#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 2.62 -4.98 1.61 2.88 -1.26 -5.09 113.62 109.39 1x3u n SER 127 Ca 0.00 -3.14 -0.20 0.00 -1.33 0.00 0.00 58.87 54.20 1x3u n SER 127 Cb 0.00 -0.52 0.00 0.00 -0.75 0.00 0.00 64.21 62.94 1x3u n SER 127 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 1x3u s HIS 128 N -3.19 3.13 -0.19 0.66 -0.00 -1.26 -4.57 115.29 109.87 1x3u s HIS 128 Ca 0.37 -0.11 0.12 0.00 -0.00 0.00 0.00 55.06 55.44 1x3u s HIS 128 Cb 0.41 -2.10 0.41 0.00 -0.00 0.00 0.00 32.58 31.31 1x3u s HIS 128 CO -0.06 -0.12 1.21 -0.12 -0.00 0.00 0.00 174.74 175.65 1x3u n MET 129 N -1.77 1.45 0.00 -0.38 0.00 -1.26 -4.96 117.12 110.20 1x3u n MET 129 Ca 0.01 -3.16 0.00 0.00 0.00 0.00 0.00 57.70 54.54 1x3u n MET 129 Cb 0.58 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 32.30 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 -1.03 0.00 0.00 6.12 8.00 -1.26 -5.11 116.55 123.27 1x3u n ASP 130 Ca 0.18 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.68 1x3u n ASP 130 Cb 0.72 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.82 1x3u n ASP 130 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1x3u n ASP 131 N 0.00 0.00 -0.35 -2.24 9.92 -1.26 -3.97 116.55 118.65 1x3u n ASP 131 Ca 0.00 0.00 0.02 0.00 -0.53 0.00 0.00 54.79 54.28 1x3u n ASP 131 Cb 0.00 0.00 0.08 0.00 -0.64 0.00 0.00 41.12 40.56 1x3u n ASP 131 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1x3u h ALA 132 N 2.43 0.38 0.00 2.24 0.00 -1.95 1.29 119.26 123.64 1x3u h ALA 132 Ca 0.00 0.32 -0.04 0.00 0.00 0.00 0.00 54.91 55.19 1x3u h ALA 132 Cb 0.00 0.86 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1x3u h ALA 132 CO 0.00 -0.51 -0.18 -0.91 0.00 0.00 0.00 179.25 177.65 1x3u h ASN 133 N -0.01 0.00 -0.90 0.00 -0.26 -1.85 -1.58 115.58 110.98 1x3u h ASN 133 Ca 0.39 0.00 0.01 0.00 -0.56 0.00 0.00 56.30 56.14 1x3u h ASN 133 Cb 0.64 0.00 -0.04 0.00 -1.06 0.00 0.00 38.32 37.86 1x3u h ASN 133 CO -0.97 0.18 0.60 -0.78 -1.06 0.00 0.00 177.43 175.40 1x3u h ASP 134 N 0.00 1.04 -0.33 5.81 3.58 0.14 -1.48 116.42 125.19 1x3u h ASP 134 Ca -0.00 -0.03 0.07 0.00 0.42 0.00 0.00 57.03 57.49 1x3u h ASP 134 Cb 0.32 -0.26 -0.06 0.00 1.72 0.00 0.00 39.33 41.05 1x3u h ASP 134 CO 0.02 0.76 -0.09 0.40 -2.88 0.00 0.00 179.24 177.45 1x3u h ILE 135 N 1.23 0.66 0.25 2.25 2.04 -0.54 0.22 117.51 123.62 1x3u h ILE 135 Ca 0.33 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.20 1x3u h ILE 135 Cb -0.14 0.66 -0.04 0.00 -0.74 0.00 0.00 36.82 36.56 1x3u h ILE 135 CO -0.07 0.00 -0.50 0.03 0.00 0.00 0.00 178.15 177.61 1x3u h ARG 136 N -0.01 -0.79 -0.44 2.37 3.08 -1.28 1.76 114.38 119.07 1x3u h ARG 136 Ca 0.16 0.05 0.13 0.00 0.07 0.00 0.00 59.98 