 -0.11 -4.85 117.16 118.51 1xrh n TYR 155 Ca 0.10 0.00 -0.27 0.00 3.32 0.00 0.00 57.90 61.05 1xrh n TYR 155 Cb 0.52 0.17 0.12 0.00 -0.63 0.00 0.00 39.34 39.52 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 -0.34 2.26 0.00 2.98 4.12 -1.24 -2.36 117.35 122.78 1xrh s TYR 156 Ca 0.00 0.34 0.00 0.00 0.02 0.00 0.00 57.07 57.43 1xrh s TYR 156 Cb 0.00 -3.54 0.00 0.00 -1.52 0.00 0.00 41.96 36.90 1xrh s TYR 156 CO 0.00 -1.95 0.00 0.41 0.02 0.00 0.00 175.55 174.03 1xrh n GLY 157 N -3.27 3.74 0.00 0.71 0.00 -1.25 -0.24 105.19 104.89 1xrh n GLY 157 Ca 0.12 -2.18 0.06 0.00 0.00 0.00 0.00 46.02 44.01 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 -0.24 0.00 -0.14 2.61 -2.24 -1.26 -4.78 114.28 108.22 1xrh n THR 158 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1xrh n THR 158 Cb 0.00 -0.61 0.00 0.00 -2.10 0.00 0.00 70.33 67.62 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 -0.87 0.00 -4.87 3.42 3.02 -1.26 -2.62 115.26 112.08 1xrh n ASN 159 Ca 0.09 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.33 1xrh n ASN 159 Cb 0.04 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.22 1xrh n ASN 159 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1xrh s PRO 160 N 0.00 3.59 0.03 3.52 0.04 -1.23 -3.89 135.00 137.06 1xrh s PRO 160 Ca 0.00 0.73 0.03 0.00 0.04 0.00 0.00 61.00 61.80 1xrh s PRO 160 Cb 0.00 -2.09 -0.02 0.00 0.04 0.00 0.00 34.50 32.44 1xrh s PRO 160 CO 0.00 -0.57 -0.09 -1.17 0.04 0.00 0.00 177.00 175.22 1xrh s LEU 161 N -5.17 2.17 0.04 -3.56 2.96 -1.26 -2.55 118.68 111.30 1xrh s LEU 161 Ca 0.55 -0.40 -0.09 0.00 -0.22 0.00 0.00 54.13 53.98 1xrh s LEU 161 Cb -0.11 -0.30 0.00 0.00 0.50 0.00 0.00 46.19 46.28 1xrh s LEU 161 CO 0.54 -0.07 0.17 0.00 -1.32 0.00 0.00 176.35 175.67 1xrh s ALA 162 N -0.89 -0.30 -0.08 5.97 0.00 0.97 -4.57 121.76 122.87 1xrh s ALA 162 Ca -0.04 -0.32 -0.13 0.00 0.00 0.00 0.00 51.96 51.47 1xrh s ALA 162 Cb -0.07 0.26 0.03 0.00 0.00 0.00 0.00 23.12 23.34 1xrh s ALA 162 CO 0.00 -0.34 0.33 0.12 0.00 0.00 0.00 175.76 175.87 1xrh s PHE 163 N -2.47 -0.28 -0.02 0.00 5.36 0.23 -1.11 117.98 119.68 1xrh s PHE 163 Ca -0.06 0.61 -0.23 0.00 -0.96 0.00 0.00 56.93 56.29 1xrh s PHE 163 Cb -0.02 0.11 0.05 0.00 -0.34 0.00 0.00 43.02 42.83 1xrh s PHE 163 CO -0.03 -0.28 0.51 0.00 -1.46 0.00 0.00 175.22 173.96 1xrh s ALA 164 N -0.52 -1.31 -0.13 11.12 0.00 -0.12 0.09 121.76 130.90 1xrh s ALA 164 Ca -0.06 0.83 -0.18 0.00 0.00 0.00 0.00 51.96 52.54 1xrh s ALA 164 Cb -0.04 0.07 0.04 0.00 0.00 0.00 0.00 23.12 23.20 1xrh s ALA 164 CO 0.02 -0.34 0.47 0.00 0.00 0.00 0.00 175.76 175.91 1xrh s ALA 165 N -1.38 -1.17 0.33 0.00 0.00 -0.09 -1.04 121.76 118.41 1xrh s ALA 165 Ca -0.11 1.12 -0.27 0.00 0.00 0.00 0.00 51.96 52.70 1xrh s ALA 165 Cb -0.02 -0.50 -0.09 0.00 0.00 0.00 0.00 23.12 22.50 1xrh s ALA 165 CO 0.06 -0.25 1.01 -1.25 0.00 0.00 0.00 175.76 175.33 1xrh s PRO 166 N -0.27 4.50 0.00 0.00 0.04 -1.26 -0.28 135.00 137.73 1xrh s PRO 166 Ca -0.04 1.51 0.00 0.00 0.04 0.00 0.00 61.00 62.50 1xrh s PRO 166 Cb -0.03 -2.86 0.00 0.00 0.04 0.00 0.00 34.50 31.64 1xrh s PRO 166 CO 0.03 0.16 0.00 0.41 0.04 0.00 0.00 177.00 177.64 1xrh n GLY 167 N 0.74 4.65 3.84 0.56 0.00 0.14 -4.45 105.19 110.67 1xrh n GLY 167 Ca 0.02 -1.99 -0.31 0.00 0.00 0.00 0.00 46.02 43.74 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 2.21 3.26 5.70 1.61 2.02 -1.20 -4.62 118.70 127.67 1xrh s GLU 168 Ca 0.00 0.90 0.00 0.00 0.02 0.00 0.00 54.97 55.89 1xrh s GLU 168 Cb 0.00 -2.03 0.00 0.00 0.10 0.00 0.00 34.13 32.20 1xrh s GLU 168 CO 0.00 -0.84 0.00 0.41 0.02 0.00 0.00 175.26 174.85 1xrh n GLY 169 N -2.15 3.58 0.96 -1.39 0.00 -1.26 -0.96 105.19 103.97 1xrh n GLY 169 Ca 0.07 0.10 0.11 0.00 0.00 0.00 0.00 46.02 46.31 1xrh n GLY 169 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1xrh n ASP 170 N 5.79 2.89 -4.73 1.61 10.43 -1.26 -4.98 116.55 126.30 1xrh n ASP 170 Ca 0.00 -1.91 -0.42 0.00 2.57 0.00 0.00 54.79 55.03 1xrh n ASP 170 Cb 0.00 -0.19 -0.03 0.00 1.84 0.00 0.00 41.12 42.75 1xrh n ASP 170 CO 0.00 0.00 0.00 -1.61 -1.07 0.00 0.00 177.20 174.52 1xrh s GLU 171 N -1.63 4.32 -0.01 -1.24 2.02 -0.13 -4.96 118.70 117.08 1xrh s GLU 171 Ca 0.36 2.13 0.01 0.00 0.02 0.00 0.00 54.97 57.49 1xrh s GLU 171 Cb 0.21 -3.20 0.01 0.00 0.10 0.00 0.00 34.13 31.25 1xrh s GLU 171 CO 0.30 -0.39 -0.02 0.42 0.02 0.00 0.00 175.26 175.60 1xrh s ILE 172 N 0.56 0.17 -0.35 -1.63 1.01 -1.26 0.25 121.20 119.95 1xrh s ILE 172 Ca 0.61 -0.05 -0.12 0.00 0.00 0.00 0.00 60.65 61.10 1xrh s ILE 172 Cb -0.38 -0.18 0.00 0.00 0.01 0.00 0.00 42.46 41.91 1xrh s ILE 172 CO 0.35 0.07 0.21 -0.22 0.00 0.00 0.00 174.94 175.36 1xrh s LEU 173 N 0.22 4.55 -0.14 2.97 0.20 0.62 -4.93 118.68 122.17 1xrh s LEU 173 Ca -0.02 -0.70 0.01 0.00 0.69 0.00 0.00 54.13 54.12 1xrh s LEU 173 Cb -0.04 -2.07 -0.00 0.00 -0.43 0.00 0.00 46.19 43.65 1xrh s LEU 173 CO -0.01 -0.30 -0.18 -0.89 -0.29 0.00 0.00 176.35 174.69 1xrh s THR 174 N 1.63 2.50 -0.10 3.68 2.01 -1.26 -0.91 115.64 123.19 1xrh s THR 174 Ca 0.04 -0.84 0.03 0.00 0.31 0.00 0.00 61.69 61.23 1xrh s THR 174 Cb -0.18 -2.03 0.01 0.00 0.01 0.00 0.00 72.50 70.31 1xrh s THR 174 CO 0.08 0.53 -0.17 0.12 -0.69 0.00 0.00 174.62 174.49 1xrh s PHE 175 N 0.69 2.02 0.25 4.92 5.36 0.11 -3.47 117.98 127.86 1xrh s PHE 175 Ca -0.08 -0.87 0.04 0.00 -0.96 0.00 0.00 56.93 55.06 1xrh s PHE 175 Cb -0.16 -1.42 -0.05 0.00 -0.34 0.00 0.00 43.02 41.05 1xrh s PHE 175 CO 0.02 -0.41 -0.01 0.34 -1.46 0.00 0.00 175.22 173.69 1xrh s ASP 176 N 0.71 2.05 0.15 6.13 3.68 -1.26 -0.60 116.67 127.53 1xrh s ASP 176 Ca -0.12 -1.22 0.10 0.00 2.13 0.00 0.00 52.55 53.43 1xrh s ASP 176 Cb -0.16 -0.03 -0.04 0.00 -1.45 0.00 0.00 42.92 41.24 1xrh s ASP 176 CO 0.03 -0.48 -0.22 0.00 0.13 0.00 0.00 175.17 174.63 1xrh s ALA 178 N -3.33 2.15 -2.10 3.66 0.00 -1.26 -5.03 121.76 115.85 1xrh s ALA 178 Ca 0.29 -1.47 0.28 0.00 0.00 0.00 0.00 51.96 51.07 1xrh s ALA 178 Cb 0.05 -0.27 1.16 0.00 0.00 0.00 0.00 23.12 24.07 1xrh s ALA 178 CO 0.10 0.36 1.81 0.25 0.00 0.00 0.00 