#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 5.40 -4.39 1.61 7.64 -1.26 -4.97 113.62 117.65 1x3u n SER 127 Ca 0.00 -3.28 -0.43 0.00 1.01 0.00 0.00 58.87 56.17 1x3u n SER 127 Cb 0.00 -1.16 0.00 0.00 -1.01 0.00 0.00 64.21 62.04 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 1.74 4.46 -1.31 1.43 8.25 -1.26 -4.69 115.22 123.83 1x3u n HIS 128 Ca 0.25 -2.94 -0.12 0.00 -0.26 0.00 0.00 57.72 54.65 1x3u n HIS 128 Cb 0.36 -2.53 0.20 0.00 1.12 0.00 0.00 29.99 29.15 1x3u n HIS 128 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1x3u n MET 129 N 7.38 2.20 -2.90 -0.41 3.85 -1.26 -4.99 117.12 120.99 1x3u n MET 129 Ca 0.47 -3.10 -0.01 0.00 -1.00 0.00 0.00 57.70 54.07 1x3u n MET 129 Cb 0.44 -2.00 0.00 0.00 -1.05 0.00 0.00 33.22 30.61 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 -1.04 -7.49 0.00 3.17 8.00 -1.26 -4.22 116.55 113.71 1x3u n ASP 130 Ca 0.45 1.03 0.00 0.00 0.71 0.00 0.00 54.79 56.98 1x3u n ASP 130 Cb 1.33 -3.94 0.00 0.00 -0.02 0.00 0.00 41.12 38.49 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 0.90 0.00 -0.10 -2.24 -0.08 -1.26 -1.91 116.55 111.85 1x3u n ASP 131 Ca 0.00 0.00 -0.14 0.00 -1.51 0.00 0.00 54.79 53.14 1x3u n ASP 131 Cb 0.20 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 43.61 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 0.71 0.92 0.21 -1.67 0.00 -1.26 -4.18 120.51 115.24 1x3u n ALA 132 Ca 0.00 -0.85 0.07 0.00 0.00 0.00 0.00 53.44 52.66 1x3u n ALA 132 Cb 0.00 0.04 0.43 0.00 0.00 0.00 0.00 19.45 19.92 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 -1.00 0.00 0.09 0.00 -0.26 -1.85 -2.89 115.58 109.68 1x3u h ASN 133 Ca -0.17 0.00 0.01 0.00 -0.56 0.00 0.00 56.30 55.59 1x3u h ASN 133 Cb 1.11 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 38.35 1x3u h ASN 133 CO -0.10 0.30 -0.16 -0.78 -1.06 0.00 0.00 177.43 175.63 1x3u h ASP 134 N 0.00 -0.44 -0.62 5.81 1.82 -1.79 0.21 116.42 121.41 1x3u h ASP 134 Ca -0.00 0.05 0.13 0.00 -0.39 0.00 0.00 57.03 56.82 1x3u h ASP 134 Cb 0.74 0.17 -0.11 0.00 0.68 0.00 0.00 39.33 40.81 1x3u h ASP 134 CO 0.04 -0.23 -0.03 0.40 -1.61 0.00 0.00 179.24 177.81 1x3u h ILE 135 N -0.32 0.47 0.05 2.25 2.04 -1.17 0.14 117.51 120.97 1x3u h ILE 135 Ca 0.02 -0.03 -0.00 0.00 1.00 0.00 0.00 64.86 65.85 1x3u h ILE 135 Cb 0.33 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 1x3u h ILE 135 CO -0.09 0.02 -0.09 0.03 0.00 0.00 0.00 178.15 178.02 1x3u h ARG 136 N 0.09 -0.14 -0.89 2.37 2.47 -1.13 1.28 114.38 118.44 1x3u h ARG 136 Ca 0.32 0.01 0.26 0.00 -1.26 0.00 0.00 59.98 59.31 1x3u h ARG 136 Cb 0.52 0.03 -0.04 0.00 -1.65 0.00 0.00 29.97 28.83 1x3u h ARG 136 CO -0.55 -0.09 