60.39 1x3u h ARG 136 Cb 0.25 0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.46 1x3u h ARG 136 CO -0.34 -0.53 0.51 0.00 -1.07 0.00 0.00 179.97 178.54 1x3u h ALA 137 N -0.57 2.15 0.13 0.04 0.00 -0.69 0.32 119.26 120.65 1x3u h ALA 137 Ca -0.02 -0.02 -0.34 0.00 0.00 0.00 0.00 54.91 54.54 1x3u h ALA 137 Cb 0.78 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1x3u h ALA 137 CO -0.21 -0.74 -1.76 0.00 0.00 0.00 0.00 179.25 176.54 1x3u h ARG 138 N 0.00 0.27 -1.41 0.00 3.08 0.28 -3.16 114.38 113.44 1x3u h ARG 138 Ca 0.21 -0.47 0.41 0.00 0.07 0.00 0.00 59.98 60.20 1x3u h ARG 138 Cb 1.23 0.17 -0.06 0.00 0.08 0.00 0.00 29.97 31.40 1x3u h ARG 138 CO -0.00 1.14 1.07 -0.07 -1.07 0.00 0.00 179.97 181.04 1x3u h LEU 139 N 0.07 0.00 0.07 3.04 4.07 0.65 0.35 115.31 123.56 1x3u h LEU 139 Ca -0.33 0.00 -0.36 0.00 0.08 0.00 0.00 57.88 57.26 1x3u h LEU 139 Cb 2.05 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 43.75 1x3u h LEU 139 CO 0.14 0.00 -2.08 0.00 -1.08 0.00 0.00 178.44 175.42 1x3u n GLN 140 N -3.97 0.69 0.23 1.13 3.00 -1.15 -3.94 117.38 113.36 1x3u n GLN 140 Ca 0.31 0.27 0.18 0.00 -0.01 0.00 0.00 57.00 57.75 1x3u n GLN 140 Cb 1.52 -1.65 0.82 0.00 0.00 0.00 0.00 30.24 30.94 1x3u n GLN 140 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.06 178.85 1x3u h THR 141 N -0.17 0.23 0.00 5.09 1.35 -0.36 -3.23 112.91 115.81 1x3u h THR 141 Ca -0.48 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 1x3u h THR 141 Cb 1.87 0.72 0.00 0.00 -1.73 0.00 0.00 68.15 69.01 1x3u h THR 141 CO -0.04 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 175.41 1x3u n LEU 142 N -3.37 0.19 0.00 3.87 4.77 -0.11 -5.09 117.00 117.25 1x3u n LEU 142 Ca 0.02 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 1x3u n LEU 142 Cb 0.43 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 1x3u n LEU 142 CO 0.22 0.00 0.00 -1.20 -1.33 0.00 0.00 177.39 175.08 1x3u n SER 143 N -0.06 0.00 -0.07 -1.43 7.64 -1.22 -4.95 113.62 113.54 1x3u n SER 143 Ca 0.00 0.00 0.25 0.00 1.01 0.00 0.00 58.87 60.13 1x3u n SER 143 Cb 0.00 0.00 0.68 0.00 -1.01 0.00 0.00 64.21 63.88 1x3u n SER 143 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1x3u h GLU 144 N 0.00 0.00 0.78 1.43 4.81 -1.91 -0.63 114.58 119.05 1x3u h GLU 144 Ca 0.00 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.19 1x3u h GLU 144 Cb 0.00 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.39 1x3u h GLU 144 CO 0.00 0.00 -0.38 0.00 -0.73 0.00 0.00 179.01 177.90 1x3u h ARG 145 N 0.00 -1.02 0.14 1.92 2.47 -1.92 0.48 114.38 116.45 1x3u h ARG 145 Ca 0.34 0.07 -0.01 0.00 -1.26 0.00 0.00 59.98 59.12 1x3u h ARG 145 Cb 1.75 0.23 0.00 0.00 -1.65 0.00 0.00 29.97 30.30 1x3u h ARG 145 CO -0.00 -0.68 -0.07 1.49 0.56 0.00 0.00 179.97 181.27 1x3u h GLU 146 N -1.06 -0.18 -0.52 0.04 4.57 -1.35 0.76 114.58 116.84 1x3u h GLU 146 Ca -0.11 0.01 0.08 0.00 -1.18 0.00 0.00 59.36 58.17 1x3u h GLU 146 Cb 0.82 0.04 -0.06 0.00 -0.16 0.00 0.00 28.75 29.38 1x3u h GLU 146 CO 0.17 0.01 0.16 0.00 -1.18 0.00 0.00 179.01 178.17 1x3u h ARG 147 N -0.34 0.31 0.48 1.92 3.08 -1.44 1.29 114.38 119.68 1x3u h ARG 147 Ca -0.02 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 1x3u h ARG 147 Cb 0.27 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.26 1x3u h ARG 147 CO 0.03 0.21 -0.23 1.96 -1.07 0.00 0.00 179.97 180.87 1x3u h GLN 148 N 0.32 -0.62 -0.06 0.04 4.20 0.14 -2.85 115.11 116.29 1x3u h GLN 148 Ca 0.26 0.04 0.00 0.00 0.06 0.00 0.00 58.65 59.01 1x3u h GLN 148 Cb 0.31 0.14 -0.00 0.00 0.30 0.00 0.00 27.48 28.23 1x3u h GLN 148 CO -0.29 -0.41 0.04 -0.24 -0.67 0.00 0.00 178.83 177.26 1x3u h VAL 149 N -1.10 1.03 0.00 -0.54 3.04 0.63 -1.31 116.25 118.00 1x3u h VAL 149 Ca -0.07 -0.08 0.00 0.00 -1.01 0.00 0.00 66.70 65.54 1x3u h VAL 149 Cb 0.49 0.98 0.00 0.00 -2.01 0.00 0.00 31.29 30.75 1x3u h VAL 149 CO 0.11 0.03 0.00 0.25 -1.01 0.00 0.00 177.57 176.95 1x3u h LEU 150 N 0.06 0.00 0.00 3.16 5.85 0.15 0.62 115.31 125.15 1x3u h LEU 150 Ca 0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1x3u h LEU 150 Cb 0.01 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.04 1x3u h LEU 150 CO -0.00 0.00 -1.55 -1.54 -0.34 0.00 0.00 178.44 175.00 1x3u n SER 151 N -2.86 0.36 -0.02 1.25 3.41 -0.91 -2.95 113.62 111.90 1x3u n SER 151 Ca -0.02 0.03 -0.13 0.00 -0.26 0.00 0.00 58.87 58.49 1x3u n SER 151 Cb 0.09 1.36 -0.14 0.00 -0.26 0.00 0.00 64.21 65.25 1x3u n SER 151 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1x3u n ALA 152 N -2.15 1.31 -0.06 7.33 0.00 -0.27 -4.16 120.51 122.50 1x3u n ALA 152 Ca -0.02 -0.77 -0.13 0.00 0.00 0.00 0.00 53.44 52.52 1x3u n ALA 152 Cb 0.54 -0.72 -0.07 0.00 0.00 0.00 0.00 19.45 19.20 1x3u n ALA 152 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 1x3u h VAL 153 N 0.02 1.34 -0.94 0.00 -1.51 0.00 -2.99 116.25 112.18 1x3u h VAL 153 Ca -0.36 -1.40 0.27 0.00 -1.23 0.00 0.00 66.70 63.98 1x3u h VAL 153 Cb 2.04 1.85 -0.04 0.00 -2.13 0.00 0.00 31.29 33.00 1x3u h VAL 153 CO 0.07 0.42 0.84 -0.37 -1.23 0.00 0.00 177.57 177.31 1x3u h VAL 154 N 0.11 0.27 0.00 7.19 -1.51 -1.69 -0.83 116.25 119.78 1x3u h VAL 154 Ca 0.02 0.00 -0.07 0.00 -1.23 0.00 0.00 66.70 65.42 1x3u h VAL 154 Cb 0.77 0.36 -0.01 0.00 -2.13 0.00 0.00 31.29 30.28 1x3u h VAL 154 CO 0.05 0.00 -0.44 0.00 -1.23 0.00 0.00 177.57 175.95 1x3u h ALA 155 N 1.20 0.08 0.00 5.19 0.00 -1.69 -3.46 119.26 120.57 1x3u h ALA 155 Ca 0.44 