175.76 178.28 1xrh n THR 179 N 0.58 0.00 -3.02 0.00 -2.24 -1.08 -4.86 114.28 103.66 1xrh n THR 179 Ca -0.15 -0.15 -0.21 0.00 -2.27 0.00 0.00 64.05 61.27 1xrh n THR 179 Cb 0.55 0.20 0.01 0.00 -2.10 0.00 0.00 70.33 69.00 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 -2.19 3.63 0.16 4.28 -4.23 -1.26 -0.19 115.64 115.83 1xrh s THR 180 Ca 0.35 -0.70 -0.15 0.00 -1.18 0.00 0.00 61.69 60.01 1xrh s THR 180 Cb 0.21 -3.31 0.03 0.00 1.34 0.00 0.00 72.50 70.76 1xrh s THR 180 CO 0.40 -0.19 1.82 0.58 -0.54 0.00 0.00 174.62 176.69 1xrh h VAL 181 N 0.46 1.09 -3.95 2.29 2.07 -1.36 -3.36 116.25 113.49 1xrh h VAL 181 Ca -0.45 -0.19 -0.25 0.00 0.82 0.00 0.00 66.70 66.63 1xrh h VAL 181 Cb 1.27 0.47 -0.20 0.00 -1.52 0.00 0.00 31.29 31.31 1xrh h VAL 181 CO 0.54 0.10 -0.72 -1.58 0.02 0.00 0.00 177.57 175.93 1xrh s GLN 182 N -6.16 0.55 0.76 1.57 2.00 -1.26 -4.93 119.66 112.19 1xrh s GLN 182 Ca -0.13 -0.85 -0.11 0.00 -2.00 0.00 0.00 55.36 52.28 1xrh s GLN 182 Cb 0.11 -0.21 0.05 0.00 0.80 0.00 0.00 33.01 33.76 1xrh s GLN 182 CO 0.73 0.02 1.09 0.00 -0.50 0.00 0.00 175.29 176.63 1xrh s ALA 183 N -1.84 2.30 0.43 1.58 0.00 -1.26 -4.94 121.76 118.04 1xrh s ALA 183 Ca -0.07 0.26 0.10 0.00 0.00 0.00 0.00 51.96 52.26 1xrh s ALA 183 Cb -0.07 -3.27 0.94 0.00 0.00 0.00 0.00 23.12 20.73 1xrh s ALA 183 CO -0.01 -1.70 2.03 2.35 0.00 0.00 0.00 175.76 178.43 1xrh h TRP 184 N -1.04 0.28 -0.12 0.00 -0.00 -2.01 -2.50 115.95 110.57 1xrh h TRP 184 Ca -0.44 -0.01 0.03 0.00 -0.00 0.00 0.00 58.89 58.48 1xrh h TRP 184 Cb 1.23 -0.09 -0.00 0.00 -0.00 0.00 0.00 29.16 30.30 1xrh h TRP 184 CO 0.58 0.26 0.11 0.78 -0.00 0.00 0.00 178.44 180.17 1xrh h GLY 185 N 0.47 0.00 1.74 2.65 0.00 -1.96 0.63 103.07 106.61 1xrh h GLY 185 Ca 0.07 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.18 1xrh h GLY 185 CO -0.00 0.00 -0.96 0.50 0.00 0.00 0.00 176.54 176.08 1xrh h LYS 186 N 0.00 0.22 -0.04 4.80 1.79 -1.82 -1.32 116.57 120.20 1xrh h LYS 186 Ca 0.06 -0.27 -0.18 0.00 -2.18 0.00 0.00 60.65 58.07 1xrh h LYS 186 Cb 0.27 0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 31.00 1xrh h LYS 186 CO -0.00 1.03 -0.77 0.28 -1.08 0.00 0.00 179.45 178.91 1xrh h VAL 187 N 0.11 1.42 -0.28 0.50 2.07 -1.31 -2.55 116.25 116.21 1xrh h VAL 187 Ca -0.06 -2.29 -0.03 0.00 0.82 0.00 0.00 66.70 65.14 1xrh h VAL 187 Cb 1.62 2.23 -0.01 0.00 -1.52 0.00 0.00 31.29 33.61 1xrh h VAL 187 CO 0.15 0.68 0.06 -0.07 0.02 0.00 0.00 177.57 178.40 1xrh h LEU 188 N 0.19 0.44 0.10 2.57 3.38 -0.87 -2.57 115.31 118.55 1xrh h LEU 188 Ca -0.03 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.69 1xrh h LEU 188 Cb 1.35 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.98 1xrh h LEU 188 CO 0.12 0.57 -0.07 -0.78 0.09 0.00 0.00 178.44 178.37 1xrh h ASP 189 N 0.28 -0.18 0.57 -0.43 -0.00 -1.21 -2.41 116.42 113.05 1xrh h ASP 189 Ca 0.09 0.01 0.00 0.00 -0.00 0.00 0.00 57.03 57.13 1xrh h ASP 189 Cb 0.31 0.06 0.00 0.00 -0.00 0.00 0.00 39.33 39.70 1xrh h ASP 189 CO 0.00 -0.11 0.00 0.00 -0.00 0.00 0.00 179.24 179.13 1xrh h ALA 190 N 0.72 1.00 -0.02 -0.78 0.00 -1.51 0.20 119.26 118.87 1xrh h ALA 190 Ca -0.01 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1xrh h ALA 190 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1xrh h ALA 190 CO 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 179.25 179.02 1xrh h ARG 191 N 0.00 0.18 -0.04 0.00 3.08 -1.01 -2.18 114.38 114.41 1xrh h ARG 191 Ca 0.00 -0.18 -0.17 0.00 0.07 0.00 0.00 59.98 59.70 1xrh h ARG 191 Cb 0.29 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 1xrh h ARG 191 CO 0.00 0.88 -0.72 0.66 -1.07 0.00 0.00 179.97 179.71 1xrh h SER 192 N -0.44 0.27 0.04 7.04 4.64 -1.10 -2.97 113.55 121.03 1xrh h SER 192 Ca -0.02 -0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 1xrh h SER 192 Cb 0.95 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 1xrh h SER 192 CO 0.05 0.90 -0.01 0.54 -0.87 0.00 0.00 176.83 177.44 1xrh n ARG 193 N -3.78 1.21 -2.87 4.77 1.74 0.02 -5.12 116.66 112.64 1xrh n ARG 193 Ca -0.03 -0.39 -0.07 0.00 -0.77 0.00 0.00 57.85 56.59 1xrh n ARG 193 Cb 0.70 -1.49 0.01 0.00 -1.02 0.00 0.00 32.46 30.66 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 -0.55 -7.76 -4.32 0.55 5.15 -0.82 -5.01 115.26 102.50 1xrh n ASN 194 Ca 0.21 0.83 -0.21 0.00 -0.60 0.00 0.00 54.58 54.81 1xrh n ASN 194 Cb 0.22 -4.92 -0.10 0.00 -0.53 0.00 0.00 39.78 34.46 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 -2.07 2.16 0.17 1.20 0.15 -1.26 -5.04 113.70 109.02 1xrh s SER 196 Ca 0.15 -1.46 0.04 0.00 0.70 0.00 0.00 55.95 55.39 1xrh s SER 196 Cb -0.04 0.13 -0.05 0.00 -1.71 0.00 0.00 66.02 64.36 1xrh s SER 196 CO 0.74 -0.72 -0.08 0.27 1.20 0.00 0.00 173.24 174.65 1xrh s ILE 197 N -3.40 1.16 0.67 6.45 -4.36 0.31 -4.96 121.20 117.07 1xrh s ILE 197 Ca 0.34 -2.06 -0.17 0.00 -0.26 0.00 0.00 60.65 58.50 1xrh s ILE 197 Cb 0.07 -1.99 0.00 0.00 1.25 0.00 0.00 42.46 41.79 1xrh s ILE 197 CO 0.15 -0.63 1.24 -2.84 0.24 0.00 0.00 174.94 173.10 1xrh s PRO 198 N -3.77 2.50 0.00 0.37 0.02 -1.26 -4.48 135.00 128.38 1xrh s PRO 198 Ca 0.20 1.88 0.00 0.00 0.02 0.00 0.00 61.00 63.11 1xrh s PRO 198 Cb 0.03 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.69 1xrh s PRO 198 CO 0.03 -1.59 0.62 -0.40 -0.33 0.00 0.00 177.00 175.33 1xrh n ASP 199 N -2.14 0.38 -0.32 2.53 5.75 -1.26 -3.70 116.55 117.78 1xrh n ASP 199 Ca 0.14 -1.61 0.07 0.00 -0.01 0.00 0.00 54.79 53.38 1xrh n ASP 199 Cb 0.49 -0.19 -0.00 0.00 -1.03 0.00 0.00 41.12 40.39 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 -0.22 0.00 0.01 2.12 -2.24 -1.26 -4.52 114.28 108.17 1xrh n THR 200 Ca 0.00 -0.34 0.02 0.00 -2.27 0.00 0.00 64.05 61.46 1xrh n THR 200 Cb 0.10 1.17 -0.10 0.00 -2.10 0.00 0.00 70.33 69.39 1xrh n THR 200 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 1xrh n TRP 201 N -0.19 0.60 -3.78 4.78 8.01 -1.24 -4.77 117.44 120.83 1xrh n TRP 201 Ca 0.06 0.19 -0.10 0.00 -1.31 0.00 0.00 57.50 56.35 1xrh n TRP 201 Cb 0.31 -0.93 -0.04 0.00 -2.01 0.00 0.00 31.31 28.64 1xrh n TRP 