#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x3u n SER 127 N 0.00 -1.34 -2.20 1.61 7.64 -1.26 -4.87 113.62 113.20 1x3u n SER 127 Ca 0.00 1.07 0.00 0.00 1.01 0.00 0.00 58.87 60.95 1x3u n SER 127 Cb 0.00 -4.38 0.00 0.00 -1.01 0.00 0.00 64.21 58.82 1x3u n SER 127 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1x3u n HIS 128 N 1.25 -4.37 -0.80 1.43 -0.00 -1.26 -4.85 115.22 106.62 1x3u n HIS 128 Ca -0.30 2.60 -0.13 0.00 -0.00 0.00 0.00 57.72 59.90 1x3u n HIS 128 Cb 0.47 -3.66 0.21 0.00 -0.00 0.00 0.00 29.99 27.00 1x3u n HIS 128 CO 0.00 0.00 0.00 -0.12 -0.00 0.00 0.00 176.34 176.22 1x3u n MET 129 N 1.66 2.73 0.00 -0.41 0.00 -1.26 -4.80 117.12 115.03 1x3u n MET 129 Ca 0.00 -2.58 0.00 0.00 0.00 0.00 0.00 57.70 55.12 1x3u n MET 129 Cb 0.00 -2.04 0.00 0.00 0.00 0.00 0.00 33.22 31.18 1x3u n MET 129 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1x3u n ASP 130 N -0.47 0.00 -0.27 6.12 8.00 -1.26 -5.08 116.55 123.58 1x3u n ASP 130 Ca 0.43 0.00 0.02 0.00 0.71 0.00 0.00 54.79 55.94 1x3u n ASP 130 Cb 1.37 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 42.46 1x3u n ASP 130 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1x3u n ASP 131 N 0.00 -1.62 -0.02 -2.24 -0.08 -1.26 -3.68 116.55 107.64 1x3u n ASP 131 Ca 0.00 0.13 -0.03 0.00 -1.51 0.00 0.00 54.79 53.38 1x3u n ASP 131 Cb 0.00 -0.48 -0.01 0.00 2.34 0.00 0.00 41.12 42.97 1x3u n ASP 131 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1x3u n ALA 132 N -0.31 1.18 0.21 -1.67 0.00 -1.26 -4.43 120.51 114.23 1x3u n ALA 132 Ca 0.00 -0.36 0.06 0.00 0.00 0.00 0.00 53.44 53.13 1x3u n ALA 132 Cb 0.05 0.04 0.47 0.00 0.00 0.00 0.00 19.45 20.02 1x3u n ALA 132 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1x3u h ASN 133 N -0.33 0.00 -0.78 0.00 -0.26 -1.87 -2.38 115.58 109.96 1x3u h ASN 133 Ca 0.00 0.00 0.05 0.00 -0.56 0.00 0.00 56.30 55.79 1x3u h ASN 133 Cb 0.33 0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 37.53 1x3u h ASN 133 CO 0.00 0.27 0.47 -0.78 -1.06 0.00 0.00 177.43 176.34 1x3u h ASP 134 N 0.00 0.75 -0.04 5.81 1.82 -1.83 0.62 116.42 123.56 1x3u h ASP 134 Ca -0.00 0.01 0.03 0.00 -0.39 0.00 0.00 57.03 56.68 1x3u h ASP 134 Cb 0.53 -0.14 -0.03 0.00 0.68 0.00 0.00 39.33 40.37 1x3u h ASP 134 CO 0.04 0.50 -0.12 0.40 -1.61 0.00 0.00 179.24 178.44 1x3u h ILE 135 N 0.89 0.69 0.38 2.25 2.04 -1.50 -0.12 117.51 122.14 1x3u h ILE 135 Ca 0.33 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.18 1x3u h ILE 135 Cb 0.12 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 36.86 1x3u h ILE 135 CO -0.15 0.00 -0.48 0.03 0.00 0.00 0.00 178.15 177.55 1x3u h ARG 136 N -0.19 -0.85 -0.70 2.37 3.08 -1.27 1.44 114.38 118.26 1x3u h ARG 136 Ca 0.06 0.06 0.20 