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1x3u h ALA 155 Cb 2.12 0.29 0.00 0.00 0.00 0.00 0.00 17.79 20.20 1x3u h ALA 155 CO -0.00 0.27 0.00 0.41 0.00 0.00 0.00 179.25 179.93 1x3u n GLY 156 N 1.59 1.78 3.88 0.00 0.00 -0.32 -5.12 105.19 107.00 1x3u n GLY 156 Ca -0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.58 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 2.46 0.90 0.99 1.43 -1.25 -5.04 118.68 118.17 1x3u s LEU 157 Ca 0.00 0.83 -0.11 0.00 -1.03 0.00 0.00 54.13 53.82 1x3u s LEU 157 Cb 0.00 -3.32 0.13 0.00 0.03 0.00 0.00 46.19 43.04 1x3u s LEU 157 CO 0.00 -1.96 1.11 -2.84 0.23 0.00 0.00 176.35 172.90 1x3u s PRO 158 N -5.53 1.18 0.60 1.29 0.02 -1.26 -4.78 135.00 126.52 1x3u s PRO 158 Ca 0.62 1.30 0.33 0.00 0.02 0.00 0.00 61.00 63.28 1x3u s PRO 158 Cb -0.11 -1.76 1.93 0.00 0.02 0.00 0.00 34.50 34.57 1x3u s PRO 158 CO 0.50 -2.44 2.26 -0.91 -0.33 0.00 0.00 177.00 176.08 1x3u h ASN 159 N -1.72 0.00 0.00 2.53 4.21 -2.00 -1.86 115.58 116.74 1x3u h ASN 159 Ca -0.46 0.00 -0.01 0.00 1.21 0.00 0.00 56.30 57.05 1x3u h ASN 159 Cb 1.27 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 38.47 1x3u h ASN 159 CO 0.46 0.02 -0.21 0.50 -1.29 0.00 0.00 177.43 176.91 1x3u h LYS 160 N 0.00 0.00 -0.91 0.81 3.64 -1.95 -3.07 116.57 115.09 1x3u h LYS 160 Ca -0.00 0.00 0.24 0.00 -1.27 0.00 0.00 60.65 59.62 1x3u h LYS 160 Cb 0.05 0.00 -0.13 0.00 -0.41 0.00 0.00 32.23 31.74 1x3u h LYS 160 CO 0.00 0.07 0.38 1.03 -2.27 0.00 0.00 179.45 178.66 1x3u h SER 161 N -1.00 0.28 0.79 4.20 0.87 -1.90 0.92 113.55 117.71 1x3u h SER 161 Ca -0.01 0.17 -0.04 0.00 -1.23 0.00 0.00 61.79 60.68 1x3u h SER 161 Cb 0.26 0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.38 1x3u h SER 161 CO -0.01 -0.05 -0.41 0.40 -0.53 0.00 0.00 176.83 176.23 1x3u h ILE 162 N 0.35 0.16 -0.89 2.23 2.04 -1.49 1.26 117.51 121.16 1x3u h ILE 162 Ca 0.58 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.61 1x3u h ILE 162 Cb 1.15 0.16 -0.07 0.00 -0.74 0.00 0.00 36.82 37.32 1x3u h ILE 162 CO -0.57 0.00 0.58 0.00 0.00 0.00 0.00 178.15 178.16 1x3u h ALA 163 N -0.92 2.01 0.00 1.87 0.00 -1.01 0.18 119.26 121.39 1x3u h ALA 163 Ca -0.11 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1x3u h ALA 163 Cb 0.86 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 1x3u h ALA 163 CO 0.15 -0.28 -0.93 -0.92 0.00 0.00 0.00 179.25 177.28 1x3u h TYR 164 N 0.54 0.00 0.00 0.00 5.03 -0.58 -1.76 116.97 120.20 1x3u h TYR 164 Ca 0.46 0.00 -0.04 0.00 2.58 0.00 0.00 58.73 61.73 1x3u h TYR 164 Cb 0.94 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 39.21 1x3u h TYR 164 CO -0.00 0.04 -0.17 -0.44 -1.32 0.00 0.00 178.16 176.26 1x3u h ASP 165 N 0.00 0.00 -0.76 -2.11 5.19 0.46 -2.61 116.42 116.58 1x3u h ASP 165 Ca -0.01 0.00 -0.48 0.00 -0.62 0.00 0.00 57.03 55.92 1x3u h ASP 165 Cb 1.04 0.00 -0.27 0.00 0.18 0.00 0.00 39.33 40.28 1x3u h ASP 165 CO 0.00 0.17 0.19 0.18 -3.12 0.00 0.00 179.24 176.67 1x3u n LEU 166 N -3.39 5.92 -4.05 1.55 4.77 -0.56 -4.96 117.00 116.29 1x3u n LEU 166 Ca -0.00 -4.14 -0.38 0.00 -0.03 0.00 0.00 56.01 51.47 1x3u n LEU 166 Cb 0.37 -0.72 -0.01 0.00 -2.33 0.00 0.00 43.42 40.74 1x3u n LEU 166 CO 0.32 1.49 -0.21 0.47 -1.33 0.00 0.00 177.39 178.13 1x3u n ASP 167 N -0.97 -2.49 -3.80 -1.43 8.00 -0.99 -4.92 116.55 109.95 1x3u n ASP 167 Ca 0.50 -1.12 -0.09 0.00 0.71 0.00 0.00 54.79 54.79 1x3u n ASP 167 Cb 1.01 -1.35 -0.03 0.00 -0.02 0.00 0.00 41.12 40.73 1x3u n ASP 167 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1x3u s ILE 168 N -3.85 0.01 1.15 0.53 -5.25 -0.66 -5.04 121.20 108.09 1x3u s ILE 168 Ca 0.33 -0.91 -0.13 0.00 -0.99 0.00 0.00 60.65 58.96 1x3u s ILE 168 Cb -0.18 -1.80 0.28 0.00 2.95 0.00 0.00 42.46 43.70 1x3u s ILE 168 CO 0.84 -0.04 1.01 -1.54 -1.79 0.00 0.00 174.94 173.42 1x3u n SER 169 N -0.40 -1.55 -0.08 4.36 3.41 -1.26 -3.74 113.62 114.35 1x3u n SER 169 Ca -0.07 -0.11 -0.17 0.00 -0.26 0.00 0.00 58.87 58.27 1x3u n SER 169 Cb 0.61 -1.28 -0.12 0.00 -0.26 0.00 0.00 64.21 63.16 1x3u n SER 169 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1x3u h PRO 170 N -2.62 0.00 -0.19 4.33 0.13 -1.91 -3.28 132.00 128.46 1x3u h PRO 170 Ca -0.60 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.59 1x3u h PRO 170 Cb 1.33 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.45 1x3u h PRO 170 CO 0.48 0.97 0.27 0.00 -0.23 0.00 0.00 178.00 179.49 1x3u h ARG 171 N -1.00 0.00 0.00 0.86 3.08 -1.94 0.98 114.38 116.35 1x3u h ARG 171 Ca -0.14 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.91 1x3u h ARG 171 Cb 1.10 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.15 1x3u h ARG 171 CO -0.08 0.00 -0.04 1.15 -1.07 0.00 0.00 179.97 179.93 1x3u h THR 172 N 0.00 0.49 0.13 2.04 2.02 -1.94 -1.87 112.91 113.77 1x3u h THR 172 Ca 0.09 -0.16 -0.01 0.00 0.77 0.00 0.00 66.41 67.10 1x3u h THR 172 Cb 0.62 1.11 0.00 0.00 -1.74 0.00 0.00 68.15 68.14 1x3u h THR 172 CO -0.00 0.03 -0.06 -0.37 0.37 0.00 0.00 175.52 175.49 1x3u h VAL 173 N 0.00 1.01 -0.73 3.16 -1.51 0.88 1.21 116.25 120.26 1x3u h VAL 173 Ca -0.00 -1.15 0.20 0.00 -1.23 0.00 0.00 66.70 64.52 1x3u h VAL 173 Cb 0.10 1.67 -0.03 0.00 -2.13 0.00 0.00 31.29 30.90 1x3u h VAL 173 CO 0.00 0.25 0.52 -0.33 -1.23 0.00 0.00 177.57 176.79 1x3u h GLU 174 N -0.77 0.05 0.00 5.19 5.08 -1.45 1.37 114.58 124.05 1x3u h GLU 174 Ca -0.02 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1x3u h GLU 174 Cb 0.54 