#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r8q h LYS 57 N 0.00 0.23 0.03 -1.46 1.57 -2.05 -2.77 116.57 112.11 1r8q h LYS 57 Ca 0.00 -0.03 -0.22 0.00 -1.87 0.00 0.00 60.65 58.53 1r8q h LYS 57 Cb 0.00 -0.04 0.02 0.00 0.08 0.00 0.00 32.23 32.29 1r8q h LYS 57 CO 0.00 0.26 -0.88 1.15 -0.57 0.00 0.00 179.45 179.41 1r8q h THR 58 N 0.23 1.36 -0.52 -0.16 2.02 -2.05 -2.30 112.91 111.49 1r8q h THR 58 Ca 0.06 -2.23 0.03 0.00 0.77 0.00 0.00 66.41 65.03 1r8q h THR 58 Cb 0.16 2.59 -0.04 0.00 -1.74 0.00 0.00 68.15 69.12 1r8q h THR 58 CO 0.00 0.67 0.30 0.25 0.37 0.00 0.00 175.52 177.11 1r8q h LEU 59 N 0.11 0.47 -0.63 2.58 5.85 -1.97 -0.87 115.31 120.85 1r8q h LEU 59 Ca -0.12 0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.49 1r8q h LEU 59 Cb 1.57 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.50 1r8q h LEU 59 CO 0.17 0.33 -0.20 1.56 -0.34 0.00 0.00 178.44 179.96 1r8q h GLN 60 N 0.59 0.87 -0.35 1.25 1.08 -1.52 -1.58 115.11 115.45 1r8q h GLN 60 Ca 0.22 -0.35 -0.03 0.00 -1.45 0.00 0.00 58.65 57.04 1r8q h GLN 60 Cb 0.06 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.43 1r8q h GLN 60 CO -0.11 0.99 0.11 -0.09 -0.95 0.00 0.00 178.83 178.78 1r8q h ARG 61 N 0.76 0.54 -0.78 1.46 2.43 -1.24 -1.56 114.38 115.99 1r8q h ARG 61 Ca 0.11 -0.11 0.07 0.00 -0.81 0.00 0.00 59.98 59.23 1r8q h ARG 61 Cb 0.74 -0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 30.16 1r8q h ARG 61 CO 0.06 0.56 0.51 -0.91 -1.51 0.00 0.00 179.97 178.68 1r8q h ASN 62 N 0.41 0.73 -0.35 -3.80 2.35 -0.95 0.10 115.58 114.08 1r8q h ASN 62 Ca 0.11 0.01 -0.10 0.00 -0.55 0.00 0.00 56.30 55.77 1r8q h ASN 62 Cb 0.24 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.45 1r8q h ASN 62 CO -0.00 0.47 -0.16 0.03 -1.65 0.00 0.00 177.43 176.12 1r8q h ARG 63 N 0.83 0.72 -0.18 0.81 3.08 -0.92 -1.30 114.38 117.42 1r8q h ARG 63 Ca 0.34 -0.31 -0.17 0.00 0.07 0.00 0.00 59.98 59.90 1r8q h ARG 63 Cb 0.26 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.28 1r8q h ARG 63 CO -0.12 0.92 -0.60 0.87 -1.07 0.00 0.00 179.97 179.96 1r8q h LYS 64 N 0.50 0.60 -0.14 0.04 1.57 -0.66 -1.23 116.57 117.25 1r8q h LYS 64 Ca 0.08 -0.41 -0.01 0.00 -1.87 0.00 0.00 60.65 58.45 1r8q h LYS 64 Cb 0.69 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.06 1r8q h LYS 64 CO 0.05 1.02 0.07 1.98 -0.57 0.00 0.00 179.45 182.00 1r8q h MET 65 N 0.45 0.21 -0.85 3.15 4.05 -0.71 -0.48 114.93 120.76 1r8q h MET 65 Ca -0.00 -0.03 0.04 0.00 -0.28 0.00 0.00 59.70 59.42 1r8q h MET 65 Cb 1.17 -0.04 -0.05 0.00 -0.80 0.00 0.00 31.60 31.88 1r8q h MET 65 CO 0.12 0.27 0.54 0.00 0.23 0.00 0.00 176.91 178.07 1r8q h ALA 66 N 0.93 1.12 -0.62 0.39 0.00 -1.15 -1.12 119.26 118.81 1r8q h ALA 66 Ca 0.05 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.96 1r8q h ALA 66 Cb 0.13 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 1r8q h ALA 66 CO -0.01 0.37 0.37 1.98 0.00 0.00 0.00 179.25 181.96 1r8q h MET 67 N 1.05 0.70 -0.41 0.00 -1.53 -1.00 -1.94 114.93 111.79 1r8q h MET 67 Ca 0.34 -0.04 -0.00 0.00 -3.44 0.00 0.00 59.70 56.56 1r8q h MET 67 Cb 0.03 -0.16 -0.02 0.00 -0.55 0.00 0.00 31.60 30.90 1r8q h MET 67 CO -0.12 0.46 0.24 0.78 0.14 0.00 0.00 176.91 178.41 1r8q h GLY 68 N 0.72 0.60 0.68 1.39 0.00 -0.62 0.17 103.07 106.02 1r8q h GLY 68 Ca 0.25 -0.26 0.05 0.00 0.00 0.00 0.00 47.33 47.37 1r8q h GLY 68 CO -0.12 0.25 0.19 3.21 0.00 0.00 0.00 176.54 180.07 1r8q h ARG 69 N 0.54 0.37 -0.91 4.80 3.08 -1.03 0.90 114.38 122.12 1r8q h ARG 69 Ca 0.15 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.17 1r8q h ARG 69 Cb 0.02 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 29.94 1r8q h ARG 69 CO -0.03 0.24 0.56 0.87 -1.07 0.00 0.00 179.97 180.55 1r8q h LYS 70 N 0.38 1.23 -0.30 0.04 1.57 -0.99 -1.13 116.57 117.36 1r8q h LYS 70 Ca 0.20 -0.10 -0.14 0.00 -1.87 0.00 0.00 60.65 58.74 1r8q h LYS 70 Cb 0.15 -0.26 -0.00 0.00 0.08 0.00 0.00 32.23 32.20 1r8q h LYS 70 CO -0.17 0.85 -0.36 0.87 -0.57 0.00 0.00 179.45 180.07 1r8q h LYS 71 N 1.25 0.77 -0.65 3.15 1.57 -0.25 -2.80 116.57 119.61 1r8q h LYS 71 Ca 0.33 -0.43 0.05 0.00 -1.87 0.00 0.00 60.65 58.73 1r8q h LYS 71 Cb -0.07 0.03 -0.05 0.00 0.08 0.00 0.00 32.23 32.21 1r8q h LYS 71 CO -0.06 1.06 0.36 0.35 -0.57 0.00 0.00 179.45 180.58 1r8q h PHE 72 N 0.53 0.66 -0.07 -1.35 3.57 -0.49 -0.60 116.94 119.19 1r8q h PHE 72 Ca 0.04 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.51 1r8q h PHE 72 Cb 0.94 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.47 1r8q h PHE 72 CO 0.07 0.32 -0.19 -0.91 -2.23 0.00 0.00 178.31 175.38 1r8q h ASN 73 N 0.67 0.11 0.18 0.41 2.35 -1.09 -1.81 115.58 116.40 1r8q h ASN 73 Ca 0.29 -0.02 -0.28 0.00 -0.55 0.00 0.00 56.30 55.73 1r8q h ASN 73 Cb 0.17 -0.03 0.02 0.00 0.05 0.00 0.00 38.32 38.53 1r8q h ASN 73 CO -0.17 0.31 -1.17 -0.03 -1.65 0.00 0.00 177.43 174.72 1r8q h MET 74 N 0.11 0.58 -0.86 0.81 4.05 -1.14 -3.45 114.93 115.03 1r8q h MET 74 Ca 0.02 -0.73 0.07 0.00 -0.28 0.00 0.00 59.70 58.78 1r8q h MET 74 Cb 0.40 0.23 -0.21 0.00 -0.80 0.00 0.00 31.60 31.23 1r8q h MET 74 CO 0.03 1.32 -0.30 0.34 0.23 0.00 0.00 176.91 178.53 1r8q s ASP 75 N -7.33 -1.38 0.38 1.39 -1.08 -0.29 -5.06 116.67 103.29 1r8q s ASP 75 Ca -0.08 0.23 0.06 0.00 -0.52 0.00 0.00 52.55 52.24 1r8q s ASP 75 Cb 0.06 1.90 0.78 0.00 -1.46 0.00 0.00 42.92 44.21 1r8q s ASP 75 CO 0.92 -0.25 2.00 -0.65 0.52 0.00 0.00 175.17 177.70 1r8q h PRO 76 N 7.87 0.67 -0.57 4.34 0.10 -1.55 -1.24 132.00 141.62 1r8q h PRO 76 Ca -0.05 -0.04 -0.04 0.00 0.10 0.00 0.00 66.00 65.97 1r8q h PRO 76 Cb 1.18 -0.15 -0.02 0.00 0.10 0.00 0.00 31.00 32.11 1r8q h PRO 76 CO 0.11 0.44 0.19 -0.22 0.10 0.00 0.00 178.00 178.63 1r8q h LYS 77 N 0.69 0.88 -0.32 1.05 3.64 -1.92 -0.55 116.57 120.05 1r8q h LYS 77 Ca 0.25 -0.18 -0.11 0.00 -1.27 0.00 0.00 60.65 59.34 1r8q h LYS 77 Cb 0.15 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 1r8q h LYS 77 CO -0.07 0.79 -0.26 0.87 -2.27 0.00 0.00 179.45 178.50 1r8q h LYS 78 N 0.80 0.64 0.01 1.90 1.57 -1.59 -1.02 116.57 118.87 1r8q h LYS 78 Ca 0.19 -0.26 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1r8q h LYS 78 Cb 0.26 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.54 1r8q h LYS 78 CO -0.01 0.84 -0.00 0.78 -0.57 0.00 0.00 179.45 180.49 1r8q h GLY 79 N 1.00 -0.01 0.80 3.86 0.00 -1.00 -1.19 103.07 106.53 1r8q h GLY 79 Ca 0.07 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.43 1r8q h GLY 79 CO 0.06 -0.00 0.01 -2.22 0.00 0.00 0.00 176.54 174.39 1r8q h ILE 80 N -0.16 0.91 -0.94 2.60 1.08 -1.00 -0.79 117.51 119.22 1r8q h ILE 80 Ca -0.00 -0.02 0.11 0.00 -0.39 0.00 0.00 64.86 64.55 1r8q h ILE 80 Cb 0.16 0.84 -0.08 0.00 -3.07 0.00 0.00 36.82 