#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qvg s GLU 96 N 0.00 1.23 0.16 -2.82 -1.05 -1.18 -4.90 118.70 110.14 1qvg s GLU 96 Ca 0.00 -1.57 -0.28 0.00 -0.15 0.00 0.00 54.97 52.96 1qvg s GLU 96 Cb 0.00 -0.74 -0.07 0.00 -0.44 0.00 0.00 34.13 32.87 1qvg s GLU 96 CO 0.00 0.03 0.89 -0.51 0.95 0.00 0.00 175.26 176.62 1qvg s LEU 97 N -3.26 4.56 -0.04 1.83 1.43 -1.26 0.15 118.68 122.10 1qvg s LEU 97 Ca 0.22 1.77 -0.01 0.00 -1.03 0.00 0.00 54.13 55.08 1qvg s LEU 97 Cb 0.03 -3.48 0.03 0.00 0.03 0.00 0.00 46.19 42.80 1qvg s LEU 97 CO 0.05 0.08 0.07 -1.10 0.23 0.00 0.00 176.35 175.69 1qvg s GLN 98 N -0.66 -0.00 0.25 1.70 -1.52 0.10 -4.91 119.66 114.62 1qvg s GLN 98 Ca 0.41 0.28 -0.30 0.00 -1.95 0.00 0.00 55.36 53.80 1qvg s GLN 98 Cb -0.24 -0.25 -0.09 0.00 -0.22 0.00 0.00 33.01 32.21 1qvg s GLN 98 CO 0.29 -0.19 1.07 0.00 -0.25 0.00 0.00 175.29 176.21 1qvg s ALA 99 N 1.27 3.39 0.75 6.09 0.00 -1.26 -2.02 121.76 129.97 1qvg s ALA 99 Ca -0.07 0.83 -0.11 0.00 0.00 0.00 0.00 51.96 52.61 1qvg s ALA 99 Cb -0.12 -3.31 0.04 0.00 0.00 0.00 0.00 23.12 19.73 1qvg s ALA 99 CO -0.04 -0.10 1.09 1.03 0.00 0.00 0.00 175.76 177.73 1qvg s ARG 100 N -1.15 2.42 0.99 0.00 0.52 -0.75 -4.90 118.95 116.09 1qvg s ARG 100 Ca 0.45 1.15 0.00 0.00 -0.52 0.00 0.00 55.73 56.81 1qvg s ARG 100 Cb -0.30 -1.92 0.00 0.00 0.52 0.00 0.00 34.95 33.25 1qvg s ARG 100 CO 0.38 -1.51 0.00 0.41 0.02 0.00 0.00 175.30 174.60 1qvg n GLY 101 N -1.29 -1.96 2.75 -3.53 0.00 -1.26 -4.50 105.19 95.39 1qvg n GLY 101 Ca 0.09 -1.38 -0.42 0.00 0.00 0.00 0.00 46.02 44.31 1qvg n GLY 101 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1qvg n LEU 102 N 0.00 7.05 0.01 0.99 4.77 -1.26 -4.77 117.00 123.78 1qvg n LEU 102 Ca 0.00 -4.66 0.01 0.00 -0.03 0.00 0.00 56.01 51.33 1qvg n LEU 102 Cb 0.02 -1.47 0.33 0.00 -2.33 0.00 0.00 43.42 39.97 1qvg n LEU 102 CO 0.00 1.54 0.98 0.74 -1.33 0.00 0.00 177.39 179.32 1qvg h THR 103 N 3.48 1.18 0.00 -5.08 2.02 -1.87 -2.56 112.91 110.08 1qvg h THR 103 Ca 0.49 -0.66 0.00 0.00 0.77 0.00 0.00 66.41 67.01 1qvg h THR 103 Cb 0.55 0.87 0.00 0.00 -1.74 0.00 0.00 68.15 67.83 1qvg h THR 103 CO 1.62 0.23 -0.09 -0.62 0.37 0.00 0.00 175.52 177.03 1qvg n GLU 104 N -4.32 0.15 -1.63 6.66 -0.58 -1.26 -4.92 120.64 114.74 1qvg n GLU 104 Ca 0.02 0.11 -0.43 0.00 -0.42 0.00 0.00 57.16 56.44 1qvg n GLU 104 Cb 0.21 -1.66 -0.01 0.00 -0.57 0.00 0.00 31.44 29.41 1qvg n GLU 104 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 1qvg n LYS 105 N -1.92 1.63 -4.90 3.49 4.81 -0.96 -5.00 118.16 115.29 1qvg n LYS 105 Ca 0.06 0.57 -0.27 0.00 -0.87 0.00 0.00 58.31 57.80 1qvg n LYS 105 Cb 0.39 -2.06 -0.16 0.00 0.02 0.00 0.00 35.03 33.22 1qvg n LYS 105 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1qvg s THR 106 N -1.12 1.54 0.78 3.15 2.01 -1.26 -5.03 115.64 115.70 1qvg s THR 106 Ca 0.59 -0.77 -0.11 0.00 0.31 0.00 0.00 61.69 61.71 1qvg s THR 106 Cb -0.62 -1.32 0.06 0.00 0.01 0.00 0.00 72.50 70.63 1qvg s THR 106 CO 0.60 0.44 1.09 -2.16 -0.69 0.00 0.00 174.62 173.90 1qvg s PRO 107 N 0.10 2.19 -0.15 4.92 0.04 -1.26 -5.01 135.00 135.82 1qvg s PRO 107 Ca -0.06 0.84 -0.06 0.00 0.04 0.00 0.00 61.00 61.76 1qvg s PRO 107 Cb -0.13 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.46 1qvg s PRO 107 CO 0.03 -1.60 0.04 0.16 0.04 0.00 0.00 177.00 175.67 1qvg s ASP 108 N -3.71 5.45 0.03 6.66 -4.77 -1.21 -5.02 116.67 114.09 1qvg s ASP 108 Ca 0.61 0.08 0.03 0.00 -3.30 0.00 0.00 52.55 49.97 1qvg s ASP 108 Cb -0.15 -1.84 -0.02 0.00 -1.09 0.00 0.00 42.92 39.82 1qvg s ASP 108 CO 0.55 0.23 -0.09 -0.76 0.70 0.00 0.00 175.17 175.81 1qvg s LEU 109 N 0.01 2.16 1.08 2.11 1.43 -1.26 -4.88 118.68 119.33 1qvg s LEU 109 Ca 0.05 -0.40 -0.15 0.00 -1.03 0.00 0.00 54.13 52.59 1qvg s LEU 109 Cb -0.12 -0.32 0.13 0.00 0.03 0.00 0.00 46.19 45.91 1qvg s LEU 109 CO 0.01 -0.06 0.38 -1.54 0.23 0.00 0.00 176.35 175.38 1qvg n SER 110 N 1.99 -1.99 -0.10 2.29 3.41 -1.26 -4.68 113.62 113.29 1qvg n SER 110 Ca -0.19 0.01 -0.03 0.00 -0.26 0.00 0.00 58.87 58.40 1qvg n SER 110 Cb 0.56 -1.11 0.19 0.00 -0.26 0.00 0.00 64.21 63.58 1qvg n SER 110 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1qvg h ASP 111 N -2.08 0.72 0.55 4.04 3.32 -2.00 -2.49 116.42 118.48 1qvg h ASP 111 Ca -0.52 -0.16 -0.03 0.00 0.02 0.00 0.00 57.03 56.34 1qvg h ASP 111 Cb 1.33 -0.19 0.01 0.00 0.22 0.00 0.00 39.33 40.70 1qvg h ASP 111 CO 0.40 0.78 -0.26 -0.08 -1.72 0.00 0.00 179.24 178.35 1qvg h GLU 112 N 0.72 -0.71 -0.71 3.56 4.57 -2.00 -2.27 114.58 117.74 1qvg h GLU 112 Ca 0.15 0.05 0.14 0.00 -1.18 0.00 0.00 59.36 58.52 1qvg h GLU 112 Cb 0.41 0.16 -0.10 0.00 -0.16 0.00 0.00 28.75 29.06 1qvg h GLU 112 CO 0.01 -0.40 0.21 -0.44 -1.18 0.00 0.00 179.01 177.21 1qvg h ASP 113 N -0.97 0.10 0.26 1.04 5.19 -1.89 0.19 116.42 120.33 1qvg h ASP 113 Ca -0.08 0.13 -0.03 0.00 -0.62 0.00 0.00 57.03 56.43 1qvg h