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 1x3u h GLU 174 CO 0.03 0.03 -0.25 0.28 -1.00 0.00 0.00 179.01 178.10 1x3u h VAL 175 N 0.05 0.01 0.00 3.13 2.07 -1.21 -3.05 116.25 117.25 1x3u h VAL 175 Ca 0.35 -1.01 0.00 0.00 0.82 0.00 0.00 66.70 66.87 1x3u h VAL 175 Cb 1.33 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 1x3u h VAL 175 CO -0.02 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.57 1x3u n HIS 176 N -4.70 0.00 -0.06 1.57 1.44 0.41 -1.65 115.22 112.23 1x3u n HIS 176 Ca -0.04 0.00 -0.05 0.00 -2.01 0.00 0.00 57.72 55.63 1x3u n HIS 176 Cb 0.13 -0.47 -0.02 0.00 0.12 0.00 0.00 29.99 29.76 1x3u n HIS 176 CO 0.00 0.00 0.00 -2.13 -2.81 0.00 0.00 176.34 171.40 1x3u n ARG 177 N -1.47 0.40 0.01 -1.40 0.63 0.47 -2.84 116.66 112.46 1x3u n ARG 177 Ca 0.03 0.43 0.21 0.00 -0.92 0.00 0.00 57.85 57.60 1x3u n ARG 177 Cb 0.12 -1.50 0.71 0.00 0.45 0.00 0.00 32.46 32.24 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 -1.15 2.42 0.03 5.13 0.00 -1.52 0.73 119.26 124.90 1x3u h ALA 178 Ca 0.00 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.73 1x3u h ALA 178 Cb 0.51 0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.36 1x3u h ALA 178 CO 0.00 -0.68 -0.66 -0.91 0.00 0.00 0.00 179.25 177.00 1x3u h ASN 179 N 0.00 0.54 0.13 0.00 2.35 -1.49 -2.40 115.58 114.71 1x3u h ASN 179 Ca 0.25 -0.79 -0.00 0.00 -0.55 0.00 0.00 56.30 55.20 1x3u h ASN 179 Cb 1.06 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 39.26 1x3u h ASN 179 CO -0.00 1.27 -0.11 0.58 -1.65 0.00 0.00 177.43 177.52 1x3u h VAL 180 N -0.13 0.00 -0.10 2.81 2.07 -0.75 1.35 116.25 121.51 1x3u h VAL 180 Ca -0.09 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.46 1x3u h VAL 180 Cb 1.39 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.16 1x3u h VAL 180 CO 0.13 0.00 0.16 0.00 0.02 0.00 0.00 177.57 177.88 1x3u h MET 181 N -0.23 0.00 0.00 1.57 -0.00 -1.39 0.18 114.93 115.06 1x3u h MET 181 Ca -0.02 0.00 -0.12 0.00 -0.00 0.00 0.00 59.70 59.56 1x3u h MET 181 Cb 0.19 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 31.77 1x3u h MET 181 CO 0.00 0.00 -0.84 0.00 -0.00 0.00 0.00 176.91 176.07 1x3u h ALA 182 N 1.77 0.66 0.00 -3.00 0.00 -0.84 1.35 119.26 119.19 1x3u h ALA 182 Ca 0.05 -0.56 -0.00 0.00 0.00 0.00 0.00 54.91 54.39 1x3u h ALA 182 Cb 0.37 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1x3u h ALA 182 CO -0.00 0.69 -0.00 0.87 0.00 0.00 0.00 179.25 180.81 1x3u h LYS 183 N 0.00 -0.01 0.00 0.00 1.57 0.48 -3.33 116.57 115.29 1x3u h LYS 183 Ca -0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1x3u h LYS 183 Cb 1.