#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 5.94 -0.08 4.04 0.01 -0.51 -4.88 113.70 118.22 1xrh s SER 3 Ca 0.00 -0.03 0.04 0.00 1.31 0.00 0.00 55.95 57.27 1xrh s SER 3 Cb 0.00 -1.35 -0.01 0.00 0.21 0.00 0.00 66.02 64.87 1xrh s SER 3 CO 0.00 -0.50 -0.23 -0.75 0.41 0.00 0.00 173.24 172.17 1xrh s LYS 4 N -4.28 2.85 0.16 12.44 2.20 -1.26 -0.98 119.74 130.87 1xrh s LYS 4 Ca 0.46 -0.86 0.01 0.00 -0.36 0.00 0.00 55.97 55.21 1xrh s LYS 4 Cb -0.10 -2.28 -0.04 0.00 -1.51 0.00 0.00 37.83 33.90 1xrh s LYS 4 CO 0.33 0.29 0.02 0.96 -0.36 0.00 0.00 175.35 176.59 1xrh s ILE 5 N 0.08 0.51 0.61 5.43 -4.36 -0.41 -4.87 121.20 118.20 1xrh s ILE 5 Ca -0.10 -1.96 -0.15 0.00 -0.26 0.00 0.00 60.65 58.18 1xrh s ILE 5 Cb -0.16 -2.10 -0.03 0.00 1.25 0.00 0.00 42.46 41.43 1xrh s ILE 5 CO 0.06 -0.48 1.05 -0.94 0.24 0.00 0.00 174.94 174.88 1xrh s SER 6 N -3.14 5.76 0.20 4.36 1.04 -1.26 0.28 113.70 120.94 1xrh s SER 6 Ca 0.24 1.77 -0.09 0.00 0.48 0.00 0.00 55.95 58.35 1xrh s SER 6 Cb 0.07 -2.53 0.15 0.00 0.10 0.00 0.00 66.02 63.80 1xrh s SER 6 CO 0.03 -1.18 1.80 -0.09 0.98 0.00 0.00 173.24 174.78 1xrh h ARG 7 N 0.28 1.08 -0.30 4.02 2.43 -1.95 -1.42 114.38 118.53 1xrh h ARG 7 Ca -0.46 -0.15 -0.00 0.00 -0.81 0.00 0.00 59.98 58.55 1xrh h ARG 7 Cb 1.22 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 30.55 1xrh h ARG 7 CO 0.57 0.84 0.18 0.93 -1.51 0.00 0.00 179.97 180.98 1xrh h GLU 8 N 1.06 0.41 -0.22 0.20 3.07 -1.99 -0.97 114.58 116.14 1xrh h GLU 8 Ca 0.26 -0.04 -0.02 0.00 -0.50 0.00 0.00 59.36 59.06 1xrh h GLU 8 Cb 0.11 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 27.92 1xrh h GLU 8 CO -0.03 0.33 0.05 1.15 -1.40 0.00 0.00 179.01 179.10 1xrh h THR 9 N 0.38 1.21 -0.09 1.13 2.02 -1.87 -2.14 112.91 113.56 1xrh h THR 9 Ca 0.11 -0.70 0.04 0.00 0.77 0.00 0.00 66.41 66.63 1xrh h THR 9 Cb 0.03 1.26 -0.04 0.00 -1.74 0.00 0.00 68.15 67.66 1xrh h THR 9 CO -0.02 0.22 -0.17 0.25 0.37 0.00 0.00 175.52 176.17 1xrh h LEU 10 N 0.16 -0.51 -0.51 2.58 5.85 -1.18 0.52 115.31 122.23 1xrh h LEU 10 Ca 0.07 0.09 0.10 0.00 0.84 0.00 0.00 57.88 58.98 1xrh h LEU 10 Cb 0.29 0.23 -0.09 0.00 0.37 0.00 0.00 40.66 41.46 1xrh h LEU 10 CO 0.00 -0.22 -0.05 -0.74 -0.34 0.00 0.00 178.44 177.09 1xrh h HIS 11 N -0.23 -0.13 -0.01 1.25 2.76 -1.07 -0.12 115.15 117.60 1xrh h HIS 11 Ca 0.08 0.04 -0.12 0.00 -2.20 0.00 0.00 60.37 58.17 1xrh h HIS 11 Cb 0.35 0.14 -0.02 0.00 1.55 0.00 0.00 27.41 29.43 1xrh h HIS 11 CO -0.26 -0.17 -0.56 -0.56 -1.30 0.00 0.00 177.93 175.08 1xrh h GLN 12 N 0.06 0.02 -0.26 5.26 3.07 -1.04 -0.30 115.11 121.92 1xrh h GLN 12 Ca 0.25 -0.01 -0.03 0.00 0.09 0.00 0.00 58.65 58.95 1xrh h GLN 12 Cb 0.39 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.94 1xrh h GLN 12 CO -0.47 0.58 0.04 -0.07 0.09 0.00 0.00 178.83 178.99 1xrh h LEU 13 N 0.01 0.42 -0.02 0.06 3.38 0.35 -1.55 115.31 117.97 1xrh h LEU 13 Ca -0.01 -0.27 -0.00 0.00 0.09 0.00 0.00 57.88 57.70 1xrh h LEU 13 Cb 1.00 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.64 1xrh h LEU 13 CO 0.07 0.58 0.00 0.40 0.09 0.00 0.00 178.44 179.59 1xrh h ILE 14 N 0.25 1.21 -0.47 1.22 2.04 -0.95 -2.39 117.51 118.42 1xrh h ILE 14 Ca 0.08 -0.63 0.05 0.00 1.00 0.00 0.00 64.86 65.36 1xrh h ILE 14 Cb 0.34 1.60 -0.05 0.00 -0.74 0.00 0.00 36.82 37.98 1xrh h ILE 14 CO 0.01 0.17 0.21 -0.08 0.00 0.00 0.00 178.15 178.45 1xrh h GLU 15 N -0.23 0.40 -0.49 2.37 4.81 -1.04 -0.91 114.58 119.49 1xrh h GLU 15 Ca 0.01 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.16 1xrh h GLU 15 Cb 0.27 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 1xrh h GLU 15 CO 0.00 0.26 0.08 -0.91 -0.73 0.00 0.00 179.01 177.72 1xrh h ASN 16 N 0.41 0.71 -0.18 1.04 2.35 -1.25 -1.37 115.58 117.30 1xrh h ASN 16 Ca 0.21 -0.14 -0.10 0.00 -0.55 0.00 0.00 56.30 55.72 1xrh h ASN 16 Cb 0.16 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 1xrh h ASN 16 CO -0.18 0.73 -0.22 0.50 -1.65 0.00 0.00 177.43 176.62 1xrh h LYS 17 N 0.73 0.63 -0.24 0.81 1.63 -0.83 0.59 116.57 119.88 1xrh h LYS 17 Ca 0.16 -0.24 -0.10 0.00 -0.85 0.00 0.00 60.65 59.62 1xrh h LYS 17 Cb 0.33 -0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 31.92 1xrh h LYS 17 CO 0.00 0.80 -0.25 -0.07 -3.45 0.00 0.00 179.45 176.48 1xrh h LEU 18 N 0.56 0.64 -0.47 5.20 4.07 -0.69 -1.00 115.31 123.62 1xrh h LEU 18 Ca 0.08 -0.48 -0.02 0.00 0.08 0.00 0.00 57.88 57.55 1xrh h LEU 18 Cb 0.68 -0.18 -0.02 0.00 1.08 0.00 0.00 40.66 42.21 1xrh h LEU 18 CO 0.05 0.99 0.23 0.00 -1.08 0.00 0.00 178.44 178.63 1xrh h GLN 20 N 0.62 0.99 0.00 0.00 4.15 -0.75 0.81 115.11 120.94 1xrh h GLN 20 Ca 0.16 -0.06 -0.04 0.00 0.77 0.00 0.00 58.65 59.49 1xrh h GLN 20 Cb 0.11 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 27.57 1xrh h GLN 20 CO -0.02 0.66 -0.17 0.00 -1.93 0.00 0.00 178.83 177.37 1xrh h ALA 21 N 1.44 1.57 0.00 3.38 0.00 -0.35 -3.46 119.26 121.83 1xrh h ALA 21 Ca 0.41 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1xrh h ALA 21 Cb 0.21 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1xrh h ALA 21 CO -0.19 0.21 0.00 0.41 0.00 0.00 0.00 179.25 179.68 1xrh n GLY 22 N -0.92 0.37 3.78 0.00 0.00 0.28 -3.99 105.19 104.71 1xrh n GLY 22 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 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 3.71 0.52 0.99 1.43 -0.84 -4.91 118.68 119.58 1xrh s LEU 23 Ca 0.00 2.03 -0.21 0.00 -1.03 0.00 0.00 54.13 54.92 1xrh s LEU 23 Cb 0.00 -4.56 -0.06 0.00 0.03 0.00 0.00 46.19 41.60 1xrh s LEU 23 CO 0.00 -1.11 1.23 -0.75 0.23 0.00 0.00 176.35 175.94 1xrh s LYS 24 N -3.45 3.37 0.19 1.70 2.20 -1.26 -4.23 119.74 118.26 1xrh s LYS 24 Ca 0.69 1.90 -0.16 0.00 -0.36 0.00 0.00 55.97 58.05 1xrh s LYS 24 Cb -0.20 -2.23 0.18 0.00 -1.51 0.00 0.00 37.83 34.08 1xrh s LYS 24 CO 0.27 -0.90 1.63 -0.09 -0.36 0.00 0.00 175.35 175.90 1xrh h ARG 25 N 1.55 -0.04 -0.64 4.03 9.65 -1.96 0.03 114.38 126.99 1xrh h ARG 25 Ca -0.50 0.00 0.02 0.00 -1.10 0.00 0.00 59.98 58.41 1xrh h ARG 25 Cb 1.27 0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 29.83 1xrh h ARG 25 CO 0.58 -0.03 0.43 1.05 2.80 0.00 0.00 179.97 184.80 1xrh h GLU 26 N -0.04 0.78 0.03 0.20 4.11 -2.00 -0.06 114.58 117.59 1xrh h GLU 26 Ca 0.26 -0.05 -0.24 0.00 0.07 0.00 0.00 59.36 59.40 1xrh h GLU 26 Cb 0.44 -0.18 0.01 0.00 0.50 0.00 0.00 28.75 29.52 1xrh h GLU 26 CO -0.59 0.51 -1.02 0.45 0.07 0.00 0.00 179.01 178.44 1xrh h HIS 27 N 0.80 0.63 -0.48 2.06 3.86 -1.64 -2.75 115.15 117.64 1xrh h HIS 27 Ca 0.25 -0.37 -0.07 0.00 -1.16 0.00 0.00 60.37 59.02 1xrh h HIS 27 Cb 0.02 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 28.40 1xrh h HIS 27 CO -0.00 1.20 0.00 0.00 0.86 0.00 0.00 177.93 179.99 1xrh h ALA 28 N 0.67 1.11 -0.39 2.45 0.00 -0.54 -0.86 119.26 121.71 1xrh h ALA 28 Ca -0.10 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.51 1xrh h ALA 28 Cb 1.67 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 19.25 1xrh h ALA 28 CO 0.18 0.57 0.09 0.00 0.00 0.00 0.00 179.25 180.08 1xrh h ALA 29 N 1.26 0.51 0.01 0.00 0.00 -0.94 0.30 119.26 120.40 1xrh h ALA 29 Ca 0.14 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1xrh h ALA 29 Cb 0.45 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1xrh h ALA 29 CO 0.02 0.19 -0.01 1.15 0.00 0.00 0.00 179.25 180.60 1xrh h THR 30 N 0.48 0.97 -0.31 0.00 2.02 -1.24 0.12 112.91 114.95 1xrh h THR 30 Ca 0.12 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.34 1xrh h THR 30 Cb 0.32 0.97 -0.03 0.00 -1.74 0.00 0.00 68.15 67.67 1xrh h THR 30 CO 0.00 0.00 0.10 0.58 0.37 0.00 0.00 175.52 176.57 1xrh h VAL 31 N -0.03 0.90 -0.56 3.16 2.07 -1.06 -1.55 116.25 119.18 1xrh h VAL 31 Ca 0.00 -0.08 0.04 0.00 0.82 0.00 0.00 66.70 67.48 1xrh h VAL 31 Cb 0.03 0.66 -0.04 0.00 -1.52 0.00 0.00 31.29 30.41 1xrh h VAL 31 CO -0.01 0.04 0.32 0.00 0.02 0.00 0.00 177.57 177.94 1xrh h ALA 32 N 1.20 0.73 -0.94 1.67 0.00 -0.70 -0.28 119.26 120.93 1xrh h ALA 32 Ca 0.14 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1xrh h ALA 32 Cb 0.12 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 1xrh h ALA 32 CO -0.15 0.01 0.59 1.49 0.00 0.00 0.00 179.25 181.19 1xrh h GLU 33 N 0.62 1.27 -0.08 0.00 4.81 -0.14 -1.47 114.58 119.60 1xrh h GLU 33 Ca 0.24 -0.10 -0.14 0.00 -0.13 0.00 0.00 59.36 59.23 1xrh h GLU 33 Cb 0.09 -0.27 -0.01 0.00 0.63 0.00 0.00 28.75 29.18 1xrh h GLU 33 CO -0.13 0.87 -0.58 0.28 -0.73 0.00 0.00 179.01 178.72 1xrh h VAL 34 N 1.30 1.37 -0.47 0.32 2.07 -0.55 -0.82 116.25 119.48 1xrh h VAL 34 Ca 0.34 -1.91 -0.13 0.00 0.82 0.00 0.00 66.70 65.82 1xrh h VAL 34 Cb -0.09 1.95 -0.01 0.00 -1.52 0.00 0.00 31.29 31.62 1xrh h VAL 34 CO -0.07 0.57 -0.22 -0.07 0.02 0.00 0.00 177.57 177.80 1xrh h LEU 35 N 0.19 0.98 -0.42 2.57 3.38 -0.61 -2.40 115.31 119.01 1xrh h LEU 35 Ca -0.00 -0.37 -0.18 0.00 0.09 0.00 0.00 57.88 57.41 1xrh h LEU 35 Cb 1.07 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 1xrh h LEU 35 CO 0.09 1.16 -0.72 0.58 0.09 0.00 0.00 178.44 179.64 1xrh h VAL 36 N 0.83 1.38 -0.54 1.22 2.07 -1.18 -2.50 116.25 117.53 1xrh h VAL 36 Ca 0.11 -2.14 0.11 0.00 0.82 0.00 0.00 66.70 65.60 1xrh h VAL 36 Cb 0.79 2.11 -0.09 0.00 -1.52 0.00 0.00 31.29 32.58 1xrh h VAL 36 CO 0.07 0.64 -0.04 0.22 0.02 0.00 0.00 177.57 178.48 1xrh h TYR 37 N 0.27 -0.11 -0.07 1.57 3.20 -1.03 0.51 116.97 121.30 1xrh h TYR 37 Ca -0.03 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 1xrh h TYR 37 Cb 1.29 0.13 -0.00 0.00 1.54 0.00 0.00 36.73 39.69 1xrh h TYR 37 CO 0.04 -0.16 0.02 0.00 -1.64 0.00 0.00 178.16 176.42 1xrh h ALA 38 N 1.50 0.10 -0.44 1.82 0.00 -1.06 -2.34 119.26 118.84 1xrh h ALA 38 Ca 0.27 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1xrh h ALA 38 Cb 0.43 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1xrh h ALA 38 CO -0.49 -0.27 0.20 -0.44 0.00 0.00 0.00 179.25 178.25 1xrh h ASP 39 N -0.10 0.55 -0.61 0.00 3.32 -1.03 0.61 116.42 119.16 1xrh h ASP 39 Ca 0.02 -0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.01 1xrh h ASP 39 Cb 0.25 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.63 1xrh h ASP 39 CO 0.00 0.48 0.31 0.00 -1.72 0.00 0.00 179.24 178.31 1xrh h ALA 40 N 1.60 0.79 -0.00 3.45 0.00 0.15 -2.52 119.26 122.73 1xrh h ALA 40 Ca 0.15 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1xrh h ALA 40 Cb 0.09 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1xrh h ALA 40 CO -0.02 0.33 -0.00 0.54 0.00 0.00 0.00 179.25 180.10 1xrh n ARG 41 N -4.53 0.90 -0.55 0.00 1.74 -0.72 -3.19 116.66 110.30 1xrh n ARG 41 Ca 0.04 -0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 1xrh n ARG 41 Cb 0.11 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.05 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 1.08 0.75 2.77 -0.13 0.00 -0.43 -4.69 105.19 104.54 1xrh n GLY 42 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.30 4.92 0.19 -0.61 5.41 0.08 -4.76 119.36 122.29 1xrh n ILE 43 Ca 0.00 -4.82 0.08 0.00 1.00 0.00 0.00 62.75 59.01 1xrh n ILE 43 Cb 0.00 -2.16 0.41 