ASP 113 Cb 0.63 0.15 -0.00 0.00 0.18 0.00 0.00 39.33 40.29 1qvg h ASP 113 CO 0.12 0.02 -0.15 0.00 -3.12 0.00 0.00 179.24 176.11 1qvg h ALA 114 N 1.56 1.49 0.03 3.45 0.00 -1.41 0.26 119.26 124.63 1qvg h ALA 114 Ca 0.39 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 1qvg h ALA 114 Cb 0.63 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1qvg h ALA 114 CO -0.45 0.19 -0.01 -0.09 0.00 0.00 0.00 179.25 178.89 1qvg h ARG 115 N 0.00 -0.04 -0.75 0.00 2.43 -0.11 -1.82 114.38 114.09 1qvg h ARG 115 Ca -0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.17 1qvg h ARG 115 Cb 0.32 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.85 1qvg h ARG 115 CO 0.02 0.52 0.45 -0.07 -1.51 0.00 0.00 179.97 179.38 1qvg h LEU 116 N -0.63 0.90 -0.40 3.80 3.38 -0.44 0.20 115.31 122.13 1qvg h LEU 116 Ca -0.00 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1qvg h LEU 116 Cb 0.58 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 1qvg h LEU 116 CO 0.01 0.71 0.20 0.25 0.09 0.00 0.00 178.44 179.70 1qvg h LEU 117 N 1.03 0.51 -1.77 1.67 5.85 -0.57 -0.15 115.31 121.87 1qvg h LEU 117 Ca 0.27 -0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.85 1qvg h LEU 117 Cb -0.03 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 40.87 1qvg h LEU 117 CO -0.05 0.47 -0.16 0.74 -0.34 0.00 0.00 178.44 179.10 1qvg h THR 118 N 0.51 0.90 0.64 1.05 2.02 -0.53 -1.93 112.91 115.56 1qvg h THR 118 Ca 0.14 -0.58 -0.03 0.00 0.77 0.00 0.00 66.41 66.70 1qvg h THR 118 Cb 0.09 1.34 0.01 0.00 -1.74 0.00 0.00 68.15 67.84 1qvg h THR 118 CO -0.02 0.15 -0.31 -0.61 0.37 0.00 0.00 175.52 175.11 1qvg h GLN 119 N 0.00 -0.83 -0.89 6.66 4.15 0.40 -2.54 115.11 122.06 1qvg h GLN 119 Ca -0.00 0.06 0.23 0.00 0.77 0.00 0.00 58.65 59.70 1qvg h GLN 119 Cb 0.32 0.19 -0.16 0.00 0.21 0.00 0.00 27.48 28.04 1qvg h GLN 119 CO 0.02 -0.55 0.04 -0.09 -1.93 0.00 0.00 178.83 176.32 1qvg h ARG 120 N -1.13 0.07 0.00 1.69 2.43 -0.81 1.05 114.38 117.68 1qvg h ARG 120 Ca -0.09 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.06 1qvg h ARG 120 Cb 0.66 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.19 1qvg h ARG 120 CO 0.14 0.05 -0.09 1.25 -1.51 0.00 0.00 179.97 179.81 1qvg h HIS 121 N 0.08 0.00 0.00 2.20 2.76 -1.35 -1.90 115.15 116.94 1qvg h HIS 121 Ca 0.52 0.00 -0.10 0.00 -2.20 0.00 0.00 60.37 58.59 1qvg h HIS 121 Cb 1.01 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.95 1qvg h HIS 121 CO -0.44 0.09 -0.70 -0.09 -1.30 0.00 0.00 177.93 175.49 1qvg h ARG 122 N 0.00 0.00 0.16 5.26 2.43 0.14 -3.39 114.38 118.98 1qvg h ARG 122 Ca -0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1qvg h ARG 122 Cb 0.48 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 1qvg h ARG 122 CO 0.01 0.57 -0.08 0.28 -1.51 0.00 0.00 179.97 179.24 1qvg h VAL 123 N -1.00 0.85 -0.61 0.20 2.07 -0.72 -3.49 116.25 113.55 1qvg h VAL 123 Ca -0.15 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.35 1qvg h VAL 123 Cb 0.86 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 31.49 1qvg h VAL 123 CO -0.09 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.11 1qvg n GLY 124 N -1.16 -1.01 3.46 2.17 0.00 -0.71 -4.99 105.19 102.94 1qvg n GLY 124 Ca -0.09 -1.17 -0.10 0.00 0.00 0.00 0.00 46.02 44.66 1qvg n GLY 124 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1qvg s LYS 125 N 0.00 1.29 0.77 1.61 -2.85 -1.26 -5.04 119.74 114.26 1qvg s LYS 125 Ca 0.00 -0.72 -0.11 0.00 -1.00 0.00 0.00 55.97 54.14 1qvg s LYS 125 Cb 0.00 0.53 0.05 0.00 -2.06 0.00 0.00 37.83 36.36 1qvg s LYS 125 CO 0.00 -0.55 1.09 -1.25 0.10 0.00 0.00 175.35 174.75 1qvg s PRO 126 N -3.82 2.29 0.48 1.78 0.04 -1.26 -4.94 135.00 129.58 1qvg s PRO 126 Ca 0.05 0.64 0.14 0.00 0.04 0.00 0.00 61.00 61.87 1qvg s PRO 126 Cb -0.01 -1.94 1.14 0.00 0.04 0.00 0.00 34.50 33.73 1qvg s PRO 126 CO -0.08 -1.47 2.10 1.96 0.04 0.00 0.00 177.00 179.55 1qvg h GLN 127 N -0.98 0.19 -6.35 4.56 4.20 -2.02 -3.46 115.11 111.24 1qvg h GLN 127 Ca -0.46 -0.01 -0.47 0.00 0.06 0.00 0.00 58.65 57.77 1qvg h GLN 127 Cb 1.26 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.99 1qvg h GLN 127 CO 0.60 0.13 -0.88 1.19 -0.67 0.00 0.00 178.83 179.19 1qvg n PHE 128 N -4.50 -1.75 -3.41 2.96 0.99 -1.26 -4.96 117.46 105.53 1qvg n PHE 128 Ca 0.01 0.74 -0.24 0.00 -0.00 0.00 0.00 57.45 57.96 1qvg n PHE 128 Cb 0.14 -3.88 -0.01 0.00 -1.00 0.00 0.00 39.48 34.73 1qvg n PHE 128 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 176.76 175.96 1qvg s ASN 129 N -4.27 6.28 0.50 4.37 0.01 -1.26 -4.52 114.94 116.06 1qvg s ASN 129 Ca 0.06 0.41 -0.23 0.00 -0.71 0.00 0.00 52.86 52.39 1qvg s ASN 129 Cb -0.02 -2.00 -0.06 0.00 0.41 0.00 0.00 41.25 39.58 1qvg s ASN 129 CO 0.86 -0.29 1.37 -0.60 -1.51 0.00 0.00 177.10 176.93 1qvg s ARG 130 N -4.30 3.39 0.18 -0.60 3.52 0.53 -4.89 118.95 116.79 1qvg s ARG 130 Ca 0.40 2.27 -0.32 0.00 -0.13 0.00 0.00 