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.74 1x3u h LYS 183 CO 0.05 -0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.93 1x3u h MET 184 N -0.05 0.00 -1.10 3.15 -0.00 -1.59 -3.45 114.93 111.88 1x3u h MET 184 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1x3u h MET 184 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.60 1x3u h MET 184 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.91 178.54 1x3u n LYS 185 N -2.70 0.00 0.00 -0.10 5.02 -1.06 -5.07 118.16 114.25 1x3u n LYS 185 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 1x3u n LYS 185 Cb 0.06 -1.85 0.00 0.00 -0.02 0.00 0.00 35.03 33.22 1x3u n LYS 185 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1x3u n ALA 186 N -1.31 0.00 0.00 7.82 0.00 0.46 -4.94 120.51 122.54 1x3u n ALA 186 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1x3u n ALA 186 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.82 1x3u n ALA 186 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1x3u n LYS 187 N 0.00 0.00 -2.38 0.00 4.76 -1.26 -4.87 118.16 114.41 1x3u n LYS 187 Ca 0.00 0.00 -0.03 0.00 -2.87 0.00 0.00 58.31 55.41 1x3u n LYS 187 Cb 0.00 -0.25 0.01 0.00 -1.84 0.00 0.00 35.03 32.96 1x3u n LYS 187 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1x3u n SER 188 N -2.72 -1.01 -0.23 4.39 7.64 -1.26 -4.99 113.62 115.44 1x3u n SER 188 Ca 0.00 -1.66 0.04 0.00 1.01 0.00 0.00 58.87 58.26 1x3u n SER 188 Cb 0.24 1.67 0.16 0.00 -1.01 0.00 0.00 64.21 65.27 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 0.02 0.98 -3.43 5.85 -2.01 -2.43 115.31 114.30 1x3u h LEU 189 Ca -0.15 0.13 -0.05 0.00 0.84 0.00 0.00 57.88 58.66 1x3u h LEU 189 Cb 0.58 0.18 0.01 0.00 0.37 0.00 0.00 40.66 41.79 1x3u h LEU 189 CO 0.19 -0.01 -0.47 -0.65 -0.34 0.00 0.00 178.44 177.16 1x3u h PRO 190 N 0.28 -1.27 -0.76 5.25 0.11 -1.97 -2.87 132.00 130.77 1x3u h PRO 190 Ca 0.38 0.09 0.07 0.00 0.11 0.00 0.00 66.00 66.65 1x3u h PRO 190 Cb 0.62 0.29 -0.10 0.00 0.11 0.00 0.00 31.00 31.92 1x3u h PRO 190 CO -0.47 -0.84 -0.53 1.25 -0.21 0.00 0.00 178.00 177.20 1x3u h HIS 191 N -1.34 -1.67 -0.09 0.65 2.76 -1.83 0.38 115.15 114.02 1x3u h HIS 191 Ca -0.13 0.11 0.01 0.00 -2.20 0.00 0.00 60.37 58.15 1x3u h HIS 191 Cb 1.01 0.83 -0.02 0.00 1.55 0.00 0.00 27.41 30.78 1x3u h HIS 191 CO 0.00 -0.36 -0.10 -0.07 -1.30 0.00 0.00 177.93 176.10 1x3u h LEU 192 N -0.10 -0.34 -0.84 0.26 3.38 -1.49 0.76 115.31 116.95 1x3u h LEU 192 Ca 0.12 0.04 0.20 0.00 0.09 0.00 0.00 57.88 58.34 1x3u h LEU 192 Cb 0.42 0.14 -0.15 0.00 0.09 0.00 0.00 40.66 41.16 1x3u h LEU 192 CO -0.77 -0.07 0.01 0.58 0.09 0.00 0.00 178.44 178.28 1x3u h VAL 193 N -0.06 0.24 0.07 1.22 2.07 -1.16 1.40 116.25 120.02 1x3u h VAL 193 Ca 0.01 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.51 1x3u h VAL 193 Cb 0.10 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.01 