0.82 0.00 0.56 0.00 0.00 179.97 180.71 1x3u h ALA 137 N -1.49 2.73 0.21 0.04 0.00 -0.12 0.79 119.26 121.42 1x3u h ALA 137 Ca -0.01 -0.03 -0.34 0.00 0.00 0.00 0.00 54.91 54.54 1x3u h ALA 137 Cb 0.13 0.07 0.02 0.00 0.00 0.00 0.00 17.79 18.01 1x3u h ALA 137 CO -0.03 -1.28 -1.57 -0.09 0.00 0.00 0.00 179.25 176.28 1x3u h ARG 138 N 0.00 0.44 -0.95 0.00 2.43 0.71 -2.84 114.38 114.17 1x3u h ARG 138 Ca 0.42 -0.75 0.28 0.00 -0.81 0.00 0.00 59.98 59.12 1x3u h ARG 138 Cb 2.06 0.28 -0.04 0.00 -0.42 0.00 0.00 29.97 31.85 1x3u h ARG 138 CO -0.00 1.35 0.85 -0.07 -1.51 0.00 0.00 179.97 180.58 1x3u h LEU 139 N 0.12 0.00 0.01 3.80 4.07 0.85 -0.35 115.31 123.82 1x3u h LEU 139 Ca -0.28 0.00 -0.39 0.00 0.08 0.00 0.00 57.88 57.29 1x3u h LEU 139 Cb 2.12 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 43.80 1x3u h LEU 139 CO 0.22 0.00 -2.21 0.00 -1.08 0.00 0.00 178.44 175.37 1x3u n GLN 140 N -3.78 0.61 -0.01 1.13 3.00 -1.14 -3.68 117.38 113.52 1x3u n GLN 140 Ca 0.20 0.31 0.23 0.00 -0.01 0.00 0.00 57.00 57.74 1x3u n GLN 140 Cb 1.16 -1.57 0.70 0.00 0.00 0.00 0.00 30.24 30.53 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 -0.72 0.33 0.00 5.09 1.35 -0.98 -2.94 112.91 115.05 1x3u h THR 141 Ca -0.58 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.28 1x3u h THR 141 Cb 1.64 0.52 0.00 0.00 -1.73 0.00 0.00 68.15 68.58 1x3u h THR 141 CO -0.27 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 175.18 1x3u n LEU 142 N -3.73 0.00 -3.65 3.87 4.77 -0.26 -5.02 117.00 112.99 1x3u n LEU 142 Ca 0.12 0.43 -0.02 0.00 -0.03 0.00 0.00 56.01 56.51 1x3u n LEU 142 Cb 0.84 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.90 1x3u n LEU 142 CO 0.29 0.00 1.19 -0.94 -1.33 0.00 0.00 177.39 176.59 1x3u s SER 143 N -2.02 -0.01 0.58 -1.43 1.04 -1.11 -4.95 113.70 105.80 1x3u s SER 143 Ca 0.00 0.01 0.29 0.00 0.48 0.00 0.00 55.95 56.73 1x3u s SER 143 Cb 0.00 0.01 1.44 0.00 0.10 0.00 0.00 66.02 67.57 1x3u s SER 143 CO 0.00 -0.02 1.85 -0.08 0.98 0.00 0.00 173.24 175.97 1x3u h GLU 144 N 2.01 0.00 0.00 4.02 4.57 -1.91 1.22 114.58 124.48 1x3u h GLU 144 Ca -0.04 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.11 1x3u h GLU 144 Cb 1.15 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.74 1x3u h GLU 144 CO 0.20 0.00 -0.15 0.00 -1.18 0.00 0.00 179.01 177.88 1x3u h ARG 145 N 0.00 0.00 -0.00 1.92 -0.00 -1.96 -2.11 114.38 112.23 1x3u h ARG 145 Ca 0.29 0.00 -0.03 0.00 -0.50 0.00 0.00 59.98 59.74 1x3u h ARG 145 Cb 1.44 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.41 1x3u h ARG 145 CO -0.00 0.15 -0.10 1.49 0.00 0.00 0.00 179.97 181.50 1x3u h GLU 146 N 0.00 0.07 -0.19 0.04 4.22 0.12 -2.29 114.58 116.55 1x3u h GLU 146 Ca -0.00 -0.08 -0.12 0.00 0.08 0.00 0.00 59.36 59.24 1x3u h GLU 146 Cb 1.02 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 1x3u h GLU 146 CO 0.02 0.84 -0.40 0.00 -2.18 0.00 0.00 179.01 177.29 1x3u h ARG 147 N -0.66 0.43 0.89 1.92 3.08 -1.56 0.18 114.38 118.66 1x3u h ARG 147 Ca -0.01 -0.21 -0.04 0.00 0.07 0.00 0.00 59.98 59.78 1x3u h ARG 147 Cb 0.87 -0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.93 1x3u h ARG 147 CO 0.02 0.76 -0.43 1.96 -1.07 0.00 0.00 179.97 181.21 1x3u h GLN 148 N 0.36 -1.16 -0.36 0.04 4.20 -1.44 -2.19 115.11 114.55 1x3u h GLN 148 Ca 0.03 0.08 -0.14 0.00 0.06 0.00 0.00 58.65 58.68 1x3u h GLN 148 Cb 0.86 0.26 -0.01 0.00 0.30 0.00 0.00 27.48 28.89 1x3u h GLN 148 CO 0.07 -0.77 -0.35 -0.24 -0.67 0.00 0.00 178.83 176.88 1x3u h VAL 149 N -1.29 1.28 0.00 -0.54 3.04 -1.44 -2.55 116.25 114.75 1x3u h VAL 149 Ca -0.12 -1.51 0.00 0.00 -1.01 0.00 0.00 66.70 64.06 1x3u h VAL 149 Cb 0.92 1.36 0.00 0.00 -2.01 0.00 0.00 31.29 31.56 1x3u h VAL 149 CO 0.20 0.50 0.00 0.25 -1.01 0.00 0.00 177.57 177.51 1x3u h LEU 150 N 0.69 0.00 0.00 3.16 5.85 -0.65 0.76 115.31 125.12 1x3u h LEU 150 Ca 0.07 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 1x3u h LEU 150 Cb 0.90 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.93 1x3u h LEU 150 CO 0.08 0.00 -1.89 -1.54 -0.34 0.00 0.00 178.44 174.76 1x3u n SER 151 N -2.63 0.13 -0.01 1.25 3.41 -0.83 -3.09 113.62 111.84 1x3u n SER 151 Ca -0.02 0.05 -0.08 0.00 -0.26 0.00 0.00 58.87 58.57 1x3u n SER 151 Cb 0.08 1.68 -0.13 0.00 -0.26 0.00 0.00 64.21 65.58 1x3u n SER 151 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1x3u h ALA 152 N 1.91 0.75 -0.05 7.33 0.00 -0.68 -3.35 119.26 125.17 1x3u h ALA 152 Ca -0.04 -1.39 -0.12 0.00 0.00 0.00 0.00 54.91 53.36 1x3u h ALA 152 Cb 1.11 0.45 0.01 0.00 0.00 0.00 0.00 17.79 19.36 1x3u h ALA 152 CO 0.00 1.51 -0.45 -0.39 0.00 0.00 0.00 179.25 179.92 1x3u h VAL 153 N 0.00 1.43 -1.09 0.00 -1.51 0.29 -3.23 116.25 112.14 1x3u h VAL 153 Ca -0.26 -1.89 0.30 0.00 -1.23 0.00 0.00 66.70 63.61 1x3u h VAL 153 Cb 1.96 2.44 -0.10 0.00 -2.13 0.00 0.00 31.29 33.46 1x3u h VAL 153 CO 0.08 0.55 0.69 -0.37 -1.23 0.00 0.00 177.57 177.29 1x3u h VAL 154 N -0.12 0.44 0.75 7.19 -1.51 -1.69 -1.77 116.25 119.54 1x3u h VAL 154 Ca -0.04 -0.12 -0.04 0.00 -1.23 0.00 0.00 66.70 65.27 1x3u h VAL 154 Cb 1.13 0.07 0.01 0.00 -2.13 0.00 0.00 31.29 30.36 1x3u h VAL 154 CO 0.09 0.06 -0.36 0.00 -1.23 0.00 0.00 177.57 176.13 1x3u h ALA 155 N 1.63 -1.01 0.00 5.19 0.00 -1.69 -3.47 119.26 119.92 1x3u h ALA 155 Ca 0.65 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.33 