34.67 1r8q h ILE 80 CO 0.00 0.01 0.57 -0.61 -0.69 0.00 0.00 178.15 177.44 1r8q h GLN 81 N 0.07 0.91 -0.31 2.37 4.15 -1.14 -0.06 115.11 121.10 1r8q h GLN 81 Ca 0.07 -0.05 -0.10 0.00 0.77 0.00 0.00 58.65 59.34 1r8q h GLN 81 Cb 0.07 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.55 1r8q h GLN 81 CO -0.11 0.60 -0.18 0.35 -1.93 0.00 0.00 178.83 177.57 1r8q h PHE 82 N 0.93 0.78 -0.65 3.99 3.57 -0.70 -0.16 116.94 124.70 1r8q h PHE 82 Ca 0.45 -0.20 -0.09 0.00 3.53 0.00 0.00 57.97 61.67 1r8q h PHE 82 Cb 0.41 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 1r8q h PHE 82 CO -0.03 0.90 0.07 -0.07 -2.23 0.00 0.00 178.31 176.96 1r8q h LEU 83 N 0.42 1.06 -0.11 0.59 3.38 -0.66 -1.89 115.31 118.10 1r8q h LEU 83 Ca 0.07 -0.28 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 1r8q h LEU 83 Cb 0.72 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 1r8q h LEU 83 CO 0.05 1.08 0.05 0.58 0.09 0.00 0.00 178.44 180.29 1r8q h VAL 84 N 1.01 1.12 -0.12 1.22 2.07 -0.87 -0.33 116.25 120.35 1r8q h VAL 84 Ca 0.19 -0.34 -0.06 0.00 0.82 0.00 0.00 66.70 67.31 1r8q h VAL 84 Cb 0.49 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 1r8q h VAL 84 CO 0.02 0.10 -0.22 -0.33 0.02 0.00 0.00 177.57 177.16 1r8q h GLU 85 N 0.05 0.20 -0.44 1.57 5.08 -0.83 -1.85 114.58 118.36 1r8q h GLU 85 Ca 0.04 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1r8q h GLU 85 Cb 0.12 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1r8q h GLU 85 CO -0.00 0.42 0.00 0.09 -1.00 0.00 0.00 179.01 178.52 1r8q n ASN 86 N -4.20 1.88 -2.45 1.42 3.02 -0.73 -4.91 115.26 109.29 1r8q n ASN 86 Ca -0.01 -2.10 -0.16 0.00 -0.03 0.00 0.00 54.58 52.28 1r8q n ASN 86 Cb 0.33 -0.30 -0.01 0.00 -0.61 0.00 0.00 39.78 39.19 1r8q n ASN 86 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1r8q n GLU 87 N 0.30 -2.10 0.05 3.52 1.02 -0.70 -4.87 120.64 117.87 1r8q n GLU 87 Ca 0.10 0.76 0.11 0.00 -0.02 0.00 0.00 57.16 58.11 1r8q n GLU 87 Cb 0.35 -5.39 -0.04 0.00 -0.02 0.00 0.00 31.44 26.34 1r8q n GLU 87 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1r8q n LEU 88 N -2.92 0.56 -3.74 -4.62 4.77 -0.16 -4.90 117.00 105.99 1r8q n LEU 88 Ca -0.18 0.15 -0.13 0.00 -0.03 0.00 0.00 56.01 55.82 1r8q n LEU 88 Cb 0.64 -0.06 -0.13 0.00 -2.33 0.00 0.00 43.42 41.54 1r8q n LEU 88 CO 0.23 -0.08 -0.13 -0.22 -1.33 0.00 0.00 177.39 175.85 1r8q s LEU 89 N -4.75 0.58 0.34 2.23 2.96 -1.07 -4.98 118.68 113.98 1r8q s LEU 89 Ca -0.01 0.48 -0.29 0.00 -0.22 0.00 0.00 54.13 54.09 1r8q s LEU 89 Cb 0.12 0.69 -0.10 0.00 0.50 0.00 0.00 46.19 47.40 1r8q s LEU 89 CO 0.82 -0.15 1.37 -1.58 -1.32 0.00 0.00 176.35 175.49 1r8q s GLN 90 N 1.06 4.28 -1.44 1.98 0.74 -1.26 -4.11 119.66 120.91 1r8q s GLN 90 Ca -0.08 2.32 -0.07 0.00 0.05 0.00 0.00 55.36 57.58 1r8q s GLN 90 Cb -0.09 -3.05 0.04 0.00 1.10 0.00 0.00 33.01 31.01 1r8q s GLN 90 CO -0.07 -0.30 2.60 -1.71 -0.55 0.00 0.00 175.29 175.27 1r8q n ASN 91 N 0.83 8.29 -4.24 6.67 5.15 -1.26 -4.28 115.26 126.41 1r8q n ASN 91 Ca 0.01 -2.92 -0.18 0.00 -0.60 0.00 0.00 54.58 50.89 1r8q n ASN 91 Cb 0.41 -1.44 -0.11 0.00 -0.53 0.00 0.00 39.78 38.11 1r8q n ASN 91 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1r8q s THR 92 N 0.14 1.31 0.38 -0.44 -4.23 -1.26 -5.04 115.64 106.50 1r8q s THR 92 Ca 0.60 -1.73 0.09 0.00 -1.18 0.00 0.00 61.69 59.47 1r8q s THR 92 Cb 0.18 -1.54 0.17 0.00 1.34 0.00 0.00 72.50 72.65 1r8q s THR 92 CO -0.08 -0.43 1.92 1.55 -0.54 0.00 0.00 174.62 177.04 1r8q h PRO 93 N 3.49 0.29 -0.51 3.99 0.13 -1.90 -1.59 132.00 135.91 1r8q h PRO 93 Ca -0.40 -0.06 -0.11 0.00 -0.87 0.00 0.00 66.00 64.56 1r8q h PRO 93 Cb 1.20 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.27 1r8q h PRO 93 CO 0.51 0.40 -0.10 0.93 -0.23 0.00 0.00 178.00 179.50 1r8q h GLU 94 N 0.28 0.97 0.03 0.86 3.07 -1.94 -0.81 114.58 117.04 1r8q h GLU 94 Ca 0.06 -0.36 -0.26 0.00 -0.50 0.00 0.00 59.36 58.30 1r8q h GLU 94 Cb 0.34 -0.06 0.02 0.00 -0.84 0.00 0.00 28.75 28.21 1r8q h GLU 94 CO 0.02 1.03 -1.05 0.93 -1.40 0.00 0.00 179.01 178.53 1r8q h GLU 95 N 0.83 0.58 -0.59 2.33 4.39 -1.77 -1.85 114.58 118.50 1r8q h GLU 95 Ca 0.13 -0.66 -0.03 0.00 0.34 0.00 0.00 59.36 59.14 1r8q h GLU 95 Cb 0.66 0.19 -0.03 0.00 -0.10 0.00 0.00 28.75 29.48 1r8q h GLU 95 CO 0.05 1.26 0.26 0.82 -1.16 0.00 0.00 179.01 180.24 1r8q h ILE 96 N 0.31 1.22 -0.39 3.13 2.04 -1.32 -1.98 117.51 120.52 1r8q h ILE 96 Ca -0.12 -0.66 0.03 0.00 1.00 0.00 0.00 64.86 65.11 1r8q h ILE 96 Cb 1.71 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 38.31 1r8q h ILE 96 CO 0.20 0.26 0.20 0.00 0.00 0.00 0.00 178.15 178.81 1r8q h ALA 97 N 1.10 0.49 -0.90 1.87 0.00 -1.08 -1.57 119.26 119.16 1r8q h ALA 97 Ca 0.20 0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.19 1r8q h ALA 97 Cb 0.16 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.82 1r8q h ALA 97 CO -0.02 -0.15 0.56 0.00 0.00 0.00 0.00 179.25 179.64 1r8q h ARG 98 N 0.41 0.98 -0.71 0.00 3.08 -1.17 0.17 114.38 117.14 1r8q h ARG 98 Ca 0.16 -0.06 0.01 0.00 0.07 0.00 0.00 59.98 60.16 1r8q h ARG 98 Cb 0.06 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 29.85 1r8q h ARG 98 CO -0.11 0.65 0.46 0.35 -1.07 0.00 0.00 179.97 180.26 1r8q h PHE 99 N 1.01 0.89 -0.15 3.04 3.57 -0.97 -0.76 116.94 123.57 1r8q h PHE 99 Ca 0.40 0.02 -0.18 0.00 3.53 0.00 0.00 57.97 61.75 1r8q h PHE 99 Cb 0.22 -0.30 -0.00 0.00 2.79 0.00 0.00 35.95 38.65 1r8q h PHE 99 CO -0.03 0.57 -0.63 -0.07 -2.23 0.00 0.00 178.31 175.92 1r8q h LEU 100 N 0.96 0.61 -0.34 0.59 3.38 -0.78 -1.29 115.31 118.43 1r8q h LEU 100 Ca 0.26 -0.36 -0.17 0.00 0.09 0.00 0.00 57.88 57.70 1r8q h LEU 100 Cb -0.10 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.47 1r8q h LEU 100 CO -0.06 1.09 -0.44 0.22 0.09 0.00 0.00 178.44 179.34 1r8q h TYR 101 N 0.39 1.10 -0.52 1.13 3.20 -0.69 -2.61 116.97 118.98 1r8q h TYR 101 Ca -0.01 -0.36 -0.10 0.00 3.14 0.00 0.00 58.73 61.40 1r8q h TYR 101 Cb 1.20 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 39.23 1r8q h TYR 101 CO 0.05 1.19 -0.06 0.87 -1.64 0.00 0.00 178.16 178.56 1r8q h LYS 102 N 0.71 0.96 -1.39 1.82 1.57 -1.12 -3.47 116.57 115.65 1r8q h LYS 102 Ca 0.04 -0.34 -0.33 0.00 -1.87 0.00 0.00 60.65 58.15 1r8q h LYS 102 Cb 1.05 -0.07 -0.09 0.00 0.08 0.00 0.00 32.23 33.20 1r8q h LYS 102 CO 0.11 1.00 -0.35 0.41 -0.57 0.00 0.00 179.45 180.05 1r8q n GLY 103 N -0.30 0.87 3.62 3.86 0.00 -0.49 -4.90 105.19 107.84 1r8q n GLY 103 Ca 0.01 -0.23 -0.43 0.00 0.00 0.00 0.00 46.02 45.37 1r8q n GLY 103 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1r8q s GLU 104 N -3.95 3.65 -1.03 1.61 2.12 -1.26 -1.75 118.70 118.09 1r8q s GLU 104 Ca 0.00 1.60 0.00 0.00 0.36 0.00 0.00 54.97 56.93 