0.00 -0.71 0.00 0.00 39.64 37.17 1xrh n ILE 43 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 1xrh n HIS 44 N 2.49 0.51 0.26 1.39 8.25 -1.26 -1.02 115.22 125.83 1xrh n HIS 44 Ca 0.43 0.25 0.14 0.00 -0.26 0.00 0.00 57.72 58.28 1xrh n HIS 44 Cb 0.32 -0.90 0.63 0.00 1.12 0.00 0.00 29.99 31.15 1xrh n HIS 44 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1xrh h SER 45 N 0.00 0.00 -0.22 0.41 4.64 -1.94 -2.97 113.55 113.46 1xrh h SER 45 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 1xrh h SER 45 Cb 0.08 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.14 1xrh h SER 45 CO 0.00 0.12 -0.04 1.41 -0.87 0.00 0.00 176.83 177.45 1xrh n HIS 46 N -3.31 0.75 -0.98 4.77 -0.00 -0.19 -4.74 115.22 111.52 1xrh n HIS 46 Ca -0.00 -1.10 0.00 0.00 -0.00 0.00 0.00 57.72 56.62 1xrh n HIS 46 Cb 0.33 -0.32 0.00 0.00 -0.00 0.00 0.00 29.99 30.00 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 -0.88 2.46 0.37 -1.41 0.00 -1.12 -4.58 105.19 100.03 1xrh n GLY 47 Ca 0.23 -1.86 0.18 0.00 0.00 0.00 0.00 46.02 44.57 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 -0.65 1.80 -0.02 4.61 0.00 -1.84 -1.20 119.26 121.96 1xrh h ALA 48 Ca 0.00 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1xrh h ALA 48 Cb 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1xrh h ALA 48 CO 0.00 -0.54 0.04 -0.24 0.00 0.00 0.00 179.25 178.51 1xrh h VAL 49 N 0.00 0.31 -0.00 0.00 3.04 -1.91 -2.15 116.25 115.53 1xrh h VAL 49 Ca 0.11 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.80 1xrh h VAL 49 Cb 0.94 0.96 0.00 0.00 -2.01 0.00 0.00 31.29 31.19 1xrh h VAL 49 CO -0.00 0.00 -0.37 0.54 -1.01 0.00 0.00 177.57 176.73 1xrh n ARG 50 N -3.53 0.25 -0.27 4.17 5.12 -0.45 -4.51 116.66 117.44 1xrh n ARG 50 Ca -0.02 -0.13 -0.06 0.00 -1.93 0.00 0.00 57.85 55.70 1xrh n ARG 50 Cb 0.12 -1.50 0.06 0.00 -1.16 0.00 0.00 32.46 29.98 1xrh n ARG 50 CO 0.00 0.00 0.00 -0.24 -1.93 0.00 0.00 177.63 175.46 1xrh h VAL 51 N 0.33 1.25 -0.94 1.55 3.04 -1.58 -1.04 116.25 118.86 1xrh h VAL 51 Ca 0.00 -0.76 -0.01 0.00 -1.01 0.00 0.00 66.70 64.92 1xrh h VAL 51 Cb 0.49 0.36 -0.05 0.00 -2.01 0.00 0.00 31.29 30.08 1xrh h VAL 51 CO 0.00 0.31 0.57 -0.08 -1.01 0.00 0.00 177.57 177.36 1xrh h GLU 52 N 1.07 1.28 -0.07 4.17 4.81 -1.80 0.40 114.58 124.45 1xrh h GLU 52 Ca 0.25 -0.12 -0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1xrh h GLU 52 Cb 0.19 -0.27 -0.00 0.00 0.63 0.00 0.00 28.75 29.29 1xrh h GLU 52 CO -0.02 0.89 0.03 -0.92 -0.73 0.00 0.00 179.01 178.26 1xrh h TYR 53 N 1.30 0.10 -0.83 0.92 3.20 -1.73 -2.05 116.97 117.88 1xrh h TYR 53 Ca 0.34 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.20 1xrh h TYR 53 Cb -0.06 -0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.14 1xrh h TYR 53 CO 0.00 0.23 0.51 1.88 -1.64 0.00 0.00 178.16 179.14 1xrh h TYR 54 N -0.05 1.09 -0.67 -3.82 0.05 -0.49 -1.92 116.97 111.16 1xrh h TYR 54 Ca 0.02 0.00 0.01 0.00 0.05 0.00 0.00 58.73 58.82 1xrh h TYR 54 Cb 0.17 -0.36 -0.04 0.00 1.01 0.00 0.00 36.73 37.51 1xrh h TYR 54 CO -0.02 0.72 0.44 0.00 -1.05 0.00 0.00 178.16 178.25 1xrh h ALA 55 N 1.28 0.86 -0.51 3.88 0.00 -0.08 0.18 119.26 124.86 1xrh h ALA 55 Ca 0.30 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.13 1xrh h ALA 55 Cb -0.06 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 1xrh h ALA 55 CO -0.06 0.25 0.14 1.49 0.00 0.00 0.00 179.25 181.08 1xrh h GLU 56 N 0.89 0.81 -0.73 0.00 4.81 -0.93 -0.15 114.58 119.28 1xrh h GLU 56 Ca 0.25 -0.18 -0.06 0.00 -0.13 0.00 0.00 59.36 59.24 1xrh h GLU 56 Cb -0.07 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.17 1xrh h GLU 56 CO -0.07 0.76 0.21 -0.09 -0.73 0.00 0.00 179.01 179.10 1xrh h ARG 57 N 0.70 1.14 -0.36 1.92 2.43 -0.72 0.35 114.38 119.85 1xrh h ARG 57 Ca 0.16 -0.25 -0.01 0.00 -0.81 0.00 0.00 59.98 59.07 1xrh h ARG 57 Cb 0.30 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.67 1xrh h ARG 57 CO -0.00 0.98 0.20 0.82 -1.51 0.00 0.00 179.97 180.46 1xrh h ILE 58 N 1.09 1.14 -0.82 1.20 2.04 -0.41 -1.33 117.51 120.41 1xrh h ILE 58 Ca 0.23 -0.34 0.07 0.00 1.00 0.00 0.00 64.86 65.82 1xrh h ILE 58 Cb 0.33 0.72 -0.06 0.00 -0.74 0.00 0.00 36.82 37.06 1xrh h ILE 58 CO -0.00 0.14 0.50 -1.28 0.00 0.00 0.00 178.15 177.50 1xrh h SER 59 N 0.45 0.77 -0.11 1.72 0.87 -0.71 -2.10 113.55 114.44 1xrh h SER 59 Ca 0.13 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 1xrh h SER 59 Cb 0.04 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 61.87 1xrh h SER 59 CO -0.02 0.48 0.00 0.29 -0.53 0.00 0.00 176.83 177.05 1xrh n LYS 60 N -4.67 1.63 -0.26 2.24 5.02 0.09 -4.93 118.16 117.27 1xrh n LYS 60 Ca 0.12 -0.93 0.00 0.00 -2.02 0.00 0.00 58.31 55.48 1xrh n LYS 60 Cb 0.19 -1.41 0.00 0.00 -0.02 0.00 0.00 35.03 33.79 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 1.11 1.02 0.20 0.72 0.00 -0.75 -4.36 105.19 103.12 1xrh n GLY 61 Ca 0.17 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.33 1xrh n GLY 61 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1xrh h GLY 62 N 0.00 0.00 -4.97 -0.02 0.00 -0.30 -3.40 103.07 94.37 1xrh h GLY 62 Ca 0.00 0.00 -0.69 0.00 0.00 0.00 0.00 47.33 46.64 1xrh h GLY 62 CO 0.00 0.00 -0.85 -1.59 0.00 0.00 0.00 176.54 174.10 1xrh s THR 63 N -3.52 2.32 -0.24 4.70 2.01 -1.22 -3.36 115.64 116.33 1xrh s THR 63 Ca 0.02 -0.97 -0.29 0.00 0.31 0.00 0.00 61.69 60.75 1xrh s THR 63 Cb 0.09 -1.87 0.00 0.00 0.01 0.00 0.00 72.50 70.74 1xrh s THR 63 CO 0.41 0.57 1.12 0.21 -0.69 0.00 0.00 174.62 176.25 1xrh s ASN 64 N -0.26 7.00 0.00 3.53 3.84 0.42 -4.77 114.94 124.69 1xrh s ASN 64 Ca -0.00 1.38 0.27 0.00 0.21 0.00 0.00 52.86 54.72 1xrh s ASN 64 Cb -0.13 -2.54 0.92 0.00 -0.55 0.00 0.00 41.25 38.95 1xrh s ASN 64 CO 0.03 -0.76 1.67 -2.11 -2.79 0.00 0.00 177.10 173.13 1xrh n ARG 65 N 6.57 0.80 -3.13 0.43 1.85 -1.26 -4.16 116.66 117.76 1xrh n ARG 65 Ca 0.13 -0.41 -0.18 0.00 -1.00 0.00 0.00 57.85 56.38 1xrh n ARG 65 Cb 0.46 -1.49 -0.03 0.00 -1.05 0.00 0.00 32.46 30.35 1xrh n ARG 65 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 177.63 175.71 1xrh n GLU 66 N -0.74 1.17 -1.96 2.89 2.13 -1.26 -4.56 120.64 118.30 1xrh n GLU 66 Ca 0.13 -3.49 -0.34 0.00 0.66 0.00 0.00 57.16 54.12 1xrh n GLU 66 Cb 0.32 -1.72 0.03 0.00 0.27 0.00 0.00 31.44 30.35 1xrh n GLU 66 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1xrh s PRO 67 N -2.57 3.00 -0.78 5.31 0.04 -1.26 -4.98 135.00 133.76 1xrh s PRO 67 Ca 0.40 1.55 -0.02 0.00 0.04 0.00 0.00 61.00 62.97 1xrh s PRO 67 Cb 0.35 -1.96 0.19 0.00 0.04 0.00 0.00 34.50 33.13 1xrh s PRO 67 CO -0.08 -1.12 0.63 -1.21 0.04 0.00 0.00 177.00 175.27 1xrh s GLU 68 N -3.67 2.97 0.35 4.56 2.02 -1.26 -5.07 118.70 118.59 1xrh s GLU 68 Ca 0.71 -2.97 -0.28 0.00 0.02 0.00 0.00 54.97 52.44 1xrh s GLU 68 Cb -0.23 -3.86 -0.11 0.00 0.10 0.00 0.00 34.13 30.03 1xrh s GLU 68 CO 0.35 -1.23 1.37 -0.06 0.02 0.00 0.00 175.26 175.71 1xrh s PHE 69 N -0.82 2.88 -0.17 1.61 0.40 -1.26 -4.67 117.98 115.95 1xrh s PHE 69 Ca 0.23 1.32 -0.04 0.00 -0.60 0.00 0.00 56.93 57.84 1xrh s PHE 69 Cb -0.12 -3.80 0.06 0.00 0.51 0.00 0.00 43.02 39.66 1xrh s PHE 69 CO -0.09 -2.27 0.07 0.50 0.70 0.00 0.00 175.22 174.13 1xrh s ARG 70 N -1.88 0.24 -0.57 0.44 3.52 -0.76 -4.99 118.95 114.96 1xrh s ARG 70 Ca 0.50 -0.15 -0.20 0.00 -0.13 0.00 0.00 55.73 55.75 1xrh s ARG 70 Cb -0.42 -1.81 0.08 0.00 -1.56 0.00 0.00 34.95 31.23 1xrh s ARG 70 CO 0.56 -0.63 0.74 -1.17 -0.81 0.00 0.00 175.30 173.99 1xrh s LEU 71 N 2.05 4.95 -0.29 -0.88 2.96 -1.26 -1.00 118.68 125.21 1xrh s LEU 71 Ca 0.01 -1.06 -0.23 0.00 -0.22 0.00 0.00 54.13 52.64 1xrh s LEU 71 Cb -0.16 -2.43 -0.00 0.00 0.50 0.00 0.00 46.19 44.10 1xrh s LEU 71 CO -0.08 -1.09 0.74 -0.70 -1.32 0.00 0.00 176.35 173.90 1xrh s GLU 72 N 3.01 3.99 -0.19 1.98 2.12 0.43 -4.93 118.70 125.11 1xrh s GLU 72 Ca 0.16 0.57 -0.17 0.00 0.36 0.00 0.00 54.97 55.89 1xrh s GLU 72 Cb -0.20 -3.71 -0.04 0.00 0.26 0.00 0.00 34.13 30.44 1xrh s GLU 72 CO 0.10 -0.61 0.45 -1.21 -0.54 0.00 0.00 175.26 173.46 1xrh s GLU 73 N 2.82 4.20 -0.00 4.30 2.02 -1.26 -0.90 118.70 129.88 1xrh s GLU 73 Ca 0.30 0.31 0.08 0.00 0.02 0.00 0.00 54.97 55.68 1xrh s GLU 73 Cb -0.15 -3.53 -0.09 0.00 0.10 0.00 0.00 34.13 30.46 1xrh s GLU 73 CO 0.11 -0.05 0.30 0.25 0.02 0.00 0.00 175.26 175.89 1xrh n THR 74 N 4.31 0.00 -3.86 3.63 -2.24 -0.44 -5.00 114.28 110.68 1xrh n THR 74 Ca -0.07 -0.29 -0.04 0.00 -2.27 0.00 0.00 64.05 61.38 1xrh n THR 74 Cb 0.51 0.87 0.02 0.00 -2.10 0.00 0.00 70.33 69.62 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 -1.96 0.13 0.27 3.38 0.00 -1.02 -4.95 107.32 103.16 1xrh s GLY 75 Ca 0.02 -0.37 -0.01 0.00 0.00 0.00 0.00 44.72 44.36 1xrh s GLY 75 CO 0.32 1.67 1.81 -2.55 0.00 0.00 0.00 173.10 174.36 1xrh h PRO 76 N 2.00 0.84 -0.30 2.90 0.11 -1.99 -3.12 132.00 132.43 1xrh h PRO 76 Ca -0.28 -0.05 -0.23 0.00 0.11 0.00 0.00 66.00 65.55 1xrh h PRO 76 Cb 1.23 -0.19 -0.22 0.00 0.11 0.00 0.00 31.00 31.93 1xrh h PRO 76 CO 0.36 0.55 -0.70 0.00 -0.21 0.00 0.00 178.00 178.00 1xrh s SER 78 N -3.30 -0.62 0.22 0.00 1.04 -1.18 -1.71 113.70 108.14 1xrh s SER 78 Ca 0.42 1.14 -0.12 0.00 0.48 0.00 0.00 55.95 57.87 1xrh s SER 78 Cb 0.38 1.12 -0.00 0.00 0.10 0.00 0.00 66.02 67.62 1xrh s SER 78 CO -0.04 -0.20 0.43 0.00 0.98 0.00 0.00 173.24 174.41 1xrh s ALA 79 N 0.63 -0.22 -0.03 5.32 0.00 -1.04 -1.33 121.76 125.09 1xrh s ALA 79 Ca -0.03 -0.83 0.04 0.00 0.00 0.00 0.00 51.96 51.15 1xrh s ALA 79 Cb -0.05 1.01 -0.01 0.00 0.00 0.00 0.00 23.12 24.08 1xrh s ALA 79 CO -0.04 -0.80 -0.16 0.42 0.00 0.00 0.00 175.76 175.19 1xrh s ILE 80 N -3.99 1.30 -0.34 0.00 1.01 -0.08 -1.12 121.20 117.97 1xrh s ILE 80 Ca 0.20 -0.66 -0.06 0.00 0.00 0.00 0.00 60.65 60.13 1xrh s ILE 80 Cb 0.00 -1.11 0.04 0.00 0.01 0.00 0.00 42.46 41.41 1xrh s ILE 80 CO 0.06 0.37 0.10 -0.22 0.00 0.00 0.00 174.94 175.25 1xrh s LEU 81 N -0.09 4.29 -0.41 2.97 2.96 0.69 -0.43 118.68 128.67 1xrh s LEU 81 Ca -0.00 -1.14 -0.29 0.00 -0.22 0.00 0.00 54.13 52.48 1xrh s LEU 81 Cb -0.09 -1.86 0.02 0.00 0.50 0.00 0.00 46.19 44.76 1xrh s LEU 81 CO 0.01 -0.32 1.10 -1.00 -1.32 0.00 0.00 176.35 174.82 1xrh s HIS 82 N 1.40 2.96 -2.17 5.38 3.76 -0.17 -0.47 115.29 125.97 1xrh s HIS 82 Ca -0.02 0.91 0.26 0.00 -0.15 0.00 0.00 55.06 56.06 1xrh s HIS 82 Cb -0.19 -4.10 0.59 0.00 1.11 0.00 0.00 32.58 29.98 1xrh s HIS 82 CO 0.03 -1.05 1.47 0.00 -0.85 0.00 0.00 174.74 174.34 1xrh n ALA 83 N 7.40 2.97 -3.82 -1.40 0.00 -0.44 -1.83 120.51 123.40 1xrh n ALA 83 Ca 0.12 -0.51 -0.30 0.00 0.00 0.00 0.00 53.44 52.75 1xrh n ALA 83 Cb 0.48 -1.02 -0.01 0.00 0.00 0.00 0.00 19.45 18.89 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 -0.03 -3.53 -3.52 0.00 4.64 -1.22 -0.35 116.55 112.54 1xrh n ASP 84 Ca 0.14 -0.71 -0.26 0.00 -1.38 0.00 0.00 54.79 52.58 1xrh n ASP 84 Cb 0.41 -2.90 0.03 0.00 -1.04 0.00 0.00 41.12 37.62 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 -2.48 -5.27 -4.09 1.67 3.02 0.22 -4.61 115.26 103.72 1xrh n ASN 85 Ca 0.04 -0.53 -0.30 0.00 -0.03 0.00 