#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yhq s GLU 96 N 0.00 1.61 -0.05 -2.82 -1.05 -0.23 -4.92 118.70 111.25 1yhq s GLU 96 Ca 0.00 -1.89 -0.16 0.00 -0.15 0.00 0.00 54.97 52.77 1yhq s GLU 96 Cb 0.00 -0.77 -0.05 0.00 -0.44 0.00 0.00 34.13 32.87 1yhq s GLU 96 CO 0.00 -0.20 0.45 -0.51 0.95 0.00 0.00 175.26 175.94 1yhq s LEU 97 N -3.46 4.39 -0.04 1.83 1.43 -1.26 0.15 118.68 121.72 1yhq s LEU 97 Ca 0.37 0.91 -0.04 0.00 -1.03 0.00 0.00 54.13 54.34 1yhq s LEU 97 Cb 0.09 -2.65 0.01 0.00 0.03 0.00 0.00 46.19 43.67 1yhq s LEU 97 CO 0.15 0.18 0.11 -1.10 0.23 0.00 0.00 176.35 175.93 1yhq s GLN 98 N -0.35 0.16 0.23 1.70 -0.21 -0.26 -4.93 119.66 116.01 1yhq s GLN 98 Ca 0.25 0.10 -0.24 0.00 0.02 0.00 0.00 55.36 55.49 1yhq s GLN 98 Cb -0.16 0.08 -0.09 0.00 1.00 0.00 0.00 33.01 33.84 1yhq s GLN 98 CO 0.12 -0.02 0.82 0.00 -2.12 0.00 0.00 175.29 174.09 1yhq s ALA 99 N -0.07 3.37 0.68 6.09 0.00 -1.26 -1.44 121.76 129.13 1yhq s ALA 99 Ca -0.01 0.37 -0.13 0.00 0.00 0.00 0.00 51.96 52.19 1yhq s ALA 99 Cb -0.01 -3.00 0.01 0.00 0.00 0.00 0.00 23.12 20.12 1yhq s ALA 99 CO 0.00 0.27 1.08 1.03 0.00 0.00 0.00 175.76 178.14 1yhq s ARG 100 N -1.63 2.81 0.00 0.00 0.52 -0.45 -4.88 118.95 115.31 1yhq s ARG 100 Ca 0.42 1.18 0.00 0.00 -0.52 0.00 0.00 55.73 56.81 1yhq s ARG 100 Cb -0.20 -1.96 0.00 0.00 0.52 0.00 0.00 34.95 33.30 1yhq s ARG 100 CO 0.25 -1.22 0.00 0.41 0.02 0.00 0.00 175.30 174.76 1yhq n GLY 101 N -1.18 -1.28 2.53 -3.53 0.00 -1.26 -4.56 105.19 95.91 1yhq n GLY 101 Ca 0.09 -1.58 -0.40 0.00 0.00 0.00 0.00 46.02 44.14 1yhq n GLY 101 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yhq n LEU 102 N -1.31 7.64 -0.17 0.99 4.77 -1.26 -4.76 117.00 122.90 1yhq n LEU 102 Ca 0.00 -4.15 0.10 0.00 -0.03 0.00 0.00 56.01 51.93 1yhq n LEU 102 Cb 0.00 -1.56 0.42 0.00 -2.33 0.00 0.00 43.42 39.95 1yhq n LEU 102 CO 0.00 1.52 1.21 0.74 -1.33 0.00 0.00 177.39 179.53 1yhq h THR 103 N 3.49 0.92 -0.01 -5.08 2.02 -1.90 -2.53 112.91 109.82 1yhq h THR 103 Ca 0.72 -0.21 0.00 0.00 0.77 0.00 0.00 66.41 67.69 1yhq h THR 103 Cb 0.44 0.26 0.00 0.00 -1.74 0.00 0.00 68.15 67.11 1yhq h THR 103 CO 1.82 0.11 -0.18 -0.62 0.37 0.00 0.00 175.52 177.02 1yhq n GLU 104 N -4.49 0.74 -1.77 6.66 -0.58 -1.26 -4.94 120.64 114.99 1yhq n GLU 104 Ca 0.12 -0.35 -0.41 0.00 -0.42 0.00 0.00 57.16 56.10 1yhq n GLU 104 Cb 0.36 -1.49 -0.01 0.00 -0.57 0.00 0.00 31.44 29.73 1yhq n GLU 104 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 1yhq s LYS 105 N -2.50 4.11 0.13 3.49 2.20 -0.95 -5.02 119.74 121.19 1yhq s LYS 105 Ca 0.26 2.59 0.10 0.00 -0.36 0.00 0.00 55.97 58.57 1yhq s LYS 105 Cb 0.20 -2.99 -0.04 0.00 -1.51 0.00 0.00 37.83 33.48 1yhq s LYS 105 CO 0.50 -0.60 -0.26 0.99 -0.36 0.00 0.00 175.35 175.62 1yhq s THR 106 N -0.49 2.16 0.47 3.43 2.01 -1.26 -5.02 115.64 116.94 1yhq s THR 106 Ca 0.59 -1.74 -0.07 0.00 0.31 0.00 0.00 61.69 60.78 1yhq s THR 106 Cb -0.48 -1.93 -0.04 0.00 0.01 0.00 0.00 72.50 70.07 1yhq s THR 106 CO 0.55 0.05 0.80 -2.16 -0.69 0.00 0.00 174.62 173.16 1yhq s PRO 107 N -2.07 3.60 -0.23 4.92 0.04 -1.26 -5.01 135.00 134.98 1yhq s PRO 107 Ca 0.13 0.29 -0.12 0.00 0.04 0.00 0.00 61.00 61.34 1yhq s PRO 107 Cb -0.10 -2.36 -0.05 0.00 0.04 0.00 0.00 34.50 32.03 1yhq s PRO 107 CO 0.06 -0.19 0.24 0.16 0.04 0.00 0.00 177.00 177.31 1yhq s ASP 108 N -3.90 6.21 0.01 6.66 -4.77 -1.20 -5.02 116.67 114.65 1yhq s ASP 108 Ca 0.49 0.22 0.07 0.00 -3.30 0.00 0.00 52.55 50.03 1yhq s ASP 108 Cb -0.10 -2.15 -0.02 0.00 -1.09 0.00 0.00 42.92 39.56 1yhq s ASP 108 CO 0.42 -0.00 -0.21 -0.76 0.70 0.00 0.00 175.17 175.33 1yhq s LEU 109 N 1.26 2.09 0.96 2.11 1.43 -1.26 -4.91 118.68 120.35 1yhq s LEU 109 Ca 0.11 -0.43 -0.13 0.00 -1.03 0.00 0.00 54.13 52.66 1yhq s LEU 109 Cb -0.14 -1.03 0.06 0.00 0.03 0.00 0.00 46.19 45.11 1yhq s LEU 109 CO 0.06 0.22 0.51 -1.54 0.23 0.00 0.00 176.35 175.83 1yhq n SER 110 N 2.31 -1.73 -0.36 2.29 3.41 -1.26 -4.64 113.62 113.64 1yhq n SER 110 Ca -0.16 0.31 -0.01 0.00 -0.26 0.00 0.00 58.87 58.75 1yhq n SER 110 Cb 0.53 -1.24 0.12 0.00 -0.26 0.00 0.00 64.21 63.36 1yhq n SER 110 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1yhq h ASP 111 N -1.66 1.07 -0.42 4.04 3.32 -2.00 -1.80 116.42 118.98 1yhq h ASP 111 Ca -0.44 -0.02 -0.06 0.00 0.02 0.00 0.00 57.03 56.54 1yhq h ASP 111 Cb 1.28 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 40.56 1yhq h ASP 111 CO 0.36 0.75 0.08 -0.08 -1.72 0.00 0.00 179.24 178.63 1yhq h GLU 112 N 1.25 0.77 -0.27 3.56 4.57 -1.99 -0.96 114.58 121.50 1yhq h GLU 112 Ca 0.37 -0.17 -0.17 0.00 -1.18 0.00 0.00 59.36 58.21 1yhq h GLU 112 Cb -0.07 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 28.41 1yhq h GLU 112 CO -0.10 0.72 -0.48 -0.44 -1.18 0.00 0.00 179.01 177.53 1yhq h ASP 113 N 0.73 0.90 0.34 1.04 5.19 -1.75 -1.34 116.42 121.54 1yhq h ASP 113 Ca 0.16 -0.53 -0.06 0.00 -0.62 0.00 0.00 57.03 55.97 1yhq h ASP 113 Cb 0.33 -0.26 -0.01 0.00 0.18 0.00 0.00 39.33 39.58 1yhq h ASP 113 CO 0.00 1.26 -0.31 0.00 -3.12 0.00 0.00 179.24 177.07 1yhq h ALA 114 N 0.67 1.44 -0.12 3.45 0.00 -1.09 0.12 119.26 123.73 1yhq h ALA 114 Ca 0.02 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.54 1yhq h ALA 114 Cb 1.09 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1yhq h ALA 114 CO 0.11 0.38 -0.36 -0.09 0.00 0.00 0.00 179.25 179.30 1yhq h ARG 115 N 0.00 0.45 -0.15 0.00 2.43 -0.98 -1.79 114.38 114.34 1yhq h ARG 115 Ca -0.00 -0.33 -0.14 0.00 -0.81 0.00 0.00 59.98 58.71 1yhq h ARG 115 Cb 0.56 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.16 1yhq h ARG 115 CO 0.04 0.95 -0.49 -0.07 -1.51 0.00 0.00 179.97 178.89 1yhq h LEU 116 N 0.04 0.44 -0.48 3.80 3.38 -0.96 -1.03 115.31 120.49 1yhq h LEU 116 Ca -0.01 -0.21 -0.09 0.00 0.09 0.00 0.00 57.88 57.66 1yhq h LEU 116 Cb 0.98 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.59 1yhq h LEU 116 CO 0.08 0.85 -0.05 0.25 0.09 0.00 0.00 178.44 179.66 1yhq h LEU 117 N 0.32 0.88 -1.20 1.67 5.85 -0.77 -1.32 115.31 120.74 1yhq h LEU 117 Ca 0.02 -0.33 -0.06 0.00 0.84 0.00 0.00 57.88 58.34 1yhq h LEU 117 Cb 0.97 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 1yhq h LEU 117 CO 0.08 1.01 -0.11 0.74 -0.34 0.00 0.00 178.44 179.82 1yhq h THR 118 N 0.74 1.21 -0.03 1.05 2.02 -1.10 -2.35 112.91 114.46 1yhq h THR 118 Ca 0.13 -0.92 -0.01 0.00 0.77 0.00 0.00 66.41 66.39 1yhq h THR 118 Cb 0.58 1.14 -0.00 0.00 -1.74 0.00 0.00 68.15 68.13 1yhq h THR 118 CO 0.03 0.30 -0.00 -0.61 0.37 0.00 0.00 175.52 175.61 1yhq h GLN 119 N 0.40 0.06 -0.49 6.66 4.15 -0.73 -1.19 115.11 123.96 1yhq h GLN 119 Ca 0.08 -0.02 0.09 0.00 0.77 0.00 0.00 58.65 59.57 1yhq h GLN 119 Cb 0.43 -0.00 -0.08 0.00 0.21 0.00 0.00 27.48 28.04 1yhq h GLN 119 CO 0.02 0.38 0.02 -0.09 -1.93 0.00 0.00 178.83 177.24 1yhq h ARG 120 N -0.27 0.13 0.00 1.69 2.43 -1.08 0.31 114.38 117.59 1yhq h ARG 120 Ca 0.01 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 1yhq h ARG 120 Cb 0.36 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.87 1yhq h ARG 120 CO 0.00 0.09 -0.24 1.25 -1.51 0.00 0.00 179.97 179.56 1yhq h HIS 121 N 0.14 0.00 0.00 2.20 2.76 -1.32 -0.18 115.15 118.75 1yhq h HIS 121 Ca 0.24 0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.41 1yhq h HIS 121 Cb 0.36 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.32 1yhq h HIS 121 CO -0.29 0.24 -0.02 -0.09 -1.30 0.00 0.00 177.93 176.47 1yhq h ARG 122 N 0.00 0.00 -0.27 5.26 2.43 0.29 -3.38 114.38 118.71 1yhq h ARG 122 Ca -0.00 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.10 1yhq h ARG 122 Cb 0.43 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.97 1yhq h ARG 122 CO 0.03 0.94 -0.10 0.28 -1.51 0.00 0.00 179.97 179.61 1yhq h VAL 123 N -1.00 1.29 0.00 0.20 2.07 -0.46 -3.49 116.25 114.87 1yhq h VAL 123 Ca -0.01 -1.16 0.00 0.00 0.82 0.00 0.00 66.70 66.36 1yhq h VAL 123 Cb 0.94 1.47 0.00 0.00 -1.52 0.00 0.00 31.29 32.18 1yhq h VAL 123 CO -0.00 0.37 0.00 0.61 0.02 0.00 0.00 177.57 178.56 1yhq n GLY 124 N -0.09 1.07 3.58 2.17 0.00 -0.08 -4.95 105.19 106.89 1yhq n GLY 124 Ca -0.03 -0.61 -0.06 0.00 0.00 0.00 0.00 46.02 45.32 1yhq n GLY 124 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yhq s LYS 125 N 0.00 0.72 0.89 1.61 -2.85 -1.26 -5.04 119.74 113.81 1yhq s LYS 125 Ca 0.00 -0.31 -0.11 0.00 -1.00 0.00 0.00 55.97 54.55 1yhq s LYS 125 Cb 0.00 0.30 0.12 0.00 -2.06 0.00 0.00 37.83 36.20 1yhq s LYS 125 CO 0.00 -0.32 1.09 -1.25 0.10 0.00 0.00 175.35 174.97 1yhq s PRO 126 N -2.91 1.32 0.35 1.78 0.04 -1.26 -4.93 135.00 129.39 1yhq s PRO 126 Ca 0.08 0.92 0.06 0.00 0.04 0.00 0.00 61.00 62.10 1yhq s PRO 126 Cb -0.01 -1.81 0.67 0.00 0.04 0.00 0.00 34.50 33.40 1yhq s PRO 126 CO -0.06 -2.23 1.89 1.96 0.04 0.00 0.00 177.00 178.61 1yhq h GLN 127 N -1.54 0.42 -5.97 4.56 4.20 -2.02 -3.47 115.11 111.29 1yhq h GLN 127 Ca -0.49 -0.09 -0.41 0.00 0.06 0.00 0.00 58.65 57.72 1yhq h GLN 127 Cb 1.28 -0.06 0.08 0.00 0.30 0.00 0.00 27.48 29.08 1yhq h GLN 127 CO 0.53 0.49 -0.75 1.19 -0.67 0.00 0.00 178.83 179.62 1yhq n PHE 128 N -4.28 -2.41 -3.17 2.96 0.99 -1.26 -4.99 117.46 105.30 1yhq n PHE 128 Ca 0.01 0.94 -0.30 0.00 -0.00 0.00 0.00 57.45 58.09 1yhq n PHE 128 Cb 0.25 -4.65 -0.04 0.00 -1.00 0.00 0.00 39.48 34.04 1yhq n PHE 128 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 176.76 175.96 1yhq s ASN 129 N -3.73 6.55 0.50 4.37 0.01 -1.26 -4.44 114.94 116.94 1yhq s ASN 129 Ca 0.37 0.96 -0.23 0.00 -0.71 0.00 0.00 52.86 53.26 1yhq s ASN 129 Cb -0.18 -2.25 -0.07 0.00 0.41 0.00 0.00 41.25 39.17 1yhq s ASN 129 CO 0.77 -0.24 1.21 -1.14 -1.51 0.00 0.00 177.10 176.20 1yhq n ARG 130 N -0.81 1.58 -1.69 -0.60 0.63 -0.64 -4.90 116.66 110.23 1yhq n ARG 130 Ca 0.01 0.58 -0.44 0.00 -0.92 0.00 0.00 57.85 57.08 1yhq n