1x3u h ALA 155 Cb 1.71 0.39 0.00 0.00 0.00 0.00 0.00 17.79 19.89 1x3u h ALA 155 CO -0.34 -0.95 0.00 0.41 0.00 0.00 0.00 179.25 178.36 1x3u n GLY 156 N -0.85 1.85 3.88 0.00 0.00 -0.67 -5.12 105.19 104.28 1x3u n GLY 156 Ca -0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 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 2.80 0.49 0.99 1.43 -1.26 -5.00 118.68 118.13 1x3u s LEU 157 Ca 0.00 1.09 -0.22 0.00 -1.03 0.00 0.00 54.13 53.97 1x3u s LEU 157 Cb 0.00 -3.82 -0.08 0.00 0.03 0.00 0.00 46.19 42.32 1x3u s LEU 157 CO 0.00 -1.50 1.09 -2.65 0.23 0.00 0.00 176.35 173.52 1x3u n PRO 158 N -3.10 1.37 -0.61 1.29 -0.02 -1.26 -4.51 135.00 128.15 1x3u n PRO 158 Ca 0.07 0.50 0.48 0.00 -2.02 0.00 0.00 63.50 62.53 1x3u n PRO 158 Cb 0.58 -2.21 0.77 0.00 -0.02 0.00 0.00 33.50 32.62 1x3u n PRO 158 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1x3u h ASN 159 N 1.31 0.07 0.08 2.55 4.21 -1.95 1.01 115.58 122.86 1x3u h ASN 159 Ca -0.47 0.05 -0.00 0.00 1.21 0.00 0.00 56.30 57.08 1x3u h ASN 159 Cb 1.33 0.05 0.00 0.00 -1.12 0.00 0.00 38.32 38.59 1x3u h ASN 159 CO 0.56 -0.08 -0.04 0.50 -1.29 0.00 0.00 177.43 177.07 1x3u h LYS 160 N 0.01 -0.11 -0.31 0.81 3.64 -1.87 -2.30 116.57 116.43 1x3u h LYS 160 Ca 0.90 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 60.38 1x3u h LYS 160 Cb 3.39 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 35.22 1x3u h LYS 160 CO -0.16 0.44 0.37 0.77 -2.27 0.00 0.00 179.45 178.59 1x3u h SER 161 N -0.82 0.00 0.47 4.20 0.02 0.58 1.04 113.55 119.05 1x3u h SER 161 Ca -0.01 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.92 1x3u h SER 161 Cb 0.60 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.14 1x3u h SER 161 CO 0.02 0.00 -0.23 0.40 -1.14 0.00 0.00 176.83 175.88 1x3u h ILE 162 N 0.00 0.00 0.28 3.27 1.08 -0.42 -2.08 117.51 119.64 1x3u h ILE 162 Ca 0.15 -0.42 -0.01 0.00 -0.39 0.00 0.00 64.86 64.19 1x3u h ILE 162 Cb 0.88 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.63 1x3u h ILE 162 CO -0.00 0.00 -0.13 0.00 -0.69 0.00 0.00 178.15 177.32 1x3u h ALA 163 N -1.29 -0.38 -0.86 1.87 0.00 -0.69 -3.19 119.26 114.73 1x3u h ALA 163 Ca -0.06 -0.19 0.13 0.00 0.00 0.00 0.00 54.91 54.79 1x3u h ALA 163 Cb 0.49 0.15 -0.09 0.00 0.00 0.00 0.00 17.79 18.33 1x3u h ALA 163 CO 0.11 -0.50 0.47 1.88 0.00 0.00 0.00 179.25 181.20 1x3u h TYR 164 N -0.79 0.83 -0.24 0.00 0.05 0.27 0.61 116.97 117.69 1x3u h TYR 164 Ca -0.04 0.03 0.07 0.00 0.05 0.00 0.00 58.73 58.84 1x3u h TYR 164 Cb 0.51 -0.24 -0.01 0.00 1.01 0.00 0.00 36.73 38.00 1x3u h TYR 164 CO 0.04 0.24 0.27 0.22 -1.05 0.00 0.00 178.16 177.88 1x3u h ASP 165 N 0.69 0.00 -0.92 3.88 1.82 -1.39 