1r8q s GLU 104 Cb 0.00 -4.09 0.00 0.00 0.26 0.00 0.00 34.13 30.30 1r8q s GLU 104 CO 0.00 -1.47 0.00 0.41 -0.54 0.00 0.00 175.26 173.66 1r8q n GLY 105 N 4.91 1.11 3.72 -1.50 0.00 -1.26 -4.98 105.19 107.18 1r8q n GLY 105 Ca 0.20 -0.44 -0.35 0.00 0.00 0.00 0.00 46.02 45.42 1r8q n GLY 105 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r8q s LEU 106 N -2.20 3.89 -0.17 0.99 1.43 -0.72 -4.86 118.68 117.03 1r8q s LEU 106 Ca 0.00 0.21 -0.29 0.00 -1.03 0.00 0.00 54.13 53.01 1r8q s LEU 106 Cb 0.00 -1.94 -0.01 0.00 0.03 0.00 0.00 46.19 44.27 1r8q s LEU 106 CO 0.00 0.31 1.26 0.20 0.23 0.00 0.00 176.35 178.35 1r8q s ASN 107 N -0.43 6.94 0.55 2.29 0.01 -1.26 -4.38 114.94 118.66 1r8q s ASN 107 Ca 0.10 1.67 0.27 0.00 -0.71 0.00 0.00 52.86 54.18 1r8q s ASN 107 Cb -0.12 -2.54 1.47 0.00 0.41 0.00 0.00 41.25 40.47 1r8q s ASN 107 CO 0.02 -0.77 2.00 0.11 -1.51 0.00 0.00 177.10 176.95 1r8q h LYS 108 N 8.23 0.00 -0.16 -0.60 1.57 -1.91 -0.64 116.57 123.05 1r8q h LYS 108 Ca -0.26 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.52 1r8q h LYS 108 Cb 1.10 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.40 1r8q h LYS 108 CO 0.97 0.00 0.10 1.15 -0.57 0.00 0.00 179.45 181.10 1r8q h THR 109 N 0.00 1.07 -0.65 -0.16 2.02 -1.91 -1.19 112.91 112.08 1r8q h THR 109 Ca 0.21 -0.16 -0.08 0.00 0.77 0.00 0.00 66.41 67.14 1r8q h THR 109 Cb 0.92 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 68.19 1r8q h THR 109 CO -0.00 0.06 0.07 0.00 0.37 0.00 0.00 175.52 176.02 1r8q h ALA 110 N 1.03 0.87 -0.01 6.16 0.00 -1.53 -0.43 119.26 125.35 1r8q h ALA 110 Ca 0.06 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1r8q h ALA 110 Cb 0.01 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 1r8q h ALA 110 CO -0.01 0.66 0.01 0.82 0.00 0.00 0.00 179.25 180.72 1r8q h ILE 111 N 1.01 1.01 -0.87 0.00 2.04 -1.09 -1.14 117.51 118.47 1r8q h ILE 111 Ca 0.19 -0.03 0.05 0.00 1.00 0.00 0.00 64.86 66.07 1r8q h ILE 111 Cb 0.48 1.01 -0.06 0.00 -0.74 0.00 0.00 36.82 37.52 1r8q h ILE 111 CO 0.02 0.01 0.55 1.23 0.00 0.00 0.00 178.15 179.96 1r8q h GLY 112 N 0.00 1.30 0.96 5.37 0.00 -1.13 -0.61 103.07 108.96 1r8q h GLY 112 Ca 0.00 -0.41 -0.03 0.00 0.00 0.00 0.00 47.33 46.89 1r8q h GLY 112 CO -0.00 0.30 0.15 -0.55 0.00 0.00 0.00 176.54 176.45 1r8q h ASP 113 N 1.03 0.65 -0.34 0.19 3.32 -0.76 -1.86 116.42 118.64 1r8q h ASP 113 Ca 0.37 -0.19 -0.00 0.00 0.02 0.00 0.00 57.03 57.22 1r8q h ASP 113 Cb 0.11 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 1r8q h ASP 113 CO -0.15 0.67 0.20 0.22 -1.72 0.00 0.00 179.24 178.45 1r8q h TYR 114 N 0.59 0.46 0.00 4.55 3.20 -0.76 -2.68 116.97 122.33 1r8q h TYR 114 Ca 0.15 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.99 1r8q h TYR 114 Cb 0.24 -0.15 -0.00 0.00 1.54 0.00 0.00 36.73 38.36 1r8q h TYR 114 CO 0.01 0.35 -0.12 -0.07 -1.64 0.00 0.00 178.16 176.70 1r8q h LEU 115 N 0.44 0.00 -0.81 2.82 3.38 -0.97 -2.75 115.31 117.42 1r8q h LEU 115 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1r8q h LEU 115 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1r8q h LEU 115 CO -0.02 0.12 0.00 0.61 0.09 0.00 0.00 178.44 179.23 1r8q n GLY 116 N -0.54 -0.15 3.84 0.83 0.00 -0.71 -4.76 105.19 103.71 1r8q n GLY 116 Ca -0.01 -0.40 -0.32 0.00 0.00 0.00 0.00 46.02 45.29 1r8q n GLY 116 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1r8q s GLU 117 N -1.98 4.02 0.00 1.61 0.41 -1.04 -4.83 118.70 116.88 1r8q s GLU 117 Ca 0.39 0.89 0.28 0.00 -0.41 0.00 0.00 54.97 56.12 1r8q s GLU 117 Cb 0.21 -2.23 1.08 0.00 -1.78 0.00 0.00 34.13 31.40 1r8q s GLU 117 CO 0.33 -0.10 1.76 0.54 -0.49 0.00 0.00 175.26 177.30 1r8q n ARG 118 N -1.08 1.20 -1.62 1.61 1.74 -1.26 -4.30 116.66 112.96 1r8q n ARG 118 Ca 0.06 -0.62 -0.35 0.00 -0.77 0.00 0.00 57.85 56.17 1r8q n ARG 118 Cb 0.54 -1.49 0.07 0.00 -1.02 0.00 0.00 32.46 30.56 1r8q n ARG 118 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1r8q s GLU 119 N -2.22 2.43 0.23 5.56 0.41 -1.26 -4.75 118.70 119.10 1r8q s GLU 119 Ca 0.33 1.73 -0.13 0.00 -0.41 0.00 0.00 54.97 56.50 1r8q s GLU 119 Cb 0.20 -1.87 0.31 0.00 -1.78 0.00 0.00 34.13 30.99 1r8q s GLU 119 CO 0.41 -1.60 1.59 1.49 -0.49 0.00 0.00 175.26 176.66 1r8q h GLU 120 N 0.05 -0.02 -0.47 1.61 4.81 -2.00 -1.20 114.58 117.35 1r8q h GLU 120 Ca -0.48 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 58.70 1r8q h GLU 120 Cb 1.29 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.66 1r8q h GLU 120 CO 0.52 -0.01 0.09 1.25 -0.73 0.00 0.00 179.01 180.12 1r8q h LEU 121 N -0.02 0.74 -0.94 1.64 5.85 -1.97 -2.41 115.31 118.20 1r8q h LEU 121 Ca 0.36 -0.25 -0.08 0.00 0.84 0.00 0.00 57.88 58.75 1r8q h LEU 121 Cb 0.59 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 1r8q h LEU 121 CO -0.82 0.80 -0.13 0.78 -0.34 0.00 0.00 178.44 178.73 1r8q h ASN 122 N 0.65 0.62 -0.64 1.25 2.35 -1.60 0.43 115.58 118.64 1r8q h ASN 122 Ca 0.14 -0.18 -0.05 0.00 -0.55 0.00 0.00 56.30 55.67 1r8q h ASN 122 Cb 0.37 -0.17 -0.03 0.00 0.05 0.00 0.00 38.32 38.54 1r8q h ASN 122 CO 0.01 0.78 0.22 -0.07 -1.65 0.00 0.00 177.43 176.72 1r8q h LEU 123 N 0.58 0.93 -0.56 1.61 3.38 -1.02 0.22 115.31 120.46 1r8q h LEU 123 Ca 0.10 -0.15 -0.16 0.00 0.09 0.00 0.00 57.88 57.76 1r8q h LEU 123 Cb 0.56 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 1r8q h LEU 123 CO 0.03 0.86 -0.70 0.00 0.09 0.00 0.00 178.44 178.73 1r8q h ALA 124 N 1.27 0.78 -0.20 1.53 0.00 -0.84 -2.03 119.26 119.77 1r8q h ALA 124 Ca 0.22 -0.62 -0.08 0.00 0.00 0.00 0.00 54.91 54.43 1r8q h ALA 124 Cb 0.25 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1r8q h ALA 124 CO -0.01 0.82 -0.20 0.28 0.00 0.00 0.00 179.25 180.14 1r8q h VAL 125 N 0.09 1.33 -0.32 0.00 2.07 -0.58 -1.77 116.25 117.07 1r8q h VAL 125 Ca -0.02 -1.36 0.05 0.00 0.82 0.00 0.00 66.70 66.19 1r8q h VAL 125 Cb 1.24 1.77 -0.05 0.00 -1.52 0.00 0.00 31.29 32.73 1r8q h VAL 125 CO 0.10 0.41 0.02 0.25 0.02 0.00 0.00 177.57 178.38 1r8q h LEU 126 N 0.15 -0.08 -0.47 2.57 5.85 -0.82 0.28 115.31 122.79 1r8q h LEU 126 Ca 0.03 0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.83 1r8q h LEU 126 Cb 0.74 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.86 1r8q h LEU 126 CO 0.05 -0.00 0.30 -0.74 -0.34 0.00 0.00 178.44 177.71 1r8q h HIS 127 N 0.12 0.57 -0.23 1.25 2.76 -1.24 -0.77 115.15 117.62 1r8q h HIS 127 Ca 0.15 0.01 -0.10 0.00 -2.20 0.00 0.00 60.37 58.24 1r8q h HIS 127 Cb 0.19 -0.19 -0.01 0.00 1.55 0.00 0.00 27.41 28.95 1r8q h HIS 127 CO -0.21 0.35 -0.27 0.00 -1.30 0.00 0.00 177.93 176.50 1r8q h ALA 128 N 1.19 1.11 -0.39 5.26 0.00 -0.82 -2.09 119.26 123.52 1r8q h ALA 128 Ca 0.18 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 1r8q h ALA 