0.00 0.07 0.00 0.00 59.98 60.37 1x3u h ARG 136 Cb 0.26 0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.48 1x3u h ARG 136 CO -0.15 -0.57 0.67 0.00 -1.07 0.00 0.00 179.97 178.86 1x3u h ALA 137 N -0.88 2.51 0.16 0.04 0.00 -0.73 0.57 119.26 120.93 1x3u h ALA 137 Ca -0.05 -0.02 -0.34 0.00 0.00 0.00 0.00 54.91 54.50 1x3u h ALA 137 Cb 0.79 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1x3u h ALA 137 CO -0.11 -1.03 -1.70 -0.09 0.00 0.00 0.00 179.25 176.31 1x3u h ARG 138 N 0.00 0.34 -0.65 0.00 2.43 0.97 -3.10 114.38 114.36 1x3u h ARG 138 Ca 0.33 -0.58 0.19 0.00 -0.81 0.00 0.00 59.98 59.11 1x3u h ARG 138 Cb 1.67 0.22 -0.03 0.00 -0.42 0.00 0.00 29.97 31.41 1x3u h ARG 138 CO -0.00 1.24 0.73 -0.07 -1.51 0.00 0.00 179.97 180.36 1x3u h LEU 139 N 0.09 0.00 0.00 3.80 3.38 0.74 0.34 115.31 123.66 1x3u h LEU 139 Ca -0.32 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.29 1x3u h LEU 139 Cb 2.07 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 42.76 1x3u h LEU 139 CO 0.17 0.00 -2.34 0.00 0.09 0.00 0.00 178.44 176.35 1x3u n GLN 140 N -3.54 0.68 0.32 1.13 1.13 -1.08 -4.12 117.38 111.90 1x3u n GLN 140 Ca 0.13 0.03 0.20 0.00 -1.94 0.00 0.00 57.00 55.42 1x3u n GLN 140 Cb 0.96 -1.54 1.05 0.00 0.11 0.00 0.00 30.24 30.82 1x3u n GLN 140 CO 0.00 0.00 0.00 1.79 -1.44 0.00 0.00 177.06 177.41 1x3u h THR 141 N 0.00 0.17 0.00 5.09 1.35 -0.28 -3.29 112.91 115.96 1x3u h THR 141 Ca -0.53 -0.11 0.00 0.00 -0.55 0.00 0.00 66.41 65.22 1x3u h THR 141 Cb 2.21 1.09 0.00 0.00 -1.73 0.00 0.00 68.15 69.72 1x3u h THR 141 CO 0.03 0.01 0.00 0.18 -0.25 0.00 0.00 175.52 175.49 1x3u n LEU 142 N -3.31 0.37 0.00 3.87 4.32 -0.78 -5.06 117.00 116.41 1x3u n LEU 142 Ca -0.02 0.29 0.00 0.00 -0.02 0.00 0.00 56.01 56.26 1x3u n LEU 142 Cb 0.11 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.91 1x3u n LEU 142 CO 0.23 0.00 0.00 -1.54 -1.22 0.00 0.00 177.39 174.86 1x3u n SER 143 N -0.35 0.00 -0.34 -1.43 3.41 -1.24 -4.96 113.62 108.70 1x3u n SER 143 Ca 0.00 0.00 0.17 0.00 -0.26 0.00 0.00 58.87 58.78 1x3u n SER 143 Cb 0.00 0.00 0.39 0.00 -0.26 0.00 0.00 64.21 64.34 1x3u n SER 143 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1x3u h GLU 144 N 0.00 0.57 -0.67 4.33 4.81 -1.95 0.73 114.58 122.39 1x3u h GLU 144 Ca 0.00 -0.03 0.10 0.00 -0.13 0.00 0.00 59.36 59.30 1x3u h GLU 144 Cb 0.00 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.21 1x3u h GLU 144 CO 0.00 0.38 0.45 0.00 -0.73 0.00 0.00 179.01 179.11 1x3u h ARG 145 N 0.59 0.49 0.00 1.92 2.47 -1.95 1.39 114.38 119.30 1x3u h ARG 145 Ca 0.63 -0.03 -0.01 0.00 -1.26 0.00 0.00 59.98 59.32 1x3u h ARG 145 Cb 1.21 -0.11 -0.00 0.00 -1.65 0.00 0.00 29.97 29.42 1x3u h ARG 145 CO -0.45 0.33 -0.04 1.49 0.56 