201 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1xrh s ALA 202 N -3.04 -0.76 0.20 6.99 0.00 -1.26 -1.29 121.76 122.60 1xrh s ALA 202 Ca -0.05 -0.35 0.05 0.00 0.00 0.00 0.00 51.96 51.61 1xrh s ALA 202 Cb 0.09 0.85 -0.05 0.00 0.00 0.00 0.00 23.12 24.02 1xrh s ALA 202 CO 0.83 -0.77 -0.08 0.54 0.00 0.00 0.00 175.76 176.28 1xrh s VAL 203 N -3.89 1.31 0.00 0.00 0.11 -0.26 -2.38 120.40 115.28 1xrh s VAL 203 Ca 0.11 -2.09 0.00 0.00 -2.93 0.00 0.00 61.98 57.06 1xrh s VAL 203 Cb -0.00 -2.10 0.00 0.00 -1.53 0.00 0.00 36.38 32.75 1xrh s VAL 203 CO -0.02 -0.55 0.00 -0.90 -3.33 0.00 0.00 175.10 170.30 1xrh n ASP 204 N -0.34 0.00 0.28 3.54 5.68 0.26 -0.96 116.55 125.01 1xrh n ASP 204 Ca -0.08 -0.70 0.19 0.00 -0.50 0.00 0.00 54.79 53.70 1xrh n ASP 204 Cb 0.62 0.00 0.85 0.00 -1.14 0.00 0.00 41.12 41.45 1xrh n ASP 204 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 1xrh h LYS 205 N 0.00 0.00 -0.02 0.11 3.64 -1.89 -2.62 116.57 115.79 1xrh h LYS 205 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1xrh h LYS 205 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1xrh h LYS 205 CO 0.00 0.00 -0.17 -1.71 -2.27 0.00 0.00 179.45 175.30 1xrh n ASN 206 N -2.98 2.39 0.00 4.20 4.05 -1.26 -4.89 115.26 116.78 1xrh n ASN 206 Ca -0.01 -1.70 0.00 0.00 0.45 0.00 0.00 54.58 53.33 1xrh n ASN 206 Cb 0.21 0.19 0.00 0.00 1.23 0.00 0.00 39.78 41.41 1xrh n ASN 206 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1xrh n GLY 207 N 1.23 0.81 3.64 8.20 0.00 -0.99 -4.81 105.19 113.28 1xrh n GLY 207 Ca 0.11 -0.24 -0.34 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.00 4.80 0.39 1.61 1.01 -1.26 -4.79 120.40 120.15 1xrh s VAL 208 Ca 0.00 -0.03 -0.25 0.00 0.00 0.00 0.00 61.98 61.70 1xrh s VAL 208 Cb 0.00 -3.16 -0.12 0.00 0.00 0.00 0.00 36.38 33.10 1xrh s VAL 208 CO 0.00 0.46 0.88 -0.81 0.00 0.00 0.00 175.10 175.63 1xrh n PRO 209 N 3.51 1.11 -3.93 2.72 -0.04 -1.26 -0.57 135.00 136.54 1xrh n PRO 209 Ca -0.17 0.40 -0.10 0.00 -0.04 0.00 0.00 63.50 63.59 1xrh n PRO 209 Cb 0.52 -1.84 -0.11 0.00 -0.04 0.00 0.00 33.50 32.04 1xrh n PRO 209 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1xrh s THR 210 N -1.27 0.09 -1.97 0.52 -1.32 -1.00 -4.76 115.64 105.93 1xrh s THR 210 Ca 0.62 -0.78 0.19 0.00 -1.21 0.00 0.00 61.69 60.51 1xrh s THR 210 Cb -0.61 -0.33 0.05 0.00 -1.51 0.00 0.00 72.50 70.10 1xrh s THR 210 CO 0.58 -0.43 1.01 0.35 -2.21 0.00 0.00 174.62 173.91 1xrh n THR 211 N 1.58 0.00 -3.21 5.08 -2.24 -1.26 -4.51 114.28 109.71 1xrh n THR 211 Ca -0.23 -0.38 -0.40 0.00 -2.27 0.00 0.00 64.05 60.77 1xrh n THR 211 Cb 0.55 1.29 -0.07 0.00 -2.10 0.00 0.00 70.33 70.00 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 -1.94 6.52 0.18 3.42 -1.08 -1.26 -0.53 116.67 121.98 1xrh s ASP 212 Ca 0.18 0.63 0.23 0.00 -0.52 0.00 0.00 52.55 53.06 1xrh s ASP 212 Cb 0.15 -2.30 0.90 0.00 -1.46 0.00 0.00 42.92 40.22 1xrh s ASP 212 CO 0.39 -0.26 1.69 -0.81 0.52 0.00 0.00 175.17 176.70 1xrh n PRO 213 N 5.24 0.16 0.02 4.34 -0.04 -1.26 -2.85 135.00 140.60 1xrh n PRO 213 Ca -0.04 0.32 0.08 0.00 -0.04 0.00 0.00 63.50 63.83 1xrh n PRO 213 Cb 0.50 -1.76 -0.11 0.00 -0.04 0.00 0.00 33.50 32.08 1xrh n PRO 213 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1xrh n PHE 214 N -2.05 0.38 1.12 0.54 3.72 -1.26 -3.89 117.46 116.02 1xrh n PHE 214 Ca 0.03 0.11 0.11 0.00 -0.05 0.00 0.00 57.45 57.66 1xrh n PHE 214 Cb 0.26 -0.74 0.36 0.00 -0.94 0.00 0.00 39.48 38.42 1xrh n PHE 214 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1xrh n ALA 215 N -2.30 2.51 -1.99 4.37 0.00 -1.13 -4.89 120.51 117.08 1xrh n ALA 215 Ca -0.06 -0.59 -0.42 0.00 0.00 0.00 0.00 53.44 52.37 1xrh n ALA 215 Cb 0.65 -1.06 -0.03 0.00 0.00 0.00 0.00 19.45 19.01 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 -1.78 3.27 -0.14 0.00 1.01 -1.20 -4.31 120.40 117.25 1xrh s VAL 216 Ca 0.34 0.62 0.08 0.00 0.00 0.00 0.00 61.98 63.02 1xrh s VAL 216 Cb 0.19 -3.40 -0.14 0.00 0.00 0.00 0.00 36.38 33.02 1xrh s VAL 216 CO 0.28 -0.02 -0.02 1.57 0.00 0.00 0.00 175.10 176.91 1xrh n HIS 217 N 5.95 0.00 -3.76 5.22 -0.00 -0.14 -4.95 115.22 117.54 1xrh n HIS 217 Ca 0.16 0.00 -0.11 0.00 0.46 0.00 0.00 57.72 58.23 1xrh n HIS 217 Cb 0.42 -0.63 -0.07 0.00 -0.12 0.00 0.00 29.99 29.58 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 -2.32 -0.64 0.34 1.57 0.00 -0.95 -4.92 121.76 114.84 1xrh s ALA 218 Ca -0.12 -0.10 0.04 0.00 0.00 0.00 0.00 51.96 51.78 1xrh s ALA 218 Cb 0.04 0.39 -0.01 0.00 0.00 0.00 0.00 23.12 23.54 1xrh s ALA 218 CO 0.48 -0.46 0.49 -0.51 0.00 0.00 0.00 175.76 175.76 1xrh s LEU 219 N -2.28 3.99 0.15 0.00 1.43 -1.26 -1.11 118.68 119.60 1xrh s LEU 219 Ca -0.02 0.03 -0.04 0.00 -1.03 0.00 0.00 54.13 53.07 1xrh s LEU 219 Cb 0.00 -2.91 -0.05 0.00 0.03 0.00 0.00 46.19 43.26 1xrh s LEU 219 CO -0.06 -0.39 0.36 -0.76 0.23 0.00 0.00 176.35 175.74 1xrh s LEU 220 N -4.22 4.27 0.13 1.79 1.43 -0.41 -2.49 118.68 119.17 1xrh s LEU 220 Ca 0.43 0.53 -0.30 0.00 -1.03 0.00 0.00 54.13 53.75 1xrh s LEU 220 Cb -0.09 -3.26 -0.06 0.00 0.03 0.00 0.00 46.19 42.81 1xrh s LEU 220 CO 0.32 0.04 1.00 -2.16 0.23 0.00 0.00 176.35 175.79 1xrh s PRO 221 N -2.76 4.67 0.32 1.29 0.04 -1.26 -1.16 135.00 136.13 1xrh s PRO 221 Ca 0.40 1.53 -0.29 0.00 0.04 0.00 0.00 61.00 62.68 1xrh s PRO 221 Cb -0.12 -3.35 -0.12 0.00 0.04 0.00 0.00 34.50 30.95 1xrh s PRO 221 CO 0.26 0.17 1.44 0.00 0.04 0.00 0.00 177.00 178.90 1xrh n ALA 222 N 2.71 1.86 -3.92 8.56 0.00 0.73 -2.05 120.51 128.40 1xrh n ALA 222 Ca 0.03 0.37 -0.31 0.00 0.00 0.00 0.00 53.44 53.52 1xrh n ALA 222 Cb 0.48 -2.35 -0.02 0.00 0.00 0.00 0.00 19.45 17.56 1xrh n ALA 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xrh n ALA 223 N 1.07 -1.19 -0.62 0.00 0.00 -1.26 0.38 120.51 118.89 1xrh n ALA 223 Ca 0.06 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1xrh n ALA 223 Cb 0.36 -3.33 0.00 0.00 0.00 0.00 0.00 19.45 16.48 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 -1.33 3.49 0.48 0.00 0.00 -0.87 -1.98 105.19 104.98 1xrh n GLY 224 Ca 0.05 0.17 0.30 0.00 