0.00 54.58 53.76 1xrh n ASN 85 Cb 0.51 -4.22 0.22 0.00 -0.61 0.00 0.00 39.78 35.68 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 -3.20 0.66 0.15 5.41 0.00 0.53 -0.44 121.76 124.87 1xrh s ALA 86 Ca 0.51 -0.76 -0.31 0.00 0.00 0.00 0.00 51.96 51.40 1xrh s ALA 86 Cb -0.25 -2.96 -0.09 0.00 0.00 0.00 0.00 23.12 19.83 1xrh s ALA 86 CO 0.63 -3.39 1.42 0.00 0.00 0.00 0.00 175.76 174.42 1xrh s ALA 87 N -2.98 3.62 0.22 0.00 0.00 -1.26 -1.88 121.76 119.48 1xrh s ALA 87 Ca 0.69 1.19 -0.08 0.00 0.00 0.00 0.00 51.96 53.75 1xrh s ALA 87 Cb -0.13 -3.55 0.36 0.00 0.00 0.00 0.00 23.12 19.80 1xrh s ALA 87 CO 0.57 -0.64 1.68 0.78 0.00 0.00 0.00 175.76 178.14 1xrh h GLY 88 N 6.40 0.82 0.86 0.00 0.00 -1.62 -1.27 103.07 108.26 1xrh h GLY 88 Ca -0.43 0.01 0.12 0.00 0.00 0.00 0.00 47.33 47.03 1xrh h GLY 88 CO 0.85 -0.18 0.46 1.46 0.00 0.00 0.00 176.54 179.13 1xrh h GLN 89 N 0.21 0.41 0.18 4.80 7.50 -1.73 0.13 115.11 126.61 1xrh h GLN 89 Ca 0.35 -0.02 -0.01 0.00 0.50 0.00 0.00 58.65 59.47 1xrh h GLN 89 Cb 0.58 -0.09 0.00 0.00 0.05 0.00 0.00 27.48 28.01 1xrh h GLN 89 CO -0.49 0.27 -0.09 0.28 -1.50 0.00 0.00 178.83 177.31 1xrh h VAL 90 N 0.43 0.63 -0.40 -0.54 2.07 -1.61 -2.26 116.25 114.56 1xrh h VAL 90 Ca 0.33 -1.09 0.08 0.00 0.82 0.00 0.00 66.70 66.84 1xrh h VAL 90 Cb 0.69 1.09 -0.08 0.00 -1.52 0.00 0.00 31.29 31.46 1xrh h VAL 90 CO -0.10 0.17 -0.14 0.00 0.02 0.00 0.00 177.57 177.53 1xrh h ALA 91 N -0.54 0.21 -0.28 1.67 0.00 -0.79 -2.09 119.26 117.44 1xrh h ALA 91 Ca -0.02 0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 1xrh h ALA 91 Cb 0.47 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1xrh h ALA 91 CO 0.04 -0.49 -0.23 0.00 0.00 0.00 0.00 179.25 178.57 1xrh h ALA 92 N 1.31 1.08 0.00 0.00 0.00 -0.87 -2.58 119.26 118.19 1xrh h ALA 92 Ca 0.20 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1xrh h ALA 92 Cb 0.35 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1xrh h ALA 92 CO -0.44 0.57 0.00 1.17 0.00 0.00 0.00 179.25 180.54 1xrh n LYS 93 N -4.13 0.32 -0.98 0.00 4.81 -0.79 -4.64 118.16 112.75 1xrh n LYS 93 Ca -0.00 0.00 -0.01 0.00 -0.87 0.00 0.00 58.31 57.43 1xrh n LYS 93 Cb 0.40 -1.29 -0.00 0.00 0.02 0.00 0.00 35.03 34.16 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 0.70 -0.02 0.99 3.14 0.00 -0.98 -4.70 105.19 104.32 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 -0.32 0.00 -0.10 1.61 1.02 -1.26 0.01 120.64 121.60 1xrh n GLU 97 Ca 0.00 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.03 1xrh n GLU 97 Cb 0.02 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 31.41 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 0.61 -0.77 -0.32 2.76 -1.97 -2.01 115.15 113.46 1xrh h HIS 98 Ca 0.00 -0.13 0.09 0.00 -2.20 0.00 0.00 60.37 58.13 1xrh h HIS 98 Cb 0.00 -0.15 -0.07 0.00 1.55 0.00 0.00 27.41 28.74 1xrh h HIS 98 CO 0.00 0.74 0.42 0.00 -1.30 0.00 0.00 177.93 177.79 1xrh h ALA 99 N 0.79 1.08 -0.61 5.26 0.00 -0.81 -0.93 119.26 124.03 1xrh h ALA 99 Ca 0.07 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 1xrh h ALA 99 Cb 0.53 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1xrh h ALA 99 CO 0.03 0.05 0.15 0.82 0.00 0.00 0.00 179.25 180.30 1xrh h ILE 100 N 0.72 1.25 -0.31 0.00 2.04 -1.76 -1.66 117.51 117.80 1xrh h ILE 100 Ca 0.37 -0.90 -0.04 0.00 1.00 0.00 0.00 64.86 65.29 1xrh h ILE 100 Cb 0.33 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 1xrh h ILE 100 CO -0.24 0.34 0.05 0.50 0.00 0.00 0.00 178.15 178.79 1xrh h LYS 101 N 0.88 0.51 -0.86 2.37 3.64 -0.82 -1.76 116.57 120.54 1xrh h LYS 101 Ca 0.19 -0.14 -0.02 0.00 -1.27 0.00 0.00 60.65 59.41 1xrh h LYS 101 Cb 0.35 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.07 1xrh h LYS 101 CO 0.00 0.61 0.46 1.15 -2.27 0.00 0.00 179.45 179.40 1xrh h THR 102 N 0.33 1.25 -0.04 1.00 2.02 -1.01 -1.42 112.91 115.05 1xrh h THR 102 Ca 0.09 -0.65 -0.10 0.00 0.77 0.00 0.00 66.41 66.52 1xrh h THR 102 Cb 0.35 0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 66.85 1xrh h THR 102 CO 0.01 0.29 -0.46 0.00 0.37 0.00 0.00 175.52 175.72 1xrh h ALA 103 N 1.29 1.16 0.23 6.16 0.00 -1.17 0.18 119.26 127.11 1xrh h ALA 103 Ca 0.30 -0.43 0.01 0.00 0.00 0.00 0.00 54.91 54.79 1xrh h ALA 103 Cb 0.05 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1xrh h ALA 103 CO -0.05 0.60 -0.30 0.37 0.00 0.00 0.00 179.25 179.87 1xrh h GLN 104 N 0.07 -0.57 0.07 0.00 -0.00 -0.35 1.02 115.11 115.36 1xrh h GLN 104 Ca 0.00 0.04 -0.10 0.00 -0.00 0.00 0.00 58.65 58.59 1xrh h GLN 104 Cb 0.85 0.13 0.01 0.00 0.00 0.00 0.00 27.48 28.47 1xrh h GLN 104 CO 0.06 -0.38 -0.44 0.37 0.00 0.00 0.00 178.83 178.44 1xrh h GLN 105 N -0.59 0.17 -0.44 1.69 5.75 -1.35 -3.39 115.11 116.95 1xrh h GLN 105 Ca 0.00 -0.28 0.00 0.00 -0.15 0.00 0.00 58.65 58.22 1xrh h GLN 105 Cb 0.57 0.10 0.00 0.00 1.07 0.00 0.00 27.48 29.22 1xrh h GLN 105 CO -0.11 1.12 0.00 0.09 -2.65 0.00 0.00 178.83 177.29 1xrh n ASN 106 N -4.35 3.53 0.00 -0.69 3.02 0.63 -5.00 115.26 112.40 1xrh n ASN 106 Ca -0.12 -1.99 0.00 0.00 -0.03 0.00 0.00 54.58 52.44 1xrh n ASN 106 Cb 0.66 -0.28 0.00 0.00 -0.61 0.00 0.00 39.78 39.55 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 1.53 2.09 3.15 7.41 0.00 0.35 -4.91 105.19 114.81 1xrh n GLY 107 Ca 0.20 -0.04 -0.10 0.00 0.00 0.00 0.00 46.02 46.08 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 -0.27 0.11 -0.16 1.61 1.01 -1.26 -0.00 120.40 121.44 1xrh s VAL 108 Ca 0.00 -0.91 -0.17 0.00 0.00 0.00 0.00 61.98 60.90 1xrh s VAL 108 Cb 0.00 -0.81 0.05 0.00 0.00 0.00 0.00 36.38 35.61 1xrh s VAL 108 CO 0.00 -0.50 0.48 0.00 0.00 0.00 0.00 175.10 175.08 1xrh s ALA 109 N -2.34 -1.19 -0.22 5.51 0.00 0.40 -4.13 121.76 119.79 1xrh s ALA 109 Ca -0.07 1.29 -0.02 0.00 0.00 0.00 0.00 51.96 53.16 1xrh s ALA 109 Cb -0.02 -0.70 0.07 0.00 0.00 0.00 0.00 23.12 22.46 1xrh s ALA 109 CO -0.03 -0.24 0.03 0.08 0.00 0.00 0.00 175.76 175.60 1xrh s VAL 110 N 0.08 0.80 -0.06 0.00 1.01 -0.70 0.25 120.40 121.79 1xrh s VAL 110 Ca -0.01 -0.84 0.05 0.00 0.00 0.00 0.00 61.98 61.18 1xrh s VAL 110 Cb -0.03 -1.30 -0.02 0.00 0.00 0.00 0.00 36.38 35.03 1xrh s VAL 110 CO 0.01 -0.26 -0.20 -0.69 0.00 0.00 0.00 175.10 173.96 1xrh s VAL 111 N 1.72 2.48 -0.08 2.92 1.01 0.14 -2.51 120.40 126.08 1xrh s VAL 111 Ca -0.00 -0.92 -0.00 0.00 0.00 0.00 0.00 61.98 61.06 1xrh s VAL 111 Cb -0.18 -1.94 -0.03 0.00 0.00 0.00 0.00 36.38 34.24 1xrh s VAL 111 CO -0.10 0.57 -0.05 -0.83 0.00 0.00 0.00 175.10 174.69 1xrh s GLY 112 N -0.33 1.74 -0.38 4.51 0.00 -0.28 0.09 107.32 112.68 1xrh s GLY 112 Ca 0.02 -0.86 -0.11 0.00 0.00 0.00 0.00 44.72 43.77 1xrh s GLY 112 CO 0.02 -0.62 0.21 -0.42 0.00 0.00 0.00 173.10 172.29 1xrh s ILE 113 N -0.80 4.53 -0.38 0.90 -1.09 0.19 -0.22 121.20 124.33 1xrh s ILE 113 Ca 0.12 -0.90 -0.15 0.00 -2.23 0.00 0.00 60.65 57.49 1xrh s ILE 113 Cb -0.11 -3.55 0.00 0.00 -1.58 0.00 0.00 42.46 37.22 1xrh s ILE 113 CO 0.02 -0.25 0.32 -0.55 -1.23 0.00 0.00 174.94 173.24 1xrh s SER 114 N 1.57 6.12 0.02 3.58 0.15 0.37 -1.47 113.70 124.04 1xrh s SER 114 Ca 0.02 -0.62 0.00 0.00 0.70 0.00 0.00 55.95 56.04 1xrh s SER 114 Cb -0.19 -2.17 0.00 0.00 -1.71 0.00 0.00 66.02 61.94 1xrh s SER 114 CO 0.06 -0.40 0.00 0.54 1.20 0.00 0.00 173.24 174.65 1xrh n ARG 115 N 5.26 -2.26 -1.99 5.44 1.74 -0.62 -1.33 116.66 122.91 1xrh n ARG 115 Ca -0.10 1.92 -0.04 0.00 -0.77 0.00 0.00 57.85 58.86 1xrh n ARG 115 Cb 0.48 -2.26 -0.00 0.00 -1.02 0.00 0.00 32.46 29.66 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 0.79 3.34 3.68 -0.13 0.00 -0.79 -0.61 105.19 111.48 1xrh n GLY 117 Ca 0.00 -2.20 -0.43 0.00 0.00 0.00 0.00 46.02 43.39 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 -0.53 2.55 0.71 1.61 -0.00 -1.26 -3.60 115.22 114.70 1xrh n HIS 118 Ca -0.01 -0.13 0.10 0.00 0.46 0.00 0.00 57.72 58.14 1xrh n HIS 118 Cb 0.09 -2.72 0.27 0.00 -0.12 0.00 0.00 29.99 27.51 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 5.80 2.46 0.00 0.26 3.41 -1.26 -3.60 113.62 120.69 1xrh n SER 119 Ca 0.19 -1.89 0.00 0.00 -0.26 0.00 0.00 58.87 56.91 1xrh n SER 119 Cb 0.36 -0.22 0.00 0.00 -0.26 0.00 0.00 64.21 64.09 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 1.28 -1.60 3.59 5.00 0.00 -1.26 -4.18 105.19 108.01 1xrh n GLY 120 Ca 0.17 -1.45 -0.42 0.00 0.00 0.00 0.00 46.02 44.31 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 -1.20 2.87 -0.77 4.61 0.00 -1.26 -4.87 121.76 121.14 1xrh s ALA 121 Ca 0.00 -0.16 0.20 0.00 0.00 0.00 0.00 51.96 52.00 1xrh s ALA 121 Cb 0.00 -4.02 0.83 0.00 0.00 0.00 0.00 23.12 19.93 1xrh s ALA 121 CO 0.00 -2.69 1.63 0.44 0.00 0.00 0.00 175.76 175.14 1xrh n ILE 122 N 7.16 0.81 0.29 0.00 -5.35 -1.26 -2.03 119.36 118.97 1xrh n ILE 122 Ca 0.18 0.18 0.18 0.00 -0.27 0.00 0.00 62.75 63.02 1xrh n ILE 122 Cb 0.48 -0.99 0.95 0.00 -1.74 0.00 0.00 39.64 38.35 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 -0.35 7.28 4.64 -1.90 -1.89 113.55 121.33 1xrh h SER 123 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xrh h SER 123 Cb 0.36 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.43 1xrh h SER 123 CO 0.00 0.00 0.22 0.22 -0.87 0.00 0.00 176.83 176.40 1xrh h TYR 124 N 0.00 0.45 -0.29 4.77 3.20 -1.81 -2.21 116.97 121.08 1xrh h TYR 124 Ca 0.00 0.01 -0.13 0.00 3.14 0.00 0.00 58.73 61.74 1xrh h TYR 124 Cb 0.07 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.18 1xrh h TYR 124 CO 0.00 0.30 -0.36 0.74 -1.64 0.00 0.00 178.16 177.20 1xrh h PHE 125 N 0.46 0.76 -0.15 -3.82 -1.00 -1.57 -2.83 116.94 108.79 1xrh h PHE 125 Ca 0.13 -0.21 -0.10 0.00 2.81 0.00 0.00 57.97 60.60 1xrh h PHE 125 Cb -0.03 -0.17 -0.01 0.00 3.61 0.00 0.00 35.95 39.35 1xrh h PHE 125 CO -0.05 0.91 -0.36 -0.39 -1.61 0.00 0.00 178.31 176.82 1xrh h VAL 126 N 0.54 1.29 -0.62 -0.55 -1.51 -1.54 -2.74 116.25 111.12 1xrh h VAL 126 Ca 0.05 -1.42 0.04 0.00 -1.23 0.00 0.00 66.70 64.15 1xrh h VAL 126 Cb 0.87 1.57 -0.04 0.00 -2.13 0.00 0.00 31.29 31.56 1xrh h VAL 126 CO 0.08 0.43 0.41 1.56 -1.23 0.00 0.00 177.57 178.82 1xrh h GLN 127 N 0.27 0.68 -0.70 5.19 4.20 -1.15 -0.20 115.11 123.39 1xrh h GLN 127 Ca 0.03 -0.04 0.10 0.00 0.06 0.00 0.00 58.65 58.80 1xrh h GLN 127 Cb 0.76 -0.15 -0.07 0.00 0.30 0.00 0.00 27.48 28.31 1xrh h GLN 127 CO 0.06 0.45 0.33 1.96 -0.67 0.00 0.00 178.83 180.96 1xrh h GLN 128 N 0.70 0.54 0.14 1.46 4.20 -1.38 0.32 115.11 121.08 1xrh h GLN 128 Ca 0.25 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.93 1xrh h GLN 128 Cb 0.13 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.79 1xrh h GLN 128 CO -0.07 0.36 -0.07 0.00 -0.67 0.00 0.00 178.83 178.38 1xrh h ALA 129 N 1.45 -0.19 -0.88 3.87 0.00 -1.10 -2.86 119.26 119.55 1xrh h ALA 129 Ca 0.35 -0.12 0.08 0.00 0.00 0.00 0.00 54.91 55.23 1xrh h ALA 129 Cb 0.41 0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.20 1xrh h ALA 129 CO -0.29 -0.51 0.54 0.00 0.00 0.00 0.00 179.25 178.99 1xrh h ALA 130 N 0.45 1.25 0.00 0.00 0.00 -0.62 0.19 119.26 120.54 1xrh h ALA 130 Ca -0.02 