55.73 57.95 1qvg s ARG 130 Cb -0.10 -2.42 -0.11 0.00 -1.56 0.00 0.00 34.95 30.76 1qvg s ARG 130 CO 0.36 -1.00 1.68 1.14 -0.81 0.00 0.00 175.30 176.67 1qvg s GLN 131 N -2.71 4.15 -1.49 5.12 -2.07 -1.26 -2.45 119.66 118.95 1qvg s GLN 131 Ca 0.67 2.52 0.00 0.00 -1.82 0.00 0.00 55.36 56.73 1qvg s GLN 131 Cb -0.41 -3.16 0.00 0.00 -1.09 0.00 0.00 33.01 28.35 1qvg s GLN 131 CO 0.50 -0.72 0.00 -0.25 -1.32 0.00 0.00 175.29 173.50 1qvg n ASP 132 N 4.18 -4.74 0.27 12.60 8.00 -1.26 -4.87 116.55 130.74 1qvg n ASP 132 Ca 0.15 0.22 0.16 0.00 0.71 0.00 0.00 54.79 56.03 1qvg n ASP 132 Cb 0.37 -3.70 0.73 0.00 -0.02 0.00 0.00 41.12 38.49 1qvg n ASP 132 CO 0.00 0.00 0.00 1.12 -0.39 0.00 0.00 177.20 177.93 1qvg h HIS 133 N 0.00 0.00 -0.00 1.24 2.07 -1.74 -1.98 115.15 114.73 1qvg h HIS 133 Ca -0.33 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.19 1qvg h HIS 133 Cb 1.11 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.09 1qvg h HIS 133 CO 0.42 0.07 -0.08 -2.39 -3.07 0.00 0.00 177.93 172.88 1qvg n HIS 134 N -3.26 0.00 -0.01 6.12 1.44 -1.26 -3.41 115.22 114.83 1qvg n HIS 134 Ca -0.00 0.00 0.08 0.00 -2.01 0.00 0.00 57.72 55.78 1qvg n HIS 134 Cb 0.28 -0.21 -0.15 0.00 0.12 0.00 0.00 29.99 30.03 1qvg n HIS 134 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 1qvg n LYS 135 N -1.07 0.66 -3.77 -1.40 5.02 -0.75 -4.92 118.16 111.93 1qvg n LYS 135 Ca 0.14 -0.13 -0.19 0.00 -2.02 0.00 0.00 58.31 56.11 1qvg n LYS 135 Cb 0.26 -1.55 -0.17 0.00 -0.02 0.00 0.00 35.03 33.55 1qvg n LYS 135 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1qvg s LYS 136 N -3.34 0.14 0.19 1.97 2.47 -1.22 -5.03 119.74 114.93 1qvg s LYS 136 Ca -0.08 0.22 -0.12 0.00 -1.56 0.00 0.00 55.97 54.44 1qvg s LYS 136 Cb 0.12 -0.53 0.17 0.00 -1.46 0.00 0.00 37.83 36.13 1qvg s LYS 136 CO 0.89 -0.25 1.80 0.87 0.16 0.00 0.00 175.35 178.82 1qvg h LYS 137 N 7.90 0.57 0.00 4.03 1.57 -1.92 -0.40 116.57 128.33 1qvg h LYS 137 Ca -0.27 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.47 1qvg h LYS 137 Cb 1.12 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.30 1qvg h LYS 137 CO 0.31 0.38 0.10 0.07 -0.57 0.00 0.00 179.45 179.75 1qvg h ARG 138 N 0.59 0.00 -5.09 3.15 0.11 -1.95 -3.38 114.38 107.81 1qvg h ARG 138 Ca 0.25 0.00 -0.67 0.00 0.10 0.00 0.00 59.98 59.66 1qvg h ARG 138 Cb 0.13 0.00 -0.17 0.00 1.11 0.00 0.00 29.97 31.05 1qvg h ARG 138 CO -0.16 0.00 -0.12 0.08 0.10 0.00 0.00 179.97 179.88 1qvg s VAL 139 N -4.04 5.04 0.71 0.08 1.01 -0.16 -5.05 120.40 117.99 1qvg s VAL 139 Ca -0.04 0.03 -0.11 0.00 0.00 0.00 0.00 61.98 61.85 1qvg s VAL 139 Cb 0.11 -4.00 0.02 0.00 0.00 0.00 0.00 36.38 32.50 1qvg s VAL 139 CO 0.34 -0.32 1.08 -0.94 0.00 0.00 0.00 175.10 175.26 1qvg s SER 140 N 1.81 5.33 0.37 3.32 1.04 -1.26 -4.64 113.70 119.67 1qvg s SER 140 Ca 0.16 1.30 0.14 0.00 0.48 0.00 0.00 55.95 58.03 1qvg s SER 140 Cb -0.16 -2.14 0.73 0.00 0.10 0.00 0.00 66.02 64.56 1qvg s SER 140 CO 0.14 -1.44 1.81 0.00 0.98 0.00 0.00 173.24 174.74 1qvg h THR 141 N -0.72 1.20 -1.60 2.02 1.03 -1.93 -3.41 112.91 109.50 1qvg h THR 141 Ca -0.45 -1.33 -0.63 0.00 -0.01 0.00 0.00 66.41 63.99 1qvg h THR 141 Cb 1.24 1.73 0.14 0.00 -1.07 0.00 0.00 68.15 70.19 1qvg h THR 141 CO 0.61 0.37 -0.75 -0.24 -0.01 0.00 0.00 175.52 175.51 1qvg n SER 142 N -3.98 -2.11 -4.73 0.00 2.88 -1.26 -0.35 113.62 104.07 1qvg n SER 142 Ca -0.02 0.91 -0.40 0.00 -1.33 0.00 0.00 58.87 58.04 1qvg n SER 142 Cb 0.42 -0.94 -0.05 0.00 -0.75 0.00 0.00 64.21 62.90 1qvg n SER 142 CO 0.00 0.00 0.00 0.86 -1.23 0.00 0.00 175.04 174.67 1qvg s TRP 143 N -1.46 3.69 -0.01 0.66 -0.11 -1.26 -3.60 118.94 116.85 1qvg s TRP 143 Ca 0.61 1.45 0.02 0.00 1.22 0.00 0.00 56.10 59.40 1qvg s TRP 143 Cb -0.71 -2.85 -0.01 0.00 -1.50 0.00 0.00 33.47 28.40 1qvg s TRP 143 CO 0.60 0.20 -0.08 1.03 -4.62 0.00 0.00 176.95 174.09 1qvg s ARG 144 N 0.25 0.62 0.10 5.86 1.81 -1.26 -4.98 118.95 121.35 1qvg s ARG 144 Ca 0.40 -0.27 -0.31 0.00 -1.72 0.00 0.00 55.73 53.83 1qvg s ARG 144 Cb -0.20 -0.60 -0.08 0.00 -0.45 0.00 0.00 34.95 33.62 1qvg s ARG 144 CO 0.22 0.16 1.51 0.21 -0.68 0.00 0.00 175.30 176.73 1qvg s LYS 145 N -0.15 4.25 0.06 3.54 2.20 -1.26 -4.67 119.74 123.71 1qvg s LYS 145 Ca 0.03 2.21 -0.31 0.00 -0.36 0.00 0.00 55.97 57.54 1qvg s LYS 145 Cb -0.03 -3.36 -0.08 0.00 -1.51 0.00 0.00 37.83 32.85 1qvg s LYS 145 CO -0.00 -0.59 1.57 -1.25 -0.36 0.00 0.00 175.35 174.72 1qvg s PRO 146 N 1.73 4.23 0.00 4.03 0.04 -1.26 -4.88 135.00 138.88 1qvg s PRO 146 Ca 0.69 2.22 0.09 0.00 0.04 0.00 0.00 61.00 64.04 1qvg s PRO 146 Cb -0.39 -3.54 -0.05 0.00 0.04 0.00 0.00 34.50 30.56 1qvg s PRO 146 CO 0.30 -0.67 0.51 0.54 0.04 0.00 0.00 177.00 177.73 1qvg n ARG 147 N 5.33 2.99 -1.69 4.56 1.74 -1.26 -4.72 116.66 123.61 1qvg n ARG 147 Ca 0.15 -0.31 -0.44 0.00 -0.77 0.00 0.00 57.85 56.47 1qvg n ARG 147 Cb 0.41 -1.01 -0.03 0.00 -1.02 0.00 0.00 