0.00 0.00 0.00 46.02 46.54 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 0.04 0.05 1.61 0.11 -1.88 -1.39 132.00 130.54 1xrh h PRO 225 Ca 0.00 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.11 1xrh h PRO 225 Cb 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.10 1xrh h PRO 225 CO 0.00 0.03 -0.02 0.87 -0.21 0.00 0.00 178.00 178.66 1xrh h LYS 226 N 0.04 -0.06 -0.67 1.05 1.57 -1.59 -0.20 116.57 116.71 1xrh h LYS 226 Ca 0.48 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 59.24 1xrh h LYS 226 Cb 1.85 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 34.15 1xrh h LYS 226 CO -0.03 0.37 0.31 0.78 -0.57 0.00 0.00 179.45 180.31 1xrh h GLY 227 N -0.51 1.03 0.76 3.86 0.00 0.86 -1.23 103.07 107.83 1xrh h GLY 227 Ca -0.01 -0.50 0.02 0.00 0.00 0.00 0.00 47.33 46.85 1xrh h GLY 227 CO 0.01 0.48 -0.04 -1.82 0.00 0.00 0.00 176.54 175.16 1xrh h TYR 228 N 0.95 -0.09 -0.42 5.60 3.20 -1.20 -2.82 116.97 122.18 1xrh h TYR 228 Ca 0.23 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.07 1xrh h TYR 228 Cb 0.12 0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.43 1xrh h TYR 228 CO 0.01 -0.07 0.11 0.78 -1.64 0.00 0.00 178.16 177.35 1xrh h GLY 229 N -0.03 0.72 -5.48 1.82 0.00 -0.76 -3.50 103.07 95.85 1xrh h GLY 229 Ca 0.05 -0.45 -0.54 0.00 0.00 0.00 0.00 47.33 46.40 1xrh h GLY 229 CO -0.12 0.42 1.25 1.04 0.00 0.00 0.00 176.54 179.13 1xrh n LEU 230 N -4.55 4.11 0.00 3.11 4.77 -0.49 -5.01 117.00 118.95 1xrh n LEU 230 Ca -0.00 0.85 0.00 0.00 -0.03 0.00 0.00 56.01 56.83 1xrh n LEU 230 Cb 0.20 -1.53 0.00 0.00 -2.33 0.00 0.00 43.42 39.77 1xrh n LEU 230 CO 0.39 0.14 0.00 -0.38 -1.33 0.00 0.00 177.39 176.21 1xrh n ILE 234 N 5.70 0.00 -0.10 -0.08 5.41 -1.26 -5.03 119.36 124.00 1xrh n ILE 234 Ca 0.21 0.00 -0.10 0.00 1.00 0.00 0.00 62.75 63.86 1xrh n ILE 234 Cb 0.41 0.00 0.04 0.00 -0.71 0.00 0.00 39.64 39.38 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 2.00 0.88 -0.35 4.38 1.82 -1.95 -0.69 116.42 122.52 1xrh h ASP 235 Ca 0.00 -0.36 -0.05 0.00 -0.39 0.00 0.00 57.03 56.23 1xrh h ASP 235 Cb 0.00 -0.24 -0.01 0.00 0.68 0.00 0.00 39.33 39.75 1xrh h ASP 235 CO 0.00 1.11 0.01 0.58 -1.61 0.00 0.00 179.24 179.33 1xrh h VAL 236 N 0.72 1.26 -0.31 2.25 2.07 -1.95 -0.23 116.25 120.05 1xrh h VAL 236 Ca 0.08 -0.95 -0.18 0.00 0.82 0.00 0.00 66.70 66.47 1xrh h VAL 236 Cb 0.85 1.18 -0.00 0.00 -1.52 0.00 0.00 31.29 31.80 1xrh h VAL 236 CO 0.07 0.32 -0.50 -0.07 0.02 0.00 0.00 177.57 177.41 1xrh h LEU 237 N 0.43 0.96 -2.51 2.57 3.38 -1.95 0.51 115.31 118.71 1xrh h LEU 237 Ca 0.10 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.58 1xrh h LEU 237 Cb 0.44 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1xrh h LEU 237 CO 0.02 1.29 0.00 -1.54 0.09 0.00 0.00 178.44 178.30 1xrh n SER 238 N -4.02 2.61 0.04 -0.43 3.41 -0.27 -4.46 113.62 110.50 1xrh n SER 238 Ca -0.04 -1.85 0.00 0.00 -0.26 0.00 0.00 58.87 56.72 1xrh n SER 238 Cb 0.60 -0.16 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 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 0.49 -0.12 0.18 5.00 0.00 -0.22 -3.76 105.19 106.77 1xrh n GLY 239 Ca 0.10 0.00 0.02 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 1.28 -0.04 1.61 2.07 -0.83 -0.58 116.25 119.76 1xrh h VAL 240 Ca 0.00 -1.35 -0.08 0.00 0.82 0.00 0.00 66.70 66.09 1xrh h VAL 240 Cb 0.00 1.71 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 1xrh h VAL 240 CO 0.00 0.39 -0.34 0.25 0.02 0.00 0.00 177.57 177.88 1xrh h LEU 241 N 0.03 0.08 -2.02 2.57 5.85 -0.20 -2.59 115.31 119.03 1xrh h LEU 241 Ca -0.00 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.69 1xrh h LEU 241 Cb 0.70 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.71 1xrh h LEU 241 CO 0.05 0.42 0.00 0.18 -0.34 0.00 0.00 178.44 178.75 1xrh n LEU 242 N -4.11 2.95 -1.91 2.25 4.77 -1.01 -4.91 117.00 115.02 1xrh n LEU 242 Ca -0.02 -1.47 -0.18 0.00 -0.03 0.00 0.00 56.01 54.31 1xrh n LEU 242 Cb 0.40 -0.37 -0.02 0.00 -2.33 0.00 0.00 43.42 41.10 1xrh n LEU 242 CO 0.39 0.73 -0.22 0.61 -1.33 0.00 0.00 177.39 177.57 1xrh n GLY 243 N 1.35 0.04 3.98 -0.72 0.00 -0.98 -5.00 105.19 103.87 1xrh n GLY 243 Ca 0.18 -0.14 -0.20 0.00 0.00 0.00 0.00 46.02 45.86 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 -4.94 3.58 0.55 0.99 1.43 -0.26 -5.03 118.68 115.00 1xrh s LEU 244 Ca 0.00 -0.08 -0.21 0.00 -1.03 0.00 0.00 54.13 52.81 1xrh s LEU 244 Cb 0.00 -2.86 -0.05 0.00 0.03 0.00 0.00 46.19 43.31 1xrh s LEU 244 CO 0.00 -0.82 1.25 -2.65 0.23 0.00 0.00 176.35 174.37 1xrh n PRO 245 N -2.03 1.51 -4.11 1.29 -0.02 -1.26 -4.48 135.00 125.90 1xrh n PRO 245 Ca 0.05 0.56 -0.10 0.00 -2.02 0.00 0.00 63.50 61.99 1xrh n PRO 245 Cb 0.59 -2.45 -0.09 0.00 -0.02 0.00 0.00 33.50 31.53 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 -1.33 0.78 0.00 6.00 -0.12 -1.26 -4.64 117.98 117.41 1xrh s PHE 246 Ca 0.72 -1.12 0.00 0.00 -0.05 0.00 0.00 56.93 56.47 1xrh s PHE 246 Cb -0.43 -0.36 0.00 0.00 -0.63 0.00 0.00 43.02 41.60 1xrh s PHE 246 CO 0.49 -0.61 0.00 0.41 -0.05 0.00 0.00 175.22 175.47 1xrh n GLY 247 N -0.16 3.18 0.00 1.99 0.00 -1.26 -1.03 105.19 107.90 1xrh n GLY 247 Ca -0.05 -0.23 0.05 0.00 0.00 0.00 0.00 46.02 45.79 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 14.00 0.09 0.10 1.61 1.85 -0.99 -2.16 116.66 131.16 1xrh n ARG 248 Ca 0.00 0.24 0.13 0.00 -1.00 0.00 0.00 57.85 57.22 1xrh n ARG 248 Cb 0.00 -1.50 0.44 0.00 -1.05 0.00 0.00 32.46 30.35 1xrh n ARG 248 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 1xrh n GLN 249 N -1.36 0.22 -1.87 2.89 6.02 -0.20 -4.87 117.38 118.21 1xrh n GLN 249 Ca 0.04 0.25 -0.41 0.00 -0.01 0.00 0.00 57.00 56.87 1xrh n GLN 249 Cb 0.09 -1.79 -0.01 0.00 1.02 0.00 0.00 30.24 29.55 1xrh n GLN 249 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1xrh s VAL 250 N -3.15 2.23 0.84 5.09 1.01 -0.92 -4.70 120.40 120.81 1xrh s VAL 250 Ca 0.09 0.21 -0.11 0.00 0.00 0.00 0.00 61.98 62.18 1xrh s VAL 250 Cb 0.12 -3.14 0.10 0.00 0.00 0.00 0.00 36.38 33.47 1xrh s VAL 250 CO 0.53 0.04 1.14 -0.94 0.00 