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1xrh h ALA 130 Cb 0.30 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1xrh h ALA 130 CO 0.03 0.22 -0.00 0.00 0.00 0.00 0.00 179.25 179.50 1xrh h ARG 131 N 0.93 0.00 -0.48 0.00 3.08 -0.18 0.97 114.38 118.71 1xrh h ARG 131 Ca 0.41 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.46 1xrh h ARG 131 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.34 1xrh h ARG 131 CO -0.22 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.68 1xrh n ALA 132 N -2.10 2.41 -1.46 0.04 0.00 0.60 -4.91 120.51 115.09 1xrh n ALA 132 Ca -0.03 -1.05 0.00 0.00 0.00 0.00 0.00 53.44 52.36 1xrh n ALA 132 Cb 0.07 -0.91 0.00 0.00 0.00 0.00 0.00 19.45 18.62 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 1.53 0.39 3.47 0.00 0.00 0.34 -5.06 105.19 105.86 1xrh n GLY 133 Ca 0.21 -0.98 -0.24 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.00 2.23 -0.06 1.61 2.99 -0.70 -4.47 117.98 117.59 1xrh s PHE 134 Ca 0.00 -0.40 -0.22 0.00 0.00 0.00 0.00 56.93 56.31 1xrh s PHE 134 Cb 0.00 -1.04 -0.04 0.00 0.00 0.00 0.00 43.02 41.94 1xrh s PHE 134 CO 0.00 0.64 0.65 0.42 -0.00 0.00 0.00 175.22 176.93 1xrh s ILE 135 N -2.59 5.04 -0.03 0.64 1.01 0.11 -2.69 121.20 122.68 1xrh s ILE 135 Ca 0.30 1.33 0.06 0.00 0.00 0.00 0.00 60.65 62.34 1xrh s ILE 135 Cb -0.03 -3.99 -0.01 0.00 0.01 0.00 0.00 42.46 38.44 1xrh s ILE 135 CO 0.14 0.30 -0.22 -0.83 0.00 0.00 0.00 174.94 174.33 1xrh s GLY 136 N 0.56 1.12 -0.02 6.18 0.00 -0.32 -1.51 107.32 113.34 1xrh s GLY 136 Ca 0.34 -0.95 0.02 0.00 0.00 0.00 0.00 44.72 44.14 1xrh s GLY 136 CO 0.17 -0.71 -0.07 -0.42 0.00 0.00 0.00 173.10 172.06 1xrh s ILE 137 N -0.38 0.63 0.34 0.90 1.01 0.09 -0.97 121.20 122.82 1xrh s ILE 137 Ca 0.04 -0.30 -0.03 0.00 0.00 0.00 0.00 60.65 60.37 1xrh s ILE 137 Cb -0.10 -0.56 0.00 0.00 0.01 0.00 0.00 42.46 41.81 1xrh s ILE 137 CO 0.00 0.20 0.46 -0.55 0.00 0.00 0.00 174.94 175.05 1xrh s SER 138 N 0.08 0.88 0.07 3.58 0.15 -0.51 -1.05 113.70 116.92 1xrh s SER 138 Ca -0.01 -1.47 -0.27 0.00 0.70 0.00 0.00 55.95 54.90 1xrh s SER 138 Cb -0.06 0.65 0.09 0.00 -1.71 0.00 0.00 66.02 64.99 1xrh s SER 138 CO -0.00 -1.27 1.15 0.00 1.20 0.00 0.00 173.24 174.31 1xrh s GLN 141 N -2.58 2.35 0.13 0.00 -0.21 -1.12 -3.84 119.66 114.39 1xrh s GLN 141 Ca 0.17 0.13 -0.19 0.00 0.02 0.00 0.00 55.36 55.49 1xrh s GLN 141 Cb 0.01 -2.04 0.05 0.00 1.00 0.00 0.00 33.01 32.03 1xrh s GLN 141 CO 0.00 -1.29 0.48 0.45 -2.12 0.00 0.00 175.29 172.81 1xrh s SER 142 N -4.48 -0.37 -0.24 5.90 0.15 -1.26 -4.83 113.70 108.58 1xrh s SER 142 Ca 0.60 -0.16 -0.43 0.00 0.70 0.00 0.00 55.95 56.65 1xrh s SER 142 Cb -0.11 0.52 -0.20 0.00 -1.71 0.00 0.00 66.02 64.52 1xrh s SER 142 CO 0.49 -0.88 1.36 -0.67 1.20 0.00 0.00 173.24 174.73 1xrh n ASP 143 N -0.21 0.74 -4.66 5.45 -0.08 -1.26 -3.84 116.55 112.68 1xrh n ASP 143 Ca -0.17 1.17 -0.44 0.00 -1.51 0.00 0.00 54.79 53.84 1xrh n ASP 143 Cb 0.64 -0.92 -0.02 0.00 2.34 0.00 0.00 41.12 43.15 1xrh n ASP 143 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 1xrh n PRO 144 N 2.87 1.91 -1.48 -0.67 -0.02 -1.26 -4.01 135.00 132.35 1xrh n PRO 144 Ca 0.25 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.41 1xrh n PRO 144 Cb 0.02 -2.26 0.00 0.00 -0.02 0.00 0.00 33.50 31.24 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 1.15 -4.46 -2.89 -1.45 0.31 -0.41 -4.89 118.33 105.70 1xrh n VAL 146 Ca 0.09 2.03 -0.32 0.00 -0.01 0.00 0.00 64.34 66.13 1xrh n VAL 146 Cb 0.33 -2.89 -0.05 0.00 -0.91 0.00 0.00 33.84 30.32 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 -3.84 4.66 0.75 2.52 -7.23 -0.87 -1.01 120.40 115.39 1xrh s VAL 147 Ca 0.00 0.94 -0.11 0.00 -1.81 0.00 0.00 61.98 61.00 1xrh s VAL 147 Cb 0.00 -3.67 0.04 0.00 0.56 0.00 0.00 36.38 33.32 1xrh s VAL 147 CO 0.00 -0.39 1.08 -2.84 -0.31 0.00 0.00 175.10 172.64 1xrh s PRO 148 N -3.47 2.44 0.27 4.82 0.02 -1.25 -4.39 135.00 133.43 1xrh s PRO 148 Ca 0.55 1.01 -0.30 0.00 0.02 0.00 0.00 61.00 62.27 1xrh s PRO 148 Cb -0.10 -1.93 -0.13 0.00 0.02 0.00 0.00 34.50 32.36 1xrh s PRO 148 CO 0.24 -1.47 1.41 0.34 -0.33 0.00 0.00 177.00 177.18 1xrh n PHE 149 N -3.39 2.28 -0.89 6.54 7.35 -1.26 -0.60 117.46 127.48 1xrh n PHE 149 Ca 0.08 0.44 0.00 0.00 -0.76 0.00 0.00 57.45 57.21 1xrh n PHE 149 Cb 0.54 -2.47 0.00 0.00 0.35 0.00 0.00 39.48 37.90 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 1.85 0.45 3.85 7.13 0.00 -1.26 -5.00 105.19 112.22 1xrh n GLY 150 Ca 0.10 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.90 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 2.00 0.00 -0.02 0.00 0.23 -5.05 107.32 102.47 1xrh s GLY 151 Ca 0.00 -1.80 0.00 0.00 0.00 0.00 0.00 44.72 42.92 1xrh s GLY 151 CO 0.00 -1.67 0.54 0.00 0.00 0.00 0.00 173.10 171.98 1xrh n ALA 152 N -1.44 2.46 -2.48 3.20 0.00 -1.26 -4.64 120.51 116.36 1xrh n ALA 152 Ca 0.01 -0.54 -0.24 0.00 0.00 0.00 0.00 53.44 52.67 1xrh n ALA 152 Cb 0.61 -0.01 -0.10 0.00 0.00 0.00 0.00 19.45 19.95 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 1.71 0.53 0.00 2.02 -1.26 -4.27 118.70 117.34 1xrh s GLU 153 Ca 0.00 -1.69 -0.18 0.00 0.02 0.00 0.00 54.97 53.12 1xrh s GLU 153 Cb 0.00 -1.82 -0.06 0.00 0.10 0.00 0.00 34.13 32.35 1xrh s GLU 153 CO 0.00 0.35 1.04 0.96 0.02 0.00 0.00 175.26 177.62 1xrh s ILE 154 N -2.34 3.92 0.15 -1.63 -4.36 -1.26 -3.87 121.20 111.80 1xrh s ILE 154 Ca 0.28 1.03 0.00 0.00 -0.26 0.00 0.00 60.65 61.71 1xrh s ILE 154 Cb -0.06 -3.46 0.00 0.00 1.25 0.00 0.00 42.46 40.19 1xrh s ILE 154 CO 0.14 -0.42 0.00 0.00 0.24 0.00 0.00 174.94 174.91 1xrh n TYR 155 N -1.50 -1.65 -2.79 1.37 9.36 -0.18 -4.90 117.16 116.87 1xrh n TYR 155 Ca 0.09 0.32 -0.20 0.00 3.32 0.00 0.00 57.90 61.42 1xrh n TYR 155 Cb 0.53 0.88 0.05 0.00 -0.63 0.00 0.00 39.34 40.18 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 -1.43 2.20 0.03 2.98 1.51 -1.25 -2.10 117.35 119.30 1xrh s TYR 156 Ca 0.00 -0.32 0.00 0.00 -1.01 0.00 0.00 57.07 55.74 1xrh s TYR 156 Cb 0.00 -2.61 0.00 0.00 -0.11 0.00 0.00 41.96 39.24 1xrh s TYR 156 CO 0.00 -1.05 0.03 0.41 -1.11 0.00 0.00 175.55 173.83 1xrh n GLY 157 N -2.34 2.40 0.00 0.71 0.00 -1.25 -1.28 105.19 103.42 1xrh n GLY 157 Ca 0.11 -2.15 0.07 0.00 0.00 0.00 0.00 46.02 44.05 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 -0.86 0.54 -0.23 2.61 -2.24 -1.26 -4.78 114.28 108.06 1xrh n THR 158 Ca 0.00 0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.92 1xrh n THR 158 Cb 0.03 -0.91 0.00 0.00 -2.10 0.00 0.00 70.33 67.35 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 -1.24 0.00 -4.84 3.42 3.02 -1.26 -1.20 115.26 113.17 1xrh n ASN 159 Ca 0.07 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.31 1xrh n ASN 159 Cb 0.10 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.30 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 3.18 -0.02 3.52 0.05 -1.25 -3.17 135.00 137.31 1xrh s PRO 160 Ca 0.00 0.89 0.01 0.00 0.05 0.00 0.00 61.00 61.95 1xrh s PRO 160 Cb 0.00 -2.02 0.01 0.00 0.05 0.00 0.00 34.50 32.54 1xrh s PRO 160 CO 0.00 -0.91 -0.02 -1.17 0.05 0.00 0.00 177.00 174.95 1xrh s LEU 161 N -5.39 1.55 0.10 -3.56 2.96 -1.26 -3.15 118.68 109.93 1xrh s LEU 161 Ca 0.57 -0.05 0.06 0.00 -0.22 0.00 0.00 54.13 54.49 1xrh s LEU 161 Cb -0.13 -0.23 -0.03 0.00 0.50 0.00 0.00 46.19 46.30 1xrh s LEU 161 CO 0.54 -0.03 -0.16 0.00 -1.32 0.00 0.00 176.35 175.38 1xrh s ALA 162 N 0.53 1.49 -0.05 5.97 0.00 0.37 -4.40 121.76 125.67 1xrh s ALA 162 Ca -0.05 -1.20 -0.06 0.00 0.00 0.00 0.00 51.96 50.65 1xrh s ALA 162 Cb -0.09 -0.12 0.01 0.00 0.00 0.00 0.00 23.12 22.93 1xrh s ALA 162 CO -0.01 0.18 0.15 0.12 0.00 0.00 0.00 175.76 176.21 1xrh s PHE 163 N -1.66 -0.15 -0.10 0.00 5.36 0.32 -1.42 117.98 120.34 1xrh s PHE 163 Ca 0.05 0.35 -0.08 0.00 -0.96 0.00 0.00 56.93 56.30 1xrh s PHE 163 Cb -0.08 0.05 0.03 0.00 -0.34 0.00 0.00 43.02 42.68 1xrh s PHE 163 CO 0.03 -0.10 0.24 0.00 -1.46 0.00 0.00 175.22 173.93 1xrh s ALA 164 N -0.08 -0.59 0.01 11.12 0.00 -0.14 -0.03 121.76 132.05 1xrh s ALA 164 Ca -0.02 0.77 0.02 0.00 0.00 0.00 0.00 51.96 52.73 1xrh s ALA 164 Cb -0.02 -0.46 -0.01 0.00 0.00 0.00 0.00 23.12 22.63 1xrh s ALA 164 CO 0.00 -0.14 -0.06 0.00 0.00 0.00 0.00 175.76 175.57 1xrh s ALA 165 N 0.43 0.45 -0.13 0.00 0.00 -0.01 -1.17 121.76 121.33 1xrh s ALA 165 Ca -0.03 -0.40 -0.29 0.00 0.00 0.00 0.00 51.96 51.24 1xrh s ALA 165 Cb -0.04 -0.05 -0.01 0.00 0.00 0.00 0.00 23.12 23.03 1xrh s ALA 165 CO -0.02 0.05 0.97 -1.25 0.00 0.00 0.00 175.76 175.51 1xrh s PRO 166 N -0.64 4.38 0.00 0.00 0.04 -1.26 -1.20 135.00 136.32 1xrh s PRO 166 Ca -0.03 1.31 0.00 0.00 0.04 0.00 0.00 61.00 62.32 1xrh s PRO 166 Cb -0.05 -3.56 0.00 0.00 0.04 0.00 0.00 34.50 30.93 1xrh s PRO 166 CO -0.00 -0.35 0.00 0.41 0.04 0.00 0.00 177.00 177.10 1xrh n GLY 167 N 3.19 1.30 3.80 0.56 0.00 -0.92 -4.39 105.19 108.74 1xrh n GLY 167 Ca 0.08 -1.85 -0.35 0.00 0.00 0.00 0.00 46.02 43.90 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 2.36 4.17 7.01 1.61 2.02 -1.17 -4.64 118.70 130.06 1xrh s GLU 168 Ca 0.00 1.33 0.00 0.00 0.02 0.00 0.00 54.97 56.32 1xrh s GLU 168 Cb 0.00 -2.37 0.00 0.00 0.10 0.00 0.00 34.13 31.86 1xrh s GLU 168 CO 0.00 -0.10 0.00 0.41 0.02 0.00 0.00 175.26 175.59 1xrh n GLY 169 N -0.05 3.78 1.29 -1.39 0.00 -1.26 -1.21 105.19 106.35 1xrh n GLY 169 Ca 0.06 0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.24 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 6.17 3.82 -4.76 1.61 8.00 -1.26 -4.97 116.55 125.16 1xrh n ASP 170 Ca 0.00 -2.00 -0.35 0.00 0.71 0.00 0.00 54.79 53.15 1xrh n ASP 170 Cb 0.00 -0.42 0.02 0.00 -0.02 0.00 0.00 41.12 40.70 1xrh n ASP 170 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1xrh s GLU 171 N -1.13 3.08 -0.21 -1.24 2.02 -0.35 -4.97 118.70 115.91 1xrh s GLU 171 Ca 0.46 1.73 -0.13 0.00 0.02 0.00 0.00 54.97 57.05 1xrh s GLU 171 Cb 0.25 -1.95 0.07 0.00 0.10 0.00 0.00 34.13 32.59 1xrh s GLU 171 CO 0.33 -1.09 0.52 0.42 0.02 0.00 0.00 175.26 175.46 1xrh s ILE 172 N -1.69 -0.01 -0.44 -1.63 1.01 -1.26 -2.16 121.20 115.02 1xrh s ILE 172 Ca 0.75 0.05 -0.14 0.00 0.00 0.00 0.00 60.65 61.31 1xrh s ILE 172 Cb -0.28 -0.76 0.05 0.00 0.01 0.00 0.00 42.46 41.48 1xrh s ILE 172 CO 0.31 0.02 0.33 -0.22 0.00 0.00 0.00 174.94 175.38 1xrh s LEU 173 N 1.32 5.31 -0.15 2.97 2.96 -0.34 -4.94 118.68 125.81 1xrh s LEU 173 Ca -0.08 -1.16 -0.03 0.00 -0.22 0.00 0.00 54.13 52.64 1xrh s LEU 173 Cb -0.07 -2.14 -0.02 0.00 0.50 0.00 0.00 46.19 44.46 1xrh s LEU 173 CO -0.13 -0.54 -0.06 -0.89 -1.32 0.00 0.00 176.35 173.41 1xrh s THR 174 N 1.63 3.70 -0.04 3.68 2.01 -1.26 -0.83 115.64 124.53 1xrh s THR 174 Ca 0.04 -0.43 0.02 0.00 0.31 0.00 0.00 61.69 61.63 1xrh s THR 174 Cb -0.22 -2.60 0.01 0.00 0.01 0.00 0.00 72.50 69.70 1xrh s THR 174 CO 0.07 0.50 -0.10 0.12 -0.69 0.00 0.00 174.62 174.53 1xrh s PHE 175 N 0.33 1.11 0.24 4.92 5.36 0.96 -3.52 117.98 127.39 1xrh s PHE 175 Ca -0.06 -0.33 0.01 0.00 -0.96 0.00 0.00 56.93 55.59 1xrh s PHE 175 Cb -0.15 -0.82 -0.05 0.00 -0.34 0.00 0.00 43.02 41.67 