128 Cb -0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1r8q h ALA 128 CO -0.06 0.55 -0.01 0.35 0.00 0.00 0.00 179.25 180.09 1r8q h PHE 129 N 0.39 0.76 -0.71 0.00 3.57 -0.04 -2.72 116.94 118.19 1r8q h PHE 129 Ca 0.06 -0.14 -0.02 0.00 3.53 0.00 0.00 57.97 61.40 1r8q h PHE 129 Cb 0.68 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 39.19 1r8q h PHE 129 CO 0.02 0.78 0.35 0.28 -2.23 0.00 0.00 178.31 177.51 1r8q h VAL 130 N 0.52 1.23 0.00 1.41 2.07 -1.02 -2.16 116.25 118.30 1r8q h VAL 130 Ca 0.11 -0.63 -0.00 0.00 0.82 0.00 0.00 66.70 67.00 1r8q h VAL 130 Cb 0.48 0.31 -0.00 0.00 -1.52 0.00 0.00 31.29 30.56 1r8q h VAL 130 CO 0.02 0.27 -0.00 0.44 0.02 0.00 0.00 177.57 178.32 1r8q h ASP 131 N 1.01 0.00 1.31 0.57 3.32 -1.08 -2.30 116.42 119.25 1r8q h ASP 131 Ca 0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.30 1r8q h ASP 131 Cb 0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.65 1r8q h ASP 131 CO -0.03 0.00 0.00 -0.07 -1.72 0.00 0.00 179.24 177.42 1r8q h LEU 132 N 0.00 0.00 -9.83 1.55 3.38 -1.11 -3.45 115.31 105.85 1r8q h LEU 132 Ca -0.00 0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.48 1r8q h LEU 132 Cb 0.25 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1r8q h LEU 132 CO 0.00 0.00 0.27 -1.00 0.09 0.00 0.00 178.44 177.80 1r8q s HIS 133 N -3.20 3.77 -0.20 1.13 3.76 -0.87 -5.05 115.29 114.63 1r8q s HIS 133 Ca 0.08 1.71 -0.02 0.00 -0.15 0.00 0.00 55.06 56.68 1r8q s HIS 133 Cb 0.11 -2.85 0.01 0.00 1.11 0.00 0.00 32.58 30.95 1r8q s HIS 133 CO 0.55 0.33 -0.12 -1.21 -0.85 0.00 0.00 174.74 173.44 1r8q s GLU 134 N -1.75 3.19 0.00 1.40 0.41 -1.26 -4.97 118.70 115.72 1r8q s GLU 134 Ca 0.45 -0.73 0.10 0.00 -0.41 0.00 0.00 54.97 54.39 1r8q s GLU 134 Cb -0.20 -2.81 0.23 0.00 -1.78 0.00 0.00 34.13 29.58 1r8q s GLU 134 CO 0.25 -0.21 1.13 1.19 -0.49 0.00 0.00 175.26 177.13 1r8q n PHE 135 N 4.71 0.32 -1.70 1.61 3.72 -1.26 -5.04 117.46 119.81 1r8q n PHE 135 Ca -0.19 -0.36 -0.43 0.00 -0.05 0.00 0.00 57.45 56.42 1r8q n PHE 135 Cb 0.50 -0.02 -0.02 0.00 -0.94 0.00 0.00 39.48 39.01 1r8q n PHE 135 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1r8q n THR 136 N 0.51 1.42 -1.83 4.37 -1.04 -1.26 -2.19 114.28 114.25 1r8q n THR 136 Ca 0.10 -0.35 -0.21 0.00 -2.04 0.00 0.00 64.05 61.55 1r8q n THR 136 Cb 0.38 -1.65 -0.07 0.00 -1.82 0.00 0.00 70.33 67.17 1r8q n THR 136 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1r8q n ASP 137 N 1.54 -5.60 -4.77 8.00 8.00 -1.26 -5.01 116.55 117.45 1r8q n ASP 137 Ca 0.08 0.35 -0.33 0.00 0.71 0.00 0.00 54.79 55.60 1r8q n ASP 137 Cb 0.35 -4.82 -0.07 0.00 -0.02 0.00 0.00 41.12 36.55 1r8q n ASP 137 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1r8q s LEU 138 N -5.06 3.86 0.89 0.64 1.43 -0.93 -5.11 118.68 114.40 1r8q s LEU 138 Ca 0.00 0.16 -0.12 0.00 -1.03 0.00 0.00 54.13 53.14 1r8q s LEU 138 Cb 0.00 -2.18 0.13 0.00 0.03 0.00 0.00 46.19 44.17 1r8q s LEU 138 CO 0.00 0.30 1.15 0.54 0.23 0.00 0.00 176.35 178.56 1r8q s ASN 139 N -1.56 3.68 0.21 2.29 2.20 -1.26 -4.79 114.94 115.70 1r8q s ASN 139 Ca 0.21 0.91 -0.10 0.00 -0.94 0.00 0.00 52.86 52.94 1r8q s ASN 139 Cb -0.12 -1.46 0.16 0.00 -2.00 0.00 0.00 41.25 37.83 1r8q s ASN 139 CO 0.11 -2.44 1.87 0.25 -2.94 0.00 0.00 177.10 173.95 1r8q h LEU 140 N -1.42 0.81 -0.63 3.54 5.85 -1.99 -0.71 115.31 120.75 1r8q h LEU 140 Ca -0.49 -0.02 -0.13 0.00 0.84 0.00 0.00 57.88 58.08 1r8q h LEU 140 Cb 1.33 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 42.16 1r8q h LEU 140 CO 0.62 0.58 -0.34 0.58 -0.34 0.00 0.00 178.44 179.54 1r8q h VAL 141 N 0.95 1.28 -0.55 1.05 2.07 -1.97 -0.62 116.25 118.46 1r8q h VAL 141 Ca 0.27 -1.49 -0.09 0.00 0.82 0.00 0.00 66.70 66.22 1r8q h VAL 141 Cb -0.07 1.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 1r8q h VAL 141 CO -0.07 0.48 -0.01 1.56 0.02 0.00 0.00 177.57 179.55 1r8q h GLN 142 N 0.59 0.96 -0.36 1.57 4.20 -1.77 0.34 115.11 120.64 1r8q h GLN 142 Ca 0.06 -0.29 -0.12 0.00 0.06 0.00 0.00 58.65 58.36 1r8q h GLN 142 Cb 0.86 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.54 1r8q h GLN 142 CO 0.07 0.96 -0.24 0.00 -0.67 0.00 0.00 178.83 178.95 1r8q h ALA 143 N 1.09 0.52 -0.58 3.87 0.00 -1.00 -1.66 119.26 121.51 1r8q h ALA 143 Ca 0.16 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1r8q h ALA 143 Cb 0.53 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1r8q h ALA 143 CO 0.03 0.51 0.25 -0.07 0.00 0.00 0.00 179.25 179.97 1r8q h LEU 144 N 0.60 0.75 -0.52 0.00 3.38 -0.80 -0.71 115.31 118.01 1r8q h LEU 144 Ca 0.07 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 1r8q h LEU 144 Cb 0.81 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 1r8q h LEU 144 CO 0.07 0.66 -0.02 0.03 0.09 0.00 0.00 178.44 179.27 1r8q h ARG 145 N 0.82 0.93 -0.35 1.13 3.08 -0.63 0.31 114.38 119.66 1r8q h ARG 145 Ca 0.20 -0.30 0.00 0.00 0.07 0.00 0.00 59.98 59.95 1r8q h ARG 145 Cb 0.13 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 1r8q h ARG 145 CO -0.02 0.96 0.23 0.37 -1.07 0.00 0.00 179.97 180.44 1r8q h GLN 146 N 0.80 0.46 0.16 0.04 4.15 -0.93 -1.99 115.11 117.80 1r8q h GLN 146 Ca 0.15 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.53 1r8q h GLN 146 Cb 0.55 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.14 1r8q h GLN 146 CO 0.03 0.31 -0.08 0.35 -1.93 0.00 0.00 178.83 177.51 1r8q h PHE 147 N 0.48 -0.20 0.00 3.99 3.57 -0.85 -2.68 116.94 121.25 1r8q h PHE 147 Ca 0.13 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.62 1r8q h PHE 147 Cb -0.05 0.07 0.00 0.00 2.79 0.00 0.00 35.95 38.76 1r8q h PHE 147 CO -0.05 -0.10 0.00 1.28 -2.23 0.00 0.00 178.31 177.21 1r8q n LEU 148 N -5.17 0.00 0.16 0.59 4.77 0.07 -1.91 117.00 115.52 1r8q n LEU 148 Ca -0.09 0.19 0.09 0.00 -0.03 0.00 0.00 56.01 56.18 1r8q n LEU 148 Cb 0.12 -0.19 0.08 0.00 -2.33 0.00 0.00 43.42 41.10 1r8q n LEU 148 CO 0.34 -0.08 0.48 -0.25 -1.33 0.00 0.00 177.39 176.56 1r8q h TRP 149 N 0.00 0.00 0.00 -1.77 2.91 -1.00 -3.36 115.95 112.73 1r8q h TRP 149 Ca 0.00 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.02 1r8q h TRP 149 Cb 0.11 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 28.76 1r8q h TRP 149 CO 0.00 0.13 -0.47 -1.13 -1.03 0.00 0.00 178.44 175.94 1r8q n SER 150 N -3.01 0.65 -3.47 2.65 3.41 -0.80 -4.69 113.62 108.36 1r8q n SER 150 Ca 0.02 0.17 -0.12 0.00 -0.26 0.00 0.00 58.87 58.68 1r8q n SER 150 Cb 0.59 -0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.50 1r8q n SER 150 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1r8q s PHE 151 N -3.12 -0.47 -0.23 7.33 -0.12 -1.26 -4.91 117.98 115.19 1r8q s PHE 151 Ca 0.08 0.27 -0.21 0.00 -0.05 0.00 0.00 56.93 57.02 1r8q s PHE 151 Cb 0.14 0.49 -0.02 