0.00 0.00 179.97 181.85 1x3u h GLU 146 N 0.51 0.00 0.00 0.04 4.22 0.06 -1.60 114.58 117.81 1x3u h GLU 146 Ca 0.31 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.75 1x3u h GLU 146 Cb 0.55 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 1x3u h GLU 146 CO -0.10 0.62 -0.02 0.00 -2.18 0.00 0.00 179.01 177.33 1x3u h ARG 147 N -1.00 0.00 0.14 1.92 3.08 -0.79 -1.31 114.38 116.42 1x3u h ARG 147 Ca -0.01 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 1x3u h ARG 147 Cb 0.64 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.69 1x3u h ARG 147 CO -0.01 0.02 -0.07 1.96 -1.07 0.00 0.00 179.97 180.81 1x3u h GLN 148 N 0.00 -0.18 -0.07 0.04 1.08 0.18 -2.98 115.11 113.17 1x3u h GLN 148 Ca -0.00 0.01 0.01 0.00 -1.45 0.00 0.00 58.65 57.22 1x3u h GLN 148 Cb 0.05 0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 27.50 1x3u h GLN 148 CO 0.00 -0.12 -0.11 0.28 -0.95 0.00 0.00 178.83 177.93 1x3u h VAL 149 N -0.57 0.00 -0.97 -0.54 2.07 -1.17 -1.48 116.25 113.60 1x3u h VAL 149 Ca -0.02 0.00 0.28 0.00 0.82 0.00 0.00 66.70 67.78 1x3u h VAL 149 Cb 0.14 0.00 -0.18 0.00 -1.52 0.00 0.00 31.29 29.74 1x3u h VAL 149 CO 0.03 0.00 0.12 0.25 0.02 0.00 0.00 177.57 177.99 1x3u h LEU 150 N -0.08 -0.30 -1.32 2.57 7.12 -1.42 1.57 115.31 123.44 1x3u h LEU 150 Ca 0.01 0.26 0.27 0.00 0.13 0.00 0.00 57.88 58.55 1x3u h LEU 150 Cb 0.12 0.42 -0.10 0.00 -0.53 0.00 0.00 40.66 40.57 1x3u h LEU 150 CO -0.11 -0.33 0.67 0.77 -0.13 0.00 0.00 178.44 179.30 1x3u h SER 151 N 0.04 0.47 0.01 1.25 4.64 -1.11 1.44 113.55 120.29 1x3u h SER 151 Ca 0.62 0.09 -0.40 0.00 -0.47 0.00 0.00 61.79 61.63 1x3u h SER 151 Cb 1.33 0.02 -0.06 0.00 -0.31 0.00 0.00 62.40 63.37 1x3u h SER 151 CO -0.86 0.08 -2.26 0.00 -0.87 0.00 0.00 176.83 172.92 1x3u n ALA 152 N -2.46 1.15 -0.26 5.18 0.00 0.31 -4.23 120.51 120.20 1x3u n ALA 152 Ca 0.26 -0.96 0.07 0.00 0.00 0.00 0.00 53.44 52.81 1x3u n ALA 152 Cb 0.88 -0.10 0.21 0.00 0.00 0.00 0.00 19.45 20.44 1x3u n ALA 152 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1x3u h VAL 153 N -0.73 0.52 -0.77 0.00 2.07 0.22 0.22 116.25 117.78 1x3u h VAL 153 Ca -0.60 -0.11 0.17 0.00 0.82 0.00 0.00 66.70 66.98 1x3u h VAL 153 Cb 1.65 0.18 -0.11 0.00 -1.52 0.00 0.00 31.29 31.48 1x3u h VAL 153 CO -0.29 0.06 0.24 1.62 0.02 0.00 0.00 177.57 179.22 1x3u h VAL 154 N 0.32 0.54 0.17 2.57 3.04 0.18 -1.83 116.25 121.23 1x3u h VAL 154 Ca 0.45 -0.11 -0.01 0.00 -1.01 0.00 0.00 66.70 66.01 1x3u h VAL 154 Cb 0.77 0.18 0.00 0.00 -2.01 0.00 0.00 31.29 30.23 1x3u h VAL 154 CO -0.50 0.06 -0.08 0.00 -1.01 0.00 0.00 177.57 176.04 1x3u h ALA 155 N 1.61 -0.22 0.00 3.17 0.00 -0.77 -3.41 119.26 119.64 1x3u h ALA 155 Ca 0.44 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1x3u