1xrh s PHE 175 CO 0.04 -0.17 0.10 0.34 -1.46 0.00 0.00 175.22 174.07 1xrh s ASP 176 N 0.44 1.01 -0.01 6.13 3.68 -1.26 -0.52 116.67 126.13 1xrh s ASP 176 Ca -0.08 -1.38 0.07 0.00 2.13 0.00 0.00 52.55 53.30 1xrh s ASP 176 Cb -0.12 0.20 -0.02 0.00 -1.45 0.00 0.00 42.92 41.53 1xrh s ASP 176 CO 0.01 -0.74 -0.23 0.00 0.13 0.00 0.00 175.17 174.34 1xrh s ALA 178 N -3.82 2.29 -1.86 3.66 0.00 -1.26 -5.00 121.76 115.76 1xrh s ALA 178 Ca 0.37 -1.12 0.00 0.00 0.00 0.00 0.00 51.96 51.22 1xrh s ALA 178 Cb 0.08 -0.63 0.00 0.00 0.00 0.00 0.00 23.12 22.57 1xrh s ALA 178 CO 0.13 0.54 0.80 0.25 0.00 0.00 0.00 175.76 177.48 1xrh n THR 179 N 2.28 0.00 -3.82 0.00 -2.24 -0.34 -4.81 114.28 105.36 1xrh n THR 179 Ca -0.16 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.41 1xrh n THR 179 Cb 0.51 -0.12 -0.03 0.00 -2.10 0.00 0.00 70.33 68.59 1xrh n THR 179 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1xrh s THR 180 N -1.86 3.89 0.52 4.28 -1.32 -1.26 -2.36 115.64 117.52 1xrh s THR 180 Ca 0.00 -1.29 0.19 0.00 -1.21 0.00 0.00 61.69 59.38 1xrh s THR 180 Cb 0.00 -3.30 0.28 0.00 -1.51 0.00 0.00 72.50 67.97 1xrh s THR 180 CO 0.00 -0.21 2.15 0.58 -2.21 0.00 0.00 174.62 174.93 1xrh h VAL 181 N 1.23 0.90 -1.66 5.08 2.07 -1.43 -3.39 116.25 119.06 1xrh h VAL 181 Ca -0.46 -0.09 0.07 0.00 0.82 0.00 0.00 66.70 67.05 1xrh h VAL 181 Cb 1.25 1.05 -0.25 0.00 -1.52 0.00 0.00 31.29 31.81 1xrh h VAL 181 CO 0.58 0.02 0.33 -1.58 0.02 0.00 0.00 177.57 176.94 1xrh s GLN 182 N -4.90 0.50 0.29 1.57 2.00 -1.26 -4.96 119.66 112.89 1xrh s GLN 182 Ca -0.05 0.76 -0.29 0.00 -2.00 0.00 0.00 55.36 53.77 1xrh s GLN 182 Cb 0.16 0.15 -0.13 0.00 0.80 0.00 0.00 33.01 33.99 1xrh s GLN 182 CO 0.64 -0.09 1.23 0.00 -0.50 0.00 0.00 175.29 176.57 1xrh n ALA 183 N 3.32 0.63 -0.37 1.58 0.00 -1.26 -4.83 120.51 119.57 1xrh n ALA 183 Ca -0.17 0.39 0.37 0.00 0.00 0.00 0.00 53.44 54.04 1xrh n ALA 183 Cb 0.57 -2.17 0.75 0.00 0.00 0.00 0.00 19.45 18.60 1xrh n ALA 183 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 1xrh h TRP 184 N 2.89 0.03 -0.99 0.00 2.91 -2.00 0.33 115.95 119.12 1xrh h TRP 184 Ca -0.44 0.00 0.23 0.00 1.13 0.00 0.00 58.89 59.81 1xrh h TRP 184 Cb 1.30 -0.01 -0.09 0.00 -0.51 0.00 0.00 29.16 29.86 1xrh h TRP 184 CO 0.52 -0.00 0.63 0.78 -1.03 0.00 0.00 178.44 179.34 1xrh h GLY 185 N 0.01 1.21 1.04 2.65 0.00 -1.97 -1.27 103.07 104.74 1xrh h GLY 185 Ca 0.62 -0.23 -0.05 0.00 0.00 0.00 0.00 47.33 47.67 1xrh h GLY 185 CO -0.02 -0.07 0.29 1.70 0.00 0.00 0.00 176.54 178.43 1xrh h LYS 186 N 0.48 1.12 -0.15 4.80 1.63 -1.26 -1.34 116.57 121.85 1xrh h LYS 186 Ca 0.55 -0.21 -0.12 0.00 -0.85 0.00 0.00 60.65 60.02 1xrh h LYS 186 Cb 1.26 -0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 32.70 1xrh h LYS 186 CO -0.27 0.93 -0.43 0.28 -3.45 0.00 0.00 179.45 176.50 1xrh h VAL 187 N 1.08 1.32 0.44 2.00 2.07 -1.38 -1.55 116.25 120.23 1xrh h VAL 187 Ca 0.25 -1.60 -0.02 0.00 0.82 0.00 0.00 66.70 66.15 1xrh h VAL 187 Cb 0.23 1.68 0.00 0.00 -1.52 0.00 0.00 31.29 31.69 1xrh h VAL 187 CO -0.02 0.48 -0.21 -0.07 0.02 0.00 0.00 177.57 177.77 1xrh h LEU 188 N 0.29 -0.50 -0.71 2.57 3.38 -1.26 0.08 115.31 119.15 1xrh h LEU 188 Ca 0.02 -0.03 0.16 0.00 0.09 0.00 0.00 57.88 58.12 1xrh h LEU 188 Cb 0.88 0.13 -0.11 0.00 0.09 0.00 0.00 40.66 41.65 1xrh h LEU 188 CO 0.07 -0.29 0.10 0.44 0.09 0.00 0.00 178.44 178.85 1xrh h ASP 189 N -0.68 -0.13 -0.28 -0.43 3.45 -1.09 0.34 116.42 117.60 1xrh h ASP 189 Ca -0.06 0.16 0.02 0.00 0.43 0.00 0.00 57.03 57.58 1xrh h ASP 189 Cb 0.50 0.25 -0.02 0.00 -0.56 0.00 0.00 39.33 39.50 1xrh h ASP 189 CO 0.10 -0.09 0.14 0.00 -1.57 0.00 0.00 179.24 177.82 1xrh h ALA 190 N 1.62 0.34 -0.91 3.45 0.00 -0.96 -2.07 119.26 120.74 1xrh h ALA 190 Ca 0.40 0.01 0.15 0.00 0.00 0.00 0.00 54.91 55.46 1xrh h ALA 190 Cb 0.68 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.35 1xrh h ALA 190 CO -0.55 -0.25 0.58 0.00 0.00 0.00 0.00 179.25 179.04 1xrh h ARG 191 N 0.30 0.68 0.00 0.00 3.08 0.11 -1.62 114.38 116.93 1xrh h ARG 191 Ca 0.12 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1xrh h ARG 191 Cb 0.04 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 29.93 1xrh h ARG 191 CO -0.08 0.45 0.00 0.43 -1.07 0.00 0.00 179.97 179.70 1xrh n SER 192 N -4.58 0.00 -2.69 7.04 7.64 -0.48 -3.35 113.62 117.20 1xrh n SER 192 Ca 0.18 0.21 -0.05 0.00 1.01 0.00 0.00 58.87 60.22 1xrh n SER 192 Cb 0.48 -0.22 0.12 0.00 -1.01 0.00 0.00 64.21 63.58 1xrh n SER 192 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1xrh n ARG 193 N -1.22 1.27 -3.09 1.43 0.00 -0.62 -5.10 116.66 109.33 1xrh n ARG 193 Ca 0.00 -1.62 -0.00 0.00 -0.00 0.00 0.00 57.85 56.23 1xrh n ARG 193 Cb 0.00 0.11 -0.00 0.00 -0.00 0.00 0.00 32.46 32.57 1xrh n ARG 193 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1xrh n ASN 194 N -0.95 -7.36 -4.29 2.89 5.15 -1.19 -5.06 115.26 104.46 1xrh n ASN 194 Ca -0.08 0.89 -0.21 0.00 -0.60 0.00 0.00 54.58 54.58 1xrh n ASN 194 Cb 0.86 -1.63 -0.10 0.00 -0.53 0.00 0.00 39.78 38.38 1xrh n ASN 194 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 1xrh s SER 196 N -0.16 2.01 0.16 1.20 1.04 -1.26 -5.03 113.70 111.66 1xrh s SER 196 Ca -0.01 -1.46 0.05 0.00 0.48 0.00 0.00 55.95 55.01 1xrh s SER 196 Cb 0.00 0.17 -0.05 0.00 0.10 0.00 0.00 66.02 66.24 1xrh s SER 196 CO 0.02 -0.74 -0.09 0.27 0.98 0.00 0.00 173.24 173.67 1xrh s ILE 197 N -3.45 1.21 0.30 -1.02 -4.36 -0.68 -4.97 121.20 108.22 1xrh s ILE 197 Ca 0.34 -2.07 -0.29 0.00 -0.26 0.00 0.00 60.65 58.37 1xrh s ILE 197 Cb 0.07 -1.94 -0.10 0.00 1.25 0.00 0.00 42.46 41.74 1xrh s ILE 197 CO 0.15 -0.67 1.31 -2.84 0.24 0.00 0.00 174.94 173.13 1xrh s PRO 198 N -3.75 4.37 0.00 0.37 0.02 -1.26 -4.39 135.00 130.36 1xrh s PRO 198 Ca 0.19 2.17 0.07 0.00 0.02 0.00 0.00 61.00 63.46 1xrh s PRO 198 Cb 0.03 -3.10 0.44 0.00 0.02 0.00 0.00 34.50 31.88 1xrh s PRO 198 CO 0.02 -0.20 0.84 -0.40 -0.33 0.00 0.00 177.00 176.94 1xrh n ASP 199 N 1.29 0.00 -0.32 2.53 5.75 -1.26 -2.09 116.55 122.45 1xrh n ASP 199 Ca 0.02 -0.44 0.12 0.00 -0.01 0.00 0.00 54.79 54.47 1xrh n ASP 199 Cb 0.42 0.00 0.20 0.00 -1.03 0.00 0.00 41.12 40.71 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 -0.84 0.00 -0.05 2.12 -2.24 -1.26 -4.34 114.28 107.67 1xrh n THR 200 Ca 0.05 -0.17 -0.19 0.00 -2.27 0.00 0.00 64.05 61.48 1xrh n THR 200 Cb 0.03 0.76 -0.13 0.00 -2.10 0.00 0.00 70.33 68.88 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 1.58 0.19 -4.39 4.78 4.06 -1.74 -3.44 115.95 116.99 1xrh h TRP 201 Ca 0.00 -0.14 -0.35 0.00 2.06 0.00 0.00 58.89 60.47 1xrh h TRP 201 Cb 0.60 -0.01 -0.10 0.00 -1.00 0.00 0.00 29.16 28.66 1xrh h TRP 201 CO 0.00 1.35 -0.29 0.00 -3.56 0.00 0.00 178.44 175.94 1xrh s ALA 202 N -2.36 1.15 0.05 1.49 0.00 -1.26 -1.00 121.76 119.83 1xrh s ALA 202 Ca -0.22 -1.72 -0.01 0.00 0.00 0.00 0.00 51.96 50.02 1xrh s ALA 202 Cb 0.02 1.26 -0.04 0.00 0.00 0.00 0.00 23.12 24.37 1xrh s ALA 202 CO 0.70 -0.75 -0.03 0.54 0.00 0.00 0.00 175.76 176.22 1xrh s VAL 203 N -3.14 0.22 0.66 0.00 0.11 -0.72 -2.32 120.40 115.22 1xrh s VAL 203 Ca 0.34 -1.61 -0.11 0.00 -2.93 0.00 0.00 61.98 57.67 1xrh s VAL 203 Cb 0.00 -1.24 0.15 0.00 -1.53 0.00 0.00 36.38 33.76 1xrh s VAL 203 CO 0.23 -0.88 0.90 -0.90 -3.33 0.00 0.00 175.10 171.12 1xrh n ASP 204 N 0.44 0.09 0.31 3.54 5.68 -0.37 -1.47 116.55 124.77 1xrh n ASP 204 Ca -0.16 -1.34 0.20 0.00 -0.50 0.00 0.00 54.79 52.99 1xrh n ASP 204 Cb 0.60 -0.69 1.00 0.00 -1.14 0.00 0.00 41.12 40.89 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 -0.08 0.11 -0.00 -1.90 -0.35 116.57 114.35 1xrh h LYS 205 Ca -0.29 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.36 1xrh h LYS 205 Cb 0.81 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.04 1xrh h LYS 205 CO 0.21 0.01 0.00 0.09 -0.00 0.00 0.00 179.45 179.76 1xrh n ASN 206 N -3.18 1.55 0.00 7.07 4.13 -1.26 -4.88 115.26 118.69 1xrh n ASN 206 Ca -0.02 -1.58 0.00 0.00 1.68 0.00 0.00 54.58 54.66 1xrh n ASN 206 Cb 0.16 -0.05 0.00 0.00 -1.54 0.00 0.00 39.78 38.35 1xrh n ASN 206 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1xrh n GLY 207 N 1.15 0.51 3.63 7.41 0.00 -0.14 -4.90 105.19 112.85 1xrh n GLY 207 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.15 5.16 0.42 1.61 1.01 -1.26 -4.73 120.40 120.46 1xrh s VAL 208 Ca 0.00 0.69 -0.22 0.00 0.00 0.00 0.00 61.98 62.45 1xrh s VAL 208 Cb 0.00 -3.74 -0.13 0.00 0.00 0.00 0.00 36.38 32.51 1xrh s VAL 208 CO 0.00 0.17 0.38 -2.65 0.00 0.00 0.00 175.10 173.00 1xrh n PRO 209 N 5.11 0.36 -4.03 2.72 -0.02 -1.26 -1.24 135.00 136.64 1xrh n PRO 209 Ca -0.07 0.13 -0.08 0.00 -2.02 0.00 0.00 63.50 61.46 1xrh n PRO 209 Cb 0.51 -1.33 -0.10 0.00 -0.02 0.00 0.00 33.50 32.55 1xrh n PRO 209 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 1xrh s THR 210 N -1.56 0.19 -1.43 3.45 -1.32 -0.98 -4.71 115.64 109.28 1xrh s THR 210 Ca 0.62 -1.53 0.14 0.00 -1.21 0.00 0.00 61.69 59.71 1xrh s THR 210 Cb -0.61 -1.27 0.03 0.00 -1.51 0.00 0.00 72.50 69.14 1xrh s THR 210 CO 0.59 -0.85 0.83 0.41 -2.21 0.00 0.00 174.62 173.40 1xrh n THR 211 N 0.34 0.00 -3.30 5.08 -1.04 -1.26 -4.12 114.28 109.99 1xrh n THR 211 Ca -0.16 -0.40 -0.44 0.00 -2.04 0.00 0.00 64.05 61.01 1xrh n THR 211 Cb 0.60 1.20 -0.07 0.00 -1.82 0.00 0.00 70.33 70.24 1xrh n THR 211 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1xrh s ASP 212 N -1.56 6.18 0.56 8.00 3.68 -1.26 -1.69 116.67 130.58 1xrh s ASP 212 Ca 0.13 -1.08 0.28 0.00 2.13 0.00 0.00 52.55 54.01 1xrh s ASP 212 Cb 0.11 -2.23 1.48 0.00 -1.45 0.00 0.00 42.92 40.84 1xrh s ASP 212 CO 0.30 -0.72 1.97 1.55 0.13 0.00 0.00 175.17 178.40 1xrh h PRO 213 N 8.84 0.00 0.00 4.34 0.13 -1.91 0.47 132.00 143.87 1xrh h PRO 213 Ca -0.28 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.79 1xrh h PRO 213 Cb 1.10 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 1xrh h PRO 213 CO 0.90 0.00 -0.30 0.74 -0.23 0.00 0.00 178.00 179.11 1xrh h PHE 214 N 0.00 0.00 -0.00 1.56 -1.00 -1.91 -3.09 116.94 112.50 1xrh h PHE 214 Ca 0.22 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.00 1xrh h PHE 214 Cb 1.02 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.58 1xrh h PHE 214 CO 0.00 0.30 -0.08 0.00 -1.61 0.00 0.00 178.31 176.92 1xrh n ALA 215 N -2.18 2.72 -2.02 2.45 0.00 0.16 -4.90 120.51 116.75 1xrh n ALA 215 Ca 0.03 -0.27 -0.42 0.00 0.00 0.00 0.00 53.44 52.78 1xrh n ALA 215 Cb 0.64 -1.35 -0.03 0.00 0.00 0.00 0.00 19.45 18.71 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 -2.37 3.24 -0.14 0.00 1.01 -1.10 -4.39 120.40 116.64 1xrh s VAL 216 Ca 0.32 0.67 0.01 0.00 0.00 0.00 0.00 61.98 62.99 1xrh s VAL 216 Cb 0.20 -3.43 -0.10 0.00 0.00 0.00 0.00 36.38 33.06 1xrh s VAL 216 CO 0.45 -0.00 -0.12 1.57 0.00 0.00 0.00 175.10 176.99 1xrh n HIS 217 N 5.52 0.00 -4.13 5.22 -0.00 -0.54 -4.96 115.22 116.33 1xrh n HIS 217 Ca 0.15 0.00 -0.11 0.00 0.46 0.00 0.00 57.72 58.22 1xrh n HIS 217 Cb 0.41 -0.56 -0.09 0.00 -0.12 0.00 0.00 29.99 29.64 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 -2.29 0.72 0.39 1.57 0.00 -1.08 -4.98 121.76 116.09 1xrh s ALA 218 Ca -0.19 -1.42 0.08 0.00 0.00 0.00 0.00 51.96 50.43 1xrh s ALA 218 Cb 0.05 1.17 -0.01 0.00 0.00 0.00 0.00 23.12 24.33 1xrh s ALA 218 CO 0.34 -0.62 0.43 -0.51 0.00 0.00 0.00 175.76 175.39 1xrh s LEU 219 N -3.09 3.58 -0.04 0.00 1.43 -1.26 -1.75 118.68 117.55 1xrh s LEU 219 Ca 0.31 -0.54 -0.03 0.00 -1.03 0.00 0.00 54.13 52.84 1xrh s LEU 219 Cb 0.05 -2.35 -0.04 0.00 0.03 0.00 0.00 46.19 43.89 1xrh s LEU 219 CO 0.08 -0.61 0.12 -0.76 0.23 0.00 0.00 176.35 175.42 1xrh s LEU 220 N -4.18 4.14 0.36 1.79 1.43 -0.17 -2.04 118.68 120.02 1xrh s LEU 220 Ca 0.49 0.29 -0.26 0.00 -1.03 0.00 0.00 54.13 53.61 1xrh s LEU 220 Cb -0.06 -2.30 -0.09 0.00 0.03 0.00 0.00 46.19 43.77 1xrh s LEU 220 CO 0.30 0.31 1.15 -2.16 0.23 0.00 0.00 176.35 176.18 1xrh s PRO 221 N -1.57 4.24 0.32 1.29 0.04 -1.26 -1.33 135.00 136.73 1xrh s PRO 221 Ca 0.22 1.83 -0.29 0.00 0.04 0.00 0.00 61.00 62.80 1xrh s PRO 221 Cb -0.12 -2.82 -0.11 0.00 0.04 0.00 0.00 34.50 31.49 1xrh s PRO 221 CO 0.12 -0.15 1.47 0.00 0.04 0.00 0.00 177.00 178.48 1xrh s ALA 222 N -1.36 3.62 -1.58 8.56 0.00 -1.00 -3.00 121.76 127.00 1xrh s ALA 222 Ca 0.53 1.47 -0.14 0.00 0.00 0.00 0.00 51.96 53.82 1xrh s ALA 222 Cb -0.31 -3.59 0.10 0.00 0.00 0.00 0.00 23.12 19.33 1xrh s ALA 222 CO 0.39 -0.90 0.87 0.00 0.00 0.00 0.00 175.76 176.12 1xrh n ALA 223 N 1.36 -1.35 -0.33 0.00 0.00 -1.26 -1.00 120.51 117.93 1xrh n ALA 223 Ca 0.04 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1xrh n ALA 223 Cb 0.39 -3.85 0.00 0.00 0.00 0.00 0.00 19.45 15.99 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 -1.60 2.47 0.41 0.00 0.00 -1.16 -1.72 105.19 103.58 1xrh n GLY 224 Ca 0.02 0.36 0.21 0.00 0.00 0.00 0.00 46.02 46.61 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 0.34 0.22 1.61 0.11 -1.90 -2.08 132.00 130.30 1xrh h PRO 225 Ca 0.00 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.08 1xrh h PRO 225 Cb 0.00 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.03 1xrh h PRO 225 CO 0.00 0.23 -0.10 0.87 -0.21 0.00 0.00 178.00 178.78 1xrh h LYS 226 N 0.35 -0.28 -0.64 1.05 1.57 -1.52 -0.06 116.57 117.04 1xrh h LYS 226 Ca 0.48 0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 59.24 1xrh h LYS 226 Cb 1.29 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.63 1xrh h LYS 226 CO -0.17 -0.05 0.24 0.78 -0.57 0.00 0.00 179.45 179.67 1xrh h GLY 227 N -0.48 1.01 0.59 3.86 0.00 -0.72 0.13 103.07 107.47 1xrh h GLY 227 Ca -0.03 -0.53 -0.00 0.00 0.00 0.00 0.00 47.33 46.77 1xrh h GLY 227 CO 0.05 0.50 -0.36 -1.82 0.00 0.00 0.00 176.54 174.91 1xrh h TYR 228 N 0.92 -0.98 -0.63 5.60 3.20 -1.26 -2.56 116.97 121.27 1xrh h TYR 228 Ca 0.21 0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.11 1xrh h TYR 228 Cb 0.20 0.39 -0.03 0.00 1.54 0.00 0.00 36.73 38.83 1xrh h TYR 228 CO 0.01 -0.50 0.41 0.78 -1.64 0.00 0.00 178.16 177.22 1xrh h GLY 229 N -0.73 0.89 -6.29 1.82 0.00 -0.43 -3.50 103.07 94.84 1xrh h GLY 229 Ca -0.02 -0.32 -0.64 0.00 0.00 0.00 0.00 47.33 46.36 1xrh h GLY 229 CO -0.08 0.29 1.22 1.04 0.00 0.00 0.00 176.54 179.01 1xrh n LEU 230 N -4.67 3.00 0.00 3.11 4.77 0.41 -5.01 117.00 118.60 1xrh n LEU 230 Ca 0.05 0.73 0.00 0.00 -0.03 0.00 0.00 56.01 56.77 1xrh n LEU 230 Cb 0.04 -1.35 0.00 0.00 -2.33 0.00 0.00 43.42 39.79 1xrh n LEU 230 CO 0.34 -0.34 0.00 -0.38 -1.33 0.00 0.00 177.39 175.68 1xrh n ILE 234 N 5.99 0.00 0.08 -0.08 5.41 -1.26 -4.99 119.36 124.50 1xrh n ILE 234 Ca 0.29 0.00 -0.01 0.00 1.00 0.00 0.00 62.75 64.03 1xrh n ILE 234 Cb 0.28 0.00 0.26 0.00 -0.71 0.00 0.00 39.64 39.48 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 1.79 0.30 -0.05 4.38 1.82 -1.95 -0.07 116.42 122.64 1xrh h ASP 235 Ca 0.00 -0.10 -0.02 0.00 -0.39 0.00 0.00 57.03 56.52 1xrh h ASP 235 Cb 0.00 -0.08 -0.00 0.00 0.68 0.00 0.00 39.33 39.93 1xrh h ASP 235 CO 0.00 0.59 -0.03 0.58 -1.61 0.00 0.00 179.24 178.77 1xrh h VAL 236 N 0.27 1.34 -0.53 2.25 2.07 -1.95 -1.24 116.25 118.47 1xrh h VAL 236 Ca 0.04 -1.09 -0.05 0.00 0.82 0.00 0.00 66.70 66.41 1xrh h VAL 236 Cb 0.65 1.96 -0.02 0.00 -1.52 0.00 0.00 31.29 32.36 1xrh h VAL 236 CO 0.05 0.30 0.12 -0.07 0.02 0.00 0.00 177.57 177.98 1xrh h LEU 237 N -0.29 0.76 -1.61 2.57 3.38 -1.91 0.31 115.31 118.52 1xrh h LEU 237 Ca 0.01 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1xrh h LEU 237 Cb 0.50 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1xrh h LEU 237 CO 0.01 0.75 0.00 -1.54 0.09 0.00 0.00 178.44 177.75 1xrh n SER 238 N -4.27 1.88 0.00 -0.43 3.41 -0.06 -4.46 113.62 109.68 1xrh n SER 238 Ca 0.04 -1.46 0.00 0.00 -0.26 0.00 0.00 58.87 57.18 1xrh n SER 238 Cb 0.23 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 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 0.43 0.16 0.24 5.00 0.00 -0.55 -3.95 105.19 106.52 1xrh n GLY 239 Ca 0.06 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.02 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 1.12 -0.06 1.61 2.07 -0.94 -1.77 116.25 118.28 1xrh h VAL 240 Ca 0.00 -0.27 0.02 0.00 0.82 0.00 0.00 66.70 67.27 1xrh h VAL 240 Cb 0.00 0.27 -0.00 0.00 -1.52 0.00 0.00 31.29 30.04 1xrh h VAL 240 CO 0.00 0.14 0.06 0.25 0.02 0.00 0.00 177.57 178.04 1xrh h LEU 241 N 0.79 0.00 -1.24 2.57 5.85 -1.16 -1.34 115.31 120.77 1xrh h LEU 241 Ca 0.23 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.95 1xrh h LEU 241 Cb -0.05 0.00 0.00 0.00 0.37 0.00 0.00 40.66 40.98 1xrh h LEU 241 CO -0.07 0.00 -0.23 0.18 -0.34 0.00 0.00 178.44 177.98 1xrh n LEU 242 N -3.94 2.16 -0.94 2.25 4.77 -0.82 -4.95 117.00 115.54 1xrh n LEU 242 Ca -0.02 -0.74 -0.06 0.00 -0.03 0.00 0.00 56.01 55.17 1xrh n LEU 242 Cb 0.16 -0.02 0.01 0.00 -2.33 0.00 0.00 43.42 41.24 1xrh n LEU 242 CO 0.28 0.38 -0.01 0.61 -1.33 0.00 0.00 177.39 177.33 1xrh n GLY 243 N 1.36 0.34 3.88 -0.72 0.00 -0.51 -5.04 105.19 104.51 1xrh n GLY 243 Ca 0.12 -0.56 -0.21 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.06 3.35 0.39 0.99 1.43 -0.73 -5.04 118.68 117.02 1xrh s LEU 244 Ca 0.07 -0.78 -0.26 0.00 -1.03 0.00 0.00 54.13 52.14 1xrh s LEU 244 Cb -0.03 -2.00 -0.11 0.00 0.03 0.00 0.00 46.19 44.08 1xrh s LEU 244 CO 0.09 -0.69 1.11 -2.65 0.23 0.00 0.00 176.35 174.43 1xrh n PRO 245 N -1.57 1.58 -4.21 1.29 -0.02 -1.26 -4.50 135.00 126.30 1xrh n PRO 245 Ca 0.03 0.56 -0.12 0.00 -2.02 0.00 0.00 63.50 61.95 1xrh n PRO 245 Cb 0.62 -2.13 -0.10 0.00 -0.02 0.00 0.00 33.50 31.87 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 -1.21 1.09 0.00 6.00 -0.12 -1.26 -4.62 117.98 117.86 1xrh s PHE 246 Ca 0.61 -0.91 0.00 0.00 -0.05 0.00 0.00 56.93 56.58 1xrh s PHE 246 Cb -0.57 -0.61 0.00 0.00 -0.63 0.00 0.00 43.02 41.22 1xrh s PHE 246 CO 0.58 -0.12 0.00 0.41 -0.05 0.00 0.00 175.22 176.05 1xrh n GLY 247 N -0.15 3.03 0.13 1.99 0.00 -1.26 -2.14 105.19 106.78 1xrh n GLY 247 Ca -0.10 -0.16 0.10 0.00 0.00 0.00 0.00 46.02 45.87 1xrh n GLY 247 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1xrh n ARG 248 N 14.00 0.14 0.13 1.61 0.63 -0.89 -2.30 116.66 129.98 1xrh n ARG 248 Ca 0.00 0.54 0.13 0.00 -0.92 0.00 0.00 57.85 57.60 1xrh n ARG 248 Cb 0.00 -1.87 0.37 0.00 0.45 0.00 0.00 32.46 31.41 1xrh n ARG 248 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 1xrh h GLN 249 N 0.00 0.00 -6.82 -0.14 4.20 -1.74 -3.46 115.11 107.15 1xrh h GLN 249 Ca 0.00 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 58.15 1xrh h GLN 249 Cb 0.13 0.00 0.11 0.00 0.30 0.00 0.00 27.48 28.02 1xrh h GLN 249 CO 0.00 0.00 0.63 0.28 -0.67 0.00 0.00 178.83 179.07 1xrh n VAL 250 N -2.45 1.94 -2.13 -0.54 0.31 -0.97 -4.78 118.33 109.72 1xrh n VAL 250 Ca 0.05 -0.49 -0.33 0.00 -0.01 0.00 0.00 64.34 63.57 1xrh n VAL 250 Cb 0.44 -1.75 0.00 0.00 -0.91 0.00 0.00 33.84 31.62 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 -0.19 5.93 0.00 4.52 1.04 -1.26 -4.52 113.70 119.21 1xrh s SER 251 Ca 0.55 1.80 0.00 0.00 0.48 0.00 0.00 55.95 58.78 1xrh s SER 251 Cb -0.53 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.06 1xrh s SER 251 CO 0.62 -1.07 0.00 -1.20 0.98 0.00 0.00 173.24 172.57 1xrh n SER 252 N -1.89 0.00 0.00 7.02 7.64 -1.26 -4.16 113.62 120.96 1xrh n SER 252 Ca 0.09 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.97 1xrh n SER 252 Cb 0.53 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.73 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 0.33 1.43 4.02 -1.26 -4.41 117.16 117.26 1xrh n TYR 254 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.76 1xrh n TYR 254 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.26 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 -0.72 -1.95 7.72 3.45 -1.94 -3.44 116.42 119.52 1xrh h ASP 255 Ca 0.00 0.02 -0.20 0.00 0.43 0.00 0.00 57.03 57.29 1xrh h ASP 255 Cb 0.00 0.19 -0.31 0.00 -0.56 0.00 0.00 39.33 38.65 1xrh h ASP 255 CO 0.00 -0.40 -0.52 -0.62 -1.57 0.00 0.00 179.24 176.13 1xrh s ASP 256 N -4.13 0.56 0.30 6.45 3.68 -1.26 -5.00 116.67 117.27 1xrh s ASP 256 Ca -0.12 -0.06 0.22 0.00 2.13 0.00 0.00 52.55 54.71 1xrh s ASP 256 Cb 0.01 0.97 1.10 0.00 -1.45 0.00 0.00 42.92 43.55 1xrh s ASP 256 CO 0.37 -0.32 1.66 0.18 0.13 0.00 0.00 175.17 177.19 1xrh n LEU 257 N 5.35 0.58 -0.04 -1.34 7.99 -1.26 -2.01 117.00 126.28 1xrh n LEU 257 Ca -0.03 0.73 0.13 0.00 -0.01 0.00 0.00 56.01 56.83 1xrh n LEU 257 Cb 0.49 -0.76 0.37 0.00 -0.11 0.00 0.00 43.42 43.41 1xrh n LEU 257 CO 0.04 -0.85 0.61 1.41 -1.51 0.00 0.00 177.39 177.09 1xrh n HIS 258 N -2.24 0.00 -4.23 -1.77 8.25 -1.26 -1.63 115.22 112.33 1xrh n HIS 258 Ca -0.01 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.16 1xrh n HIS 258 Cb 0.08 -0.28 -0.10 0.00 1.12 0.00 0.00 29.99 30.81 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 -2.90 3.00 0.41 -1.41 0.00 -0.85 -3.56 121.76 116.45 1xrh s ALA 259 Ca 0.15 -1.21 -0.26 0.00 0.00 0.00 0.00 51.96 50.64 1xrh s ALA 259 Cb 0.18 -0.95 -0.08 0.00 0.00 0.00 0.00 23.12 22.27 1xrh s ALA 259 CO 0.63 0.65 1.28 0.20 0.00 0.00 0.00 175.76 178.52 1xrh s GLY 260 N -2.17 2.91 0.33 0.00 0.00 -1.21 -4.60 107.32 102.58 1xrh s GLY 260 Ca 0.22 1.19 0.03 0.00 0.00 0.00 0.00 44.72 46.15 1xrh s GLY 260 CO 0.14 1.75 1.88 3.21 0.00 0.00 0.00 173.10 180.08 1xrh h ARG 261 N 2.58 0.61 -3.48 2.90 2.47 -1.91 -3.47 114.38 114.07 1xrh h ARG 261 Ca -0.50 -0.12 -0.35 0.00 -1.26 0.00 0.00 59.98 57.76 1xrh h ARG 261 Cb 1.25 -0.10 0.03 0.00 -1.65 0.00 0.00 29.97 29.50 1xrh h ARG 261 CO 0.62 0.58 -0.50 0.09 0.56 0.00 0.00 179.97 181.33 1xrh n ASN 262 N -4.30 -5.37 -4.81 7.04 3.02 -1.26 -4.39 115.26 105.19 1xrh n ASN 262 Ca 0.02 -0.18 -0.32 0.00 -0.03 0.00 0.00 54.58 54.07 1xrh n ASN 262 Cb 0.22 -4.27 0.03 0.00 -0.61 0.00 0.00 39.78 35.14 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 -5.54 3.33 0.19 3.41 1.02 -1.26 -4.48 118.68 115.35 1xrh s LEU 263 Ca 0.19 1.71 0.08 0.00 0.02 0.00 0.00 54.13 56.13 1xrh s LEU 263 Cb -0.08 -4.51 -0.04 0.00 0.02 0.00 0.00 46.19 41.57 1xrh s LEU 263 CO 0.23 -1.27 -0.16 -0.83 0.02 0.00 