0.00 -0.63 0.00 0.00 43.02 43.00 1r8q s PHE 151 CO 0.69 -0.81 0.65 0.50 -0.05 0.00 0.00 175.22 176.20 1r8q s ARG 152 N -3.65 4.16 0.18 1.99 3.52 -0.60 -4.74 118.95 119.81 1r8q s ARG 152 Ca 0.01 0.62 -0.32 0.00 -0.13 0.00 0.00 55.73 55.91 1r8q s ARG 152 Cb -0.00 -3.62 -0.11 0.00 -1.56 0.00 0.00 34.95 29.66 1r8q s ARG 152 CO -0.12 -0.36 1.62 -1.17 -0.81 0.00 0.00 175.30 174.46 1r8q s LEU 153 N 2.33 4.37 0.88 -0.88 2.96 -1.26 -4.29 118.68 122.79 1r8q s LEU 153 Ca 0.28 2.70 -0.11 0.00 -0.22 0.00 0.00 54.13 56.78 1r8q s LEU 153 Cb -0.16 -3.60 0.12 0.00 0.50 0.00 0.00 46.19 43.06 1r8q s LEU 153 CO 0.09 -0.87 1.10 -2.84 -1.32 0.00 0.00 176.35 172.51 1r8q s PRO 154 N 1.14 1.32 0.00 0.98 0.02 -1.26 -4.97 135.00 132.23 1r8q s PRO 154 Ca 0.71 1.15 0.23 0.00 0.02 0.00 0.00 61.00 63.12 1r8q s PRO 154 Cb -0.46 -1.79 0.09 0.00 0.02 0.00 0.00 34.50 32.37 1r8q s PRO 154 CO 0.32 -2.29 1.17 0.41 -0.33 0.00 0.00 177.00 176.28 1r8q n GLY 155 N -0.59 0.41 3.74 0.52 0.00 -1.26 -4.70 105.19 103.32 1r8q n GLY 155 Ca 0.09 -0.66 -0.39 0.00 0.00 0.00 0.00 46.02 45.06 1r8q n GLY 155 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1r8q s GLU 156 N -2.28 4.33 0.32 1.61 8.01 -1.26 -4.98 118.70 124.45 1r8q s GLU 156 Ca 0.23 0.64 0.03 0.00 0.01 0.00 0.00 54.97 55.87 1r8q s GLU 156 Cb 0.19 -3.40 0.61 0.00 -4.31 0.00 0.00 34.13 27.22 1r8q s GLU 156 CO 0.46 0.24 1.91 0.00 0.01 0.00 0.00 175.26 177.88 1r8q h ALA 157 N 6.26 1.59 -0.29 5.21 0.00 -1.99 -1.84 119.26 128.20 1r8q h ALA 157 Ca -0.43 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 1r8q h ALA 157 Cb 1.19 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 1r8q h ALA 157 CO 0.73 0.25 0.10 -0.56 0.00 0.00 0.00 179.25 179.77 1r8q h GLN 158 N 0.93 0.40 0.01 0.00 -0.00 -1.99 0.16 115.11 114.61 1r8q h GLN 158 Ca 0.39 -0.05 -0.06 0.00 -0.00 0.00 0.00 58.65 58.93 1r8q h GLN 158 Cb 0.30 -0.08 0.01 0.00 -0.00 0.00 0.00 27.48 27.71 1r8q h GLN 158 CO -0.15 0.36 -0.25 0.87 -0.00 0.00 0.00 178.83 179.65 1r8q h LYS 159 N 0.40 0.15 -0.87 0.06 1.57 -1.69 -2.81 116.57 113.39 1r8q h LYS 159 Ca 0.10 -0.18 0.05 0.00 -1.87 0.00 0.00 60.65 58.76 1r8q h LYS 159 Cb 0.12 0.05 -0.06 0.00 0.08 0.00 0.00 32.23 32.42 1r8q h LYS 159 CO -0.01 0.94 0.55 0.82 -0.57 0.00 0.00 179.45 181.18 1r8q h ILE 160 N -0.56 1.08 -0.13 1.86 2.04 -1.08 -0.31 117.51 120.41 1r8q h ILE 160 Ca -0.03 -0.35 -0.00 0.00 1.00 0.00 0.00 64.86 65.47 1r8q h ILE 160 Cb 1.03 -0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 1r8q h ILE 160 CO 0.05 0.19 0.07 -0.78 0.00 0.00 0.00 178.15 177.67 1r8q h ASP 161 N 1.02 0.16 -0.69 1.72 3.58 -0.74 -0.02 116.42 121.45 1r8q h ASP 161 Ca 0.37 -0.09 -0.07 0.00 0.42 0.00 0.00 57.03 57.66 1r8q h ASP 161 Cb 0.12 -0.04 -0.03 0.00 1.72 0.00 0.00 39.33 41.10 1r8q h ASP 161 CO -0.15 0.20 0.15 0.03 -2.88 0.00 0.00 179.24 176.58 1r8q h ARG 162 N 0.10 1.11 -0.68 0.28 3.08 -1.22 -0.93 114.38 116.13 1r8q h ARG 162 Ca 0.04 -0.28 -0.06 0.00 0.07 0.00 0.00 59.98 59.76 1r8q h ARG 162 Cb 0.08 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 29.96 1r8q h ARG 162 CO -0.01 1.00 0.20 0.52 -1.07 0.00 0.00 179.97 180.61 1r8q h MET 163 N 1.04 1.05 0.01 0.04 2.86 -0.87 -2.02 114.93 117.04 1r8q h MET 163 Ca 0.21 -0.22 -0.19 0.00 -2.06 0.00 0.00 59.70 57.44 1r8q h MET 163 Cb 0.40 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.88 1r8q h MET 163 CO 0.01 0.91 -0.89 0.52 1.06 0.00 0.00 176.91 178.51 1r8q h MET 164 N 1.01 0.06 -0.39 1.72 2.86 -0.72 -0.93 114.93 118.53 1r8q h MET 164 Ca 0.22 -0.07 -0.10 0.00 -2.06 0.00 0.00 59.70 57.69 1r8q h MET 164 Cb 0.31 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.97 1r8q h MET 164 CO -0.01 0.91 -0.15 1.49 1.06 0.00 0.00 176.91 180.22 1r8q h GLU 165 N 0.03 0.72 -0.18 1.72 4.81 -1.02 -1.08 114.58 119.57 1r8q h GLU 165 Ca -0.02 -0.25 -0.19 0.00 -0.13 0.00 0.00 59.36 58.77 1r8q h GLU 165 Cb 1.55 -0.06 0.01 0.00 0.63 0.00 0.00 28.75 30.89 1r8q h GLU 165 CO 0.12 0.83 -0.61 0.00 -0.73 0.00 0.00 179.01 178.63 1r8q h ALA 166 N 1.19 0.32 -0.50 2.92 0.00 -1.17 -2.56 119.26 119.46 1r8q h ALA 166 Ca 0.11 -0.54 0.05 0.00 0.00 0.00 0.00 54.91 54.53 1r8q h ALA 166 Cb 0.62 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 1r8q h ALA 166 CO 0.04 0.58 0.23 0.35 0.00 0.00 0.00 179.25 180.45 1r8q h PHE 167 N 0.45 0.42 -0.36 0.00 3.57 -1.14 -2.83 116.94 117.05 1r8q h PHE 167 Ca -0.02 0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.36 1r8q h PHE 167 Cb 1.23 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.85 1r8q h PHE 167 CO 0.09 0.19 -0.31 0.00 -2.23 0.00 0.00 178.31 176.05 1r8q h ALA 168 N 1.29 0.78 -0.57 2.41 0.00 -0.92 0.13 119.26 122.38 1r8q h ALA 168 Ca 0.23 -0.41 0.05 0.00 0.00 0.00 0.00 54.91 54.77 1r8q h ALA 168 Cb 0.17 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 1r8q h ALA 168 CO -0.18 0.65 0.30 1.96 0.00 0.00 0.00 179.25 181.98 1r8q h GLN 169 N 0.66 0.56 -0.26 0.00 4.20 -1.34 -0.58 115.11 118.34 1r8q h GLN 169 Ca 0.07 -0.03 -0.09 0.00 0.06 0.00 0.00 58.65 58.66 1r8q h GLN 169 Cb 0.85 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.50 1r8q h GLN 169 CO 0.07 0.37 -0.19 -0.09 -0.67 0.00 0.00 178.83 178.32 1r8q h ARG 170 N 0.58 0.60 -0.65 1.46 9.65 -1.16 -2.37 114.38 122.48 1r8q h ARG 170 Ca 0.25 -0.29 0.03 0.00 -1.10 0.00 0.00 59.98 58.87 1r8q h ARG 170 Cb 0.14 -0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 28.68 1r8q h ARG 170 CO -0.16 0.88 0.40 -0.92 2.80 0.00 0.00 179.97 182.97 1r8q h TYR 171 N 0.32 0.75 -0.31 2.20 3.20 -0.48 -0.59 116.97 122.07 1r8q h TYR 171 Ca 0.05 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.85 1r8q h TYR 171 Cb 0.73 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.74 1r8q h TYR 171 CO 0.07 0.42 -0.18 0.00 -1.64 0.00 0.00 178.16 176.83 1r8q h LEU 173 N 0.50 0.68 -0.46 0.00 5.85 -0.84 -2.78 115.31 118.26 1r8q h LEU 173 Ca 0.08 -0.32 -0.11 0.00 0.84 0.00 0.00 57.88 58.37 1r8q h LEU 173 Cb 0.60 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 1r8q h LEU 173 CO 0.04 1.03 -0.53 0.00 -0.34 0.00 0.00 178.44 178.65 1r8q n ASN 175 N -3.42 1.76 -4.75 0.00 4.13 -0.16 -4.45 115.26 108.38 1r8q n ASN 175 Ca 0.01 -3.06 -0.37 0.00 1.68 0.00 0.00 54.58 52.83 1r8q n ASN 175 Cb 0.66 -0.64 0.05 0.00 -1.54 0.00 0.00 39.78 38.30 1r8q n ASN 175 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1r8q s PRO 176 N -1.99 2.97 0.00 3.52 0.04 -1.07 -2.86 135.00 135.61 1r8q s PRO 176 Ca 0.39 2.09 0.00 0.00 0.04 0.00 0.00 61.00 63.52 1r8q s PRO 176 Cb 0.20 -2.09 0.00 0.00 0.04 0.00 0.00 34.50 32.65 1r8q s PRO 176 CO -0.08 -1.28 0.00 0.41 0.04 0.00 0.00 177.00 176.09 1r8q n GLY 177 N 0.73 1.97 0.22 0.56 0.00 -1.26 -4.85 105.19 102.56 1r8q n GLY 177 Ca 0.12 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.97 1r8q n GLY 177 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1r8q h VAL 178 N 0.00 1.28 -4.24 1.61 2.07 -1.89 -3.45 116.25 111.63 1r8q h VAL 178 Ca 0.00 -2.03 -0.66 0.00 0.82 0.00 0.00 66.70 64.82 1r8q h VAL 178 Cb 0.00 2.06 -0.26 0.00 -1.52 0.00 0.00 31.29 31.58 1r8q h VAL 178 CO 0.00 0.64 -0.87 -0.36 0.02 0.00 0.00 177.57 177.00 1r8q s PHE 179 N -3.66 2.17 -0.07 1.57 0.08 -1.26 -5.05 117.98 111.76 1r8q s PHE 179 Ca -0.10 -0.40 0.23 0.00 0.12 0.00 0.00 56.93 56.78 1r8q s PHE 179 Cb 0.08 -1.29 0.65 0.00 -0.57 0.00 0.00 43.02 41.89 1r8q s PHE 179 CO 0.91 0.13 1.71 1.96 -0.10 0.00 0.00 175.22 179.83 1r8q h GLN 180 N 4.74 0.00 -3.16 0.44 4.20 -1.97 -3.45 115.11 115.91 1r8q h GLN 180 Ca -0.46 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.16 1r8q h GLN 180 Cb 1.15 0.00 -0.18 0.00 0.30 0.00 0.00 27.48 28.75 1r8q h GLN 180 CO 0.43 0.20 -0.22 -1.54 -0.67 0.00 0.00 178.83 177.03 1r8q s SER 181 N -6.18 -0.18 0.40 1.46 1.04 -1.26 -5.02 113.70 103.95 1r8q s SER 181 Ca 0.03 -0.07 0.12 0.00 0.48 0.00 0.00 55.95 56.51 1r8q s SER 181 Cb 0.08 0.36 0.81 0.00 0.10 0.00 0.00 66.02 67.38 1r8q s SER 181 CO 0.66 -0.58 1.90 0.71 0.98 0.00 0.00 173.24 176.91 1r8q h THR 182 N 3.35 1.20 -0.50 2.02 1.35 -1.93 -2.90 112.91 115.51 1r8q h THR 182 Ca -0.31 -0.93 0.00 0.00 -0.55 0.00 0.00 66.41 64.62 1r8q h THR 182 Cb 1.19 1.43 -0.02 0.00 -1.73 0.00 0.00 68.15 69.02 1r8q h THR 182 CO 0.44 0.27 0.32 0.44 -0.25 0.00 0.00 175.52 176.74 1r8q h ASP 183 N 0.08 0.59 -0.54 5.36 3.32 -1.95 0.20 116.42 123.48 1r8q h ASP 183 Ca 0.01 -0.04 0.06 0.00 0.02 0.00 0.00 57.03 57.09 1r8q h ASP 183 Cb 0.47 -0.15 -0.05 0.00 0.22 0.00 0.00 39.33 39.82 1r8q h ASP 183 CO 0.03 0.45 0.24 0.74 -1.72 0.00 0.00 179.24 178.99 1r8q h THR 184 N 0.68 0.89 -0.18 0.35 2.02 -1.67 -0.58 112.91 114.42 1r8q h THR 184 Ca 0.18 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 67.20 1r8q h THR 184 Cb -0.04 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 66.74 1r8q h THR 184 CO -0.04 0.09 0.10 0.00 0.37 0.00 0.00 175.52 176.04 1r8q h TYR 186 N 0.19 0.32 -0.52 0.00 3.20 -0.48 -0.79 116.97 118.89 1r8q h TYR 186 Ca 0.06 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.92 1r8q h TYR 186 Cb 0.06 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.21 1r8q h TYR 186 CO -0.04 0.17 0.22 0.28 -1.64 0.00 0.00 178.16 177.15 1r8q h VAL 187 N 0.36 1.21 -0.63 1.81 2.07 -1.02 -1.25 116.25 118.80 1r8q h VAL 187 Ca 0.15 -0.64 -0.03 0.00 0.82 0.00 0.00 66.70 67.00 1r8q h VAL 187 Cb 0.05 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 30.46 1r8q h VAL 187 CO -0.10 0.25 0.29 0.25 0.02 0.00 0.00 177.57 178.28 1r8q h LEU 188 N 0.70 0.84 -0.50 2.57 5.85 -1.17 -0.66 115.31 122.95 1r8q h LEU 188 Ca 0.18 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 1r8q h LEU 188 Cb 0.18 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.97 1r8q h LEU 188 CO -0.02 0.75 0.25 0.28 -0.34 0.00 0.00 178.44 179.37 1r8q h SER 189 N 0.88 0.64 -0.77 1.25 0.02 -0.88 0.06 113.55 114.75 1r8q h SER 189 Ca 0.22 -0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 61.04 1r8q h SER 189 Cb 0.14 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.48 1r8q h SER 189 CO -0.02 0.57 0.43 0.22 -1.14 0.00 0.00 176.83 176.88 1r8q h TYR 190 N 0.66 1.06 -0.10 3.45 3.20 -1.00 -1.86 116.97 122.38 1r8q h TYR 190 Ca 0.17 -0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.96 1r8q h TYR 190 Cb 0.09 -0.34 -0.01 0.00 1.54 0.00 0.00 36.73 38.01 1r8q h TYR 190 CO -0.01 0.73 -0.24 0.66 -1.64 0.00 0.00 178.16 177.66 1r8q h SER 191 N 1.08 0.17 -0.47 -2.11 4.64 -0.18 -0.60 113.55 116.08 1r8q h SER 191 Ca 0.27 -0.05 -0.10 0.00 -0.47 0.00 0.00 61.79 61.45 1r8q h SER 191 Cb 0.02 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.05 1r8q h SER 191 CO -0.04 0.42 -0.08 0.58 -0.87 0.00 0.00 176.83 176.84 1r8q h VAL 192 N 0.16 1.27 -0.79 0.95 2.07 -0.24 0.57 116.25 120.24 1r8q h VAL 192 Ca 0.03 -1.19 -0.04 0.00 0.82 0.00 0.00 66.70 66.32 1r8q h VAL 192 Cb 0.52 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 31.33 1r8q h VAL 192 CO 0.04 0.41 0.34 0.40 0.02 0.00 0.00 177.57 178.78 1r8q h ILE 193 N 0.74 1.26 -0.41 4.57 1.08 -0.95 0.00 117.51 123.80 1r8q h ILE 193 Ca 0.12 -0.78 0.04 0.00 -0.39 0.00 0.00 64.86 63.86 1r8q h ILE 193 Cb 0.62 0.30 -0.04 0.00 -3.07 0.00 0.00 36.82 34.62 1r8q h ILE 193 CO 0.04 0.32 0.18 0.24 -0.69 0.00 0.00 178.15 178.24 1r8q h MET 194 N 1.14 0.35 -0.34 2.37 2.86 -0.80 -2.11 114.93 118.41 1r8q h MET 194 Ca 0.27 -0.02 0.03 0.00 -2.06 0.00 0.00 59.70 57.92 1r8q h MET 194 Cb 0.18 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.73 1r8q h MET 194 CO -0.03 0.23 0.14 1.25 1.06 0.00 0.00 176.91 179.56 1r8q h LEU 195 N 0.36 0.17 -0.75 1.22 5.85 -0.56 0.16 115.31 121.76 1r8q h LEU 195 Ca 0.18 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.96 1r8q h LEU 195 Cb 0.12 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.11 1r8q h LEU 195 CO -0.15 0.14 0.47 -1.13 -0.34 0.00 0.00 178.44 177.43 1r8q h ASN 196 N 0.29 0.78 -0.16 1.25 -0.73 -0.80 0.11 115.58 116.32 1r8q h ASN 196 Ca 0.15 -0.00 -0.02 0.00 1.87 0.00 0.00 56.30 58.30 1r8q h ASN 196 Cb 0.10 -0.17 -0.01 0.00 0.27 0.00 0.00 38.32 38.52 1r8q h ASN 196 CO -0.13 0.53 0.02 0.74 -0.37 0.00 0.00 177.43 178.22 1r8q h THR 197 N 0.92 1.23 -0.03 -3.57 2.02 -1.05 -1.55 112.91 110.90 1r8q h THR 197 Ca 0.30 -0.76 -0.00 0.00 0.77 0.00 0.00 66.41 66.72 1r8q h THR 197 Cb 0.03 1.42 -0.00 0.00 -1.74 0.00 0.00 68.15 67.86 1r8q h THR 197 CO -0.12 0.23 0.01 -0.78 0.37 0.00 0.00 175.52 175.23 1r8q h ASP 198 N 0.05 0.04 0.32 4.18 1.82 -0.34 -0.10 116.42 122.39 1r8q h ASP 198 Ca 0.05 -0.17 -0.07 0.00 -0.39 0.00 0.00 57.03 56.44 1r8q h ASP 198 Cb 0.33 -0.01 -0.01 0.00 0.68 0.00 0.00 39.33 40.32 1r8q h ASP 198 CO 0.01 0.20 -0.34 -0.07 -1.61 0.00 0.00 179.24 177.43 1r8q h LEU 199 N -0.13 0.02 -0.71 2.28 3.38 -0.82 -3.36 115.31 115.96 1r8q h LEU 199 Ca 0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1r8q h LEU 199 Cb 0.18 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1r8q h LEU 199 CO -0.00 0.36 0.00 1.41 0.09 0.00 0.00 178.44 180.30 1r8q n HIS 200 N -4.13 0.00 -3.20 1.13 8.25 -0.58 -4.93 115.22 111.75 1r8q n HIS 200 Ca -0.02 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.04 1r8q n HIS 200 Cb 0.38 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.42 1r8q n HIS 200 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1r8q s ASN 201 N -0.21 6.53 0.00 0.41 3.84 -0.06 -4.95 114.94 120.50 1r8q s ASN 201 Ca 0.00 0.65 