h ALA 155 Cb 0.74 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1x3u h ALA 155 CO -0.49 -0.51 0.00 0.41 0.00 0.00 0.00 179.25 178.67 1x3u n GLY 156 N -0.53 1.84 3.85 0.00 0.00 -0.69 -4.97 105.19 104.69 1x3u n GLY 156 Ca -0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 1x3u n GLY 156 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x3u s LEU 157 N 0.00 2.58 0.57 0.99 1.43 -1.25 -5.01 118.68 117.98 1x3u s LEU 157 Ca 0.00 1.07 -0.21 0.00 -1.03 0.00 0.00 54.13 53.97 1x3u s LEU 157 Cb 0.00 -3.67 -0.04 0.00 0.03 0.00 0.00 46.19 42.51 1x3u s LEU 157 CO 0.00 -1.84 1.31 -2.84 0.23 0.00 0.00 176.35 173.21 1x3u s PRO 158 N -5.34 3.05 0.57 1.29 0.02 -1.26 -4.66 135.00 128.68 1x3u s PRO 158 Ca 0.61 2.11 0.36 0.00 0.02 0.00 0.00 61.00 64.10 1x3u s PRO 158 Cb -0.13 -2.14 1.44 0.00 0.02 0.00 0.00 34.50 33.69 1x3u s PRO 158 CO 0.52 -1.22 1.66 -0.97 -0.33 0.00 0.00 177.00 176.66 1x3u h ASN 159 N 1.25 0.00 0.00 2.53 -0.73 -1.98 0.15 115.58 116.81 1x3u h ASN 159 Ca -0.51 0.00 -0.00 0.00 1.87 0.00 0.00 56.30 57.66 1x3u h ASN 159 Cb 1.30 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 39.89 1x3u h ASN 159 CO 0.56 0.00 -0.00 0.50 -0.37 0.00 0.00 177.43 178.12 1x3u h LYS 160 N 0.00 0.00 -0.66 6.67 3.64 -1.90 -3.10 116.57 121.22 1x3u h LYS 160 Ca 0.56 0.00 0.14 0.00 -1.27 0.00 0.00 60.65 60.08 1x3u h LYS 160 Cb 2.54 0.00 -0.12 0.00 -0.41 0.00 0.00 32.23 34.24 1x3u h LYS 160 CO -0.01 0.02 -0.06 1.03 -2.27 0.00 0.00 179.45 178.16 1x3u h SER 161 N -1.00 -0.41 -0.33 4.20 0.87 -1.53 0.46 113.55 115.81 1x3u h SER 161 Ca -0.00 0.18 0.07 0.00 -1.23 0.00 0.00 61.79 60.81 1x3u h SER 161 Cb 0.02 0.34 -0.07 0.00 -0.44 0.00 0.00 62.40 62.25 1x3u h SER 161 CO -0.00 -0.17 -0.14 0.40 -0.53 0.00 0.00 176.83 176.39 1x3u h ILE 162 N 0.07 0.54 0.00 2.23 2.04 -1.18 1.17 117.51 122.38 1x3u h ILE 162 Ca 0.34 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 66.15 1x3u h ILE 162 Cb 0.56 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 1x3u h ILE 162 CO -0.61 0.00 -0.26 0.00 0.00 0.00 0.00 178.15 177.28 1x3u h ALA 163 N 1.18 1.41 -0.00 1.87 0.00 -0.89 -2.12 119.26 120.71 1x3u h ALA 163 Ca 0.17 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1x3u h ALA 163 Cb 0.34 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1x3u h ALA 163 CO -0.39 0.33 -0.42 0.66 0.00 0.00 0.00 179.25 179.42 1x3u n TYR 164 N -3.99 0.00 0.41 0.00 4.02 0.14 -0.03 117.16 117.71 1x3u n TYR 164 Ca -0.02 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 57.99 1x3u n TYR 164 Cb 0.33 -0.25 0.11 0.00 -0.02 0.00 0.00 39.34 39.51 1x3u n TYR 164 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 176.86 176.07 1x3u h ASP 165 N 0.16 0.00 -0.49 