0.00 176.35 174.34 1xrh s GLY 264 N -3.29 1.42 0.01 -3.19 0.00 -1.26 -1.58 107.32 99.43 1xrh s GLY 264 Ca 0.61 -1.60 -0.08 0.00 0.00 0.00 0.00 44.72 43.64 1xrh s GLY 264 CO 0.45 -1.68 0.16 1.62 0.00 0.00 0.00 173.10 173.66 1xrh s GLN 265 N -3.33 0.55 -0.06 2.90 0.74 -0.54 -2.80 119.66 117.12 1xrh s GLN 265 Ca 0.20 -0.44 0.03 0.00 0.05 0.00 0.00 55.36 55.19 1xrh s GLN 265 Cb -0.03 0.23 0.01 0.00 1.10 0.00 0.00 33.01 34.32 1xrh s GLN 265 CO 0.07 -0.14 -0.14 -1.17 -0.55 0.00 0.00 175.29 173.36 1xrh s LEU 266 N -1.56 1.76 -0.09 3.68 2.96 -1.26 0.56 118.68 124.72 1xrh s LEU 266 Ca -0.12 -0.33 0.01 0.00 -0.22 0.00 0.00 54.13 53.47 1xrh s LEU 266 Cb -0.06 -0.90 -0.02 0.00 0.50 0.00 0.00 46.19 45.71 1xrh s LEU 266 CO 0.01 0.07 -0.11 -1.00 -1.32 0.00 0.00 176.35 174.00 1xrh s HIS 267 N 0.46 2.82 -0.08 5.38 3.76 0.11 -4.26 115.29 123.49 1xrh s HIS 267 Ca -0.12 -0.31 0.02 0.00 -0.15 0.00 0.00 55.06 54.50 1xrh s HIS 267 Cb -0.15 -1.76 0.01 0.00 1.11 0.00 0.00 32.58 31.80 1xrh s HIS 267 CO 0.04 0.05 -0.15 0.42 -0.85 0.00 0.00 174.74 174.25 1xrh s ILE 268 N -0.24 1.38 -0.01 0.60 1.01 -0.21 0.25 121.20 123.98 1xrh s ILE 268 Ca 0.02 -0.61 0.04 0.00 0.00 0.00 0.00 60.65 60.10 1xrh s ILE 268 Cb -0.13 -1.25 -0.01 0.00 0.01 0.00 0.00 42.46 41.08 1xrh s ILE 268 CO 0.03 0.41 -0.13 -0.69 0.00 0.00 0.00 174.94 174.56 1xrh s VAL 269 N 0.70 1.03 -0.07 2.92 1.01 0.14 -0.73 120.40 125.40 1xrh s VAL 269 Ca -0.13 -0.55 0.01 0.00 0.00 0.00 0.00 61.98 61.31 1xrh s VAL 269 Cb -0.16 -0.87 0.02 0.00 0.00 0.00 0.00 36.38 35.37 1xrh s VAL 269 CO 0.03 0.30 -0.09 -0.63 0.00 0.00 0.00 175.10 174.71 1xrh s ILE 270 N -0.23 0.94 -0.50 2.22 1.01 -0.57 -0.45 121.20 123.63 1xrh s ILE 270 Ca 0.04 -0.32 -0.22 0.00 0.00 0.00 0.00 60.65 60.14 1xrh s ILE 270 Cb -0.06 -0.92 0.04 0.00 0.01 0.00 0.00 42.46 41.54 1xrh s ILE 270 CO -0.00 0.33 0.77 0.21 0.00 0.00 0.00 174.94 176.25 1xrh s ASN 271 N 1.07 6.32 0.62 3.58 3.84 0.99 -0.71 114.94 130.64 1xrh s ASN 271 Ca -0.08 -0.45 0.26 0.00 0.21 0.00 0.00 52.86 52.81 1xrh s ASN 271 Cb -0.14 -2.37 1.30 0.00 -0.55 0.00 0.00 41.25 39.49 1xrh s ASN 271 CO -0.01 -0.99 1.73 -0.65 -2.79 0.00 0.00 177.10 174.39 1xrh h PRO 272 N 9.08 0.00 -0.60 0.43 0.11 -1.87 -0.30 132.00 138.85 1xrh h PRO 272 Ca -0.26 0.00 0.07 0.00 0.11 0.00 0.00 66.00 65.92 1xrh h PRO 272 Cb 1.09 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.16 1xrh h PRO 272 CO 0.99 0.00 0.40 -0.91 -0.21 0.00 0.00 178.00 178.27 1xrh h ASN 273 N 0.00 0.48 -0.05 -2.05 -0.26 -1.91 0.32 115.58 112.11 1xrh h ASN 273 Ca 0.19 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.94 1xrh h ASN 273 Cb 1.42 -0.10 0.00 0.00 -1.06 0.00 0.00 38.32 38.58 1xrh h ASN 273 CO -0.00 0.31 0.00 0.49 -1.06 0.00 0.00 177.43 177.17 1xrh n PHE 274 N -4.48 0.11 0.00 1.19 3.01 -0.12 -3.79 117.46 113.38 1xrh n PHE 274 Ca 0.09 -0.04 0.00 0.00 1.01 0.00 0.00 57.45 58.50 1xrh n PHE 274 Cb 0.26 -0.05 0.00 0.00 -0.01 0.00 0.00 39.48 39.68 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 -0.19 0.00 0.00 1.38 3.01 -0.04 -5.11 117.46 116.52 1xrh n PHE 275 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.48 1xrh n PHE 275 Cb 0.15 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.62 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 -0.83 0.00 -4.33 4.37 3.41 -0.38 -5.11 113.62 110.75 1xrh n SER 276 Ca 0.00 0.00 -0.55 0.00 -0.26 0.00 0.00 58.87 58.06 1xrh n SER 276 Cb 0.12 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 63.96 1xrh n SER 276 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1xrh n SER 277 N 0.00 1.14 -0.08 4.04 2.88 -1.26 -4.02 113.62 116.32 1xrh n SER 277 Ca 0.00 0.54 0.03 0.00 -1.33 0.00 0.00 58.87 58.12 1xrh n SER 277 Cb 0.00 -1.02 0.37 0.00 -0.75 0.00 0.00 64.21 62.81 1xrh n SER 277 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1xrh h SER 278 N 10.39 0.60 0.55 -3.46 4.64 -1.89 0.24 113.55 124.62 1xrh h SER 278 Ca -0.15 -0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.13 1xrh h SER 278 Cb 1.38 -0.15 0.01 0.00 -0.31 0.00 0.00 62.40 63.33 1xrh h SER 278 CO 1.09 0.43 -0.26 -0.08 -0.87 0.00 0.00 176.83 177.14 1xrh h GLU 279 N 0.71 -0.71 -0.71 4.77 4.57 -1.98 -1.00 114.58 120.23 1xrh h GLU 279 Ca 0.20 0.05 0.02 0.00 -1.18 0.00 0.00 59.36 58.45 1xrh h GLU 279 Cb -0.05 0.16 -0.04 0.00 -0.16 0.00 0.00 28.75 28.67 1xrh h GLU 279 CO -0.05 -0.46 0.47 -0.07 -1.18 0.00 0.00 179.01 177.72 1xrh h LEU 280 N -0.76 0.78 -0.33 1.64 3.38 -1.85 -2.62 115.31 115.55 1xrh h LEU 280 Ca -0.08 -0.02 0.06 0.00 0.09 0.00 0.00 57.88 57.94 1xrh h LEU 280 Cb 0.58 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.08 1xrh h LEU 280 CO 0.12 0.55 -0.06 0.15 0.09 0.00 0.00 178.44 179.29 1xrh h PHE 281 N 0.92 -0.14 -0.20 1.13 3.57 -0.06 -1.62 116.94 120.54 1xrh h PHE 281 Ca 0.27 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.71 1xrh h PHE 281 Cb -0.04 0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 1xrh h PHE 281 CO -0.00 -0.12 -0.27 0.00 -2.23 0.00 0.00 178.31 175.68 1xrh h ARG 282 N 0.02 0.37 -0.35 1.11 3.08 -0.84 -2.52 114.38 115.25 1xrh h ARG 282 Ca 0.16 -0.14 -0.03 0.00 0.07 0.00 0.00 59.98 60.04 1xrh h ARG 282 Cb 0.24 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 1xrh h ARG 282 CO -0.32 0.62 0.12 1.96 -1.07 0.00 0.00 179.97 181.28 1xrh h GLN 283 N 0.33 0.54 -0.56 0.04 4.20 -1.15 -2.56 115.11 115.97 1xrh h GLN 283 Ca 0.05 -0.11 -0.05 0.00 0.06 0.00 0.00 58.65 58.59 1xrh h GLN 283 Cb 0.66 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.33 1xrh h GLN 283 CO 0.05 0.56 0.13 0.45 -0.67 0.00 0.00 178.83 179.35 1xrh h HIS 284 N 0.42 0.89 -0.55 2.96 3.86 -1.06 0.79 115.15 122.47 1xrh h HIS 284 Ca 0.12 -0.09 -0.04 0.00 -1.16 0.00 0.00 60.37 59.20 1xrh h HIS 284 Cb 0.23 -0.26 -0.02 0.00 1.06 0.00 0.00 27.41 28.42 1xrh h HIS 284 CO 0.01 0.75 0.20 1.25 0.86 0.00 0.00 177.93 181.00 1xrh h LEU 285 N 0.83 0.76 -0.62 2.43 7.12 -1.31 0.51 115.31 125.04 1xrh h LEU 285 Ca 0.18 -0.18 -0.13 0.00 0.13 0.00 0.00 57.88 57.88 1xrh h LEU 285 Cb 0.31 -0.20 -0.01 0.00 -0.53 0.00 0.00 40.66 40.23 1xrh h LEU 285 CO -0.00 0.74 -0.33 0.28 -0.13 0.00 0.00 178.44 179.00 1xrh h SER 286 N 0.75 0.76 -0.25 1.25 0.02 -1.07 -2.73 113.55 112.27 1xrh h SER 286 Ca 0.18 -0.31 -0.01 0.00 -0.84 0.00 0.00 61.79 60.81 1xrh h SER 286 Cb 0.22 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 1xrh h SER 286 CO -0.01 1.02 0.12 -0.61 -1.14 0.00 0.00 176.83 176.21 1xrh h GLN 287 N 0.61 0.37 0.00 3.45 4.15 -0.34 0.24 115.11 123.59 1xrh h GLN 287 Ca 0.07 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.43 1xrh h GLN 287 Cb 0.85 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.48 1xrh h GLN 287 CO 0.07 0.37 0.00 2.41 -1.93 0.00 0.00 178.83 179.75 1xrh n THR 288 N -4.81 0.00 0.00 2.39 -1.04 0.18 -0.35 114.28 110.64 1xrh n THR 288 Ca -0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.98 1xrh n THR 288 Cb 0.10 -0.33 0.00 0.00 -1.82 0.00 0.00 70.33 68.29 1xrh n THR 288 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 1xrh n ARG 290 N -0.09 0.00 -0.24 -2.82 0.63 0.83 -1.19 116.66 113.78 1xrh n ARG 290 Ca 0.00 0.00 0.03 0.00 -0.92 0.00 0.00 57.85 56.96 1xrh n ARG 290 Cb 0.00 0.00 0.15 0.00 0.45 0.00 0.00 32.46 33.06 1xrh n ARG 290 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1xrh h GLU 291 N 0.00 0.41 -0.20 -0.14 5.08 -0.93 0.62 114.58 119.43 1xrh h GLU 291 Ca 0.00 -0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.39 1xrh h GLU 291 Cb 0.00 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 1xrh h GLU 291 CO 0.00 0.27 0.20 -0.07 -1.00 0.00 0.00 179.01 178.41 1xrh h LEU 292 N 0.43 0.00 -0.63 1.33 3.38 -1.37 0.26 115.31 118.70 1xrh h LEU 292 Ca 0.37 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.19 1xrh h LEU 292 Cb 0.53 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 1xrh h LEU 292 CO -0.37 0.00 -0.67 0.78 0.09 0.00 0.00 178.44 178.27 1xrh h ASN 293 N 0.00 0.10 1.23 -0.43 -0.26 0.05 -3.18 115.58 113.09 1xrh h ASN 293 Ca 0.09 -0.06 -0.09 0.00 -0.56 0.00 0.00 56.30 55.68 1xrh h ASN 293 Cb 0.49 -0.03 -0.01 0.00 -1.06 0.00 0.00 38.32 37.71 1xrh h ASN 293 CO -0.00 0.74 -0.42 0.00 -1.06 0.00 0.00 177.43 176.68 1xrh h ALA 294 N 1.26 0.81 -1.39 -0.83 0.00 -0.14 -3.42 119.26 115.55 1xrh h ALA 294 Ca -0.01 -0.38 -0.74 0.00 0.00 0.00 0.00 54.91 53.78 1xrh h ALA 294 Cb 1.19 -0.07 0.04 0.00 0.00 0.00 0.00 17.79 18.95 1xrh h ALA 294 CO 0.09 0.53 0.42 -0.89 0.00 0.00 0.00 179.25 179.40 1xrh n ILE 295 N -3.33 0.04 -1.91 0.00 -0.00 -1.02 -4.80 119.36 108.34 1xrh n ILE 295 Ca 0.01 -0.01 -0.42 0.00 -0.00 0.00 0.00 62.75 62.33 1xrh n ILE 295 Cb 0.63 -0.60 -0.03 0.00 -0.00 0.00 0.00 39.64 39.64 1xrh n ILE 295 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.55 175.66 1xrh s THR 296 N 0.99 2.82 0.65 1.39 2.01 -1.26 -4.56 115.64 117.68 1xrh s THR 296 Ca 0.90 0.43 -0.14 0.00 0.31 0.00 0.00 61.69 63.20 1xrh s THR 296 Cb -1.12 -3.28 -0.01 0.00 0.01 0.00 0.00 72.50 68.10 1xrh s THR 296 CO 0.56 0.01 1.06 -2.16 -0.69 0.00 0.00 174.62 173.40 1xrh s PRO 297 N 2.04 3.08 0.54 4.92 0.04 -1.26 -4.99 135.00 139.37 1xrh s PRO 297 Ca 0.73 1.12 -0.01 0.00 0.04 0.00 0.00 61.00 62.88 1xrh s PRO 297 Cb -0.42 -2.00 0.02 0.00 0.04 0.00 0.00 34.50 32.14 1xrh s PRO 297 CO 0.32 -0.99 0.79 0.00 0.04 0.00 0.00 177.00 177.15 1xrh s ALA 298 N -2.70 3.70 0.35 8.56 0.00 -1.26 -5.00 121.76 125.41 1xrh s ALA 298 Ca 0.61 -1.13 -0.29 0.00 0.00 0.00 0.00 51.96 51.16 1xrh s ALA 298 Cb -0.16 -2.22 -0.11 0.00 0.00 0.00 0.00 23.12 20.63 1xrh s ALA 298 CO 0.45 -0.71 1.53 -2.14 0.00 0.00 0.00 175.76 174.89 1xrh s PRO 299 N -4.79 4.10 0.00 0.00 0.02 -1.26 -1.94 135.00 131.13 1xrh s PRO 299 Ca 0.55 2.59 0.00 0.00 0.02 0.00 0.00 61.00 64.16 1xrh s PRO 299 Cb -0.10 -2.98 0.00 0.00 0.02 0.00 0.00 34.50 31.43 1xrh s PRO 299 CO 0.40 -0.58 0.00 0.41 -0.33 0.00 0.00 177.00 176.89 1xrh n GLY 300 N 1.04 0.72 2.91 0.52 0.00 -1.26 -5.04 105.19 104.08 1xrh n GLY 300 Ca 0.04 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.63 0.83 -0.70 1.61 0.40 -0.82 -5.02 117.98 111.64 1xrh s PHE 301 Ca 0.00 -0.24 0.26 0.00 -0.60 0.00 0.00 56.93 56.35 1xrh s PHE 301 Cb 0.00 -0.71 0.81 0.00 0.51 0.00 0.00 43.02 43.63 1xrh s PHE 301 CO 0.00 -0.20 1.77 0.09 0.70 0.00 0.00 175.22 177.58 1xrh n ASN 302 N 4.01 0.84 -2.10 1.36 3.02 -1.26 -4.52 115.26 116.60 1xrh n ASN 302 Ca -0.25 0.59 0.02 0.00 -0.03 0.00 0.00 54.58 54.91 1xrh n ASN 302 Cb 0.51 -0.81 0.00 0.00 -0.61 0.00 0.00 39.78 38.88 1xrh n ASN 302 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1xrh n GLN 303 N -2.29 0.01 -3.92 3.52 7.27 -1.26 -4.98 117.38 115.72 1xrh n GLN 303 Ca 0.05 -0.19 -0.27 0.00 0.07 0.00 0.00 57.00 56.66 1xrh n GLN 303 Cb 0.42 0.37 -0.17 0.00 2.41 0.00 0.00 30.24 33.27 1xrh n GLN 303 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 1xrh s VAL 304 N -2.01 1.09 -0.04 1.69 1.01 -1.26 -4.83 120.40 116.05 1xrh s VAL 304 Ca 0.12 -0.35 -0.04 0.00 0.00 