32.46 30.81 1qvg n ARG 147 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1qvg n GLY 148 N 1.04 1.14 0.29 -0.13 0.00 -1.26 -4.82 105.19 101.45 1qvg n GLY 148 Ca 0.03 0.58 0.13 0.00 0.00 0.00 0.00 46.02 46.76 1qvg n GLY 148 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1qvg h GLN 149 N 5.51 0.00 -0.01 1.61 1.08 -2.02 -1.63 115.11 119.66 1qvg h GLN 149 Ca -0.45 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.75 1qvg h GLN 149 Cb 1.25 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.68 1qvg h GLN 149 CO 0.86 0.00 -0.60 1.28 -0.95 0.00 0.00 178.83 179.42 1qvg n LEU 150 N -4.13 1.25 -4.67 1.46 4.77 -1.26 -4.98 117.00 109.44 1qvg n LEU 150 Ca -0.02 -0.63 -0.64 0.00 -0.03 0.00 0.00 56.01 54.69 1qvg n LEU 150 Cb 0.11 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.11 1qvg n LEU 150 CO 0.30 0.26 1.01 -0.24 -1.33 0.00 0.00 177.39 177.39 1qvg n SER 151 N -0.78 1.03 0.24 -1.43 2.88 -0.62 -4.82 113.62 110.12 1qvg n SER 151 Ca 0.05 1.17 0.08 0.00 -1.33 0.00 0.00 58.87 58.84 1qvg n SER 151 Cb 0.32 -0.93 0.58 0.00 -0.75 0.00 0.00 64.21 63.42 1qvg n SER 151 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 1qvg h LYS 152 N 4.68 0.00 0.01 -1.46 1.79 -1.95 -1.87 116.57 117.77 1qvg h LYS 152 Ca -0.46 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 57.99 1qvg h LYS 152 Cb 1.38 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.03 1qvg h LYS 152 CO 0.88 0.17 -0.07 0.37 -1.08 0.00 0.00 179.45 179.72 1qvg h GLN 153 N 0.00 0.03 -0.22 3.15 4.15 -1.87 -1.27 115.11 119.07 1qvg h GLN 153 Ca -0.00 -0.05 0.07 0.00 0.77 0.00 0.00 58.65 59.44 1qvg h GLN 153 Cb 0.33 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.02 1qvg h GLN 153 CO 0.02 0.97 0.35 -0.09 -1.93 0.00 0.00 178.83 178.15 1qvg h ARG 154 N -0.89 0.00 -0.00 1.69 2.43 -1.78 0.88 114.38 116.71 1qvg h ARG 154 Ca -0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1qvg h ARG 154 Cb 1.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.55 1qvg h ARG 154 CO 0.01 0.00 -0.56 0.54 -1.51 0.00 0.00 179.97 178.46 1qvg n ARG 155 N -3.45 0.25 -2.54 0.20 1.74 -0.73 -4.97 116.66 107.16 1qvg n ARG 155 Ca 0.03 -0.17 -0.04 0.00 -0.77 0.00 0.00 57.85 56.90 1qvg n ARG 155 Cb 0.47 -1.50 0.02 0.00 -1.02 0.00 0.00 32.46 30.43 1qvg n ARG 155 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1qvg n GLY 156 N 1.46 0.48 3.66 -0.13 0.00 0.30 -5.00 105.19 105.96 1qvg n GLY 156 Ca 0.07 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.24 1qvg n GLY 156 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1qvg s ILE 157 N -3.07 4.82 -0.14 -0.61 1.01 -0.49 -4.95 121.20 117.77 1qvg s ILE 157 Ca 0.07 1.70 -0.37 0.00 0.00 0.00 0.00 60.65 62.05 1qvg s ILE 157 Cb -0.03 -4.17 -0.14 0.00 0.01 0.00 0.00 42.46 38.13 1qvg s ILE 157 CO 0.15 -0.06 1.76 1.17 0.00 0.00 0.00 174.94 177.97 1qvg n LYS 158 N 5.77 1.68 0.00 2.79 4.81 -1.26 -1.20 118.16 130.75 1qvg n LYS 158 Ca 0.07 0.61 0.00 0.00 -0.87 0.00 0.00 58.31 58.12 1qvg n LYS 158 Cb 0.48 -2.37 0.00 0.00 0.02 0.00 0.00 35.03 33.15 1qvg n LYS 158 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1qvg n GLY 159 N 4.11 1.78 0.72 3.14 0.00 -1.26 -4.96 105.19 108.73 1qvg n GLY 159 Ca 0.23 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.38 1qvg n GLY 159 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1qvg n LYS 160 N -0.49 2.00 0.00 1.61 4.76 -0.34 -5.05 118.16 120.65 1qvg n LYS 160 Ca 0.00 -1.45 0.00 0.00 -2.87 0.00 0.00 58.31 53.99 1qvg n LYS 160 Cb 0.00 -1.47 0.00 0.00 -1.84 0.00 0.00 35.03 31.72 1qvg n LYS 160 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1qvg n GLY 161 N 1.26 2.57 3.76 0.72 0.00 -1.26 -4.76 105.19 107.49 1qvg n GLY 161 Ca 0.17 -1.83 -0.40 0.00 0.00 0.00 0.00 46.02 43.96 1qvg n GLY 161 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1qvg s ASP 162 N 0.00 7.54 -0.01 1.61 1.01 -1.26 -4.91 116.67 120.65 1qvg s ASP 162 Ca 0.00 1.82 -0.17 0.00 0.71 0.00 0.00 52.55 54.91 1qvg s ASP 162 Cb 0.00 -2.57 -0.06 0.00 1.01 0.00 0.00 42.92 41.31 1qvg s ASP 162 CO 0.00 0.17 0.49 -0.89 0.21 0.00 0.00 175.17 175.15 1qvg s THR 163 N -1.11 4.98 0.03 -1.27 2.01 -1.26 -4.80 115.64 114.22 1qvg s THR 163 Ca 0.39 1.02 -0.30 0.00 0.31 0.00 0.00 61.69 63.11 1qvg s THR 163 Cb -0.25 -3.81 -0.09 0.00 0.01 0.00 0.00 72.50 68.36 1qvg s THR 163 CO 0.30 0.49 1.98 0.52 -0.69 0.00 0.00 174.62 177.22 1qvg n VAL 164 N 2.36 0.77 -4.15 3.82 0.31 -1.26 -4.98 118.33 115.20 1qvg n VAL 164 Ca -0.10 -0.15 -0.10 0.00 -0.01 0.00 0.00 64.34 63.98 1qvg n VAL 164 Cb 0.52 -2.33 -0.10 0.00 -0.91 0.00 0.00 33.84 31.02 1qvg n VAL 164 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1qvg s GLU 165 N 4.51 0.82 0.51 5.55 2.02 -1.26 -5.03 118.70 125.82 1qvg s GLU 165 Ca 0.89 -1.35 0.28 0.00 0.02 0.00 0.00 54.97 54.82 1qvg s GLU 165 Cb -0.43 -0.01 1.35 0.00 0.10 0.00 0.00 34.13 35.14 