7.72 1.82 0.20 -3.35 116.42 122.48 1x3u h ASP 165 Ca 0.00 -0.15 -0.34 0.00 -0.39 0.00 0.00 57.03 56.16 1x3u h ASP 165 Cb 0.50 0.00 -0.23 0.00 0.68 0.00 0.00 39.33 40.28 1x3u h ASP 165 CO 0.00 0.07 -0.39 0.18 -1.61 0.00 0.00 179.24 177.50 1x3u n LEU 166 N -2.32 4.47 -2.77 2.28 4.77 -1.17 -4.90 117.00 117.35 1x3u n LEU 166 Ca 0.02 -4.26 -0.14 0.00 -0.03 0.00 0.00 56.01 51.61 1x3u n LEU 166 Cb 0.48 -0.53 -0.01 0.00 -2.33 0.00 0.00 43.42 41.04 1x3u n LEU 166 CO 0.38 1.66 -0.09 0.47 -1.33 0.00 0.00 177.39 178.48 1x3u n ASP 167 N -0.94 -3.26 -4.91 -1.43 9.92 -1.26 -4.90 116.55 109.77 1x3u n ASP 167 Ca 0.37 0.05 -0.23 0.00 -0.53 0.00 0.00 54.79 54.45 1x3u n ASP 167 Cb 0.89 -2.78 -0.01 0.00 -0.64 0.00 0.00 41.12 38.59 1x3u n ASP 167 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1x3u s ILE 168 N -2.61 2.08 -0.03 0.53 -1.09 0.96 -5.03 121.20 116.01 1x3u s ILE 168 Ca 0.13 -1.37 0.00 0.00 -2.23 0.00 0.00 60.65 57.19 1x3u s ILE 168 Cb -0.07 -2.45 -0.03 0.00 -1.58 0.00 0.00 42.46 38.32 1x3u s ILE 168 CO 0.17 0.00 -0.00 -0.94 -1.23 0.00 0.00 174.94 172.93 1x3u s SER 169 N -4.28 5.12 0.60 3.58 1.04 -1.21 -3.89 113.70 114.65 1x3u s SER 169 Ca 0.43 0.04 0.35 0.00 0.48 0.00 0.00 55.95 57.25 1x3u s SER 169 Cb -0.03 -1.36 1.95 0.00 0.10 0.00 0.00 66.02 66.68 1x3u s SER 169 CO 0.26 0.31 2.25 -0.65 0.98 0.00 0.00 173.24 176.39 1x3u h PRO 170 N 4.64 0.00 0.00 4.02 0.11 -1.84 0.33 132.00 139.27 1x3u h PRO 170 Ca -0.49 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.59 1x3u h PRO 170 Cb 1.18 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 1x3u h PRO 170 CO 0.56 0.02 -0.50 0.00 -0.21 0.00 0.00 178.00 177.87 1x3u h ARG 171 N 0.00 0.00 0.13 1.05 -0.00 -1.94 -3.13 114.38 110.48 1x3u h ARG 171 Ca -0.00 0.00 -0.01 0.00 -0.50 0.00 0.00 59.98 59.47 1x3u h ARG 171 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.07 1x3u h ARG 171 CO 0.00 0.10 -0.06 1.15 0.00 0.00 0.00 179.97 181.16 1x3u h THR 172 N 0.00 0.86 -0.69 2.04 2.02 -0.77 -3.06 112.91 113.32 1x3u h THR 172 Ca -0.01 -1.26 0.13 0.00 0.77 0.00 0.00 66.41 66.04 1x3u h THR 172 Cb 1.10 1.49 -0.04 0.00 -1.74 0.00 0.00 68.15 68.96 1x3u h THR 172 CO 0.01 0.24 0.46 -0.37 0.37 0.00 0.00 175.52 176.23 1x3u h VAL 173 N -0.90 0.84 -0.63 3.16 -1.51 -1.45 1.32 116.25 117.09 1x3u h VAL 173 Ca -0.02 -0.14 0.06 0.00 -1.23 0.00 0.00 66.70 65.37 1x3u h VAL 173 Cb 0.53 0.39 -0.05 0.00 -2.13 0.00 0.00 31.29 30.02 1x3u h VAL 173 CO 0.03 0.08 0.34 -0.33 -1.23 0.00 0.00 177.57 176.45 1x3u h GLU 174 N 0.41 0.61 0.03 5.19 4.39 -1.56 1.27 114.58 124.94 1x3u h GLU 174 Ca 0.33 -0.04 -0.00 0.00 0.34 0.00 0.00 59.36 59.99 1x3u h GLU 174 Cb 0.71 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 