0.20 116.42 120.71 1x3u h ASP 165 Ca 0.45 0.00 -0.62 0.00 -0.39 0.00 0.00 57.03 56.47 1x3u h ASP 165 Cb 0.58 0.00 -0.36 0.00 0.68 0.00 0.00 39.33 40.23 1x3u h ASP 165 CO -0.33 0.00 0.07 0.18 -1.61 0.00 0.00 179.24 177.55 1x3u n LEU 166 N -3.75 6.37 -3.97 2.28 4.77 0.21 -4.94 117.00 117.96 1x3u n LEU 166 Ca 0.03 -4.53 -0.40 0.00 -0.03 0.00 0.00 56.01 51.08 1x3u n LEU 166 Cb 0.41 -0.68 0.01 0.00 -2.33 0.00 0.00 43.42 40.84 1x3u n LEU 166 CO 0.27 1.79 -0.17 0.47 -1.33 0.00 0.00 177.39 178.42 1x3u n ASP 167 N -0.81 -3.77 -3.52 -1.43 9.92 0.69 -4.96 116.55 112.67 1x3u n ASP 167 Ca 0.54 -1.20 -0.11 0.00 -0.53 0.00 0.00 54.79 53.49 1x3u n ASP 167 Cb 0.79 -2.27 -0.02 0.00 -0.64 0.00 0.00 41.12 38.98 1x3u n ASP 167 CO 0.00 0.00 0.00 0.27 0.13 0.00 0.00 177.20 177.60 1x3u s ILE 168 N -3.62 0.01 0.72 0.53 -4.36 -0.76 -4.96 121.20 108.76 1x3u s ILE 168 Ca 0.41 -0.25 -0.12 0.00 -0.26 0.00 0.00 60.65 60.44 1x3u s ILE 168 Cb -0.20 -1.21 0.03 0.00 1.25 0.00 0.00 42.46 42.33 1x3u s ILE 168 CO 0.94 -0.03 1.08 -0.94 0.24 0.00 0.00 174.94 176.23 1x3u s SER 169 N -2.79 4.94 0.00 4.36 1.04 -1.26 -1.13 113.70 118.86 1x3u s SER 169 Ca 0.03 1.79 0.23 0.00 0.48 0.00 0.00 55.95 58.49 1x3u s SER 169 Cb -0.02 -2.52 1.39 0.00 0.10 0.00 0.00 66.02 64.97 1x3u s SER 169 CO -0.09 -1.74 1.77 -0.81 0.98 0.00 0.00 173.24 173.35 1x3u n PRO 170 N -3.13 0.75 0.06 4.02 -0.04 -1.26 -2.23 135.00 133.17 1x3u n PRO 170 Ca 0.09 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.63 1x3u n PRO 170 Cb 0.53 -1.49 -0.06 0.00 -0.04 0.00 0.00 33.50 32.45 1x3u n PRO 170 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1x3u n ARG 171 N -0.99 0.62 0.09 0.54 0.00 -1.26 -3.95 116.66 111.72 1x3u n ARG 171 Ca 0.17 0.07 -0.06 0.00 -0.00 0.00 0.00 57.85 58.03 1x3u n ARG 171 Cb 0.08 -1.75 0.07 0.00 0.00 0.00 0.00 32.46 30.87 1x3u n ARG 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1x3u h THR 172 N 0.00 1.44 -0.59 5.15 1.03 -1.82 -3.08 112.91 115.03 1x3u h THR 172 Ca -0.05 -2.26 0.07 0.00 -0.01 0.00 0.00 66.41 64.16 1x3u h THR 172 Cb 1.15 2.20 -0.06 0.00 -1.07 0.00 0.00 68.15 70.37 1x3u h THR 172 CO 0.01 0.66 0.27 -0.37 -0.01 0.00 0.00 175.52 176.08 1x3u h VAL 173 N 0.13 0.88 -0.77 0.00 -1.51 -1.69 1.47 116.25 114.75 1x3u h VAL 173 Ca -0.02 -0.17 0.05 0.00 -1.23 0.00 0.00 66.70 65.33 1x3u h VAL 173 Cb 1.26 0.33 -0.05 0.00 -2.13 0.00 0.00 31.29 30.71 1x3u h VAL 173 CO 0.11 0.09 0.51 -0.33 -1.23 0.00 0.00 177.57 176.72 1x3u h GLU 174 N 0.50 0.86 0.24 5.19 4.39 -1.72 1.23 114.58 125.27 1x3u h GLU 174 Ca 0.28 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.91 1x3u h GLU 174 Cb 0.26 -0.20 0.00 0.00 -0.10 0.00 0.00 28.75 28.71 1x3u h GLU 174 CO -0.23 0.57 -0.11 0.28 -1.16 0.00 0.00 179.01 178.36 1x3u h VAL 175 N 0.89 0.40 0.57 3.13 2.07 -0.44 -2.86 116.25 120.02 1x3u h VAL 175 Ca 0.32 -0.93 -0.03 0.00 0.82 0.00 0.00 66.70 66.89 1x3u h VAL 175 Cb 0.14 0.69 0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1x3u h VAL 175 CO -0.10 0.11 -0.27 0.45 0.02 0.00 0.00 177.57 177.77 1x3u h HIS 176 N -1.00 -0.71 -0.99 1.57 3.86 0.21 -1.42 115.15 116.66 1x3u h HIS 176 Ca -0.03 -0.02 0.11 0.00 -1.16 0.00 0.00 60.37 59.27 1x3u h HIS 176 Cb 0.42 0.24 -0.13 0.00 1.06 0.00 0.00 27.41 29.00 1x3u h HIS 176 CO 0.04 -0.44 -0.53 -2.13 0.86 0.00 0.00 177.93 175.73 1x3u n ARG 177 N -4.10 -0.38 0.20 2.45 0.63 0.42 0.19 116.66 116.06 1x3u n ARG 177 Ca -0.10 1.51 0.15 0.00 -0.92 0.00 0.00 57.85 58.49 1x3u n ARG 177 Cb 0.30 -2.22 0.76 0.00 0.45 0.00 0.00 32.46 31.75 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 0.73 1.96 0.19 5.13 0.00 -1.52 0.21 119.26 125.96 1x3u h ALA 178 Ca 0.21 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.80 1x3u h ALA 178 Cb 0.46 0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.28 1x3u h ALA 178 CO -0.95 -0.23 -1.43 -0.91 0.00 0.00 0.00 179.25 175.73 1x3u h ASN 179 N 0.00 0.62 0.69 0.00 2.35 0.29 -2.40 115.58 117.12 1x3u h ASN 179 Ca 0.08 -0.70 -0.03 0.00 -0.55 0.00 0.00 56.30 55.09 1x3u h ASN 179 Cb 0.37 -0.20 0.01 0.00 0.05 0.00 0.00 38.32 38.55 1x3u h ASN 179 CO -0.00 1.56 -0.33 0.58 -1.65 0.00 0.00 177.43 177.59 1x3u h VAL 180 N 0.11 0.00 0.00 2.81 2.07 0.44 1.37 116.25 123.05 1x3u h VAL 180 Ca -0.22 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 67.23 1x3u h VAL 180 Cb 2.08 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.84 1x3u h VAL 180 CO 0.23 0.00 -0.10 0.00 0.02 0.00 0.00 177.57 177.72 1x3u h MET 181 N -0.97 0.00 0.22 1.57 -0.00 -0.85 1.23 114.93 116.13 1x3u h MET 181 Ca -0.09 0.00 -0.35 0.00 -0.00 0.00 0.00 59.70 59.26 1x3u h MET 181 Cb 0.71 0.00 0.02 0.00 -0.00 0.00 0.00 31.60 32.33 1x3u h MET 181 CO 0.16 0.10 -1.64 0.00 -0.00 0.00 0.00 176.91 175.53 1x3u h ALA 182 N 1.90 0.01 0.00 -3.00 0.00 -1.26 1.20 119.26 118.11 1x3u h ALA 182 Ca -0.00 -1.02 -0.05 0.00 0.00 0.00 0.00 54.91 53.85 1x3u h ALA 182 Cb 0.31 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1x3u h ALA 182 CO 0.01 0.87 -0.32 0.87 0.00 0.00 0.00 179.25 180.69 1x3u h LYS 183 N 0.13 0.00 0.00 0.00 1.79 0.22 -3.32 116.57 115.39 1x3u h LYS 183 Ca -0.31 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.16 1x3u h LYS 183 Cb 2.14 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.79 1x3u h LYS 183 CO 0.22 0.63 0.00 0.00 -1.08 0.00 0.00 