1x3u h VAL 193 CO -0.11 0.01 -0.06 0.03 0.02 0.00 0.00 177.57 177.46 1x3u h ARG 194 N 0.08 -0.14 0.00 1.57 2.47 0.13 0.21 114.38 118.69 1x3u h ARG 194 Ca 0.47 0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 59.20 1x3u h ARG 194 Cb 0.87 0.03 -0.00 0.00 -1.65 0.00 0.00 29.97 29.22 1x3u h ARG 194 CO -0.75 -0.09 -0.01 0.52 0.56 0.00 0.00 179.97 180.19 1x3u h MET 195 N -0.15 0.00 0.29 0.04 2.86 0.41 -1.01 114.93 117.37 1x3u h MET 195 Ca 0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1x3u h MET 195 Cb 0.14 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.80 1x3u h MET 195 CO -0.02 0.01 -0.14 0.00 1.06 0.00 0.00 176.91 177.82 1x3u h ALA 196 N 1.99 -0.39 0.22 6.32 0.00 0.43 -0.39 119.26 127.44 1x3u h ALA 196 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1x3u h ALA 196 Cb 0.21 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1x3u h ALA 196 CO 0.00 -0.42 -0.22 -0.07 0.00 0.00 0.00 179.25 178.54 1x3u h LEU 197 N -0.98 -0.59 -1.96 0.00 3.38 -0.43 1.29 115.31 116.02 1x3u h LEU 197 Ca -0.04 0.06 0.15 0.00 0.09 0.00 0.00 57.88 58.13 1x3u h LEU 197 Cb 0.48 0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 1x3u h LEU 197 CO 0.07 -0.33 0.49 0.00 0.09 0.00 0.00 178.44 178.76 1x3u h ALA 198 N 0.24 2.29 -0.90 1.53 0.00 -1.29 0.86 119.26 121.98 1x3u h ALA 198 Ca -0.00 -0.02 -0.50 0.00 0.00 0.00 0.00 54.91 54.39 1x3u h ALA 198 Cb 0.44 0.04 -0.28 0.00 0.00 0.00 0.00 17.79 17.99 1x3u h ALA 198 CO -0.05 -0.76 0.55 0.41 0.00 0.00 0.00 179.25 179.40 1x3u n GLY 199 N -1.54 4.84 2.33 0.00 0.00 0.83 -4.51 105.19 107.14 1x3u n GLY 199 Ca 0.10 -1.35 -0.01 0.00 0.00 0.00 0.00 46.02 44.75 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 -1.10 -0.43 2.18 -0.02 0.00 0.30 -4.61 105.19 101.51 1x3u n GLY 200 Ca 0.56 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.30 1x3u n GLY 200 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1x3u n PHE 201 N -2.40 2.97 -4.10 1.61 7.35 0.41 -4.96 117.46 118.33 1x3u n PHE 201 Ca -0.01 -2.47 -0.27 0.00 -0.76 0.00 0.00 57.45 53.94 1x3u n PHE 201 Cb 0.45 -1.13 -0.06 0.00 0.35 0.00 0.00 39.48 39.10 1x3u n PHE 201 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 1x3u s GLY 202 N -1.85 1.75 0.18 7.13 0.00 -1.26 -4.56 107.32 108.72 1x3u s GLY 202 Ca 0.60 -1.23 -0.33 0.00 0.00 0.00 0.00 44.72 43.76 1x3u s GLY 202 CO 0.03 -1.23 1.30 -1.05 0.00 0.00 0.00 173.10 172.15 1x3u n PRO 203 N -0.21 1.53 0.00 2.90 -0.02 -1.26 -5.06 135.00 132.87 1x3u n PRO 203 Ca -0.09 0.55 0.12 0.00 -2.02 0.00 0.00 63.50 62.06 1x3u n PRO 203 Cb 0.54 -2.14 0.74 0.00 -0.02 0.00 0.00 33.50 32.63 1x3u n PRO 203 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91