#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dkp h MET 138 N 0.00 0.80 -0.28 4.33 2.86 -2.05 0.21 114.93 120.80 3dkp h MET 138 Ca 0.00 -0.05 0.06 0.00 -2.06 0.00 0.00 59.70 57.65 3dkp h MET 138 Cb 0.00 -0.18 -0.06 0.00 0.06 0.00 0.00 31.60 31.42 3dkp h MET 138 CO 0.00 0.53 -0.11 0.87 1.06 0.00 0.00 176.91 179.25 3dkp h LYS 139 N 0.82 -0.06 -0.17 1.72 1.57 -2.05 -0.16 116.57 118.23 3dkp h LYS 139 Ca 0.29 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 59.03 3dkp h LYS 139 Cb 0.07 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 3dkp h LYS 139 CO -0.13 -0.04 -0.06 0.82 -0.57 0.00 0.00 179.45 179.47 3dkp h ILE 140 N -0.06 1.30 -0.78 1.86 1.08 -1.93 -1.65 117.51 117.32 3dkp h ILE 140 Ca 0.14 -1.07 0.06 0.00 -0.39 0.00 0.00 64.86 63.60 3dkp h ILE 140 Cb 0.28 1.65 -0.06 0.00 -3.07 0.00 0.00 36.82 35.62 3dkp h ILE 140 CO -0.33 0.32 0.47 0.78 -0.69 0.00 0.00 178.15 178.70 3dkp h ASN 141 N 0.05 0.73 -0.49 1.72 2.35 -0.54 -2.12 115.58 117.28 3dkp h ASN 141 Ca 0.04 0.02 0.06 0.00 -0.55 0.00 0.00 56.30 55.87 3dkp h ASN 141 Cb 0.52 -0.13 -0.05 0.00 0.05 0.00 0.00 38.32 38.71 3dkp h ASN 141 CO 0.02 0.47 0.21 0.15 -1.65 0.00 0.00 177.43 176.63 3dkp h PHE 142 N 0.87 0.37 -0.09 1.19 3.57 -0.80 0.35 116.94 122.40 3dkp h PHE 142 Ca 0.34 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.89 3dkp h PHE 142 Cb 0.16 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 38.77 3dkp h PHE 142 CO -0.05 0.15 -0.08 -0.07 -2.23 0.00 0.00 178.31 176.03 3dkp h LEU 143 N 0.41 -0.25 -0.52 0.59 3.38 -0.67 0.31 115.31 118.55 3dkp h LEU 143 Ca 0.23 0.05 -0.16 0.00 0.09 0.00 0.00 57.88 58.09 3dkp h LEU 143 Cb 0.20 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 3dkp h LEU 143 CO -0.20 -0.11 -0.49 0.03 0.09 0.00 0.00 178.44 177.76 3dkp h ARG 144 N -0.10 0.64 -0.01 1.13 3.08 -1.24 -1.78 114.38 116.11 3dkp h ARG 144 Ca 0.06 -0.37 -0.07 0.00 0.07 0.00 0.00 59.98 59.67 3dkp h ARG 144 Cb 0.19 0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.27 3dkp h ARG 144 CO -0.15 0.98 -0.28 -0.91 -1.07 0.00 0.00 179.97 178.55 3dkp h ASN 145 N 0.51 0.25 -0.90 7.04 2.35 -0.69 -0.51 115.58 123.64 3dkp h ASN 145 Ca 0.02 -0.76 0.00 0.00 -0.55 0.00 0.00 56.30 55.01 3dkp h ASN 145 Cb 1.03 -0.08 -0.04 0.00 0.05 0.00 0.00 38.32 39.28 3dkp h ASN 145 CO 0.10 0.98 0.58 0.50 -1.65 0.00 0.00 177.43 177.94 3dkp h LYS 146 N -0.45 1.19 -0.59 0.81 1.63 -0.44 -3.06 116.57 115.66 3dkp h LYS 146 Ca -0.03 -0.08 0.00 0.00 -0.85 