ARG 130 Cb 0.53 -2.37 -0.02 0.00 0.45 0.00 0.00 32.46 31.05 1yhq n ARG 130 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1yhq n GLN 131 N -0.53 2.18 -1.62 -0.14 10.64 -1.26 -2.20 117.38 124.45 1yhq n GLN 131 Ca 0.10 0.77 -0.16 0.00 -1.83 0.00 0.00 57.00 55.88 1yhq n GLN 131 Cb 0.43 -2.44 -0.06 0.00 -0.86 0.00 0.00 30.24 27.31 1yhq n GLN 131 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 1yhq n ASP 132 N 1.91 -4.31 0.27 2.61 8.00 -1.26 -4.83 116.55 118.94 1yhq n ASP 132 Ca 0.10 0.35 0.10 0.00 0.71 0.00 0.00 54.79 56.05 1yhq n ASP 132 Cb 0.33 -3.87 0.73 0.00 -0.02 0.00 0.00 41.12 38.29 1yhq n ASP 132 CO 0.00 0.00 0.00 1.12 -0.39 0.00 0.00 177.20 177.93 1yhq h HIS 133 N 0.00 0.00 0.00 1.24 2.07 -1.70 -1.45 115.15 115.30 1yhq h HIS 133 Ca -0.34 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.18 1yhq h HIS 133 Cb 1.08 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.06 1yhq h HIS 133 CO 0.48 0.02 0.00 -2.39 -3.07 0.00 0.00 177.93 172.97 1yhq n HIS 134 N -4.25 0.61 0.34 6.12 1.44 -1.26 -3.51 115.22 114.71 1yhq n HIS 134 Ca -0.03 0.18 0.12 0.00 -2.01 0.00 0.00 57.72 55.98 1yhq n HIS 134 Cb 0.10 -0.80 0.05 0.00 0.12 0.00 0.00 29.99 29.47 1yhq n HIS 134 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 1yhq n LYS 135 N -2.00 0.44 -3.66 -1.40 5.02 -0.55 -4.85 118.16 111.17 1yhq n LYS 135 Ca 0.06 0.07 -0.21 0.00 -2.02 0.00 0.00 58.31 56.21 1yhq n LYS 135 Cb 0.38 -1.72 -0.18 0.00 -0.02 0.00 0.00 35.03 33.49 1yhq n LYS 135 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1yhq s LYS 136 N -3.28 -0.06 0.53 1.97 2.47 -1.22 -5.03 119.74 115.13 1yhq s LYS 136 Ca 0.02 0.32 0.22 0.00 -1.56 0.00 0.00 55.97 54.97 1yhq s LYS 136 Cb 0.12 -0.69 1.37 0.00 -1.46 0.00 0.00 37.83 37.17 1yhq s LYS 136 CO 0.78 -0.38 2.08 0.87 0.16 0.00 0.00 175.35 178.86 1yhq h LYS 137 N 8.44 0.00 0.00 4.03 1.57 -1.89 -0.38 116.57 128.34 1yhq h LYS 137 Ca -0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1yhq h LYS 137 Cb 1.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.43 1yhq h LYS 137 CO 0.17 0.00 0.00 2.89 -0.57 0.00 0.00 179.45 181.94 1yhq n ARG 138 N -4.38 0.20 -3.54 3.15 1.85 -1.26 -4.56 116.66 108.12 1yhq n ARG 138 Ca 0.03 0.07 -0.41 0.00 -1.00 0.00 0.00 57.85 56.54 1yhq n ARG 138 Cb 0.35 -1.50 -0.11 0.00 -1.05 0.00 0.00 32.46 30.15 1yhq n ARG 138 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1yhq s VAL 139 N -2.74 4.90 0.82 8.89 1.01 -0.15 -5.08 120.40 128.04 1yhq s VAL 139 Ca 0.18 -0.71 -0.12 0.00 0.00 0.00 0.00 61.98 61.33 1yhq s VAL 139 Cb 0.16 -3.70 0.08 0.00 0.00 0.00 0.00 36.38 32.92 1yhq s VAL 139 CO 0.39 -0.23 1.14 -0.94 0.00 0.00 0.00 175.10 175.45 1yhq s SER 140 N 1.62 4.38 0.37 3.32 1.04 -1.26 -4.64 113.70 118.53 1yhq s SER 140 Ca 0.04 1.01 0.18 0.00 0.48 0.00 0.00 55.95 57.65 1yhq s SER 140 Cb -0.19 -1.63 0.68 0.00 0.10 0.00 0.00 66.02 64.99 1yhq s SER 140 CO 0.08 -2.00 1.74 0.00 0.98 0.00 0.00 173.24 174.04 1yhq h THR 141 N -1.12 0.97 -1.49 2.02 1.03 -1.93 -3.42 112.91 108.97 1yhq h THR 141 Ca -0.47 -1.52 -0.71 0.00 -0.01 0.00 0.00 66.41 63.70 1yhq h THR 141 Cb 1.30 1.90 0.06 0.00 -1.07 0.00 0.00 68.15 70.34 1yhq h THR 141 CO 0.63 0.38 0.30 -0.24 -0.01 0.00 0.00 175.52 176.58 1yhq n SER 142 N -3.62 1.07 -4.73 0.00 2.88 -1.26 -1.63 113.62 106.33 1yhq n SER 142 Ca -0.01 1.13 -0.42 0.00 -1.33 0.00 0.00 58.87 58.25 1yhq n SER 142 Cb 0.50 -1.11 -0.03 0.00 -0.75 0.00 0.00 64.21 62.82 1yhq n SER 142 CO 0.00 0.00 0.00 0.86 -1.23 0.00 0.00 175.04 174.67 1yhq s TRP 143 N 0.24 3.09 -0.01 0.66 -0.11 -1.26 -4.17 118.94 117.38 1yhq s TRP 143 Ca 0.85 0.96 0.01 0.00 1.22 0.00 0.00 56.10 59.14 1yhq s TRP 143 Cb -1.03 -3.80 0.01 0.00 -1.50 0.00 0.00 33.47 27.14 1yhq s TRP 143 CO 0.50 -2.68 -0.03 1.03 -4.62 0.00 0.00 176.95 171.15 1yhq s ARG 144 N 0.15 0.35 0.08 5.86 1.81 -1.26 -4.96 118.95 120.98 1yhq s ARG 144 Ca 0.62 -0.08 -0.31 0.00 -1.72 0.00 0.00 55.73 54.24 1yhq s ARG 144 Cb -0.41 -0.39 -0.08 0.00 -0.45 0.00 0.00 34.95 33.62 1yhq s ARG 144 CO 0.38 0.02 1.60 0.21 -0.68 0.00 0.00 175.30 176.83 1yhq s LYS 145 N 0.26 4.21 -0.02 3.54 2.20 -1.26 -4.67 119.74 124.01 1yhq s LYS 145 Ca -0.02 2.28 -0.30 0.00 -0.36 0.00 0.00 55.97 57.57 1yhq s LYS 145 Cb -0.06 -3.52 -0.07 0.00 -1.51 0.00 0.00 37.83 32.67 1yhq s LYS 145 CO -0.00 -0.69 1.72 -1.25 -0.36 0.00 0.00 175.35 174.77 1yhq s PRO 146 N 2.35 4.18 -0.02 4.03 0.04 -1.26 -4.86 135.00 139.46 1yhq s PRO 146 Ca 0.72 2.31 0.17 0.00 0.04 0.00 0.00 61.00 64.23 1yhq s PRO 146 Cb -0.39 -3.97 -0.24 0.00 0.04 0.00 0.00 34.50 29.94 1yhq s PRO 146 CO 0.31 -0.85 0.47 0.54 0.04 0.00 0.00 177.00 177.51 1yhq n ARG 147 N 7.00 0.84 -1.63 4.56 5.12 -1.26 -4.75 116.66 126.54 1yhq n ARG 147 Ca 0.18 -0.11 -0.48 0.00 -1.93 0.00 0.00 57.85 55.51 1yhq n ARG 147 Cb 0.42 -1.36 -0.04 0.00 -1.16 0.00 0.00 32.46 30.31 1yhq n ARG 147 