1qvg s GLU 165 CO 0.42 -0.11 2.01 0.00 0.02 0.00 0.00 175.26 177.60 1qvg h ALA 166 N 2.96 1.15 0.00 5.21 0.00 -2.02 -2.48 119.26 124.09 1qvg h ALA 166 Ca -0.35 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1qvg h ALA 166 Cb 1.17 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1qvg h ALA 166 CO 0.64 0.16 0.00 0.78 0.00 0.00 0.00 179.25 180.83 1qvg h GLY 167 N 1.30 0.00 1.78 0.00 0.00 -1.97 -2.11 103.07 102.06 1qvg h GLY 167 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1qvg h GLY 167 CO 0.02 0.00 -0.16 0.69 0.00 0.00 0.00 176.54 177.09 1qvg n PHE 168 N -2.97 0.73 -1.03 5.60 3.01 -0.93 -4.96 117.46 116.91 1qvg n PHE 168 Ca -0.02 0.21 -0.36 0.00 1.01 0.00 0.00 57.45 58.29 1qvg n PHE 168 Cb 0.09 -0.81 0.06 0.00 -0.01 0.00 0.00 39.48 38.81 1qvg n PHE 168 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1qvg n ARG 169 N -2.13 -0.01 -3.21 -1.08 5.12 -0.80 -5.00 116.66 109.55 1qvg n ARG 169 Ca 0.05 0.02 -0.27 0.00 -1.93 0.00 0.00 57.85 55.72 1qvg n ARG 169 Cb 0.42 -1.42 -0.02 0.00 -1.16 0.00 0.00 32.46 30.28 1qvg n ARG 169 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1qvg s SER 170 N -1.38 6.37 0.09 0.55 1.04 -1.26 -5.02 113.70 114.09 1qvg s SER 170 Ca 0.52 0.69 -0.36 0.00 0.48 0.00 0.00 55.95 57.29 1qvg s SER 170 Cb -0.27 -2.14 -0.16 0.00 0.10 0.00 0.00 66.02 63.56 1qvg s SER 170 CO 0.71 -0.30 1.46 -2.65 0.98 0.00 0.00 173.24 173.44 1qvg n PRO 171 N -1.42 1.51 -0.29 4.02 -0.02 -1.26 -4.73 135.00 132.82 1qvg n PRO 171 Ca -0.02 0.55 -0.07 0.00 -2.02 0.00 0.00 63.50 61.94 1qvg n PRO 171 Cb 0.55 -2.24 -0.03 0.00 -0.02 0.00 0.00 33.50 31.76 1qvg n PRO 171 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1qvg h THR 172 N 3.58 0.05 -0.75 3.45 2.02 -1.97 -1.29 112.91 118.01 1qvg h THR 172 Ca -0.47 0.00 0.22 0.00 0.77 0.00 0.00 66.41 66.93 1qvg h THR 172 Cb 1.31 0.05 -0.03 0.00 -1.74 0.00 0.00 68.15 67.74 1qvg h THR 172 CO 0.83 0.00 0.71 0.00 0.37 0.00 0.00 175.52 177.43 1qvg h ALA 173 N 0.81 2.57 0.00 6.16 0.00 -2.00 -2.98 119.26 123.82 1qvg h ALA 173 Ca 0.22 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1qvg h ALA 173 Cb 0.55 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1qvg h ALA 173 CO -0.81 -1.10 -1.10 0.28 0.00 0.00 0.00 179.25 176.52 1qvg n VAL 174 N -3.76 0.00 -1.56 0.00 0.31 -0.60 -5.00 118.33 107.72 1qvg n VAL 174 Ca 0.16 -0.13 -0.61 0.00 -0.01 0.00 0.00 64.34 63.75 1qvg n VAL 174 Cb 0.97 0.46 -0.09 0.00 -0.91 0.00 0.00 33.84 34.27 1qvg n VAL 174 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1qvg n ARG 175 N -1.60 0.46 0.00 5.55 0.63 -0.59 -0.67 116.66 120.44 1qvg n ARG 175 Ca -0.01 0.15 0.00 0.00 -0.92 0.00 0.00 57.85 57.08 1qvg n ARG 175 Cb 0.11 -1.80 0.00 0.00 0.45 0.00 0.00 32.46 31.23 1qvg n ARG 175 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1qvg n GLY 176 N 5.41 1.44 3.77 5.14 0.00 -1.26 -5.06 105.19 114.63 1qvg n GLY 176 Ca 0.38 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 46.02 1qvg n GLY 176 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qvg s LYS 177 N -0.85 4.04 0.71 1.61 1.02 0.16 -4.69 119.74 121.74 1qvg s LYS 177 Ca 0.00 1.90 -0.14 0.00 0.02 0.00 0.00 55.97 57.75 1qvg s LYS 177 Cb 0.00 -2.69 0.03 0.00 -0.52 0.00 0.00 37.83 34.65 1qvg s LYS 177 CO 0.00 -0.35 1.14 -1.58 -0.92 0.00 0.00 175.35 173.64 1qvg s HIS 178 N -1.38 2.35 0.53 3.18 5.65 -0.37 -4.84 115.29 120.41 1qvg s HIS 178 Ca 0.57 1.59 0.31 0.00 0.25 0.00 0.00 55.06 57.78 1qvg s HIS 178 Cb -0.32 -3.27 1.47 0.00 -1.18 0.00 0.00 32.58 29.28 1qvg s HIS 178 CO 0.41 -2.09 1.90 -1.00 -0.65 0.00 0.00 174.74 173.30 1qvg h PRO 179 N -0.35 0.01 0.00 2.88 0.13 -1.94 0.17 132.00 132.90 1qvg h PRO 179 Ca -0.46 -0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.66 1qvg h PRO 179 Cb 1.26 -0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.39 1qvg h PRO 179 CO 0.51 0.01 -0.04 0.66 -0.23 0.00 0.00 178.00 178.91 1qvg h SER 180 N 0.01 0.00 0.00 1.44 4.64 -2.01 -3.45 113.55 114.18 1qvg h SER 180 Ca 0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 1qvg h SER 180 Cb 1.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.74 1qvg h SER 180 CO -0.01 0.04 0.00 0.61 -0.87 0.00 0.00 176.83 176.60 1qvg n GLY 181 N -0.31 1.60 3.78 -0.77 0.00 0.60 -4.63 105.19 105.46 1qvg n GLY 181 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1qvg n GLY 181 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1qvg s PHE 182 N -2.18 2.80 -0.15 1.61 2.99 -1.26 -4.72 117.98 117.07 1qvg s PHE 182 Ca 0.00 1.54 -0.13 0.00 0.00 0.00 0.00 56.93 58.34 1qvg s PHE 182 Cb 0.00 -3.14 -0.05 0.00 0.00 0.00 0.00 43.02 39.84 1qvg s PHE 182 CO 0.00 -1.37 0.27 -1.21 -0.00 0.00 0.00 175.22 172.92 1qvg s GLU 183 N -3.76 4.17 0.44 0.44 0.41 -1.03 -1.23 118.70 118.13 1qvg s GLU 183 Ca 0.67 0.07 -0.14 0.00 -0.41 0.00 0.00 54.97 55.17 1qvg s GLU 183 Cb -0.19 -3.39 -0.08 