0.00 0.00 60.65 59.68 3dkp h LYS 146 Cb 1.02 -0.26 0.00 0.00 -0.60 0.00 0.00 32.23 32.39 3dkp h LYS 146 CO 0.06 0.81 0.00 0.72 -3.45 0.00 0.00 179.45 177.58 3dkp n HIS 147 N -4.44 0.78 -3.37 1.91 8.25 -0.67 -4.95 115.22 112.72 3dkp n HIS 147 Ca 0.10 -0.39 -0.23 0.00 -0.26 0.00 0.00 57.72 56.94 3dkp n HIS 147 Cb 0.03 -0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.20 3dkp n HIS 147 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3dkp n LYS 148 N 1.60 -6.79 -2.75 -0.41 4.76 -0.81 -4.72 118.16 109.04 3dkp n LYS 148 Ca 0.22 0.85 -0.43 0.00 -2.87 0.00 0.00 58.31 56.09 3dkp n LYS 148 Cb 0.62 -5.82 -0.04 0.00 -1.84 0.00 0.00 35.03 27.96 3dkp n LYS 148 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3dkp s ILE 149 N -3.27 4.24 -0.21 -0.18 1.01 -0.26 -1.33 121.20 121.20 3dkp s ILE 149 Ca 0.48 0.44 -0.13 0.00 0.00 0.00 0.00 60.65 61.44 3dkp s ILE 149 Cb -0.21 -4.62 -0.05 0.00 0.01 0.00 0.00 42.46 37.59 3dkp s ILE 149 CO 0.59 -1.24 0.25 -1.00 0.00 0.00 0.00 174.94 173.54 3dkp s HIS 150 N 4.35 3.36 -0.04 3.97 3.76 0.63 -4.79 115.29 126.53 3dkp s HIS 150 Ca 0.34 0.41 0.03 0.00 -0.15 0.00 0.00 55.06 55.69 3dkp s HIS 150 Cb -0.11 -2.35 0.00 0.00 1.11 0.00 0.00 32.58 31.23 3dkp s HIS 150 CO 0.20 0.08 -0.13 0.14 -0.85 0.00 0.00 174.74 174.19 3dkp s VAL 151 N 1.00 1.12 0.06 -0.90 -7.23 -1.26 -0.67 120.40 112.53 3dkp s VAL 151 Ca 0.12 -0.53 0.07 0.00 -1.81 0.00 0.00 61.98 59.83 3dkp s VAL 151 Cb -0.14 -0.99 -0.03 0.00 0.56 0.00 0.00 36.38 35.79 3dkp s VAL 151 CO 0.05 0.34 -0.19 -1.58 -0.31 0.00 0.00 175.10 173.40 3dkp s GLN 152 N 0.23 1.19 0.00 4.82 0.74 0.15 -4.98 119.66 121.80 3dkp s GLN 152 Ca -0.06 -0.99 0.00 0.00 0.05 0.00 0.00 55.36 54.37 3dkp s GLN 152 Cb -0.11 -1.33 0.00 0.00 1.10 0.00 0.00 33.01 32.67 3dkp s GLN 152 CO 0.02 0.33 0.00 0.41 -0.55 0.00 0.00 175.29 175.49 3dkp n GLY 153 N 1.56 1.03 3.56 2.59 0.00 -1.26 -0.70 105.19 111.96 3dkp n GLY 153 Ca -0.18 -1.95 -0.31 0.00 0.00 0.00 0.00 46.02 43.58 3dkp n GLY 153 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dkp s THR 154 N -1.10 3.37 -1.25 2.61 -4.23 -1.26 -4.70 115.64 109.08 3dkp s THR 154 Ca 0.00 -1.08 -0.02 0.00 -1.18 0.00 0.00 61.69 59.40 3dkp s THR 154 Cb 0.00 -2.51 0.00 0.00 1.34 0.00 0.00 72.50 71.33 3dkp s THR 154 CO 0.00 0.25 1.03 -0.67 -0.54 0.00 0.00 174.62 174.69 3dkp n ASP 155 N 1.14 -3.09 -4.70 3.99 -0.08 -1.26 -4.91 116.55 107.64 3dkp n ASP 155 Ca -0.14 -0.61 -0.42 0.00 -1.51 0.00 0.00 54.79 52.10 3dkp