179.45 179.23 1x3u n MET 184 N -4.62 0.15 -1.90 3.15 0.00 0.42 -4.83 117.12 109.48 1x3u n MET 184 Ca -0.12 0.59 0.00 0.00 0.00 0.00 0.00 57.70 58.17 1x3u n MET 184 Cb 0.38 -1.93 0.00 0.00 0.00 0.00 0.00 33.22 31.67 1x3u n MET 184 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 1x3u n LYS 185 N -2.23 0.00 -3.11 3.17 4.76 -1.14 -4.98 118.16 114.63 1x3u n LYS 185 Ca -0.01 0.00 -0.40 0.00 -2.87 0.00 0.00 58.31 55.03 1x3u n LYS 185 Cb 0.07 -2.58 -0.06 0.00 -1.84 0.00 0.00 35.03 30.63 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 -2.40 3.51 0.33 7.82 0.00 0.41 -4.86 121.76 126.57 1x3u s ALA 186 Ca 0.00 -0.19 0.01 0.00 0.00 0.00 0.00 51.96 51.78 1x3u s ALA 186 Cb 0.00 -2.96 0.57 0.00 0.00 0.00 0.00 23.12 20.73 1x3u s ALA 186 CO 0.00 -0.46 1.97 1.57 0.00 0.00 0.00 175.76 178.84 1x3u h LYS 187 N 7.31 0.84 -2.92 0.00 2.10 -1.96 -3.40 116.57 118.54 1x3u h LYS 187 Ca -0.33 -0.08 0.02 0.00 -2.00 0.00 0.00 60.65 58.26 1x3u h LYS 187 Cb 1.15 -0.18 -0.01 0.00 -0.90 0.00 0.00 32.23 32.29 1x3u h LYS 187 CO 0.77 0.60 0.31 0.45 -2.00 0.00 0.00 179.45 179.59 1x3u s SER 188 N -6.49 -0.04 0.13 7.07 0.15 -1.26 -5.03 113.70 108.23 1x3u s SER 188 Ca -0.10 -0.98 -0.18 0.00 0.70 0.00 0.00 55.95 55.38 1x3u s SER 188 Cb 0.17 0.78 -0.02 0.00 -1.71 0.00 0.00 66.02 65.24 1x3u s SER 188 CO 0.77 -1.53 1.77 0.25 1.20 0.00 0.00 173.24 175.70 1x3u h LEU 189 N 2.00 0.18 -0.68 3.45 5.85 -1.98 -1.86 115.31 122.26 1x3u h LEU 189 Ca -0.29 0.01 0.14 0.00 0.84 0.00 0.00 57.88 58.58 1x3u h LEU 189 Cb 1.25 -0.02 -0.10 0.00 0.37 0.00 0.00 40.66 42.15 1x3u h LEU 189 CO 0.37 0.14 0.14 -0.65 -0.34 0.00 0.00 178.44 178.10 1x3u h PRO 190 N 0.26 0.24 0.10 5.25 0.11 -2.00 -2.01 132.00 133.95 1x3u h PRO 190 Ca 0.11 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.20 1x3u h PRO 190 Cb 0.04 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.09 1x3u h PRO 190 CO -0.08 0.16 -0.05 1.25 -0.21 0.00 0.00 178.00 179.08 1x3u h HIS 191 N 0.25 -0.12 -0.43 0.65 2.76 -1.87 -3.05 115.15 113.34 1x3u h HIS 191 Ca 0.37 -0.00 0.04 0.00 -2.20 0.00 0.00 60.37 58.58 1x3u h HIS 191 Cb 0.60 0.04 -0.05 0.00 1.55 0.00 0.00 27.41 29.55 1x3u h HIS 191 CO -0.27 0.05 -0.25 1.28 -1.30 0.00 0.00 177.93 177.44 1x3u n LEU 192 N -5.08 -0.45 -0.25 0.26 4.77 -0.74 0.10 117.00 115.61 1x3u n LEU 192 Ca -0.08 1.28 0.05 0.00 -0.03 0.00 0.00 56.01 57.23 1x3u n LEU 192 Cb 0.13 -0.36 0.17 0.00 -2.33 0.00 0.00 43.42 41.03 1x3u n LEU 192 CO 0.33 -0.88 0.87 0.58 -1.33 0.00 0.00 177.39 176.97 1x3u h VAL 193 N 0.00 0.42 -0.30 4.08 2.07 -1.56 1.38 116.25 122.34 1x3u h VAL 193 Ca 0.07 -0.06 -0.05 0.00 0.82 0.00 0.00 66.70 67.48 1x3u