0.00 -1.78 0.00 0.00 34.13 28.69 1qvg s GLU 183 CO 0.33 0.32 0.86 -1.21 -0.49 0.00 0.00 175.26 175.06 1qvg s GLU 184 N 0.24 3.89 -0.06 1.61 2.02 -1.26 -2.11 118.70 123.04 1qvg s GLU 184 Ca 0.16 0.71 -0.02 0.00 0.02 0.00 0.00 54.97 55.84 1qvg s GLU 184 Cb -0.13 -2.29 0.03 0.00 0.10 0.00 0.00 34.13 31.84 1qvg s GLU 184 CO 0.04 -0.10 0.06 0.08 0.02 0.00 0.00 175.26 175.36 1qvg s VAL 185 N -2.41 -0.05 -0.02 2.63 1.01 -1.09 -4.93 120.40 115.54 1qvg s VAL 185 Ca 0.55 0.34 -0.30 0.00 0.00 0.00 0.00 61.98 62.57 1qvg s VAL 185 Cb -0.10 -0.23 -0.04 0.00 0.00 0.00 0.00 36.38 36.01 1qvg s VAL 185 CO 0.29 0.15 1.16 -0.60 0.00 0.00 0.00 175.10 176.09 1qvg s ARG 186 N 2.14 4.40 -0.05 2.72 6.06 -1.26 -1.26 118.95 131.71 1qvg s ARG 186 Ca 0.05 1.65 0.03 0.00 -2.50 0.00 0.00 55.73 54.95 1qvg s ARG 186 Cb -0.12 -3.48 0.01 0.00 0.06 0.00 0.00 34.95 31.41 1qvg s ARG 186 CO -0.04 -0.33 -0.12 0.54 -2.50 0.00 0.00 175.30 172.85 1qvg s VAL 187 N 1.72 1.09 -0.06 7.11 0.11 -0.45 -4.94 120.40 124.98 1qvg s VAL 187 Ca 0.56 -0.48 0.13 0.00 -2.93 0.00 0.00 61.98 59.25 1qvg s VAL 187 Cb -0.25 -0.98 -0.19 0.00 -1.53 0.00 0.00 36.38 33.42 1qvg s VAL 187 CO 0.24 0.34 0.30 1.41 -3.33 0.00 0.00 175.10 174.06 1qvg n HIS 188 N 3.60 0.00 -3.39 1.54 -0.00 -1.26 -1.36 115.22 114.34 1qvg n HIS 188 Ca -0.21 0.00 -0.02 0.00 -0.00 0.00 0.00 57.72 57.49 1qvg n HIS 188 Cb 0.52 -0.27 0.00 0.00 -0.00 0.00 0.00 29.99 30.25 1qvg n HIS 188 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.34 176.61 1qvg n ASN 189 N -1.89 -0.35 -0.06 0.41 2.04 -1.26 -4.89 115.26 109.25 1qvg n ASN 189 Ca -0.02 -1.33 -0.13 0.00 -0.44 0.00 0.00 54.58 52.66 1qvg n ASN 189 Cb 0.32 0.61 -0.01 0.00 -2.53 0.00 0.00 39.78 38.18 1qvg n ASN 189 CO 0.00 0.00 0.00 0.58 -0.44 0.00 0.00 177.26 177.40 1qvg h VAL 190 N 1.19 1.29 -0.98 3.53 2.07 -1.96 -3.18 116.25 118.21 1qvg h VAL 190 Ca -0.06 -1.73 0.13 0.00 0.82 0.00 0.00 66.70 65.87 1qvg h VAL 190 Cb 0.23 1.64 -0.08 0.00 -1.52 0.00 0.00 31.29 31.56 1qvg h VAL 190 CO 0.08 0.56 0.62 0.44 0.02 0.00 0.00 177.57 179.28 1qvg h ASP 191 N 0.62 0.85 0.00 0.57 3.32 -1.99 0.86 116.42 120.65 1qvg h ASP 191 Ca 0.02 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1qvg h ASP 191 Cb 1.12 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.55 1qvg h ASP 191 CO 0.11 0.44 0.07 0.44 -1.72 0.00 0.00 179.24 178.58 1qvg h ASP 192 N 0.91 0.00 0.92 6.45 3.32 -1.96 0.11 116.42 126.16 1qvg h ASP 192 Ca 0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.54 1qvg h ASP 192 Cb 0.58 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.13 1qvg h ASP 192 CO -0.26 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.44 1qvg n LEU 193 N -2.96 0.58 -4.67 1.55 4.77 0.30 -4.76 117.00 111.81 1qvg n LEU 193 Ca -0.03 0.61 -0.43 0.00 -0.03 0.00 0.00 56.01 56.14 1qvg n LEU 193 Cb 0.13 -0.49 -0.02 0.00 -2.33 0.00 0.00 43.42 40.71 1qvg n LEU 193 CO 0.18 -0.38 0.90 -0.70 -1.33 0.00 0.00 177.39 176.05 1qvg s GLU 194 N -3.20 4.32 0.00 3.23 2.12 0.02 -3.00 118.70 122.19 1qvg s GLU 194 Ca 0.07 1.42 0.00 0.00 0.36 0.00 0.00 54.97 56.82 1qvg s GLU 194 Cb 0.11 -3.62 0.00 0.00 0.26 0.00 0.00 34.13 30.88 1qvg s GLU 194 CO 0.44 -0.52 0.00 0.41 -0.54 0.00 0.00 175.26 175.05 1qvg n GLY 195 N 3.28 0.55 3.64 -1.50 0.00 -1.26 -5.07 105.19 104.82 1qvg n GLY 195 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1qvg n GLY 195 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qvg s VAL 196 N -2.00 4.85 -0.66 1.61 1.01 -1.16 -5.01 120.40 119.03 1qvg s VAL 196 Ca 0.00 1.50 -0.28 0.00 0.00 0.00 0.00 61.98 63.20 1qvg s VAL 196 Cb 0.00 -4.10 0.03 0.00 0.00 0.00 0.00 36.38 32.31 1qvg s VAL 196 CO 0.00 -0.07 1.28 -0.62 0.00 0.00 0.00 175.10 175.69 1qvg s ASP 197 N 1.37 6.24 0.00 3.32 -1.08 -1.26 -4.87 116.67 120.38 1qvg s ASP 197 Ca 0.34 -0.15 0.05 0.00 -0.52 0.00 0.00 52.55 52.27 1qvg s ASP 197 Cb -0.15 -2.56 0.31 0.00 -1.46 0.00 0.00 42.92 39.06 1qvg s ASP 197 CO 0.08 -1.71 0.72 0.61 0.52 0.00 0.00 175.17 175.38 1qvg n GLY 198 N 5.26 -0.21 0.13 2.66 0.00 -1.26 0.58 105.19 112.36 1qvg n GLY 198 Ca 0.06 -0.03 -0.20 0.00 0.00 0.00 0.00 46.02 45.86 1qvg n GLY 198 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1qvg n ASP 199 N -0.89 2.03 -0.07 1.61 8.00 -1.26 -4.62 116.55 121.35 1qvg n ASP 199 Ca 0.04 0.01 -0.22 0.00 0.71 0.00 0.00 54.79 55.33 1qvg n ASP 199 Cb 0.02 -0.59 -0.12 0.00 -0.02 0.00 0.00 41.12 40.40 1qvg n ASP 199 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1qvg n THR 200 N -3.39 1.63 -4.74 -3.53 -1.04 -0.71 -3.35 114.28 99.15 1qvg n THR 200 Ca -0.41 -0.46 -0.32 0.00 -2.04 0.00 0.00 64.05 60.81 1qvg n THR 200 Cb 1.00 -1.75 -0.12 0.00 -1.82 0.00 0.00 70.33 67.64 1qvg n THR 200 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1qvg s GLU 201 N -2.50 2.43 0.42 -2.82 2.02 0.20 -2.46 118.70 115.98 1qvg s GLU 201 Ca -0.29 -0.76 