0.11 0.00 0.21 0.00 0.00 52.86 53.82 1r8q s ASN 201 Cb 0.00 -2.30 0.48 0.00 -0.55 0.00 0.00 41.25 38.88 1r8q s ASN 201 CO 0.00 -0.26 1.32 -0.81 -2.79 0.00 0.00 177.10 174.56 1r8q n PRO 202 N 5.26 0.04 0.02 0.43 -0.04 -1.26 -1.45 135.00 138.00 1r8q n PRO 202 Ca -0.03 0.28 0.12 0.00 -0.04 0.00 0.00 63.50 63.83 1r8q n PRO 202 Cb 0.50 -1.50 0.50 0.00 -0.04 0.00 0.00 33.50 32.95 1r8q n PRO 202 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1r8q n ASN 203 N -1.45 0.14 -4.50 3.54 3.02 -1.26 -4.55 115.26 110.20 1r8q n ASN 203 Ca 0.03 0.52 -0.38 0.00 -0.03 0.00 0.00 54.58 54.72 1r8q n ASN 203 Cb 0.12 -0.55 -0.11 0.00 -0.61 0.00 0.00 39.78 38.62 1r8q n ASN 203 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1r8q s VAL 204 N -3.03 4.86 -0.13 2.41 1.01 -0.53 -4.98 120.40 120.02 1r8q s VAL 204 Ca 0.11 -0.19 0.07 0.00 0.00 0.00 0.00 61.98 61.97 1r8q s VAL 204 Cb 0.15 -3.41 -0.23 0.00 0.00 0.00 0.00 36.38 32.89 1r8q s VAL 204 CO 0.45 0.14 0.34 0.54 0.00 0.00 0.00 175.10 176.57 1r8q n ARG 205 N 5.02 0.68 -3.16 2.72 1.74 -1.26 -4.70 116.66 117.70 1r8q n ARG 205 Ca -0.14 0.21 -0.45 0.00 -0.77 0.00 0.00 57.85 56.70 1r8q n ARG 205 Cb 0.50 -1.68 -0.01 0.00 -1.02 0.00 0.00 32.46 30.26 1r8q n ARG 205 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1r8q s ASP 206 N -6.29 7.05 0.39 0.55 2.15 -1.26 -5.00 116.67 114.26 1r8q s ASP 206 Ca -0.15 -3.02 -0.23 0.00 0.43 0.00 0.00 52.55 49.58 1r8q s ASP 206 Cb 0.07 -2.30 -0.10 0.00 -0.30 0.00 0.00 42.92 40.30 1r8q s ASP 206 CO 0.78 -0.59 0.97 -0.54 -0.17 0.00 0.00 175.17 175.62 1r8q s LYS 207 N 0.44 4.32 0.13 4.34 1.02 -1.26 -4.95 119.74 123.77 1r8q s LYS 207 Ca 0.32 1.27 -0.31 0.00 0.02 0.00 0.00 55.97 57.27 1r8q s LYS 207 Cb -0.07 -2.44 -0.09 0.00 -0.52 0.00 0.00 37.83 34.71 1r8q s LYS 207 CO -0.06 0.04 1.49 1.41 -0.92 0.00 0.00 175.35 177.30 1r8q s MET 208 N -2.69 4.26 0.73 1.68 -2.45 -1.26 -5.03 119.30 114.55 1r8q s MET 208 Ca 0.58 2.21 -0.04 0.00 -1.25 0.00 0.00 55.69 57.19 1r8q s MET 208 Cb -0.15 -3.25 0.12 0.00 1.25 0.00 0.00 34.83 32.80 1r8q s MET 208 CO 0.19 -0.54 1.02 0.20 1.05 0.00 0.00 175.02 176.94 1r8q s GLY 209 N 1.26 1.76 0.24 2.11 0.00 -1.26 -4.94 107.32 106.49 1r8q s GLY 209 Ca 0.68 -1.48 -0.05 0.00 0.00 0.00 0.00 44.72 43.87 1r8q s GLY 209 CO 0.31 -0.95 1.81 -2.00 0.00 0.00 0.00 173.10 172.27 1r8q h LEU 210 N -0.62 0.66 -0.93 0.66 5.85 -1.99 -2.49 115.31 116.44 1r8q h LEU 210 Ca -0.39 0.05 -0.09 0.00 0.84 0.00 0.00 57.88 58.28 1r8q h LEU 210 Cb 1.27 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.21 1r8q h LEU 210 CO 0.44 0.38 -0.20 -0.33 -0.34 0.00 0.00 178.44 178.39 1r8q h GLU 211 N 0.78 0.55 -0.58 1.25 4.39 -1.99 0.86 114.58 119.83 1r8q h GLU 211 Ca 0.39 -0.19 -0.06 0.00 0.34 0.00 0.00 59.36 59.83 1r8q h GLU 211 Cb 0.35 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.93 1r8q h GLU 211 CO -0.24 0.72 0.12 0.00 -1.16 0.00 0.00 179.01 178.44 1r8q h ARG 212 N 0.49 0.91 -0.30 2.33 3.08 -1.89 0.69 114.38 119.70 1r8q h ARG 212 Ca 0.08 -0.21 -0.07 0.00 0.07 0.00 0.00 59.98 59.86 1r8q h ARG 212 Cb 0.62 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 1r8q h ARG 212 CO 0.04 0.83 -0.07 0.35 -1.07 0.00 0.00 179.97 180.06 1r8q h PHE 213 N 0.87 0.64 -0.32 3.04 3.57 -0.72 0.02 116.94 124.05 1r8q h PHE 213 Ca 0.18 -0.14 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 1r8q h PHE 213 Cb 0.35 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.92 1r8q h PHE 213 CO 0.02 0.76 0.15 0.28 -2.23 0.00 0.00 178.31 177.29 1r8q h VAL 214 N 0.34 1.16 -0.44 1.41 2.07 -0.80 -3.06 116.25 116.94 1r8q h VAL 214 Ca 0.08 -0.46 -0.03 0.00 0.82 0.00 0.00 66.70 67.10 1r8q h VAL 214 Cb 0.55 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.18 1r8q h VAL 214 CO 0.03 0.17 0.13 0.00 0.02 0.00 0.00 177.57 177.91 1r8q h ALA 215 N 1.00 1.41 0.00 1.67 0.00 -0.61 -1.13 119.26 121.59 1r8q h ALA 215 Ca 0.11 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1r8q h ALA 215 Cb 0.13 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1r8q h ALA 215 CO -0.01 0.44 -0.27 0.00 0.00 0.00 0.00 179.25 179.41 1r8q h MET 216 N 0.63 0.00 -0.02 0.00 -0.00 -0.89 -2.06 114.93 112.59 1r8q h MET 216 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.85 1r8q h MET 216 Cb 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.81 1r8q h MET 216 CO -0.01 0.27 -0.05 0.09 -0.00 0.00 0.00 176.91 177.21 1r8q n ASN 217 N -3.65 1.62 -4.68 -0.10 3.02 -0.47 -4.90 115.26 106.10 1r8q n ASN 217 Ca -0.01 -1.47 -0.46 0.00 -0.03 0.00 0.00 54.58 52.62 1r8q n ASN 217 Cb 0.39 0.03 -0.04 0.00 -0.61 0.00 0.00 39.78 39.55 1r8q n ASN 217 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1r8q n ARG 218 N 0.19 2.44 -1.50 3.52 1.74 -0.78 -2.59 116.66 119.67 1r8q n ARG 218 Ca 0.17 0.89 0.00 0.00 -0.77 0.00 0.00 57.85 58.14 1r8q n ARG 218 Cb 0.39 -2.76 0.00 0.00 -1.02 0.00 0.00 32.46 29.07 1r8q n ARG 218 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1r8q n GLY 219 N 4.25 0.74 0.57 -0.13 0.00 -1.22 -4.99 105.19 104.40 1r8q n GLY 219 Ca 0.20 -0.69 0.07 0.00 0.00 0.00 0.00 46.02 45.60 1r8q n GLY 219 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1r8q n ILE 220 N -3.28 1.60 -1.42 -0.61 -5.35 -1.07 -3.96 119.36 105.28 1r8q n ILE 220 Ca 0.00 -1.50 -0.21 0.00 -0.27 0.00 0.00 62.75 60.77 1r8q n ILE 220 Cb 0.37 0.12 0.14 0.00 -1.74 0.00 0.00 39.64 38.53 1r8q n ILE 220 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1r8q n ASN 221 N -0.26 4.50 -3.37 7.28 5.15 -0.98 -4.14 115.26 123.44 1r8q n ASN 221 Ca 0.14 -3.73 -0.23 0.00 -0.60 0.00 0.00 54.58 50.17 1r8q n ASN 221 Cb 0.61 -0.76 0.02 0.00 -0.53 0.00 0.00 39.78 39.12 1r8q n ASN 221 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1r8q n GLU 222 N -1.04 -1.25 0.00 1.20 -0.58 -1.26 -3.64 120.64 114.07 1r8q n GLU 222 Ca 0.51 1.17 0.00 0.00 -0.42 0.00 0.00 57.16 58.42 1r8q n GLU 222 Cb 1.15 -1.65 0.00 0.00 -0.57 0.00 0.00 31.44 30.37 1r8q n GLU 222 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1r8q n GLY 223 N 0.44 2.20 3.69 0.62 0.00 -1.25 -5.03 105.19 105.86 1r8q n GLY 223 Ca -0.05 -0.37 -0.33 0.00 0.00 0.00 0.00 46.02 45.27 1r8q n GLY 223 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1r8q s GLY 224 N 0.00 2.10 -0.12 -0.02 0.00 -1.24 -3.71 107.32 104.33 1r8q s GLY 224 Ca 0.00 0.82 -0.05 0.00 0.00 0.00 0.00 44.72 45.48 1r8q s GLY 224 CO 0.00 1.24 0.08 0.99 0.00 0.00 0.00 173.10 175.41 1r8q s ASP 225 N -2.21 5.89 0.65 1.64 1.01 -1.26 -2.32 116.67 120.06 1r8q s ASP 225 Ca 0.72 0.29 -0.14 0.00 0.71 0.00 0.00 52.55 54.14 1r8q s ASP 225 Cb -0.28 -1.86 -0.01 0.00 1.01 0.00 0.00 42.92 41.78 1r8q s ASP 225 CO 0.52 0.35 1.07 -0.76 0.21 