h VAL 193 Cb 0.17 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 1x3u h VAL 193 CO -0.40 0.03 0.01 0.08 0.02 0.00 0.00 177.57 177.30 1x3u h ARG 194 N 0.17 0.53 0.00 1.57 0.11 -0.70 0.12 114.38 116.19 1x3u h ARG 194 Ca 0.41 -0.17 0.00 0.00 0.10 0.00 0.00 59.98 60.32 1x3u h ARG 194 Cb 0.72 -0.05 0.00 0.00 1.11 0.00 0.00 29.97 31.75 1x3u h ARG 194 CO -0.59 0.67 0.00 0.52 0.10 0.00 0.00 179.97 180.67 1x3u h MET 195 N 0.33 0.00 0.02 0.08 2.86 0.29 1.23 114.93 119.74 1x3u h MET 195 Ca 0.09 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.73 1x3u h MET 195 Cb 0.43 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.09 1x3u h MET 195 CO 0.01 0.00 -0.01 0.00 1.06 0.00 0.00 176.91 177.97 1x3u h ALA 196 N 2.07 -0.03 -0.03 6.32 0.00 0.34 -3.31 119.26 124.62 1x3u h ALA 196 Ca 0.00 -0.31 -0.17 0.00 0.00 0.00 0.00 54.91 54.42 1x3u h ALA 196 Cb 0.23 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1x3u h ALA 196 CO 0.00 -0.05 -0.74 -0.07 0.00 0.00 0.00 179.25 178.39 1x3u h LEU 197 N -0.96 0.27 -1.89 0.00 3.38 -0.49 1.33 115.31 116.94 1x3u h LEU 197 Ca -0.00 -0.18 0.41 0.00 0.09 0.00 0.00 57.88 58.20 1x3u h LEU 197 Cb 0.64 -0.08 -0.07 0.00 0.09 0.00 0.00 40.66 41.24 1x3u h LEU 197 CO 0.01 0.91 1.01 0.00 0.09 0.00 0.00 178.44 180.45 1x3u h ALA 198 N 1.08 3.23 -3.00 1.53 0.00 0.14 -3.30 119.26 118.94 1x3u h ALA 198 Ca -0.03 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1x3u h ALA 198 Cb 1.31 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.21 1x3u h ALA 198 CO 0.11 -1.67 0.00 0.41 0.00 0.00 0.00 179.25 178.10 1x3u n GLY 199 N -1.77 -0.15 0.14 0.00 0.00 -1.12 -4.73 105.19 97.57 1x3u n GLY 199 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.34 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 3.20 -0.29 2.82 -0.02 0.00 -0.96 -4.96 105.19 104.98 1x3u n GLY 200 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 0.00 2.92 -4.63 1.61 3.01 0.45 -4.93 117.46 115.89 1x3u n PHE 201 Ca 0.00 -2.42 -0.33 0.00 1.01 0.00 0.00 57.45 55.71 1x3u n PHE 201 Cb 0.52 -1.18 -0.16 0.00 -0.01 0.00 0.00 39.48 38.66 1x3u n PHE 201 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1x3u s GLY 202 N -1.20 1.44 -0.30 1.37 0.00 -1.26 -3.31 107.32 104.06 1x3u s GLY 202 Ca 0.48 -1.04 -0.40 0.00 0.00 0.00 0.00 44.72 43.76 1x3u s GLY 202 CO -0.32 -0.03 1.80 -1.05 0.00 0.00 0.00 173.10 173.50 1x3u n PRO 203 N 3.98 1.09 0.00 2.90 -0.02 -1.26 -5.03 135.00 136.66 1x3u n PRO 203 Ca -0.19 0.39 0.06 0.00 -2.02 0.00 0.00 63.50 61.74 1x3u n PRO 203 Cb 0.52 -2.11 0.34 0.00 -0.02 0.00 0.00 33.50 32.23 1x3u n PRO 203 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93