1x3u h GLU 174 CO -0.10 0.40 -0.02 0.28 -1.16 0.00 0.00 179.01 178.42 1x3u h VAL 175 N 0.63 0.73 -0.53 3.13 2.07 -0.48 -3.09 116.25 118.70 1x3u h VAL 175 Ca 0.28 -1.47 0.11 0.00 0.82 0.00 0.00 66.70 66.44 1x3u h VAL 175 Cb 0.19 1.35 -0.09 0.00 -1.52 0.00 0.00 31.29 31.22 1x3u h VAL 175 CO -0.19 0.24 -0.05 0.45 0.02 0.00 0.00 177.57 178.05 1x3u h HIS 176 N -0.99 -0.12 0.00 1.57 3.86 0.16 -0.77 115.15 118.87 1x3u h HIS 176 Ca -0.00 0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.25 1x3u h HIS 176 Cb 0.43 0.14 0.00 0.00 1.06 0.00 0.00 27.41 29.03 1x3u h HIS 176 CO 0.11 -0.16 0.00 -2.13 0.86 0.00 0.00 177.93 176.60 1x3u n ARG 177 N -5.29 0.00 -0.48 2.45 0.63 0.44 0.16 116.66 114.57 1x3u n ARG 177 Ca 0.06 0.49 0.39 0.00 -0.92 0.00 0.00 57.85 57.88 1x3u n ARG 177 Cb 0.29 -1.44 0.69 0.00 0.45 0.00 0.00 32.46 32.45 1x3u n ARG 177 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1x3u h ALA 178 N -1.90 2.96 0.02 5.13 0.00 -1.45 0.83 119.26 124.85 1x3u h ALA 178 Ca 0.00 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 1x3u h ALA 178 Cb 0.00 0.18 0.01 0.00 0.00 0.00 0.00 17.79 17.97 1x3u h ALA 178 CO 0.00 -1.55 -0.30 -0.97 0.00 0.00 0.00 179.25 176.43 1x3u h ASN 179 N 0.08 0.23 0.21 0.00 -0.73 -0.85 -2.86 115.58 111.66 1x3u h ASN 179 Ca 0.81 -0.83 0.00 0.00 1.87 0.00 0.00 56.30 58.15 1x3u h ASN 179 Cb 2.73 -0.07 -0.03 0.00 0.27 0.00 0.00 38.32 41.22 1x3u h ASN 179 CO -0.30 1.04 -0.37 0.58 -0.37 0.00 0.00 177.43 178.00 1x3u h VAL 180 N -0.54 0.00 -0.71 2.57 2.07 0.84 0.76 116.25 121.23 1x3u h VAL 180 Ca -0.04 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.66 1x3u h VAL 180 Cb 1.10 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 1x3u h VAL 180 CO 0.06 0.00 0.50 0.00 0.02 0.00 0.00 177.57 178.15 1x3u h MET 181 N -0.62 0.14 -0.36 1.57 -0.00 -0.99 0.87 114.93 115.53 1x3u h MET 181 Ca -0.02 -0.01 -0.16 0.00 -0.00 0.00 0.00 59.70 59.51 1x3u h MET 181 Cb 0.58 -0.03 -0.01 0.00 -0.00 0.00 0.00 31.60 32.14 1x3u h MET 181 CO -0.13 0.09 -0.40 0.00 -0.00 0.00 0.00 176.91 176.47 1x3u h ALA 182 N 1.66 0.60 0.08 -3.00 0.00 -0.85 1.27 119.26 119.02 1x3u h ALA 182 Ca 0.35 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1x3u h ALA 182 Cb 1.16 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1x3u h ALA 182 CO -0.05 0.68 -0.04 0.87 0.00 0.00 0.00 179.25 180.71 1x3u h LYS 183 N 0.73 -0.11 0.00 0.00 1.79 0.43 -3.16 116.57 116.25 1x3u h LYS 183 Ca 0.06 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 1x3u h LYS 183 Cb 0.99 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.66 1x3u h LYS 183 CO 0.10 0.44 0.00 1.98 -1.08 0.00 0.00 179.45 180.88 1x3u h MET 184 N -0.85 0.00 -0.08 3.15 4.05 0.48 -3.45 114.93 