0.00 0.00 175.10 175.87 1xrh s SER 251 N 0.10 3.58 0.00 3.32 1.04 -1.26 -4.35 113.70 116.13 1xrh s SER 251 Ca 0.57 2.10 0.00 0.00 0.48 0.00 0.00 55.95 59.10 1xrh s SER 251 Cb -0.45 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.11 1xrh s SER 251 CO 0.54 -2.66 0.00 -0.24 0.98 0.00 0.00 173.24 171.86 1xrh n SER 252 N -3.80 0.00 0.00 7.02 2.88 -1.26 -4.07 113.62 114.39 1xrh n SER 252 Ca 0.11 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.65 1xrh n SER 252 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 1xrh n SER 252 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 1xrh n TYR 254 N 0.00 0.00 -0.12 0.66 4.02 -1.26 -4.44 117.16 116.02 1xrh n TYR 254 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 57.83 1xrh n TYR 254 Cb 0.00 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.34 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 0.00 0.27 -0.61 7.72 3.45 -2.00 -3.43 116.42 121.83 1xrh h ASP 255 Ca 0.00 0.02 0.15 0.00 0.43 0.00 0.00 57.03 57.63 1xrh h ASP 255 Cb 0.00 -0.03 -0.20 0.00 -0.56 0.00 0.00 39.33 38.54 1xrh h ASP 255 CO 0.00 0.20 -0.12 -0.62 -1.57 0.00 0.00 179.24 177.13 1xrh s ASP 256 N -5.44 -0.93 0.61 6.45 3.68 -1.26 -5.02 116.67 114.76 1xrh s ASP 256 Ca -0.13 0.29 0.39 0.00 2.13 0.00 0.00 52.55 55.23 1xrh s ASP 256 Cb 0.12 1.66 1.89 0.00 -1.45 0.00 0.00 42.92 45.14 1xrh s ASP 256 CO 0.72 -0.17 2.18 -0.07 0.13 0.00 0.00 175.17 177.96 1xrh h LEU 257 N 7.78 0.00 -0.26 -1.34 -0.00 -1.94 -1.68 115.31 117.86 1xrh h LEU 257 Ca -0.11 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.77 1xrh h LEU 257 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.84 1xrh h LEU 257 CO 0.03 0.01 -0.28 1.41 -0.00 0.00 0.00 178.44 179.62 1xrh n HIS 258 N -3.13 0.00 -4.37 1.13 8.25 -1.26 -2.05 115.22 113.79 1xrh n HIS 258 Ca -0.01 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.18 1xrh n HIS 258 Cb 0.19 -0.20 -0.11 0.00 1.12 0.00 0.00 29.99 30.99 1xrh n HIS 258 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1xrh s ALA 259 N -2.67 2.71 0.48 -1.41 0.00 -0.63 -3.67 121.76 116.56 1xrh s ALA 259 Ca 0.21 -1.59 -0.23 0.00 0.00 0.00 0.00 51.96 50.35 1xrh s ALA 259 Cb 0.19 -0.49 -0.07 0.00 0.00 0.00 0.00 23.12 22.76 1xrh s ALA 259 CO 0.56 0.44 1.24 0.20 0.00 0.00 0.00 175.76 178.20 1xrh s GLY 260 N -2.77 2.82 0.21 0.00 0.00 -1.25 -4.59 107.32 101.75 1xrh s GLY 260 Ca 0.23 1.08 -0.02 0.00 0.00 0.00 0.00 44.72 46.00 1xrh s GLY 260 CO 0.12 1.57 1.57 3.21 0.00 0.00 0.00 173.10 179.57 1xrh h ARG 261 N 1.91 0.60 -2.31 2.90 2.47 -1.91 -3.48 114.38 114.56 1xrh h ARG 261 Ca -0.50 -0.31 -0.32 0.00 -1.26 0.00 0.00 59.98 57.59 1xrh h ARG 261 Cb 1.26 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.58 1xrh h ARG 261 CO 0.59 0.90 -0.41 0.09 0.56 0.00 0.00 179.97 181.71 1xrh n ASN 262 N -4.02 -4.76 -4.78 7.04 3.02 -1.26 -4.38 115.26 106.11 1xrh n ASN 262 Ca -0.02 -0.02 -0.34 0.00 -0.03 0.00 0.00 54.58 54.17 1xrh n ASN 262 Cb 0.53 -3.87 0.00 0.00 -0.61 0.00 0.00 39.78 35.83 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 -4.59 3.66 0.13 3.41 1.43 -1.26 -4.49 118.68 116.97 1xrh s LEU 263 Ca 0.01 2.02 0.11 0.00 -1.03 0.00 0.00 54.13 55.23 1xrh s LEU 263 Cb -0.00 -4.56 -0.04 0.00 0.03 0.00 0.00 46.19 41.61 1xrh s LEU 263 CO 0.01 -1.19 -0.25 -0.83 0.23 0.00 0.00 176.35 174.32 1xrh s GLY 264 N -2.16 1.60 0.01 -3.19 0.00 -1.25 -1.34 107.32 100.99 1xrh s GLY 264 Ca 0.69 -1.46 -0.02 0.00 0.00 0.00 0.00 44.72 43.93 1xrh s GLY 264 CO 0.30 -1.44 0.02 1.62 0.00 0.00 0.00 173.10 173.59 1xrh s GLN 265 N -2.10 0.34 -0.09 2.90 0.74 -0.65 -2.89 119.66 117.91 1xrh s GLN 265 Ca 0.15 -0.52 0.02 0.00 0.05 0.00 0.00 55.36 55.06 1xrh s GLN 265 Cb -0.10 0.13 0.01 0.00 1.10 0.00 0.00 33.01 34.15 1xrh s GLN 265 CO 0.07 -0.06 -0.14 -1.17 -0.55 0.00 0.00 175.29 173.43 1xrh s LEU 266 N -1.36 1.70 -0.10 3.68 2.96 -1.26 0.13 118.68 124.43 1xrh s LEU 266 Ca -0.15 -0.38 -0.03 0.00 -0.22 0.00 0.00 54.13 53.36 1xrh s LEU 266 Cb -0.09 -1.00 -0.03 0.00 0.50 0.00 0.00 46.19 45.57 1xrh s LEU 266 CO -0.00 0.03 0.01 -1.00 -1.32 0.00 0.00 176.35 174.07 1xrh s HIS 267 N 0.81 3.18 -0.05 5.38 3.76 0.19 -4.27 115.29 124.27 1xrh s HIS 267 Ca -0.11 0.16 0.01 0.00 -0.15 0.00 0.00 55.06 54.97 1xrh s HIS 267 Cb -0.16 -1.83 0.02 0.00 1.11 0.00 0.00 32.58 31.72 1xrh s HIS 267 CO 0.02 0.42 -0.07 0.42 -0.85 0.00 0.00 174.74 174.67 1xrh s ILE 268 N -0.70 0.75 -0.05 0.60 1.01 -0.22 -0.33 121.20 122.27 1xrh s ILE 268 Ca 0.11 -0.24 0.03 0.00 0.00 0.00 0.00 60.65 60.55 1xrh s ILE 268 Cb -0.12 -0.73 0.00 0.00 0.01 0.00 0.00 42.46 41.62 1xrh s ILE 268 CO 0.02 0.27 -0.14 -0.69 0.00 0.00 0.00 174.94 174.41 1xrh s VAL 269 N 0.88 1.20 -0.08 2.92 1.01 -0.37 -0.93 120.40 125.03 1xrh s VAL 269 Ca -0.11 -0.57 0.03 0.00 0.00 0.00 0.00 61.98 61.32 1xrh s VAL 269 Cb -0.15 -1.06 0.01 0.00 0.00 0.00 0.00 36.38 35.19 1xrh s VAL 269 CO 0.01 0.36 -0.16 -0.63 0.00 0.00 0.00 175.10 174.68 1xrh s ILE 270 N 0.25 1.45 -0.42 2.22 1.01 -0.53 -1.70 121.20 123.48 1xrh s ILE 270 Ca -0.07 -0.66 -0.21 0.00 0.00 0.00 0.00 60.65 59.71 1xrh s ILE 270 Cb -0.12 -1.29 0.02 0.00 0.01 0.00 0.00 42.46 41.08 1xrh s ILE 270 CO 0.02 0.43 0.64 0.21 0.00 0.00 0.00 174.94 176.24 1xrh s ASN 271 N 0.58 6.34 0.45 3.58 3.84 -0.06 -1.09 114.94 128.59 1xrh s ASN 271 Ca -0.16 -0.23 0.21 0.00 0.21 0.00 0.00 52.86 52.89 1xrh s ASN 271 Cb -0.16 -2.32 1.18 0.00 -0.55 0.00 0.00 41.25 39.39 1xrh s ASN 271 CO 0.05 -0.74 1.88 -0.65 -2.79 0.00 0.00 177.10 174.85 1xrh h PRO 272 N 8.79 0.29 -0.29 0.43 0.11 -1.87 -1.84 132.00 137.61 1xrh h PRO 272 Ca -0.26 -0.02 0.08 0.00 0.11 0.00 0.00 66.00 65.92 1xrh h PRO 272 Cb 1.10 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 1xrh h PRO 272 CO 0.88 0.19 0.29 -0.91 -0.21 0.00 0.00 178.00 178.24 1xrh h ASN 273 N 0.30 0.00 -0.19 -2.05 4.21 -1.92 0.45 115.58 116.38 1xrh h ASN 273 Ca 0.43 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.94 1xrh h ASN 273 Cb 1.22 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.42 1xrh h ASN 273 