0.00 0.00 61.98 61.72 1xrh s VAL 304 Cb -0.00 -1.11 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 1xrh s VAL 304 CO -0.01 0.37 0.16 -0.31 0.00 0.00 0.00 175.10 175.31 1xrh s TYR 305 N 1.68 3.54 0.54 5.22 4.12 -1.26 -4.35 117.35 126.85 1xrh s TYR 305 Ca 0.05 0.39 -0.18 0.00 0.02 0.00 0.00 57.07 57.36 1xrh s TYR 305 Cb -0.13 -1.85 -0.06 0.00 -1.52 0.00 0.00 41.96 38.40 1xrh s TYR 305 CO -0.08 0.66 1.04 1.52 0.02 0.00 0.00 175.55 178.71 1xrh s TYR 306 N -1.23 3.05 -0.22 2.71 -0.85 -1.26 -4.91 117.35 114.63 1xrh s TYR 306 Ca 0.23 1.53 -0.42 0.00 -0.52 0.00 0.00 57.07 57.89 1xrh s TYR 306 Cb -0.12 -3.00 -0.19 0.00 0.38 0.00 0.00 41.96 39.02 1xrh s TYR 306 CO 0.14 -0.92 1.39 -2.30 -1.52 0.00 0.00 175.55 172.35 1xrh n PRO 307 N -1.58 0.28 -0.97 -3.49 -0.02 -1.26 -1.38 135.00 126.58 1xrh n PRO 307 Ca 0.09 0.10 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 1xrh n PRO 307 Cb 0.53 -1.64 0.00 0.00 -0.02 0.00 0.00 33.50 32.36 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 2.93 0.91 0.21 -1.23 0.00 -1.23 -4.23 105.19 102.55 1xrh n GLY 308 Ca 0.25 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.19 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 2.68 0.52 0.00 1.61 4.15 -1.50 -2.31 115.11 120.25 1xrh h GLN 309 Ca 0.00 -0.31 0.00 0.00 0.77 0.00 0.00 58.65 59.11 1xrh h GLN 309 Cb 0.00 0.03 0.00 0.00 0.21 0.00 0.00 27.48 27.72 1xrh h GLN 309 CO 0.00 0.91 0.00 -0.40 -1.93 0.00 0.00 178.83 177.41 1xrh n ASP 310 N -3.97 0.40 -0.03 -0.69 5.75 -1.26 -1.05 116.55 115.71 1xrh n ASP 310 Ca -0.03 0.60 -0.15 0.00 -0.01 0.00 0.00 54.79 55.20 1xrh n ASP 310 Cb 0.58 -0.69 -0.14 0.00 -1.03 0.00 0.00 41.12 39.85 1xrh n ASP 310 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1xrh n GLN 311 N -1.94 0.69 -0.18 0.11 6.02 -1.08 -2.81 117.38 118.18 1xrh n GLN 311 Ca 0.02 0.24 -0.09 0.00 -0.01 0.00 0.00 57.00 57.17 1xrh n GLN 311 Cb 0.20 -1.71 0.01 0.00 1.02 0.00 0.00 30.24 29.76 1xrh n GLN 311 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.06 175.61 1xrh h ASP 312 N 0.03 0.82 -0.20 1.08 5.19 -0.82 -1.51 116.42 121.01 1xrh h ASP 312 Ca -0.40 -0.25 -0.00 0.00 -0.62 0.00 0.00 57.03 55.76 1xrh h ASP 312 Cb 2.03 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 41.32 1xrh h ASP 312 CO 0.06 0.86 0.11 0.40 -3.12 0.00 0.00 179.24 177.56 1xrh h ILE 313 N 0.75 1.10 -0.92 0.35 2.04 -1.23 0.48 117.51 120.07 1xrh h ILE 313 Ca 0.16 -0.25 0.05 0.00 1.00 0.00 0.00 64.86 65.82 1xrh h ILE 313 Cb 0.38 0.90 -0.06 0.00 -0.74 0.00 0.00 36.82 37.30 1xrh h ILE 313 CO 0.01 0.09 0.60 0.11 0.00 0.00 0.00 178.15 178.96 1xrh h LYS 314 N 0.23 1.08 0.00 2.37 1.57 -1.37 0.39 116.57 120.83 1xrh h LYS 314 Ca 0.07 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.73 1xrh h LYS 314 Cb 0.05 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 1xrh h LYS 314 CO -0.01 0.71 -0.26 0.37 -0.57 0.00 0.00 179.45 179.69 1xrh h GLN 315 N 1.11 0.00 -0.02 3.15 4.15 -0.60 -2.27 115.11 120.62 1xrh h GLN 315 Ca 0.38 0.00 -0.22 0.00 0.77 0.00 0.00 58.65 59.59 1xrh h GLN 315 Cb 0.10 0.00 0.02 0.00 0.21 0.00 0.00 27.48 27.81 1xrh h GLN 315 CO -0.13 0.26 -0.83 0.00 -1.93 0.00 0.00 178.83 176.21 1xrh h ARG 316 N 0.00 0.60 -0.14 1.69 3.08 0.12 -3.25 114.38 116.48 1xrh h ARG 316 Ca -0.00 -0.61 -0.01 0.00 0.07 0.00 0.00 59.98 59.43 1xrh h ARG 316 Cb 0.65 0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.86 1xrh h ARG 316 CO 0.03 1.23 0.07 0.87 -1.07 0.00 0.00 179.97 181.09 1xrh h LYS 317 N 0.21 0.20 -0.98 0.04 1.57 -1.11 -3.04 116.57 113.46 1xrh h LYS 317 Ca -0.10 -0.03 0.20 0.00 -1.87 0.00 0.00 60.65 58.86 1xrh h LYS 317 Cb 1.50 -0.04 -0.09 0.00 0.08 0.00 0.00 32.23 33.68 1xrh h LYS 317 CO 0.16 0.26 0.62 0.00 -0.57 0.00 0.00 179.45 179.92 1xrh h ALA 318 N 0.93 1.90 0.00 3.86 0.00 -1.52 0.90 119.26 125.33 1xrh h ALA 318 Ca 0.05 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1xrh h ALA 318 Cb 0.12 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1xrh h ALA 318 CO -0.01 -0.26 0.06 0.00 0.00 0.00 0.00 179.25 179.04 1xrh h ALA 319 N 1.63 1.05 0.00 0.00 0.00 -1.56 0.06 119.26 120.44 1xrh h ALA 319 Ca 0.55 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.43 1xrh h ALA 319 Cb 1.06 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 1xrh h ALA 319 CO -0.31 -0.05 -0.58 0.28 0.00 0.00 0.00 179.25 178.59 1xrh n VAL 320 N -2.73 0.88 0.83 0.00 0.31 0.27 -4.75 118.33 113.13 1xrh n VAL 320 Ca -0.02 0.20 0.13 0.00 -0.01 0.00 0.00 64.34 64.64 1xrh n VAL 320 Cb 0.11 -1.65 0.52 0.00 -0.91 0.00 0.00 33.84 31.91 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 -3.48 0.11 0.00 5.55 1.02 0.14 -5.05 120.64 118.94 1xrh n GLU 321 Ca -0.05 0.10 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 1xrh n GLU 321 Cb 0.27 -1.63 0.00 0.00 -0.02 0.00 0.00 31.44 30.05 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 1.37 -0.09 3.43 0.62 0.00 0.01 -4.80 105.19 105.73 1xrh n GLY 322 Ca 0.06 -1.91 -0.33 0.00 0.00 0.00 0.00 46.02 43.85 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 -1.19 3.39 0.20 -0.61 1.01 0.14 -4.26 121.20 119.89 1xrh s ILE 323 Ca 0.00 -0.54 -0.30 0.00 0.00 0.00 0.00 60.65 59.81 1xrh s ILE 323 Cb 0.00 -2.44 -0.08 0.00 0.01 0.00 0.00 42.46 39.94 1xrh s ILE 323 CO 0.00 0.52 1.16 -1.83 0.00 0.00 0.00 174.94 174.79 1xrh s GLU 324 N 0.25 4.53 -0.01 2.79 -1.05 -1.26 -1.29 118.70 122.66 1xrh s GLU 324 Ca -0.06 1.83 0.00 0.00 -0.15 0.00 0.00 54.97 56.59 1xrh s GLU 324 Cb -0.15 -3.24 0.01 0.00 -0.44 0.00 0.00 34.13 30.31 1xrh s GLU 324 CO 0.04 -0.01 0.00 -1.50 0.95 0.00 0.00 175.26 174.74 1xrh s ILE 325 N -0.27 0.06 0.29 1.83 2.07 -0.15 -4.96 121.20 120.06 1xrh s ILE 325 Ca 0.51 0.03 -0.30 0.00 -1.41 0.00 0.00 60.65 59.48 1xrh s ILE 325 Cb -0.32 -0.10 -0.11 0.00 0.13 0.00 0.00 42.46 42.06 1xrh s ILE 325 CO 0.37 0.05 1.57 -0.69 -1.91 0.00 0.00 174.94 174.33 1xrh s VAL 326 N 0.35 2.15 0.24 4.00 1.01 -1.26 -1.43 120.40 125.46 1xrh s VAL 326 Ca -0.03 0.12 -0.07 0.00 0.00 0.00 0.00 61.98 62.00 1xrh s VAL 326 Cb -0.05 -3.08 0.28 0.00 0.00 0.00 0.00 36.38 33.53 1xrh s VAL 326 CO -0.01 0.02 1.63 0.44 0.00 0.00 0.00 175.10 177.18 1xrh h ASP 327 N 4.83 -0.37 -0.01 3.32 3.32 -1.93 0.83 116.42 126.41 1xrh h ASP 327 Ca -0.47 0.20 -0.04 0.00 0.02 0.00 0.00 57.03 56.74 1xrh h ASP 327 Cb 1.22 0.35 -0.01 0.00 0.22 0.00 0.00 39.33 41.11 1xrh h ASP 327 CO 0.79 -0.18 -0.08 -0.78 -1.72 0.00 0.00 179.24 177.26 1xrh h ASP 328 N 0.09 0.20 -0.24 6.45 1.82 -2.00 -2.46 116.42 120.29 1xrh h ASP 328 Ca 0.41 -0.03 -0.14 0.00 -0.39 0.00 0.00 57.03 56.87 1xrh h ASP 328 Cb 0.71 -0.05 -0.00 0.00 0.68 0.00 0.00 39.33 40.67 1xrh h ASP 328 CO -0.67 0.32 -0.40 0.40 -1.61 0.00 0.00 179.24 177.28 1xrh h ILE 329 N 0.21 1.31 -0.79 2.25 2.04 -1.21 -2.60 117.51 118.71 1xrh h ILE 329 Ca 0.05 -1.60 0.02 0.00 1.00 0.00 0.00 64.86 64.33 1xrh h ILE 329 Cb 0.29 1.75 -0.05 0.00 -0.74 0.00 0.00 36.82 38.07 1xrh h ILE 329 CO 0.01 0.51 0.51 0.22 0.00 0.00 0.00 178.15 179.40 1xrh h TYR 330 N 0.41 0.97 -0.43 1.37 3.20 -1.14 -0.98 116.97 120.36 1xrh h TYR 330 Ca 0.02 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.89 1xrh h TYR 330 Cb 0.99 -0.32 -0.02 0.00 1.54 0.00 0.00 36.73 38.92 1xrh h TYR 330 CO 0.08 0.57 0.19 1.96 -1.64 0.00 0.00 178.16 179.32 1xrh h GLN 331 N 1.02 0.61 0.23 1.82 4.20 -1.40 -0.88 115.11 120.70 1xrh h GLN 331 Ca 0.31 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.93 1xrh h GLN 331 Cb -0.04 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.63 1xrh h GLN 331 CO -0.10 0.49 -0.11 -0.92 -0.67 0.00 0.00 178.83 177.53 1xrh h TYR 332 N 0.61 -0.28 -0.78 2.96 3.20 -1.04 -2.26 116.97 119.38 1xrh h TYR 332 Ca 0.15 -0.01 0.14 0.00 3.14 0.00 0.00 58.73 62.15 1xrh h TYR 332 Cb 0.10 0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.41 1xrh h TYR 332 CO 0.01 0.10 0.52 -0.07 -1.64 0.00 0.00 178.16 177.07 1xrh h LEU 333 N -0.78 0.48 -1.56 2.82 3.38 -0.91 -0.61 115.31 118.14 1xrh h LEU 333 Ca -0.03 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1xrh h LEU 333 Cb 0.51 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1xrh h LEU 333 CO 0.05 0.26 0.00 2.30 0.09 0.00 0.00 178.44 181.14 1xrh n ILE 334 N -4.50 0.39 -2.56 1.22 -5.35 -0.36 -4.90 119.36 103.30 1xrh n ILE 334 Ca 0.15 -0.52 -0.23 0.00 -0.27 0.00 0.00 62.75 61.88 1xrh n ILE 334 Cb 0.48 0.50 0.08 0.00 -1.74 0.00 0.00 39.64 38.96 1xrh n ILE 334 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1xrh s SER 335 N -1.40 4.73 0.03 7.28 1.04 -0.24 -5.03 113.70 120.12 1xrh s SER 335 Ca 0.33 -0.15 0.23 0.00 0.48 0.00 0.00 55.95 56.85 1xrh s SER 335 Cb 0.18 -0.45 0.07 0.00 0.10 0.00 0.00 66.02 65.92 1xrh s SER 335 CO 0.26 -1.57 1.06 0.47 0.98 0.00 0.00 173.24 174.44 1xrh n ASP 336 N -2.66 0.65 -4.77 7.02 8.00 -1.26 -4.95 116.55 118.57 1xrh n ASP 336 Ca 0.12 -0.37 -0.37 0.00 0.71 0.00 0.00 54.79 54.88 1xrh n ASP 336 Cb 0.60 0.77 -0.00 0.00 -0.02 0.00 0.00 41.12 42.47 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 -3.13 2.90 0.01 2.24 0.00 -1.26 -4.96 121.76 117.57 1xrh s ALA 337 Ca 0.06 0.94 -0.03 0.00 0.00 0.00 0.00 51.96 52.93 1xrh s ALA 337 Cb 0.15 -3.39 -0.28 0.00 0.00 0.00 0.00 23.12 19.60 1xrh s ALA 337 CO 0.80 -0.74 0.89 -0.07 0.00 0.00 0.00 175.76 176.65 1xrh h LEU 338 N 1.83 0.38 -7.00 0.00 3.38 -1.95 -3.48 115.31 108.47 1xrh h LEU 338 Ca -0.50 -0.51 0.13 0.00 0.09 0.00 0.00 57.88 57.09 1xrh h LEU 338 Cb 1.25 -0.12 -0.23 0.00 0.09 0.00 0.00 40.66 41.65 1xrh h LEU 338 CO 0.59 1.42 0.65 -0.72 0.09 0.00 0.00 178.44 180.48 1xrh s TYR 339 N -2.62 -0.27 0.00 1.13 -0.85 -1.26 -4.53 117.35 108.94 1xrh s TYR 339 Ca -0.08 0.43 0.00 0.00 -0.52 0.00 0.00 57.07 56.90 1xrh s TYR 339 Cb 0.07 0.47 0.00 0.00 0.38 0.00 0.00 41.96 42.88 1xrh s TYR 339 CO 0.86 -0.28 0.00 0.09 -1.52 0.00 0.00 175.55 174.70 1xrh n ASN 340 N 0.55 0.00 -4.42 -0.18 3.02 -1.26 -4.93 115.26 108.05 1xrh n ASN 340 Ca -0.07 0.18 -0.33 0.00 -0.03 0.00 0.00 54.58 54.33 1xrh n ASN 340 Cb 0.58 -0.24 -0.13 0.00 -0.61 0.00 0.00 39.78 39.37 1xrh n ASN 340 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1xrh s THR 341 N -0.49 3.37 0.27 3.41 -4.23 -1.26 -5.08 115.64 111.63 1xrh s THR 341 Ca 0.00 -0.54 -0.27 0.00 -1.18 0.00 0.00 61.69 59.69 1xrh s THR 341 Cb 0.00 -2.45 -0.15 0.00 1.34 0.00 0.00 72.50 71.24 1xrh s THR 341 CO 0.00 0.51 0.73 -0.24 -0.54 0.00 0.00 174.62 175.08 1xrh n SER 342 N 3.56 -0.11 0.00 3.99 2.88 -1.26 -4.83 113.62 117.85 1xrh n SER 342 Ca -0.18 1.12 0.09 0.00 -1.33 0.00 0.00 58.87 58.57 1xrh n SER 342 Cb 0.53 -1.12 0.51 0.00 -0.75 0.00 0.00 64.21 63.38 1xrh n SER 342 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 1xrh n TYR 343 N -0.01 0.00 -0.58 0.66 4.02 -1.26 -5.22 117.16 114.77 1xrh n TYR 343 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.02 1xrh n TYR 343 Cb 0.30 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.62 1xrh n TYR 343 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 176.86 173.94