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1yhq n GLY 148 N 1.49 0.59 0.36 -0.13 0.00 -1.26 -4.84 105.19 101.40 1yhq n GLY 148 Ca -0.01 0.59 0.07 0.00 0.00 0.00 0.00 46.02 46.67 1yhq n GLY 148 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1yhq h GLN 149 N 4.47 0.85 -0.08 1.61 1.08 -2.04 -1.98 115.11 119.03 1yhq h GLN 149 Ca -0.45 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 56.70 1yhq h GLN 149 Cb 1.30 -0.19 0.00 0.00 -0.05 0.00 0.00 27.48 28.54 1yhq h GLN 149 CO 0.78 0.56 0.00 1.28 -0.95 0.00 0.00 178.83 180.50 1yhq n LEU 150 N -4.52 2.79 -4.62 1.46 4.77 -1.26 -4.95 117.00 110.66 1yhq n LEU 150 Ca 0.15 -0.98 -0.57 0.00 -0.03 0.00 0.00 56.01 54.58 1yhq n LEU 150 Cb 0.29 -0.04 -0.07 0.00 -2.33 0.00 0.00 43.42 41.27 1yhq n LEU 150 CO 0.32 0.49 0.98 -0.24 -1.33 0.00 0.00 177.39 177.60 1yhq n SER 151 N 1.15 1.48 -0.12 -1.43 2.88 -0.75 -4.87 113.62 111.96 1yhq n SER 151 Ca 0.16 1.12 -0.11 0.00 -1.33 0.00 0.00 58.87 58.71 1yhq n SER 151 Cb 0.55 -1.09 -0.03 0.00 -0.75 0.00 0.00 64.21 62.90 1yhq n SER 151 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 1yhq h LYS 152 N 5.01 0.66 -0.55 -1.46 1.79 -1.94 -1.71 116.57 118.37 1yhq h LYS 152 Ca -0.48 -0.24 -0.07 0.00 -2.18 0.00 0.00 60.65 57.69 1yhq h LYS 152 Cb 1.35 -0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 31.94 1yhq h LYS 152 CO 0.82 0.81 0.09 0.37 -1.08 0.00 0.00 179.45 180.47 1yhq h GLN 153 N 0.45 0.91 -0.77 3.15 4.15 -1.87 -2.17 115.11 118.96 1yhq h GLN 153 Ca 0.09 -0.24 0.00 0.00 0.77 0.00 0.00 58.65 59.27 1yhq h GLN 153 Cb 0.56 -0.11 -0.04 0.00 0.21 0.00 0.00 27.48 28.10 1yhq h GLN 153 CO 0.03 0.88 0.49 -0.09 -1.93 0.00 0.00 178.83 178.20 1yhq h ARG 154 N 0.80 1.02 0.00 1.69 2.43 -1.82 -0.04 114.38 118.47 1yhq h ARG 154 Ca 0.17 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1yhq h ARG 154 Cb 0.41 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 1yhq h ARG 154 CO 0.01 0.70 0.00 0.54 -1.51 0.00 0.00 179.97 179.71 1yhq n ARG 155 N -4.40 0.81 -2.37 0.20 1.74 -0.66 -4.90 116.66 107.08 1yhq n ARG 155 Ca 0.08 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.08 1yhq n ARG 155 Cb 0.05 -1.50 0.01 0.00 -1.02 0.00 0.00 32.46 29.99 1yhq n ARG 155 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1yhq n GLY 156 N 0.92 0.11 3.71 -0.13 0.00 -0.03 -4.99 105.19 104.78 1yhq n GLY 156 Ca 0.20 -0.47 -0.42 0.00 0.00 0.00 0.00 46.02 45.33 1yhq n GLY 156 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yhq s ILE 157 N -2.61 3.81 0.07 -0.61 1.01 -0.85 -4.92 121.20 117.10 1yhq s ILE 157 Ca 0.06 1.28 -0.34 0.00 0.00 0.00 0.00 60.65 61.65 1yhq s ILE 157 Cb -0.03 -3.82 -0.13 0.00 0.01 0.00 0.00 42.46 38.50 1yhq s ILE 157 CO 0.08 0.08 1.71 1.17 0.00 0.00 0.00 174.94 177.97 1yhq n LYS 158 N 4.21 2.22 0.00 2.79 4.81 -1.26 -2.05 118.16 128.88 1yhq n LYS 158 Ca 0.10 0.80 0.00 0.00 -0.87 0.00 0.00 58.31 58.35 1yhq n LYS 158 Cb 0.45 -2.61 0.00 0.00 0.02 0.00 0.00 35.03 32.89 1yhq n LYS 158 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1yhq n GLY 159 N 3.83 1.76 1.03 3.14 0.00 -1.26 -4.92 105.19 108.77 1yhq n GLY 159 Ca 0.19 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.28 1yhq n GLY 159 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1yhq n LYS 160 N -1.29 2.50 0.00 1.61 4.76 -0.87 -5.02 118.16 119.85 1yhq n LYS 160 Ca 0.00 -1.83 0.00 0.00 -2.87 0.00 0.00 58.31 53.61 1yhq n LYS 160 Cb 0.00 -1.54 0.00 0.00 -1.84 0.00 0.00 35.03 31.65 1yhq n LYS 160 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1yhq n GLY 161 N 1.05 -1.10 3.78 0.72 0.00 -1.26 -4.63 105.19 103.74 1yhq n GLY 161 Ca 0.17 -1.43 -0.37 0.00 0.00 0.00 0.00 46.02 44.38 1yhq n GLY 161 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1yhq s ASP 162 N -1.86 6.74 -0.12 1.61 1.01 -1.26 -4.92 116.67 117.86 1yhq s ASP 162 Ca 0.00 2.15 -0.12 0.00 0.71 0.00 0.00 52.55 55.29 1yhq s ASP 162 Cb 0.00 -2.60 -0.05 0.00 1.01 0.00 0.00 42.92 41.29 1yhq s ASP 162 CO 0.00 -0.51 0.26 0.28 0.21 0.00 0.00 175.17 175.41 1yhq s THR 163 N -1.54 5.31 0.16 -1.27 -1.32 -1.26 -4.82 115.64 110.89 1yhq s THR 163 Ca 0.56 0.49 -0.34 0.00 -1.21 0.00 0.00 61.69 61.20 1yhq s THR 163 Cb -0.25 -3.57 -0.15 0.00 -1.51 0.00 0.00 72.50 67.01 1yhq s THR 163 CO 0.32 0.50 1.31 0.52 -2.21 0.00 0.00 174.62 175.06 1yhq n VAL 164 N 2.77 0.52 -3.72 5.08 0.31 -1.26 -4.98 118.33 117.05 1yhq n VAL 164 Ca -0.15 -0.13 -0.14 0.00 -0.01 0.00 0.00 64.34 63.91 1yhq n VAL 164 Cb 0.53 -1.03 -0.08 0.00 -0.91 0.00 0.00 33.84 32.35 1yhq n VAL 164 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1yhq s GLU 165 N 0.04 0.73 0.54 5.55 2.02 -1.26 -5.04 118.70 121.28 1yhq s GLU 165 Ca 0.76 -0.11 0.21 0.00 0.02 0.00 0.00 54.97 55.86 1yhq s GLU 165 Cb -0.83 0.33 1.40 0.00 0.10 0.00 0.00 34.13 35.13 1yhq s GLU 165 CO 0.48 -0.21 2.13 0.00 0.02 0.00 0.00 175.26 