118.22 1x3u h MET 184 Ca -0.01 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.40 1x3u h MET 184 Cb 0.59 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.39 1x3u h MET 184 CO 0.02 0.00 -0.02 1.63 0.23 0.00 0.00 176.91 178.77 1x3u n LYS 185 N -2.57 -0.05 -1.57 0.39 4.76 -0.09 -5.00 118.16 114.03 1x3u n LYS 185 Ca -0.02 0.12 -0.30 0.00 -2.87 0.00 0.00 58.31 55.24 1x3u n LYS 185 Cb 0.08 -3.65 0.20 0.00 -1.84 0.00 0.00 35.03 29.81 1x3u n LYS 185 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1x3u s ALA 186 N -2.03 1.57 -0.12 7.82 0.00 0.42 -4.91 121.76 124.51 1x3u s ALA 186 Ca 0.00 -1.03 0.08 0.00 0.00 0.00 0.00 51.96 51.01 1x3u s ALA 186 Cb 0.00 -2.84 -0.13 0.00 0.00 0.00 0.00 23.12 20.14 1x3u s ALA 186 CO 0.00 -2.85 -0.00 1.63 0.00 0.00 0.00 175.76 174.53 1x3u n LYS 187 N -4.14 1.67 -2.82 0.00 5.02 -1.26 -4.72 118.16 111.91 1x3u n LYS 187 Ca 0.13 0.02 -0.00 0.00 -2.02 0.00 0.00 58.31 56.44 1x3u n LYS 187 Cb 0.59 -1.30 0.01 0.00 -0.02 0.00 0.00 35.03 34.32 1x3u n LYS 187 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1x3u n SER 188 N -2.56 -0.80 -0.24 4.39 7.64 -1.26 -4.99 113.62 115.80 1x3u n SER 188 Ca -0.21 -1.34 0.05 0.00 1.01 0.00 0.00 58.87 58.39 1x3u n SER 188 Cb 0.85 1.27 0.17 0.00 -1.01 0.00 0.00 64.21 65.50 1x3u n SER 188 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1x3u h LEU 189 N 0.00 -0.00 0.66 -3.43 7.12 -2.00 -2.78 115.31 114.88 1x3u h LEU 189 Ca -0.13 0.15 -0.03 0.00 0.13 0.00 0.00 57.88 57.99 1x3u h LEU 189 Cb 0.62 0.20 0.00 0.00 -0.53 0.00 0.00 40.66 40.96 1x3u h LEU 189 CO 0.18 -0.04 -0.34 -0.65 -0.13 0.00 0.00 178.44 177.46 1x3u h PRO 190 N 0.26 -0.88 -0.57 5.25 0.11 -1.97 -3.12 132.00 131.07 1x3u h PRO 190 Ca 0.41 0.06 0.05 0.00 0.11 0.00 0.00 66.00 66.63 1x3u h PRO 190 Cb 0.69 0.20 -0.07 0.00 0.11 0.00 0.00 31.00 31.93 1x3u h PRO 190 CO -0.51 -0.59 -0.34 1.58 -0.21 0.00 0.00 178.00 177.94 1x3u n HIS 191 N -4.56 -0.25 -0.03 0.65 -0.00 -1.06 -0.29 115.22 109.68 1x3u n HIS 191 Ca -0.11 0.71 -0.01 0.00 0.46 0.00 0.00 57.72 58.77 1x3u n HIS 191 Cb 0.37 -0.52 -0.01 0.00 -0.12 0.00 0.00 29.99 29.70 1x3u n HIS 191 CO 0.00 0.00 0.00 -0.07 0.46 0.00 0.00 176.34 176.73 1x3u h LEU 192 N 0.00 -0.20 -0.90 0.27 3.38 -1.59 0.57 115.31 116.84 1x3u h LEU 192 Ca 0.09 0.03 0.25 0.00 0.09 0.00 0.00 57.88 58.34 1x3u h LEU 192 Cb 0.23 0.09 -0.14 0.00 0.09 0.00 0.00 40.66 40.93 1x3u h LEU 192 CO -0.54 -0.03 0.29 0.58 0.09 0.00 0.00 178.44 178.84 1x3u h VAL 193 N -0.01 0.32 0.27 1.22 2.07 -1.29 0.61 116.25 119.44 1x3u h VAL 193 Ca 0.01 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 1x3u h VAL 193 Cb 0.04 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 29.88 1x3u h VAL 193 CO -0.08 0.04 -0.13 0.03 0.02 0.00 0.00 177.57 177.45 1x3u h ARG 194 N 0.23 -0.35 0.00 1.57 3.08 0.21 0.12 114.38 119.24 1x3u h ARG 194 Ca 0.58 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.65 1x3u h ARG 194 Cb 1.19 0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.32 1x3u h ARG 194 CO -0.65 -0.22 0.00 0.52 -1.07 0.00 0.00 179.97 178.55 1x3u h MET 195 N -0.38 0.00 -0.02 0.04 2.86 0.31 0.68 114.93 118.42 1x3u h MET 195 Ca -0.04 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.51 1x3u h MET 195 Cb 0.29 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.96 1x3u h MET 195 CO 0.06 0.00 -0.35 0.00 1.06 0.00 0.00 176.91 177.68 1x3u h ALA 196 N 2.00 0.07 0.00 6.32 0.00 0.21 -2.48 119.26 125.39 1x3u h ALA 196 Ca 0.00 -0.48 -0.12 0.00 0.00 0.00 0.00 54.91 54.30 1x3u h ALA 196 Cb 0.08 0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.89 1x3u h ALA 196 CO 0.00 0.17 -0.49 -0.07 0.00 0.00 0.00 179.25 178.86 1x3u h LEU 197 N -0.31 0.43 -1.84 0.00 3.38 0.07 0.32 115.31 117.37 1x3u h LEU 197 Ca -0.04 -0.77 0.25 0.00 0.09 0.00 0.00 57.88 57.41 1x3u h LEU 197 Cb 1.06 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.63 1x3u h LEU 197 CO 0.07 1.14 0.65 0.00 0.09 0.00 0.00 178.44 180.39 1x3u h ALA 198 N 0.29 2.67 -2.32 1.53 0.00 0.22 -3.20 119.26 118.46 1x3u h ALA 198 Ca -0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1x3u h ALA 198 Cb 1.22 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1x3u h ALA 198 CO 0.10 -0.95 0.00 0.41 0.00 0.00 0.00 179.25 178.80 1x3u n GLY 199 N -1.65 0.68 0.00 0.00 0.00 -0.93 -4.81 105.19 98.47 1x3u n GLY 199 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1x3u n GLY 199 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x3u n GLY 200 N 2.35 0.21 0.00 -0.02 0.00 -0.33 -4.81 105.19 102.59 1x3u n GLY 200 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1x3u n GLY 200 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1x3u n PHE 201 N -1.27 0.00 -0.86 1.61 3.01 0.99 -4.84 117.46 116.10 1x3u n PHE 201 Ca 0.00 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.57 1x3u n PHE 201 Cb 0.00 -0.30 -0.05 0.00 -0.01 0.00 0.00 39.48 39.13 1x3u n PHE 201 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1x3u n GLY 202 N -1.00 -2.61 3.57 1.37 0.00 -1.01 -4.64 105.19 100.87 1x3u n GLY 202 Ca 0.00 -1.24 -0.39 0.00 0.00 0.00 0.00 46.02 44.39 1x3u n GLY 202 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1x3u s PRO 203 N -3.10 2.56 0.00 1.61 0.02 -1.26 -4.81 135.00 130.02 1x3u s PRO 203 Ca 0.00 1.65 0.27 0.00 0.02 0.00 0.00 61.00 62.94 1x3u s PRO 203 Cb 0.00 -4.48 1.63 0.00 0.02 0.00 0.00 34.50 31.66 1x3u s PRO 203 CO 0.00 -2.75 1.98 -1.13 -0.33 0.00 0.00 177.00 174.76