CO -0.13 0.00 0.00 0.49 -1.29 0.00 0.00 177.43 176.50 1xrh n PHE 274 N -3.91 0.25 0.00 1.19 3.01 -0.69 -4.09 117.46 113.21 1xrh n PHE 274 Ca 0.04 -0.13 0.00 0.00 1.01 0.00 0.00 57.45 58.38 1xrh n PHE 274 Cb 0.44 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.91 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 0.06 0.00 -3.04 1.38 3.01 0.15 -5.10 117.46 113.92 1xrh n PHE 275 Ca 0.07 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.53 1xrh n PHE 275 Cb 0.17 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.64 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 -0.77 0.00 -4.64 4.37 3.41 -0.56 -5.11 113.62 110.32 1xrh n SER 276 Ca 0.00 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.18 1xrh n SER 276 Cb 0.09 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.01 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 -4.00 6.37 0.40 4.04 0.15 -1.26 -3.98 113.70 115.42 1xrh s SER 277 Ca 0.00 2.02 0.18 0.00 0.70 0.00 0.00 55.95 58.85 1xrh s SER 277 Cb 0.00 -2.53 0.85 0.00 -1.71 0.00 0.00 66.02 62.63 1xrh s SER 277 CO 0.00 -1.20 1.84 0.77 1.20 0.00 0.00 173.24 175.84 1xrh h SER 278 N 10.85 0.00 -0.28 5.45 4.64 -1.91 0.61 113.55 132.91 1xrh h SER 278 Ca -0.39 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.88 1xrh h SER 278 Cb 1.18 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 1xrh h SER 278 CO 0.97 0.33 -0.01 1.05 -0.87 0.00 0.00 176.83 178.30 1xrh h GLU 279 N 0.00 0.50 -0.14 4.77 9.09 -1.99 -1.21 114.58 125.60 1xrh h GLU 279 Ca -0.00 -0.17 -0.15 0.00 0.05 0.00 0.00 59.36 59.09 1xrh h GLU 279 Cb 0.69 -0.04 -0.01 0.00 -1.65 0.00 0.00 28.75 27.74 1xrh h GLU 279 CO 0.04 0.67 -0.56 -0.07 0.05 0.00 0.00 179.01 179.14 1xrh h LEU 280 N 0.28 0.49 -0.13 3.06 3.38 -1.87 -2.83 115.31 117.69 1xrh h LEU 280 Ca 0.08 -0.26 0.03 0.00 0.09 0.00 0.00 57.88 57.82 1xrh h LEU 280 Cb 0.45 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 1xrh h LEU 280 CO 0.02 0.95 -0.07 0.15 0.09 0.00 0.00 178.44 179.57 1xrh h PHE 281 N 0.33 -0.16 -0.37 1.13 3.57 -0.75 0.08 116.94 120.77 1xrh h PHE 281 Ca 0.00 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.45 1xrh h PHE 281 Cb 1.08 0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.90 1xrh h PHE 281 CO 0.04 -0.11 -0.05 0.00 -2.23 0.00 0.00 178.31 175.95 1xrh h ARG 282 N -0.06 0.61 -0.61 1.11 3.08 -1.16 -2.01 114.38 115.33 1xrh h ARG 282 Ca 0.08 -0.16 -0.04 0.00 0.07 0.00 0.00 59.98 59.93 1xrh h ARG 282 Cb 0.17 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 1xrh h ARG 282 CO -0.17 0.67 0.24 1.96 -1.07 0.00 0.00 179.97 181.59 1xrh h GLN 283 N 0.57 0.92 -0.04 0.04 4.20 -1.19 -1.95 115.11 117.66 1xrh h GLN 283 Ca 0.11 -0.17 -0.08 0.00 0.06 0.00 0.00 58.65 58.57 1xrh h GLN 283 Cb 0.44 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 1xrh h GLN 283 CO 0.02 0.78 -0.34 0.45 -0.67 0.00 0.00 178.83 179.07 1xrh h HIS 284 N 0.85 0.09 -0.09 2.96 3.86 -0.67 0.23 115.15 122.38 1xrh h HIS 284 Ca 0.20 -0.02 -0.19 0.00 -1.16 0.00 0.00 60.37 59.21 1xrh h HIS 284 Cb 0.22 -0.02 0.01 0.00 1.06 0.00 0.00 27.41 28.67 1xrh h HIS 284 CO 0.01 0.42 -0.68 1.25 0.86 0.00 0.00 177.93 179.79 1xrh h LEU 285 N 0.07 0.74 -0.75 2.43 5.85 -1.09 0.65 115.31 123.22 1xrh h LEU 285 Ca 0.01 -0.67 -0.03 0.00 0.84 0.00 0.00 57.88 58.02 1xrh h LEU 285 Cb 0.65 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.42 1xrh h LEU 285 CO 0.05 1.30 0.33 0.28 -0.34 0.00 0.00 178.44 180.06 1xrh h SER 286 N 0.24 1.00 -0.76 1.25 0.02 -1.03 -2.15 113.55 112.12 1xrh h SER 286 Ca -0.06 -0.15 -0.01 0.00 -0.84 0.00 0.00 61.79 60.73 1xrh h SER 286 Cb 1.33 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 63.57 1xrh h SER 286 CO 0.14 0.87 0.43 -0.61 -1.14 0.00 0.00 176.83 176.53 1xrh h GLN 287 N 1.06 1.05 -0.68 3.45 4.15 -0.45 -1.22 115.11 122.47 1xrh h GLN 287 Ca 0.25 -0.11 0.00 0.00 0.77 0.00 0.00 58.65 59.56 1xrh h GLN 287 Cb 0.16 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 27.64 1xrh h GLN 287 CO -0.03 0.76 0.00 2.41 -1.93 0.00 0.00 178.83 180.05 1xrh n THR 288 N -4.47 0.00 0.00 2.39 -1.04 0.21 -1.37 114.28 110.01 1xrh n THR 288 Ca 0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.08 1xrh n THR 288 Cb 0.08 -0.17 0.00 0.00 -1.82 0.00 0.00 70.33 68.41 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 0.66 0.00 0.03 -2.82 1.74 -0.46 -1.60 116.66 114.21 1xrh n ARG 290 Ca 0.00 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.98 1xrh n ARG 290 Cb 0.00 0.00 -0.04 0.00 -1.02 0.00 0.00 32.46 31.40 1xrh n ARG 290 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1xrh h GLU 291 N 0.00 -0.20 -0.46 5.56 5.08 -1.49 -1.27 114.58 121.79 1xrh h GLU 291 Ca 0.00 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.44 1xrh h GLU 291 Cb 0.00 0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.24 1xrh h GLU 291 CO 0.00 -0.14 0.13 -0.07 -1.00 0.00 0.00 179.01 177.94 1xrh h LEU 292 N -0.21 0.10 -2.20 1.33 3.38 -1.55 0.12 115.31 116.28 1xrh h LEU 292 Ca 0.07 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1xrh h LEU 292 Cb 0.31 0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 1xrh h LEU 292 CO -0.19 0.09 -0.06 -1.13 0.09 0.00 0.00 178.44 177.24 1xrh h ASN 293 N 0.29 0.00 1.37 -0.43 -0.00 -1.69 -2.11 115.58 113.01 1xrh h ASN 293 Ca 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.52 1xrh h ASN 293 Cb 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.58 1xrh h ASN 293 CO -0.26 0.06 -0.51 0.00 -0.00 0.00 0.00 177.43 176.72 1xrh h ALA 294 N 1.94 0.73 -1.77 1.57 0.00 0.42 -3.39 119.26 118.75 1xrh h ALA 294 Ca -0.00 0.00 -0.65 0.00 0.00 0.00 0.00 54.91 54.26 1xrh h ALA 294 Cb 0.18 0.00 0.08 0.00 0.00 0.00 0.00 17.79 18.05 1xrh h ALA 294 CO 0.01 0.00 0.30 -0.89 0.00 0.00 0.00 179.25 178.67 1xrh n ILE 295 N -2.71 0.83 -1.70 0.00 2.08 -0.67 -4.84 119.36 112.35 1xrh n ILE 295 Ca 0.02 -0.21 -0.42 0.00 0.56 0.00 0.00 62.75 62.70 1xrh n ILE 295 Cb 0.52 -0.87 -0.03 0.00 -0.75 0.00 0.00 39.64 38.51 1xrh n ILE 295 CO 0.00 0.00 0.00 0.41 0.56 0.00 