0.08 0.00 0.02 0.00 0.00 54.97 54.02 1qvg s GLU 201 Cb 0.08 -2.37 -0.02 0.00 0.10 0.00 0.00 34.13 31.92 1qvg s GLU 201 CO 0.66 0.60 0.37 0.00 0.02 0.00 0.00 175.26 176.91 1qvg s ALA 202 N -0.83 4.06 0.06 5.21 0.00 -0.90 -4.14 121.76 125.22 1qvg s ALA 202 Ca 0.13 -1.89 0.07 0.00 0.00 0.00 0.00 51.96 50.28 1qvg s ALA 202 Cb -0.11 -1.01 -0.03 0.00 0.00 0.00 0.00 23.12 21.98 1qvg s ALA 202 CO 0.03 -0.22 -0.21 0.54 0.00 0.00 0.00 175.76 175.90 1qvg s VAL 203 N -2.47 1.67 -0.20 0.00 0.11 -0.09 -2.67 120.40 116.75 1qvg s VAL 203 Ca 0.48 -1.28 0.01 0.00 -2.93 0.00 0.00 61.98 58.26 1qvg s VAL 203 Cb -0.03 -1.47 0.04 0.00 -1.53 0.00 0.00 36.38 33.39 1qvg s VAL 203 CO 0.28 0.14 -0.13 -0.60 -3.33 0.00 0.00 175.10 171.46 1qvg s ARG 204 N -1.35 2.30 -0.21 1.54 3.52 -0.39 -0.44 118.95 123.92 1qvg s ARG 204 Ca 0.07 -0.88 -0.29 0.00 -0.13 0.00 0.00 55.73 54.50 1qvg s ARG 204 Cb -0.09 -2.48 -0.00 0.00 -1.56 0.00 0.00 34.95 30.82 1qvg s ARG 204 CO 0.02 -0.38 1.17 0.42 -0.81 0.00 0.00 175.30 175.72 1qvg s ILE 205 N 1.34 4.45 0.18 4.11 1.01 -1.26 -1.34 121.20 129.68 1qvg s ILE 205 Ca -0.00 1.74 -0.28 0.00 0.00 0.00 0.00 60.65 62.10 1qvg s ILE 205 Cb -0.16 -4.15 -0.17 0.00 0.01 0.00 0.00 42.46 37.99 1qvg s ILE 205 CO -0.09 -0.19 0.56 0.00 0.00 0.00 0.00 174.94 175.22 1qvg n ALA 206 N 6.56 -2.90 0.10 9.38 0.00 -0.46 -4.80 120.51 128.39 1qvg n ALA 206 Ca 0.13 0.44 0.03 0.00 0.00 0.00 0.00 53.44 54.04 1qvg n ALA 206 Cb 0.45 -1.59 0.41 0.00 0.00 0.00 0.00 19.45 18.73 1qvg n ALA 206 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1qvg h SER 207 N 1.16 0.26 -0.74 0.00 4.64 -1.93 -2.94 113.55 114.01 1qvg h SER 207 Ca -0.29 -0.04 0.04 0.00 -0.47 0.00 0.00 61.79 61.03 1qvg h SER 207 Cb 1.41 -0.07 -0.04 0.00 -0.31 0.00 0.00 62.40 63.38 1qvg h SER 207 CO 0.56 0.35 0.49 0.11 -0.87 0.00 0.00 176.83 177.47 1qvg h LYS 208 N 0.28 0.84 -6.30 4.77 1.57 -1.99 -3.43 116.57 112.32 1qvg h LYS 208 Ca 0.06 -0.05 -0.66 0.00 -1.87 0.00 0.00 60.65 58.13 1qvg h LYS 208 Cb 0.26 -0.19 0.04 0.00 0.08 0.00 0.00 32.23 32.42 1qvg h LYS 208 CO 0.01 0.56 0.76 0.28 -0.57 0.00 0.00 179.45 180.48 1qvg n VAL 209 N -4.46 0.18 -1.59 0.50 0.31 -1.11 -4.94 118.33 107.22 1qvg n VAL 209 Ca 0.10 -0.03 -0.31 0.00 -0.01 0.00 0.00 64.34 64.09 1qvg n VAL 209 Cb 0.14 -1.27 0.06 0.00 -0.91 0.00 0.00 33.84 31.86 1qvg n VAL 209 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1qvg s GLY 210 N 1.94 1.65 0.25 2.92 0.00 -1.26 -4.81 107.32 108.02 1qvg s GLY 210 Ca 0.88 -0.03 -0.06 0.00 0.00 0.00 0.00 44.72 45.51 1qvg s GLY 210 CO 0.50 0.31 1.63 0.00 0.00 0.00 0.00 173.10 175.54 1qvg h ALA 211 N -0.82 0.84 0.11 3.20 0.00 -1.96 -0.89 119.26 119.73 1qvg h ALA 211 Ca -0.45 0.26 0.02 0.00 0.00 0.00 0.00 54.91 54.74 1qvg h ALA 211 Cb 1.23 0.44 -0.05 0.00 0.00 0.00 0.00 17.79 19.42 1qvg h ALA 211 CO 0.58 -0.44 -0.44 -0.09 0.00 0.00 0.00 179.25 178.87 1qvg h ARG 212 N 0.09 -0.64 0.00 0.00 2.43 -2.01 -1.47 114.38 112.78 1qvg h ARG 212 Ca 0.44 0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.64 1qvg h ARG 212 Cb 0.79 0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 30.48 1qvg h ARG 212 CO -0.70 -0.43 -0.04 -0.22 -1.51 0.00 0.00 179.97 177.07 1qvg h LYS 213 N -0.66 0.00 0.87 0.20 3.64 -1.81 -3.16 116.57 115.65 1qvg h LYS 213 Ca 0.02 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.36 1qvg h LYS 213 Cb 0.69 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.52 1qvg h LYS 213 CO -0.26 0.04 -0.42 0.00 -2.27 0.00 0.00 179.45 176.55 1qvg h ARG 214 N 0.00 -1.12 -0.94 1.90 3.08 -0.16 -1.96 114.38 115.17 1qvg h ARG 214 Ca -0.00 0.08 0.28 0.00 0.07 0.00 0.00 59.98 60.41 1qvg h ARG 214 Cb 0.50 0.25 -0.15 0.00 0.08 0.00 0.00 29.97 30.66 1qvg h ARG 214 CO 0.01 -0.74 0.39 1.49 -1.07 0.00 0.00 179.97 180.04 1qvg h GLU 215 N -1.27 0.25 0.03 0.04 4.81 -1.35 0.77 114.58 117.86 1qvg h GLU 215 Ca -0.12 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.09 1qvg h GLU 215 Cb 0.90 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.22 1qvg h GLU 215 CO 0.20 0.16 -0.02 0.00 -0.73 0.00 0.00 179.01 178.62 1qvg h ARG 216 N 0.25 -0.04 0.31 1.92 3.08 -1.56 -2.14 114.38 116.20 1qvg h ARG 216 Ca 0.65 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.68 1qvg h ARG 216 Cb 1.40 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.47 1qvg h ARG 216 CO -0.64 0.27 -0.15 0.82 -1.07 0.00 0.00 179.97 179.19 1qvg h ILE 217 N -0.36 0.69 -1.01 2.04 2.04 0.11 -2.20 117.51 118.84 1qvg h ILE 217 Ca -0.00 -0.01 0.14 0.00 1.00 0.00 0.00 64.86 65.98 1qvg h ILE 217 Cb 0.33 0.70 -0.09 0.00 -0.74 0.00 0.00 36.82 37.02 1qvg h ILE 217 CO 0.01 0.00 0.63 -0.33 0.00 0.00 0.00 178.15 178.46 1qvg h GLU 218 N -0.43 0.91 -0.08 2.37 5.08 0.36 0.17 114.58 122.96 1qvg h GLU 218 Ca -0.04 -0.05 -0.22 0.00 -1.00 0.00 0.00 59.36 58.04 1qvg h GLU 218 Cb 0.33 -0.21 0.01 0.00 0.50 0.00 0.00 