0.00 0.00 175.17 176.56 1r8q s LEU 226 N -0.71 3.33 0.32 1.23 1.43 -1.26 -4.98 118.68 118.04 1r8q s LEU 226 Ca 0.12 1.77 -0.29 0.00 -1.03 0.00 0.00 54.13 54.70 1r8q s LEU 226 Cb -0.12 -4.52 -0.12 0.00 0.03 0.00 0.00 46.19 41.46 1r8q s LEU 226 CO 0.03 -1.37 1.46 -2.65 0.23 0.00 0.00 176.35 174.05 1r8q n PRO 227 N -2.53 2.44 -0.21 1.29 -0.02 -1.26 -4.88 135.00 129.82 1r8q n PRO 227 Ca 0.09 0.86 0.07 0.00 -2.02 0.00 0.00 63.50 62.50 1r8q n PRO 227 Cb 0.53 -2.56 0.34 0.00 -0.02 0.00 0.00 33.50 31.79 1r8q n PRO 227 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1r8q h GLU 228 N 3.63 0.76 -0.19 -0.52 4.81 -2.00 -2.28 114.58 118.78 1r8q h GLU 228 Ca -0.47 -0.05 -0.09 0.00 -0.13 0.00 0.00 59.36 58.62 1r8q h GLU 228 Cb 1.25 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 30.45 1r8q h GLU 228 CO 0.70 0.50 -0.27 1.49 -0.73 0.00 0.00 179.01 180.71 1r8q h GLU 229 N 0.78 0.36 -0.54 1.92 4.57 -1.99 0.09 114.58 119.79 1r8q h GLU 229 Ca 0.34 -0.13 -0.01 0.00 -1.18 0.00 0.00 59.36 58.38 1r8q h GLU 229 Cb 0.33 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.87 1r8q h GLU 229 CO -0.12 0.61 0.28 1.25 -1.18 0.00 0.00 179.01 179.84 1r8q h LEU 230 N 0.32 0.69 -0.54 1.64 6.46 -1.79 -1.15 115.31 120.94 1r8q h LEU 230 Ca 0.05 -0.11 -0.14 0.00 -0.12 0.00 0.00 57.88 57.56 1r8q h LEU 230 Cb 0.65 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 40.39 1r8q h LEU 230 CO 0.05 0.60 -0.33 -0.07 -0.62 0.00 0.00 178.44 178.07 1r8q h LEU 231 N 0.72 0.86 -0.75 2.25 3.38 -1.26 -2.52 115.31 117.99 1r8q h LEU 231 Ca 0.19 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1r8q h LEU 231 Cb 0.08 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.56 1r8q h LEU 231 CO -0.03 1.11 0.48 -0.09 0.09 0.00 0.00 178.44 180.00 1r8q h ARG 232 N 0.69 1.01 -0.32 1.13 2.43 -0.79 0.59 114.38 119.12 1r8q h ARG 232 Ca 0.07 -0.08 -0.12 0.00 -0.81 0.00 0.00 59.98 59.05 1r8q h ARG 232 Cb 0.88 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 30.20 1r8q h ARG 232 CO 0.08 0.69 -0.29 -0.91 -1.51 0.00 0.00 179.97 178.03 1r8q h ASN 233 N 1.02 0.68 -0.01 -3.80 2.35 -1.00 0.38 115.58 115.20 1r8q h ASN 233 Ca 0.27 -0.26 -0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1r8q h ASN 233 Cb -0.08 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.10 1r8q h ASN 233 CO -0.06 0.93 0.00 -0.07 -1.65 0.00 0.00 177.43 176.59 1r8q h LEU 234 N 0.56 0.02 -0.23 1.61 3.38 -1.27 -2.55 115.31 116.83 1r8q h LEU 234 Ca 0.07 -0.19 0.02 0.00 0.09 0.00 0.00 57.88 57.87 1r8q h LEU 234 Cb 0.78 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.51 1r8q h LEU 234 CO 0.06 0.21 0.08 0.22 0.09 0.00 0.00 178.44 179.10 1r8q h TYR 235 N -0.17 0.15 -0.33 1.13 3.20 -0.60 -2.38 116.97 117.97 1r8q h TYR 235 Ca 0.00 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.82 1r8q h TYR 235 Cb 0.20 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.41 1r8q h TYR 235 CO -0.01 0.08 -0.08 -0.44 -1.64 0.00 0.00 178.16 176.06 1r8q h ASP 236 N 0.20 0.54 -0.18 -2.11 3.32 -0.94 -0.79 116.42 116.46 1r8q h ASP 236 Ca 0.10 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.00 1r8q h ASP 236 Cb 0.06 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 1r8q h ASP 236 CO -0.10 0.67 0.05 -1.28 -1.72 0.00 0.00 179.24 176.86 1r8q h SER 237 N 0.52 0.26 -0.46 6.45 0.87 -1.07 -2.36 113.55 117.77 1r8q h SER 237 Ca 0.10 -0.22 -0.12 0.00 -1.23 0.00 0.00 61.79 60.33 1r8q h SER 237 Cb 0.46 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.34 1r8q h SER 237 CO 0.02 0.41 -0.16 0.40 -0.53 0.00 0.00 176.83 176.97 1r8q h ILE 238 N 0.11 1.27 -0.66 2.23 1.08 -1.26 -1.14 117.51 119.14 1r8q h ILE 238 Ca 0.06 -1.31 0.00 0.00 -0.39 0.00 0.00 64.86 63.22 1r8q h ILE 238 Cb 0.25 1.16 -0.03 0.00 -3.07 0.00 0.00 36.82 35.12 1r8q h ILE 238 CO -0.00 0.45 0.42 -0.09 -0.69 0.00 0.00 178.15 178.23 1r8q h ARG 239 N 0.76 0.88 0.00 2.37 2.43 -1.04 -2.92 114.38 116.85 1r8q h ARG 239 Ca 0.11 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1r8q h ARG 239 Cb 0.73 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 1r8q h ARG 239 CO 0.06 0.60 -0.63 -0.91 -1.51 0.00 0.00 179.97 177.58 1r8q h ASN 240 N 0.89 0.00 -2.47 -3.80 2.35 -1.42 -3.42 115.58 107.71 1r8q h ASN 240 Ca 0.24 -0.07 -0.45 0.00 -0.55 0.00 0.00 56.30 55.47 1r8q h ASN 240 Cb -0.07 0.00 -0.37 0.00 0.05 0.00 0.00 38.32 37.93 1r8q h ASN 240 CO -0.05 0.03 -0.73 -0.70 -1.65 0.00 0.00 177.43 174.34 1r8q s GLU 241 N -3.25 0.32 0.84 0.81 2.12 -0.44 -5.10 118.70 113.99 1r8q s GLU 241 Ca 0.04 -0.52 -0.13 0.00 0.36 0.00 0.00 54.97 54.72 1r8q s GLU 241 Cb 0.10 -0.96 0.08 0.00 0.26 0.00 0.00 34.13 33.60 1r8q s GLU 241 CO 0.73 -1.06 1.03 -2.30 -0.54 0.00 0.00 175.26 173.13 1r8q n PRO 242 N 5.04 0.02 -1.67 4.30 -0.02 -1.22 -4.37 135.00 137.08 1r8q n PRO 242 Ca -0.01 0.08 -0.47 0.00 -2.02 0.00 0.00 63.50 61.08 1r8q n PRO 242 Cb 0.43 -2.30 -0.04 0.00 -0.02 0.00 0.00 33.50 31.57 1r8q n PRO 242 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1r8q n PHE 243 N -3.42 2.25 -2.84 6.00 3.72 -1.26 -4.92 117.46 117.00 1r8q n PHE 243 Ca 0.12 0.24 -0.34 0.00 -0.05 0.00 0.00 57.45 57.43 1r8q n PHE 243 Cb 0.51 -2.55 -0.07 0.00 -0.94 0.00 0.00 39.48 36.43 1r8q n PHE 243 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1r8q s LYS 244 N 1.40 4.27 0.01 -1.08 2.20 -1.26 -4.98 119.74 120.29 1r8q s LYS 244 Ca 0.81 1.12 -0.30 0.00 -0.36 0.00 0.00 55.97 57.24 1r8q s LYS 244 Cb -0.69 -2.30 -0.06 0.00 -1.51 0.00 0.00 37.83 33.27 1r8q s LYS 244 CO 0.40 0.03 1.55 0.42 -0.36 0.00 0.00 175.35 177.40 1r8q s ILE 245 N -2.08 3.43 0.20 5.43 -1.09 -1.26 -4.90 121.20 120.94 1r8q s ILE 245 Ca 0.59 0.78 -0.31 0.00 -2.23 0.00 0.00 60.65 59.49 1r8q s ILE 245 Cb -0.11 -3.50 -0.10 0.00 -1.58 0.00 0.00 42.46 37.17 1r8q s ILE 245 CO 0.15 -0.02 1.46 -2.84 -1.23 0.00 0.00 174.94 172.46 1r8q s PRO 246 N 2.88 4.27 -0.05 2.79 0.02 -1.26 -4.98 135.00 138.66 1r8q s PRO 246 Ca 0.70 2.27 -0.16 0.00 0.02 0.00 0.00 61.00 63.82 1r8q s PRO 246 Cb -0.35 -3.15 -0.05 0.00 0.02 0.00 0.00 34.50 30.97 1r8q s PRO 246 CO 0.29 -0.47 0.44 -1.21 -0.33 0.00 0.00 177.00 175.73 1r8q s GLU 247 N 0.29 4.14 0.29 5.54 0.41 -1.26 -4.91 118.70 123.20 1r8q s GLU 247 Ca 0.63 0.43 -0.30 0.00 -0.41 0.00 0.00 54.97 55.32 1r8q s GLU 247 Cb -0.41 -3.33 -0.11 0.00 -1.78 0.00 0.00 34.13 28.50 1r8q s GLU 247 CO 0.38 0.43 1.56 -0.51 -0.49 0.00 0.00 175.26 176.63 1r8q s ASP 248 N -0.26 6.41 0.00 -0.19 1.01 -1.26 -4.97 116.67 117.41 1r8q s ASP 248 Ca 0.24 2.92 0.00 0.00 0.71 0.00 0.00 52.55 56.43 1r8q s ASP 248 Cb -0.16 -2.64 0.00 0.00 1.01 0.00 0.00 42.92 41.13 1r8q s ASP 248 CO 0.12 -0.88 0.00 0.47 0.21 0.00 0.00 175.17 175.09