0.00 176.55 177.52 1xrh n THR 296 N 1.59 0.30 -1.37 1.39 -1.04 -1.26 -4.35 114.28 109.53 1xrh n THR 296 Ca 0.15 -0.05 -0.31 0.00 -2.04 0.00 0.00 64.05 61.80 1xrh n THR 296 Cb 0.24 -2.10 0.08 0.00 -1.82 0.00 0.00 70.33 66.73 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 2.43 2.41 0.44 -2.82 0.04 -1.26 -4.95 135.00 131.29 1xrh s PRO 297 Ca 0.81 1.05 -0.04 0.00 0.04 0.00 0.00 61.00 62.86 1xrh s PRO 297 Cb -0.48 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.10 1xrh s PRO 297 CO 0.36 -1.50 0.71 0.00 0.04 0.00 0.00 177.00 176.62 1xrh s ALA 298 N -2.97 3.49 0.12 8.56 0.00 -1.26 -4.97 121.76 124.73 1xrh s ALA 298 Ca 0.60 -0.62 -0.34 0.00 0.00 0.00 0.00 51.96 51.60 1xrh s ALA 298 Cb -0.16 -2.45 -0.13 0.00 0.00 0.00 0.00 23.12 20.38 1xrh s ALA 298 CO 0.56 -0.25 1.65 -2.30 0.00 0.00 0.00 175.76 175.42 1xrh n PRO 299 N -2.10 2.20 0.00 0.00 -0.02 -1.26 -1.59 135.00 132.23 1xrh n PRO 299 Ca -0.01 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 1xrh n PRO 299 Cb 0.55 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 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 3.64 2.49 3.47 -1.23 0.00 -1.26 -5.07 105.19 107.23 1xrh n GLY 300 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.29 2.91 -0.24 1.61 0.40 -0.62 -4.99 117.98 114.76 1xrh s PHE 301 Ca 0.00 -0.35 0.26 0.00 -0.60 0.00 0.00 56.93 56.24 1xrh s PHE 301 Cb 0.00 -1.85 0.66 0.00 0.51 0.00 0.00 43.02 42.34 1xrh s PHE 301 CO 0.00 -0.02 1.72 -0.91 0.70 0.00 0.00 175.22 176.72 1xrh h ASN 302 N 6.35 0.00 -5.38 1.36 4.21 -1.98 -3.42 115.58 116.73 1xrh h ASN 302 Ca -0.33 0.00 0.20 0.00 1.21 0.00 0.00 56.30 57.38 1xrh h ASN 302 Cb 1.19 0.00 -0.09 0.00 -1.12 0.00 0.00 38.32 38.31 1xrh h ASN 302 CO 0.58 0.03 0.53 0.00 -1.29 0.00 0.00 177.43 177.28 1xrh s GLN 303 N -3.35 1.07 -0.09 0.81 -2.07 -1.26 -4.90 119.66 109.87 1xrh s GLN 303 Ca 0.05 -0.59 -0.07 0.00 -1.82 0.00 0.00 55.36 52.93 1xrh s GLN 303 Cb 0.06 0.37 -0.04 0.00 -1.09 0.00 0.00 33.01 32.31 1xrh s GLN 303 CO 0.63 -0.49 0.17 0.08 -1.32 0.00 0.00 175.29 174.36 1xrh s VAL 304 N -3.16 5.46 -0.10 3.63 1.01 -1.26 -4.90 120.40 121.07 1xrh s VAL 304 Ca 0.12 0.20 -0.02 0.00 0.00 0.00 0.00 61.98 62.28 1xrh s VAL 304 Cb -0.00 -3.45 -0.03 0.00 0.00 0.00 0.00 36.38 32.90 1xrh s VAL 304 CO 0.01 0.57 -0.02 -0.31 0.00 0.00 0.00 175.10 175.34 1xrh s TYR 305 N -1.09 3.07 0.57 5.22 4.12 -1.26 -4.31 117.35 123.67 1xrh s TYR 305 Ca 0.18 0.02 -0.15 0.00 0.02 0.00 0.00 57.07 57.14 1xrh s TYR 305 Cb -0.12 -1.82 -0.05 0.00 -1.52 0.00 0.00 41.96 38.44 1xrh s TYR 305 CO 0.07 0.29 1.02 1.52 0.02 0.00 0.00 175.55 178.47 1xrh s TYR 306 N -0.50 3.31 -0.11 2.71 -0.85 -1.26 -4.81 117.35 115.84 1xrh s TYR 306 Ca 0.08 1.45 -0.39 0.00 -0.52 0.00 0.00 57.07 57.70 1xrh s TYR 306 Cb -0.12 -2.85 -0.16 0.00 0.38 0.00 0.00 41.96 39.20 1xrh s TYR 306 CO 0.02 -0.71 1.54 -2.30 -1.52 0.00 0.00 175.55 172.59 1xrh n PRO 307 N -2.00 1.10 -0.35 -3.49 -0.02 -1.26 -1.16 135.00 127.82 1xrh n PRO 307 Ca 0.07 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 1xrh n PRO 307 Cb 0.54 -2.06 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 1xrh n PRO 307 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xrh n GLY 308 N 3.37 1.95 0.34 -1.23 0.00 -1.23 -4.26 105.19 104.14 1xrh n GLY 308 Ca 0.23 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.27 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 2.65 0.98 -0.31 1.61 4.15 -1.42 -0.33 115.11 122.44 1xrh h GLN 309 Ca 0.00 -0.06 0.06 0.00 0.77 0.00 0.00 58.65 59.42 1xrh h GLN 309 Cb 0.00 -0.22 -0.06 0.00 0.21 0.00 0.00 27.48 27.41 1xrh h GLN 309 CO 0.00 0.65 -0.10 0.38 -1.93 0.00 0.00 178.83 177.83 1xrh h ASP 310 N 1.01 -0.34 -0.45 -0.69 2.03 -1.91 0.58 116.42 116.64 1xrh h ASP 310 Ca 0.42 0.10 -0.07 0.00 -0.73 0.00 0.00 57.03 56.75 1xrh h ASP 310 Cb 0.26 0.21 -0.02 0.00 -0.83 0.00 0.00 39.33 38.95 1xrh h ASP 310 CO -0.20 -0.13 0.03 1.56 -1.03 0.00 0.00 179.24 179.48 1xrh h GLN 311 N -0.03 0.84 -0.81 4.15 4.20 -1.58 -1.70 115.11 120.18 1xrh h GLN 311 Ca 0.15 -0.22 -0.00 0.00 0.06 0.00 0.00 58.65 58.64 1xrh h GLN 311 Cb 0.26 -0.10 -0.04 0.00 0.30 0.00 0.00 27.48 27.90 1xrh h GLN 311 CO -0.33 0.82 0.50 -0.44 -0.67 0.00 0.00 178.83 178.70 1xrh h ASP 312 N 0.79 0.96 -0.68 1.46 3.45 0.67 -1.42 116.42 121.64 1xrh h ASP 312 Ca 0.16 -0.06 0.03 0.00 0.43 0.00 0.00 57.03 57.59 1xrh h ASP 312 Cb 0.43 -0.24 -0.04 0.00 -0.56 0.00 0.00 39.33 38.91 1xrh h ASP 312 CO 0.02 0.73 0.43 0.40 -1.57 0.00 0.00 179.24 179.25 1xrh h ILE 313 N 1.10 1.11 -0.45 0.35 2.04 0.85 -0.92 117.51 121.59 1xrh h ILE 313 Ca 0.29 -0.29 -0.06 0.00 1.00 0.00 0.00 64.86 65.79 1xrh h ILE 313 Cb -0.06 0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 36.18 1xrh h ILE 313 CO -0.06 0.16 0.02 0.11 0.00 0.00 0.00 178.15 178.37 1xrh h LYS 314 N 0.85 0.72 -0.28 2.37 1.57 -0.55 -1.80 116.57 119.45 1xrh h LYS 314 Ca 0.27 -0.18 -0.10 0.00 -1.87 0.00 0.00 60.65 58.77 1xrh h LYS 314 Cb -0.00 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 1xrh h LYS 314 CO -0.10 0.73 -0.24 0.37 -0.57 0.00 0.00 179.45 179.64 1xrh h GLN 315 N 0.68 0.54 -0.13 3.15 4.15 -0.65 0.00 115.11 122.86 1xrh h GLN 315 Ca 0.14 -0.21 -0.18 0.00 0.77 0.00 0.00 58.65 59.18 1xrh h GLN 315 Cb 0.40 -0.03 -0.00 0.00 0.21 0.00 0.00 27.48 28.05 1xrh h GLN 315 CO 0.01 0.74 -0.66 0.00 -1.93 0.00 0.00 178.83 177.00 1xrh h ARG 316 N 0.48 0.50 0.06 1.69 3.08 -0.66 -1.20 114.38 118.33 1xrh h ARG 316 Ca 0.07 -0.36 -0.00 0.00 0.07 0.00 0.00 59.98 59.75 1xrh h ARG 316 Cb 0.68 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.79 1xrh h ARG 316 CO 0.05 0.98 -0.03 -0.22 -1.07 0.00 0.00 179.97 179.68 1xrh h LYS 317 N 0.36 -0.08 -0.61 0.04 3.11 -1.05 -2.85 116.57 115.50 1xrh h LYS 317 Ca -0.02 0.01 0.09 0.00 -2.81 0.00 0.00 60.65 57.92 1xrh h LYS 317 Cb 1.22 0.02 -0.07 0.00 -1.00 0.00 0.00 32.23 32.40 1xrh h LYS 317 CO 0.12 -0.02 0.23 0.00 -2.81 0.00 0.00 179.45 176.97 1xrh h ALA 318 N 0.82 0.78 -0.12 5.00 0.00 -0.88 0.73 119.26 125.59 1xrh h ALA 