28.75 29.38 1qvg h GLU 218 CO 0.07 0.60 -0.84 1.05 -1.00 0.00 0.00 179.01 178.89 1qvg h GLU 219 N 0.94 0.62 0.00 2.33 4.11 -1.21 -2.93 114.58 118.45 1qvg h GLU 219 Ca 0.52 -0.56 0.00 0.00 0.07 0.00 0.00 59.36 59.39 1qvg h GLU 219 Cb 0.59 0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.98 1qvg h GLU 219 CO -0.30 1.18 -0.03 1.49 0.07 0.00 0.00 179.01 181.42 1qvg h GLU 220 N 0.40 0.00 -0.18 1.06 4.81 -0.96 -2.72 114.58 116.99 1qvg h GLU 220 Ca -0.07 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.10 1qvg h GLU 220 Cb 1.46 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.84 1qvg h GLU 220 CO 0.16 0.00 -0.13 0.00 -0.73 0.00 0.00 179.01 178.31 1qvg h ALA 221 N 2.01 0.26 -0.70 2.92 0.00 -0.68 -2.52 119.26 120.55 1qvg h ALA 221 Ca 0.00 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.54 1qvg h ALA 221 Cb 1.00 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 1qvg h ALA 221 CO 0.00 0.12 0.20 1.49 0.00 0.00 0.00 179.25 181.06 1qvg h GLU 222 N 0.08 1.11 0.00 0.00 4.81 -1.47 -0.50 114.58 118.60 1qvg h GLU 222 Ca 0.04 -0.25 -0.04 0.00 -0.13 0.00 0.00 59.36 58.97 1qvg h GLU 222 Cb 0.64 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.85 1qvg h GLU 222 CO 0.03 0.96 -0.21 -0.44 -0.73 0.00 0.00 179.01 178.63 1qvg h ASP 223 N 1.05 0.00 -0.27 1.04 3.32 -1.46 -1.07 116.42 119.02 1qvg h ASP 223 Ca 0.22 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.27 1qvg h ASP 223 Cb 0.33 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.88 1qvg h ASP 223 CO -0.00 0.21 0.00 0.00 -1.72 0.00 0.00 179.24 177.73 1qvg n ALA 224 N -2.44 2.52 -1.17 3.45 0.00 -0.86 -4.89 120.51 117.13 1qvg n ALA 224 Ca -0.02 -0.50 -0.06 0.00 0.00 0.00 0.00 53.44 52.86 1qvg n ALA 224 Cb 0.28 -0.99 -0.02 0.00 0.00 0.00 0.00 19.45 18.72 1qvg n ALA 224 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qvg n GLY 225 N 0.85 0.75 3.72 0.00 0.00 -0.41 -4.55 105.19 105.55 1qvg n GLY 225 Ca 0.09 -0.25 -0.35 0.00 0.00 0.00 0.00 46.02 45.50 1qvg n GLY 225 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1qvg s ILE 226 N -1.94 5.38 0.27 -0.61 1.01 -0.25 -4.50 121.20 120.55 1qvg s ILE 226 Ca 0.00 0.26 -0.27 0.00 0.00 0.00 0.00 60.65 60.64 1qvg s ILE 226 Cb 0.00 -3.51 -0.09 0.00 0.01 0.00 0.00 42.46 38.87 1qvg s ILE 226 CO 0.00 0.41 0.91 -0.60 0.00 0.00 0.00 174.94 175.67 1qvg s ARG 227 N 0.49 4.69 -0.22 2.79 3.52 -1.26 -3.78 118.95 125.18 1qvg s ARG 227 Ca 0.10 1.36 -0.08 0.00 -0.13 0.00 0.00 55.73 56.98 1qvg s ARG 227 Cb -0.12 -3.06 -0.04 0.00 -1.56 0.00 0.00 34.95 30.18 1qvg s ARG 227 CO 0.00 0.42 0.07 0.08 -0.81 0.00 0.00 175.30 175.06 1qvg s VAL 228 N -1.37 4.59 0.18 7.11 1.01 -1.26 -0.91 120.40 129.74 1qvg s VAL 228 Ca 0.44 -0.09 -0.07 0.00 0.00 0.00 0.00 61.98 62.26 1qvg s VAL 228 Cb -0.22 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.02 1qvg s VAL 228 CO 0.27 0.39 1.52 -0.07 0.00 0.00 0.00 175.10 177.21 1qvg h LEU 229 N 7.53 0.83 -7.38 3.92 3.38 -1.13 -3.35 115.31 119.10 1qvg h LEU 229 Ca -0.37 -0.38 -0.71 0.00 0.09 0.00 0.00 57.88 56.51 1qvg h LEU 229 Cb 1.17 -0.23 -0.35 0.00 0.09 0.00 0.00 40.66 41.34 1qvg h LEU 229 CO 0.63 1.13 -0.12 0.54 0.09 0.00 0.00 178.44 180.70 1qvg s ASN 230 N -6.86 5.92 0.52 -0.43 4.22 -1.26 -5.07 114.94 111.97 1qvg s ASN 230 Ca -0.09 -3.54 -0.09 0.00 -2.14 0.00 0.00 52.86 47.00 1qvg s ASN 230 Cb 0.12 -1.91 -0.05 0.00 1.28 0.00 0.00 41.25 40.69 1qvg s ASN 230 CO 0.86 -0.23 0.88 -2.16 -2.04 0.00 0.00 177.10 174.41 1qvg s PRO 231 N -1.08 3.63 0.22 3.55 0.04 -1.26 -4.77 135.00 135.34 1qvg s PRO 231 Ca 0.25 0.48 -0.21 0.00 0.04 0.00 0.00 61.00 61.56 1qvg s PRO 231 Cb -0.10 -2.26 -0.08 0.00 0.04 0.00 0.00 34.50 32.10 1qvg s PRO 231 CO -0.11 -0.30 0.76 0.99 0.04 0.00 0.00 177.00 178.38 1qvg s THR 232 N -2.81 4.49 -0.25 1.26 2.01 -1.26 -4.86 115.64 114.22 1qvg s THR 232 Ca 0.51 1.43 -0.07 0.00 0.31 0.00 0.00 61.69 63.87 1qvg s THR 232 Cb -0.10 -3.93 -0.02 0.00 0.01 0.00 0.00 72.50 68.45 1qvg s THR 232 CO 0.45 0.27 0.05 -0.31 -0.69 0.00 0.00 174.62 174.38 1qvg s TYR 233 N -1.46 3.06 0.26 4.92 1.51 -1.26 -1.80 117.35 122.59 1qvg s TYR 233 Ca 0.42 -0.57 0.09 0.00 -1.01 0.00 0.00 57.07 56.00 1qvg s TYR 233 Cb -0.18 -2.21 -0.04 0.00 -0.11 0.00 0.00 41.96 39.41 1qvg s TYR 233 CO 0.22 -0.41 0.04 0.08 -1.11 0.00 0.00 175.55 174.37 1qvg s VAL 234 N 1.58 3.66 -0.37 0.71 1.01 -0.86 -4.85 120.40 121.29 1qvg s VAL 234 Ca 0.06 -1.79 -0.16 0.00 0.00 0.00 0.00 61.98 60.09 1qvg s VAL 234 Cb -0.15 -2.97 -0.00 0.00 0.00 0.00 0.00 36.38 33.25 1qvg s VAL 234 CO 0.02 -0.36 0.38 -1.61 0.00 0.00 0.00 175.10 173.53 1qvg s GLU 235 N -3.72 3.40 0.00 2.72 8.01 -1.26 0.02 118.70 127.88 1qvg s GLU 235 Ca 0.32 -0.54 0.06 0.00 0.01 0.00 0.00 54.97 54.82 1qvg s GLU 235 Cb -0.07 -3.86 0.05 0.00 -4.31 0.00 0.00 34.13 25.94 1qvg s GLU 235 CO 0.21 -0.63 0.68 0.28 0.01 0.00 0.00 175.26 175.81