177.69 1yhq h ALA 166 N 3.75 2.01 0.00 5.21 0.00 -2.01 -1.80 119.26 126.42 1yhq h ALA 166 Ca -0.29 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1yhq h ALA 166 Cb 1.17 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1yhq h ALA 166 CO 0.40 -0.15 0.15 0.78 0.00 0.00 0.00 179.25 180.43 1yhq h GLY 167 N 0.00 0.00 0.89 0.00 0.00 -1.98 -0.82 103.07 101.16 1yhq h GLY 167 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1yhq h GLY 167 CO -0.00 0.00 -0.37 0.69 0.00 0.00 0.00 176.54 176.86 1yhq n PHE 168 N -2.59 0.00 -1.58 5.60 3.01 -0.67 -4.96 117.46 116.27 1yhq n PHE 168 Ca -0.02 0.00 -0.41 0.00 1.01 0.00 0.00 57.45 58.03 1yhq n PHE 168 Cb 0.20 -0.23 0.01 0.00 -0.01 0.00 0.00 39.48 39.45 1yhq n PHE 168 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1yhq n ARG 169 N -1.26 1.13 -1.85 -1.08 5.12 -0.32 -4.99 116.66 113.41 1yhq n ARG 169 Ca 0.08 0.41 -0.30 0.00 -1.93 0.00 0.00 57.85 56.10 1yhq n ARG 169 Cb 0.33 -1.94 0.03 0.00 -1.16 0.00 0.00 32.46 29.73 1yhq n ARG 169 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1yhq s SER 170 N -0.84 5.72 0.22 0.55 1.04 -1.26 -4.98 113.70 114.16 1yhq s SER 170 Ca 0.65 1.27 -0.32 0.00 0.48 0.00 0.00 55.95 58.03 1yhq s SER 170 Cb -0.55 -2.17 -0.13 0.00 0.10 0.00 0.00 66.02 63.26 1yhq s SER 170 CO 0.56 -1.18 1.54 -2.65 0.98 0.00 0.00 173.24 172.49 1yhq n PRO 171 N -2.92 2.30 -0.25 4.02 -0.02 -1.26 -4.78 135.00 132.09 1yhq n PRO 171 Ca 0.07 0.82 0.05 0.00 -2.02 0.00 0.00 63.50 62.42 1yhq n PRO 171 Cb 0.56 -2.56 0.18 0.00 -0.02 0.00 0.00 33.50 31.65 1yhq n PRO 171 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1yhq h THR 172 N 3.37 0.51 -0.05 3.45 2.02 -1.96 -0.44 112.91 119.79 1yhq h THR 172 Ca -0.45 -0.09 0.02 0.00 0.77 0.00 0.00 66.41 66.66 1yhq h THR 172 Cb 1.25 0.23 -0.00 0.00 -1.74 0.00 0.00 68.15 67.89 1yhq h THR 172 CO 0.83 0.05 0.06 0.00 0.37 0.00 0.00 175.52 176.83 1yhq h ALA 173 N 1.61 1.59 0.00 6.16 0.00 -2.00 -3.18 119.26 123.43 1yhq h ALA 173 Ca 0.41 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 1yhq h ALA 173 Cb 0.70 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1yhq h ALA 173 CO -0.52 -0.09 -0.09 0.28 0.00 0.00 0.00 179.25 178.84 1yhq n VAL 174 N -3.79 0.00 -1.68 0.00 0.31 -0.86 -5.02 118.33 107.29 1yhq n VAL 174 Ca -0.02 -0.40 -0.58 0.00 -0.01 0.00 0.00 64.34 63.32 1yhq n VAL 174 Cb 0.16 0.95 -0.08 0.00 -0.91 0.00 0.00 33.84 33.96 1yhq n VAL 174 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1yhq n ARG 175 N -0.94 0.86 -0.21 5.55 0.63 -0.23 -1.09 116.66 121.24 1yhq n ARG 175 Ca 0.00 0.31 0.00 0.00 -0.92 0.00 0.00 57.85 57.24 1yhq n ARG 175 Cb 0.00 -1.94 0.00 0.00 0.45 0.00 0.00 32.46 30.97 1yhq n ARG 175 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1yhq n GLY 176 N 3.64 0.91 3.78 5.14 0.00 -1.26 -5.05 105.19 112.35 1yhq n GLY 176 Ca 0.25 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.91 1yhq n GLY 176 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yhq s LYS 177 N -0.61 4.38 0.72 1.61 1.02 -0.25 -4.72 119.74 121.89 1yhq s LYS 177 Ca 0.00 1.40 -0.16 0.00 0.02 0.00 0.00 55.97 57.23 1yhq s LYS 177 Cb 0.00 -2.64 0.03 0.00 -0.52 0.00 0.00 37.83 34.70 1yhq s LYS 177 CO 0.00 0.07 1.24 -1.58 -0.92 0.00 0.00 175.35 174.16 1yhq s HIS 178 N -1.68 1.99 0.66 3.18 5.65 -0.47 -4.83 115.29 119.79 1yhq s HIS 178 Ca 0.54 1.58 0.33 0.00 0.25 0.00 0.00 55.06 57.76 1yhq s HIS 178 Cb -0.19 -3.56 1.80 0.00 -1.18 0.00 0.00 32.58 29.45 1yhq s HIS 178 CO 0.25 -2.80 2.02 -1.00 -0.65 0.00 0.00 174.74 172.56 1yhq h PRO 179 N -0.14 0.00 0.00 2.88 0.13 -1.95 0.97 132.00 133.89 1yhq h PRO 179 Ca -0.49 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.64 1yhq h PRO 179 Cb 1.31 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.44 1yhq h PRO 179 CO 0.50 0.00 -0.04 0.66 -0.23 0.00 0.00 178.00 178.89 1yhq h SER 180 N 0.00 0.00 0.00 1.44 4.64 -2.01 -3.47 113.55 114.15 1yhq h SER 180 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1yhq h SER 180 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1yhq h SER 180 CO -0.00 0.04 0.00 0.61 -0.87 0.00 0.00 176.83 176.61 1yhq n GLY 181 N 0.69 1.12 3.80 -0.77 0.00 0.33 -4.61 105.19 105.75 1yhq n GLY 181 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1yhq n GLY 181 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1yhq s PHE 182 N -2.05 2.93 -0.16 1.61 0.40 -1.26 -4.76 117.98 114.69 1yhq s PHE 182 Ca 0.00 1.54 -0.12 0.00 -0.60 0.00 0.00 56.93 57.75 1yhq s PHE 182 Cb 0.00 -3.07 -0.05 0.00 0.51 0.00 0.00 43.02 40.41 1yhq s PHE 182 CO 0.00 -1.10 0.22 -1.21 0.70 0.00 0.00 175.22 173.83 1yhq s GLU 183 N -3.68 4.09 0.30 0.44 0.41 -1.03 -1.37 118.70 117.85 1yhq s GLU 183 Ca 0.66 -0.02 -0.18 0.00 -0.41 0.00 0.00 54.97 55.02 1yhq s GLU 183 Cb -0.17 -3.37 -0.09 0.00 -1.78 0.00 0.00 34.13 28.71 1yhq s GLU 183 CO 0.30 0.37 0.77 -1.21 -0.49 0.00 0.00 175.26 175.00 1yhq s GLU 184 N 0.09 4.16 -0.14 1.61 2.02 -1.26 -1.97 118.70 123.21 1yhq s GLU 184 Ca 0.14 0.84 -0.01 0.00 0.02 0.00 0.00 54.97 55.96 1yhq s GLU 184 Cb -0.12 -2.60 0.04 0.00 0.10 0.00 0.00 34.13 31.54 1yhq s GLU 184 CO 0.03 0.24 -0.03 0.08 0.02 0.00 0.00 175.26 175.60 1yhq s VAL 185 N -1.80 0.82 0.05 2.63 1.01 -0.85 -4.94 120.40 117.31 1yhq s VAL 185 Ca 0.50 -0.39 -0.31 0.00 0.00 0.00 0.00 61.98 61.79 1yhq s VAL 185 Cb -0.13 -1.02 -0.07 0.00 0.00 0.00 0.00 36.38 35.16 1yhq s VAL 185 CO 0.19 0.13 1.43 -0.60 0.00 0.00 0.00 175.10 176.25 1yhq s ARG 186 N 1.77 4.29 -0.08 2.72 6.06 -1.26 -1.28 118.95 131.17 1yhq s ARG 186 Ca 0.02 2.04 0.04 0.00 -2.50 0.00 0.00 55.73 55.34 1yhq s ARG 186 Cb -0.14 -3.47 -0.00 0.00 0.06 0.00 0.00 34.95 31.40 1yhq s ARG 186 CO -0.07 -0.55 -0.21 0.08 -2.50 0.00 0.00 175.30 172.05 1yhq s VAL 187 N 1.99 1.82 -0.08 7.11 1.01 0.64 -4.90 120.40 128.00 1yhq s VAL 187 Ca 0.65 -0.90 0.10 0.00 0.00 0.00 0.00 61.98 61.83 1yhq s VAL 187 Cb -0.34 -1.57 -0.14 0.00 0.00 0.00 0.00 36.38 34.32 1yhq s VAL 187 CO 0.28 0.51 0.09 1.41 0.00 0.00 0.00 175.10 177.40 1yhq n HIS 188 N 3.38 0.00 -3.81 5.22 8.25 -1.26 -0.95 115.22 126.04 1yhq n HIS 188 Ca -0.19 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.18 1yhq n HIS 188 Cb 0.53 -0.45 -0.01 0.00 1.12 0.00 0.00 29.99 31.17 1yhq n HIS 188 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1yhq n ASN 189 N -2.26 -0.90 -0.20 0.41 2.04 -1.26 -4.90 115.26 108.20 1yhq n ASN 189 Ca -0.13 -2.12 -0.09 0.00 -0.44 0.00 0.00 54.58 51.80 1yhq n ASN 189 Cb 0.70 1.64 0.02 0.00 -2.53 0.00 0.00 39.78 39.61 1yhq n ASN 189 CO 0.00 0.00 0.00 0.58 -0.44 0.00 0.00 177.26 177.40 1yhq h VAL 190 N 1.61 1.26 0.00 3.53 2.07 -1.96 -2.71 116.25 120.05 1yhq h VAL 190 Ca -0.17 -0.97 0.00 0.00 0.82 0.00 0.00 66.70 66.38 1yhq h VAL 190 Cb 0.72 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1yhq h VAL 190 CO 0.23 0.35 0.00 0.44 0.02 0.00 0.00 177.57 178.61 1yhq h ASP 191 N 0.82 0.00 0.96 0.57 3.32 -1.99 -1.38 116.42 118.72 1yhq h ASP 191 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1yhq h ASP 191 Cb 0.42 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.97 1yhq h ASP 191 CO 0.01 0.00 0.00 0.44 -1.72 0.00 0.00 179.24 177.97 1yhq h ASP 192 N 0.00 0.00 1.63 6.45 3.32 -1.89 -2.93 116.42 123.00 1yhq h ASP 192 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 1yhq h ASP 192 Cb 0.19 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.74 1yhq h ASP 192 CO 0.00 0.00 -0.01 -0.07 -1.72 0.00 0.00 179.24 177.44 1yhq h LEU 193 N 0.00 0.00 -9.59 1.55 3.38 -1.37 -3.45 115.31 105.82 1yhq h LEU 193 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 1yhq h LEU 193 Cb 0.48 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.26 1yhq h LEU 193 CO 0.00 0.01 0.75 -0.70 0.09 0.00 0.00 178.44 178.59 1yhq s GLU 194 N -3.38 4.30 0.00 1.13 2.12 -1.11 -2.52 118.70 119.25 1yhq s GLU 194 Ca 0.05 2.16 0.00 0.00 0.36 0.00 0.00 54.97 57.54 1yhq s GLU 194 Cb 0.07 -3.21 0.00 0.00 0.26 0.00 0.00 34.13 31.25 1yhq s GLU 194 CO 0.62 -0.45 0.00 0.41 -0.54 0.00 0.00 175.26 175.30 1yhq n GLY 195 N 3.30 0.76 3.70 -1.50 0.00 -1.26 -5.04 105.19 105.15 1yhq n GLY 195 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 1yhq n GLY 195 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yhq s VAL 196 N -2.76 5.11 -0.59 1.61 1.01 -1.05 -5.03 120.40 118.70 1yhq s VAL 196 Ca 0.00 1.15 -0.20 0.00 0.00 0.00 0.00 61.98 62.93 1yhq s VAL 196 Cb 0.00 -3.91 0.08 0.00 0.00 0.00 0.00 36.38 32.55 1yhq s VAL 196 CO 0.00 0.25 0.76 -0.62 0.00 0.00 0.00 175.10 175.49 1yhq s ASP 197 N 0.83 6.19 0.00 3.32 2.15 -1.26 -4.93 116.67 122.98 1yhq s ASP 197 Ca 0.30 -1.18 0.00 0.00 0.43 0.00 0.00 52.55 52.10 1yhq s ASP 197 Cb -0.16 -2.33 0.00 0.00 -0.30 0.00 0.00 42.92 40.13 1yhq s ASP 197 CO 0.13 -1.16 0.80 0.61 -0.17 0.00 0.00 175.17 175.38 1yhq n GLY 198 N 5.27 -0.31 0.08 2.66 0.00 -1.26 0.29 105.19 111.91 1yhq n GLY 198 Ca -0.07 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.87 1yhq n GLY 198 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1yhq n ASP 199 N -1.30 0.70 -0.01 1.61 8.00 -1.26 -4.46 116.55 119.83 1yhq n ASP 199 Ca 0.00 0.33 0.05 0.00 0.71 0.00 0.00 54.79 55.88 1yhq n ASP 199 Cb 0.02 0.19 -0.09 0.00 -0.02 0.00 0.00 41.12 41.22 1yhq n ASP 199 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1yhq n THR 200 N -2.96 0.04 -4.30 -3.53 -1.04 -0.43 -3.26 114.28 98.80 1yhq n THR 200 Ca -0.19 -0.27 -0.20 0.00 -2.04 0.00 0.00 64.05 61.35 1yhq n THR 200 Cb 1.04 0.19 -0.11 0.00 -1.82 0.00 0.00 70.33 69.63 1yhq n THR 200 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1yhq s GLU 201 N -2.75 1.20 0.08 -2.82 2.02 0.14 -2.45 118.70 114.12 1yhq s GLU 201 Ca -0.04 -1.36 0.07 0.00 0.02 0.00 0.00 54.97 53.66 1yhq s GLU 201 Cb 0.07 -1.18 -0.03 0.00 0.10 0.00 0.00 34.13 33.09 1yhq s GLU 201 CO 0.46 0.23 -0.20 0.00 0.02 0.00 0.00 175.26 175.78 1yhq s ALA 202 N -2.13 1.68 -0.00 5.21 0.00 -0.83 -4.35 121.76 121.33 1yhq s ALA 202 Ca 0.14 -1.14 -0.00 0.00 0.00 0.00 0.00 51.96 50.96 1yhq s ALA 202 Cb -0.05 -0.25 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 1yhq s ALA 202 CO 0.05 0.34 0.07 0.54 0.00 0.00 0.00 175.76 176.76 1yhq s VAL 203 N -1.06 4.63 -0.23 0.00 0.11 -0.17 -2.01 120.40 121.68 1yhq s VAL 203 Ca 0.05 -0.45 0.01 0.00 -2.93 0.00 0.00 61.98 58.67 1yhq s VAL 203 Cb -0.10 -3.11 0.05 0.00 -1.53 0.00 0.00 36.38 31.70 1yhq s VAL 203 CO 0.03 0.35 -0.08 -0.60 -3.33 0.00 0.00 175.10 171.47 1yhq s ARG 204 N -1.73 1.85 -0.02 1.54 3.52 -0.40 -0.80 118.95 122.91 1yhq s ARG 204 Ca 0.22 -1.00 -0.30 0.00 -0.13 0.00 0.00 55.73 54.53 1yhq s ARG 204 Cb -0.12 -2.58 -0.04 0.00 -1.56 0.00 0.00 34.95 30.66 1yhq s ARG 204 CO 0.14 -0.54 1.19 0.42 -0.81 0.00 0.00 175.30 175.70 1yhq s ILE 205 N 1.35 4.23 0.39 4.11 1.01 -1.26 -0.26 121.20 130.77 1yhq s ILE 205 Ca -0.05 1.57 -0.26 0.00 0.00 0.00 0.00 60.65 61.92 1yhq s ILE 205 Cb -0.18 -4.01 -0.11 0.00 0.01 0.00 0.00 42.46 38.17 1yhq s ILE 205 CO -0.07 0.04 1.17 0.00 0.00 0.00 0.00 174.94 176.08 1yhq n ALA 206 N 4.79 0.80 -0.05 9.38 0.00 -0.12 -4.87 120.51 130.44 1yhq n ALA 206 Ca 0.10 0.29 0.07 0.00 0.00 0.00 0.00 53.44 53.90 1yhq n ALA 206 Cb 0.46 -2.18 0.45 0.00 0.00 0.00 0.00 19.45 18.18 1yhq n ALA 206 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1yhq h SER 207 N 2.01 0.44 -0.42 0.00 4.64 -1.93 -2.38 113.55 115.90 1yhq h SER 207 Ca -0.46 -0.00 0.08 0.00 -0.47 0.00 0.00 61.79 60.94 1yhq h SER 207 Cb 1.31 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 63.28 1yhq h SER 207 CO 0.60 0.30 0.29 0.11 -0.87 0.00 0.00 176.83 177.25 1yhq h LYS 208 N 0.51 0.24 -6.51 4.77 1.57 -1.99 -3.43 116.57 111.73 1yhq h LYS 208 Ca 0.22 -0.01 -0.57 0.00 -1.87 0.00 0.00 60.65 58.41 1yhq h LYS 208 Cb 0.21 -0.05 0.05 0.00 0.08 0.00 0.00 32.23 32.52 1yhq h LYS 208 CO -0.06 0.16 0.88 0.28 -0.57 0.00 0.00 179.45 180.14 1yhq n VAL 209 N -4.47 0.07 -1.76 0.50 0.31 -0.90 -4.97 118.33 107.12 1yhq n VAL 209 Ca 0.06 -0.01 -0.29 0.00 -0.01 0.00 0.00 64.34 64.08 1yhq n VAL 209 Cb 0.32 -1.68 0.09 0.00 -0.91 0.00 0.00 33.84 31.65 1yhq n VAL 209 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1yhq s GLY 210 N 1.34 1.61 0.29 2.92 0.00 -1.26 -4.82 107.32 107.39 1yhq s GLY 210 Ca 0.79 -0.45 -0.01 0.00 0.00 0.00 0.00 44.72 45.06 1yhq s GLY 210 CO 0.38 0.01 1.92 0.00 0.00 0.00 0.00 173.10 175.41 1yhq h ALA 211 N -1.02 1.46 0.04 3.20 0.00 -1.97 0.17 119.26 121.14 1yhq h ALA 211 Ca -0.47 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.42 1yhq h ALA 211 Cb 1.30 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1yhq h ALA 211 CO 0.63 0.43 -0.08 -0.09 0.00 0.00 0.00 179.25 180.14 1yhq h ARG 212 N 1.09 -0.16 0.00 0.00 2.43 -2.01 -1.51 114.38 114.22 1yhq h ARG 212 Ca 0.37 0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 59.43 1yhq h ARG 212 Cb 0.09 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.66 1yhq h ARG 212 CO -0.12 -0.11 -0.58 -0.22 -1.51 0.00 0.00 179.97 177.43 1yhq h LYS 213 N -0.16 0.00 -0.55 0.20 3.64 -1.88 -3.14 116.57 114.68 1yhq h LYS 213 Ca 0.02 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.32 1yhq h LYS 213 Cb 0.18 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.98 1yhq h LYS 213 CO -0.06 0.58 0.03 0.00 -2.27 0.00 0.00 179.45 177.73 1yhq h ARG 214 N 0.00 0.91 -0.12 1.90 3.08 -0.68 -1.79 114.38 117.68 1yhq h ARG 214 Ca -0.01 -0.25 0.01 0.00 0.07 0.00 0.00 59.98 59.80 1yhq h ARG 214 Cb 1.15 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 31.09 1yhq h ARG 214 CO 0.07 0.89 0.04 1.49 -1.07 0.00 0.00 179.97 181.40 1yhq h GLU 215 N 0.85 0.10 -0.23 0.04 4.81 -1.23 0.34 114.58 119.26 1yhq h GLU 215 Ca 0.16 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.38 1yhq h GLU 215 Cb 0.46 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 1yhq h GLU 215 CO 0.02 0.07 0.12 0.00 -0.73 0.00 0.00 179.01 178.49 1yhq h ARG 216 N 0.11 0.33 -0.35 1.92 3.08 -1.56 -2.43 114.38 115.47 1yhq h ARG 216 Ca 0.05 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.07 1yhq h ARG 216 Cb 0.02 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 1yhq h ARG 216 CO -0.05 0.32 0.20 0.82 -1.07 0.00 0.00 179.97 180.19 1yhq h ILE 217 N 0.25 1.03 -0.73 2.04 2.04 -1.01 -1.95 117.51 119.18 1yhq h ILE 217 Ca 0.08 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.80 1yhq h ILE 217 Cb 0.09 0.59 -0.04 0.00 -0.74 0.00 0.00 36.82 36.73 1yhq h ILE 217 CO -0.01 0.07 0.43 -0.33 0.00 0.00 0.00 178.15 178.31 1yhq h GLU 218 N 0.40 1.00 -0.15 2.37 5.08 -0.21 -1.31 114.58 121.76 1yhq h GLU 218 Ca 0.14 -0.10 -0.16 0.00 -1.00 0.00 0.00 59.36 58.24 1yhq h GLU 218 Cb 0.01 