318 Ca -0.01 0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.02 1xrh h ALA 318 Cb 0.10 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1xrh h ALA 318 CO 0.01 -0.19 0.21 0.00 0.00 0.00 0.00 179.25 179.28 1xrh h ALA 319 N 1.41 1.56 0.00 0.00 0.00 -0.99 0.63 119.26 121.88 1xrh h ALA 319 Ca 0.30 -0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.90 1xrh h ALA 319 Cb 0.37 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.11 1xrh h ALA 319 CO -0.30 -0.27 -2.20 0.28 0.00 0.00 0.00 179.25 176.76 1xrh n VAL 320 N -3.45 1.20 0.93 0.00 0.31 0.22 -4.71 118.33 112.83 1xrh n VAL 320 Ca 0.00 -0.46 0.10 0.00 -0.01 0.00 0.00 64.34 63.97 1xrh n VAL 320 Cb 0.31 -1.24 -0.12 0.00 -0.91 0.00 0.00 33.84 31.88 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 -3.11 0.30 0.00 5.55 -0.58 0.97 -5.10 120.64 118.67 1xrh n GLU 321 Ca -0.37 -0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.36 1xrh n GLU 321 Cb 0.90 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 30.31 1xrh n GLU 321 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1xrh n GLY 322 N 1.48 1.76 3.73 0.62 0.00 0.20 -4.75 105.19 108.23 1xrh n GLY 322 Ca 0.04 -2.00 -0.38 0.00 0.00 0.00 0.00 46.02 43.67 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 -2.24 5.10 0.28 -0.61 1.01 0.24 -4.36 121.20 120.62 1xrh s ILE 323 Ca 0.00 1.09 -0.29 0.00 0.00 0.00 0.00 60.65 61.45 1xrh s ILE 323 Cb 0.00 -3.87 -0.10 0.00 0.01 0.00 0.00 42.46 38.50 1xrh s ILE 323 CO 0.00 0.34 1.37 -0.70 0.00 0.00 0.00 174.94 175.95 1xrh s GLU 324 N 0.42 4.32 -0.04 2.79 2.56 -1.26 -1.25 118.70 126.24 1xrh s GLU 324 Ca 0.29 2.24 -0.11 0.00 0.00 0.00 0.00 54.97 57.39 1xrh s GLU 324 Cb -0.16 -3.10 0.02 0.00 2.00 0.00 0.00 34.13 32.88 1xrh s GLU 324 CO 0.13 -0.30 0.24 -1.50 -0.56 0.00 0.00 175.26 173.27 1xrh s ILE 325 N -0.47 0.04 0.20 -3.70 2.07 -0.39 -4.94 121.20 114.02 1xrh s ILE 325 Ca 0.55 -0.37 -0.30 0.00 -1.41 0.00 0.00 60.65 59.12 1xrh s ILE 325 Cb -0.40 -0.48 -0.08 0.00 0.13 0.00 0.00 42.46 41.63 1xrh s ILE 325 CO 0.47 -0.20 1.04 -0.69 -1.91 0.00 0.00 174.94 173.65 1xrh s VAL 326 N -0.83 3.93 0.32 4.00 1.01 -1.26 -1.49 120.40 126.08 1xrh s VAL 326 Ca -0.09 1.77 0.05 0.00 0.00 0.00 0.00 61.98 63.70 1xrh s VAL 326 Cb -0.05 -4.13 0.30 0.00 0.00 0.00 0.00 36.38 32.50 1xrh s VAL 326 CO 0.02 0.35 1.87 -2.24 0.00 0.00 0.00 175.10 175.11 1xrh h ASP 327 N 4.68 0.80 -0.44 3.32 2.03 -1.94 -1.32 116.42 123.56 1xrh h ASP 327 Ca -0.45 0.03 -0.03 0.00 -0.73 0.00 0.00 57.03 55.85 1xrh h ASP 327 Cb 1.21 -0.13 -0.02 0.00 -0.83 0.00 0.00 39.33 39.56 1xrh h ASP 327 CO 0.70 0.44 0.17 0.44 -1.03 0.00 0.00 179.24 179.96 1xrh h ASP 328 N 0.87 0.66 -0.16 4.15 3.32 -1.98 0.17 116.42 123.44 1xrh h ASP 328 Ca 0.44 -0.09 -0.07 0.00 0.02 0.00 0.00 57.03 57.34 1xrh h ASP 328 Cb 0.50 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.88 1xrh h ASP 328 CO -0.20 0.62 -0.15 0.40 -1.72 0.00 0.00 179.24 178.18 1xrh h ILE 329 N 0.71 1.34 -0.43 0.35 2.04 -1.67 -1.03 117.51 118.82 1xrh h ILE 329 Ca 0.17 -1.30 0.06 0.00 1.00 0.00 0.00 64.86 64.79 1xrh h ILE 329 Cb 0.19 1.83 -0.05 0.00 -0.74 0.00 0.00 36.82 38.04 1xrh h ILE 329 CO -0.01 0.39 0.11 0.22 0.00 0.00 0.00 178.15 178.86 1xrh h TYR 330 N 0.04 0.19 -0.86 1.37 3.20 -0.77 -1.13 116.97 119.01 1xrh h TYR 330 Ca 0.03 0.02 0.08 0.00 3.14 0.00 0.00 58.73 62.00 1xrh h TYR 330 Cb 0.68 -0.02 -0.07 0.00 1.54 0.00 0.00 36.73 38.86 1xrh h TYR 330 CO 0.08 0.05 0.53 1.96 -1.64 0.00 0.00 178.16 179.13 1xrh h GLN 331 N 0.26 0.90 -0.77 1.82 4.20 -0.48 -1.18 115.11 119.86 1xrh h GLN 331 Ca 0.21 -0.05 -0.06 0.00 0.06 0.00 0.00 58.65 58.80 1xrh h GLN 331 Cb 0.23 -0.20 -0.03 0.00 0.30 0.00 0.00 27.48 27.77 1xrh h GLN 331 CO -0.24 0.60 0.26 -0.92 -0.67 0.00 0.00 178.83 177.85 1xrh h TYR 332 N 0.93 1.22 -0.17 2.96 3.20 -0.37 -2.55 116.97 122.19 1xrh h TYR 332 Ca 0.39 -0.11 -0.16 0.00 3.14 0.00 0.00 58.73 61.98 1xrh h TYR 332 Cb 0.25 -0.36 -0.01 0.00 1.54 0.00 0.00 36.73 38.16 1xrh h TYR 332 CO -0.04 0.94 -0.57 -0.07 -1.64 0.00 0.00 178.16 176.78 1xrh h LEU 333 N 1.14 0.60 -0.05 2.82 3.38 -0.15 -2.85 115.31 120.20 1xrh h LEU 333 Ca 0.25 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1xrh h LEU 333 Cb 0.28 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1xrh h LEU 333 CO -0.01 1.05 -0.04 2.30 0.09 0.00 0.00 178.44 181.82 1xrh n ILE 334 N -3.94 0.00 -2.30 1.22 -5.35 -0.55 -4.80 119.36 103.63 1xrh n ILE 334 Ca -0.03 -0.01 -0.25 0.00 -0.27 0.00 0.00 62.75 62.19 1xrh n ILE 334 Cb 0.62 -0.38 0.15 0.00 -1.74 0.00 0.00 39.64 38.28 1xrh n ILE 334 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1xrh n SER 335 N -1.24 0.80 -0.76 7.28 3.41 -0.97 -5.02 113.62 117.13 1xrh n SER 335 Ca 0.13 -1.83 0.07 0.00 -0.26 0.00 0.00 58.87 56.99 1xrh n SER 335 Cb 0.26 -0.76 0.21 0.00 -0.26 0.00 0.00 64.21 63.65 1xrh n SER 335 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1xrh n ASP 336 N -3.29 3.43 -4.94 4.04 5.75 -1.26 -5.01 116.55 115.27 1xrh n ASP 336 Ca 0.16 -2.58 -0.24 0.00 -0.01 0.00 0.00 54.79 52.12 1xrh n ASP 336 Cb 0.56 -0.40 0.04 0.00 -1.03 0.00 0.00 41.12 40.28 1xrh n ASP 336 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1xrh s ALA 337 N -2.03 3.53 -0.20 2.12 0.00 -1.26 -5.02 121.76 118.89 1xrh s ALA 337 Ca 0.33 -1.00 0.06 0.00 0.00 0.00 0.00 51.96 51.35 1xrh s ALA 337 Cb 0.24 -2.36 -0.16 0.00 0.00 0.00 0.00 23.12 20.84 1xrh s ALA 337 CO 0.11 -0.81 -0.12 1.28 0.00 0.00 0.00 175.76 176.23 1xrh n LEU 338 N -2.48 2.08 -3.63 0.00 4.77 -1.26 -5.01 117.00 111.47 1xrh n LEU 338 Ca 0.06 -0.08 -0.09 0.00 -0.03 0.00 0.00 56.01 55.86 1xrh n LEU 338 Cb 0.59 -0.40 -0.07 0.00 -2.33 0.00 0.00 43.42 41.20 1xrh n LEU 338 CO 0.49 0.73 0.74 -0.72 -1.33 0.00 0.00 177.39 177.31 1xrh s TYR 339 N -2.43 -0.47 -2.33 -1.77 -0.85 -1.26 -4.50 117.35 103.74 1xrh s TYR 339 Ca -0.23 1.12 0.29 0.00 -0.52 0.00 0.00 57.07 57.74 1xrh s TYR 339 Cb 0.07 0.37 1.34 0.00 0.38 0.00 0.00 41.96 44.11 1xrh s TYR 339 CO 0.56 -0.24 1.91 0.09 -1.52 0.00 0.00 175.55 176.35