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.05 1yhq h GLU 218 CO -0.07 0.72 -0.59 1.05 -1.00 0.00 0.00 179.01 179.11 1yhq h GLU 219 N 1.00 0.50 -0.03 2.33 4.11 -1.30 -2.70 114.58 118.49 1yhq h GLU 219 Ca 0.26 -0.33 -0.12 0.00 0.07 0.00 0.00 59.36 59.24 1yhq h GLU 219 Cb -0.01 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1yhq h GLU 219 CO -0.05 0.95 -0.52 1.49 0.07 0.00 0.00 179.01 180.95 1yhq h GLU 220 N 0.37 0.08 -0.18 1.06 4.57 -1.17 -2.74 114.58 116.57 1yhq h GLU 220 Ca -0.00 -0.05 -0.22 0.00 -1.18 0.00 0.00 59.36 57.91 1yhq h GLU 220 Cb 1.14 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.74 1yhq h GLU 220 CO 0.11 0.59 -0.74 0.00 -1.18 0.00 0.00 179.01 177.79 1yhq h ALA 221 N 1.41 0.33 -0.60 2.92 0.00 -1.16 -2.82 119.26 119.34 1yhq h ALA 221 Ca -0.00 -0.58 -0.04 0.00 0.00 0.00 0.00 54.91 54.29 1yhq h ALA 221 Cb 0.95 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 1yhq h ALA 221 CO 0.07 0.68 0.22 1.49 0.00 0.00 0.00 179.25 181.71 1yhq h GLU 222 N 0.57 0.88 0.00 0.00 4.81 -1.40 0.10 114.58 119.54 1yhq h GLU 222 Ca -0.04 -0.15 -0.03 0.00 -0.13 0.00 0.00 59.36 59.01 1yhq h GLU 222 Cb 1.36 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 30.59 1yhq h GLU 222 CO 0.15 0.73 -0.16 -0.44 -0.73 0.00 0.00 179.01 178.56 1yhq h ASP 223 N 0.86 0.00 -0.57 1.04 3.32 -1.42 -2.00 116.42 117.65 1yhq h ASP 223 Ca 0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1yhq h ASP 223 Cb 0.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.75 1yhq h ASP 223 CO -0.02 0.16 0.00 0.00 -1.72 0.00 0.00 179.24 177.67 1yhq n ALA 224 N -2.20 2.73 -3.15 3.45 0.00 -0.70 -4.92 120.51 115.71 1yhq n ALA 224 Ca -0.00 -1.18 -0.20 0.00 0.00 0.00 0.00 53.44 52.06 1yhq n ALA 224 Cb 0.37 -0.99 0.05 0.00 0.00 0.00 0.00 19.45 18.88 1yhq n ALA 224 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yhq n GLY 225 N 1.21 -0.37 3.27 0.00 0.00 -0.75 -4.56 105.19 103.98 1yhq n GLY 225 Ca 0.21 0.07 -0.33 0.00 0.00 0.00 0.00 46.02 45.97 1yhq n GLY 225 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yhq s ILE 226 N -3.18 2.67 0.31 -0.61 1.01 0.28 -4.31 121.20 117.38 1yhq s ILE 226 Ca 0.37 -0.77 -0.27 0.00 0.00 0.00 0.00 60.65 59.98 1yhq s ILE 226 Cb -0.16 -2.13 -0.09 0.00 0.01 0.00 0.00 42.46 40.09 1yhq s ILE 226 CO 0.46 0.52 1.00 -0.60 0.00 0.00 0.00 174.94 176.31 1yhq s ARG 227 N 0.80 4.57 -0.32 2.79 3.52 -1.26 -3.94 118.95 125.11 1yhq s ARG 227 Ca -0.05 1.51 -0.10 0.00 -0.13 0.00 0.00 55.73 56.95 1yhq s ARG 227 Cb -0.15 -2.94 -0.00 0.00 -1.56 0.00 0.00 34.95 30.29 1yhq s ARG 227 CO 0.00 0.23 0.16 0.08 -0.81 0.00 0.00 175.30 174.96 1yhq s VAL 228 N -1.43 4.63 0.35 7.11 1.01 -1.26 -1.00 120.40 129.81 1yhq s VAL 228 Ca 0.48 -0.45 0.02 0.00 0.00 0.00 0.00 61.98 62.04 1yhq s VAL 228 Cb -0.24 -3.38 0.26 0.00 0.00 0.00 0.00 36.38 33.02 1yhq s VAL 228 CO 0.30 0.04 2.00 -0.07 0.00 0.00 0.00 175.10 177.37 1yhq h LEU 229 N 8.36 0.72 -6.74 3.92 3.38 -1.33 -3.26 115.31 120.37 1yhq h LEU 229 Ca -0.32 -0.02 -0.64 0.00 0.09 0.00 0.00 57.88 56.99 1yhq h LEU 229 Cb 1.14 -0.18 -0.40 0.00 0.09 0.00 0.00 40.66 41.31 1yhq h LEU 229 CO 0.62 0.53 -0.41 -0.46 0.09 0.00 0.00 178.44 178.81 1yhq n ASN 230 N -4.43 3.77 -4.83 -0.43 6.94 -1.26 -5.09 115.26 109.93 1yhq n ASN 230 Ca 0.06 -3.32 -0.31 0.00 -0.02 0.00 0.00 54.58 51.00 1yhq n ASN 230 Cb 0.05 -0.80 0.05 0.00 -2.36 0.00 0.00 39.78 36.72 1yhq n ASN 230 CO 0.00 0.00 0.00 -2.16 -1.03 0.00 0.00 177.26 174.07 1yhq s PRO 231 N -1.98 2.81 -0.01 -0.53 0.04 -1.23 -4.80 135.00 129.29 1yhq s PRO 231 Ca 0.32 0.82 -0.17 0.00 0.04 0.00 0.00 61.00 62.02 1yhq s PRO 231 Cb 0.04 -1.99 -0.06 0.00 0.04 0.00 0.00 34.50 32.54 1yhq s PRO 231 CO -0.08 -1.16 0.46 0.99 0.04 0.00 0.00 177.00 177.26 1yhq s THR 232 N -3.11 4.99 -0.37 1.26 2.01 -1.26 -4.88 115.64 114.28 1yhq s THR 232 Ca 0.58 0.95 -0.13 0.00 0.31 0.00 0.00 61.69 63.41 1yhq s THR 232 Cb -0.14 -3.78 -0.00 0.00 0.01 0.00 0.00 72.50 68.59 1yhq s THR 232 CO 0.54 0.52 0.25 -0.31 -0.69 0.00 0.00 174.62 174.94 1yhq s TYR 233 N -0.71 3.23 0.15 4.92 1.51 -1.26 -1.35 117.35 123.84 1yhq s TYR 233 Ca 0.25 -0.42 0.06 0.00 -1.01 0.00 0.00 57.07 55.95 1yhq s TYR 233 Cb -0.17 -2.51 -0.04 0.00 -0.11 0.00 0.00 41.96 39.13 1yhq s TYR 233 CO 0.14 -0.47 0.05 0.08 -1.11 0.00 0.00 175.55 174.24 1yhq s VAL 234 N 1.69 4.06 -0.31 0.71 1.01 -0.52 -4.84 120.40 122.20 1yhq s VAL 234 Ca 0.05 -1.19 -0.26 0.00 0.00 0.00 0.00 61.98 60.58 1yhq s VAL 234 Cb -0.18 -3.02 0.01 0.00 0.00 0.00 0.00 36.38 33.18 1yhq s VAL 234 CO 0.10 -0.05 0.94 -1.61 0.00 0.00 0.00 175.10 174.48 1yhq s GLU 235 N -2.82 4.02 0.00 2.72 8.01 -1.26 -1.10 118.70 128.27 1yhq s GLU 235 Ca 0.28 0.85 0.00 0.00 0.01 0.00 0.00 54.97 56.11 1yhq s GLU 235 Cb -0.10 -3.73 0.00 0.00 -4.31 0.00 0.00 34.13 25.99 1yhq s GLU 235 CO 0.20 -0.79 0.37 0.28 0.01 0.00 0.00 175.26 175.33