n ASP 155 Cb 0.52 -5.04 -0.03 0.00 2.34 0.00 0.00 41.12 38.91 3dkp n ASP 155 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 3dkp s LEU 156 N -6.62 4.35 0.41 -2.67 1.43 -1.26 -5.00 118.68 109.33 3dkp s LEU 156 Ca 0.15 2.37 -0.26 0.00 -1.03 0.00 0.00 54.13 55.37 3dkp s LEU 156 Cb -0.07 -3.57 -0.08 0.00 0.03 0.00 0.00 46.19 42.50 3dkp s LEU 156 CO 0.74 -0.80 1.29 -2.84 0.23 0.00 0.00 176.35 174.97 3dkp s PRO 157 N 2.17 3.93 0.52 1.29 0.02 -1.26 -4.99 135.00 136.69 3dkp s PRO 157 Ca 0.69 2.13 -0.22 0.00 0.02 0.00 0.00 61.00 63.62 3dkp s PRO 157 Cb -0.37 -2.72 -0.05 0.00 0.02 0.00 0.00 34.50 31.38 3dkp s PRO 157 CO 0.30 -0.52 1.28 -0.51 -0.33 0.00 0.00 177.00 177.23 3dkp s ASP 158 N -0.79 5.54 0.67 2.53 1.01 -1.26 -4.87 116.67 119.50 3dkp s ASP 158 Ca 0.58 2.59 -0.14 0.00 0.71 0.00 0.00 52.55 56.28 3dkp s ASP 158 Cb -0.37 -2.62 0.01 0.00 1.01 0.00 0.00 42.92 40.94 3dkp s ASP 158 CO 0.48 -1.37 1.10 -2.16 0.21 0.00 0.00 175.17 173.42 3dkp s PRO 159 N -2.88 2.77 -0.01 8.23 0.04 -1.26 -4.78 135.00 137.11 3dkp s PRO 159 Ca 0.70 1.30 -0.11 0.00 0.04 0.00 0.00 61.00 62.92 3dkp s PRO 159 Cb -0.36 -1.95 -0.05 0.00 0.04 0.00 0.00 34.50 32.18 3dkp s PRO 159 CO 0.42 -1.26 0.33 0.96 0.04 0.00 0.00 177.00 177.49 3dkp s ILE 160 N -2.51 5.19 0.07 0.56 -5.25 0.11 -4.98 121.20 114.39 3dkp s ILE 160 Ca 0.65 0.53 0.04 0.00 -0.99 0.00 0.00 60.65 60.88 3dkp s ILE 160 Cb -0.19 -3.61 -0.24 0.00 2.95 0.00 0.00 42.46 41.38 3dkp s ILE 160 CO 0.44 0.50 1.11 0.00 -1.79 0.00 0.00 174.94 175.21 3dkp h ALA 161 N 4.47 0.35 -2.57 2.27 0.00 -1.96 -3.42 119.26 118.40 3dkp h ALA 161 Ca -0.52 -1.01 -0.12 0.00 0.00 0.00 0.00 54.91 53.27 3dkp h ALA 161 Cb 1.21 0.02 -0.17 0.00 0.00 0.00 0.00 17.79 18.85 3dkp h ALA 161 CO 0.62 1.23 -0.50 0.95 0.00 0.00 0.00 179.25 181.55 3dkp s THR 162 N -2.67 0.13 0.38 0.00 -4.23 -1.26 -4.58 115.64 103.42 3dkp s THR 162 Ca -0.02 -1.10 0.27 0.00 -1.18 0.00 0.00 61.69 59.65 3dkp s THR 162 Cb 0.09 -0.97 0.29 0.00 1.34 0.00 0.00 72.50 73.25 3dkp s THR 162 CO 0.84 -0.61 2.04 -0.26 -0.54 0.00 0.00 174.62 176.09 3dkp h PHE 163 N 3.52 0.00 -0.85 3.99 0.04 -1.93 -2.99 116.94 118.72 3dkp h PHE 163 Ca -0.33 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.41 3dkp h PHE 163 Cb 1.18 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 39.30 3dkp h PHE 163 CO 0.53 0.13 0.41 1.96 -0.60 0.00 0.00 178.31 180.74 3dkp h GLN 164 N 0.00 1.23 -0.98 1.51 7.50 -1.95 -1.92 115.11 120.49 3dkp h GLN 164 Ca -0.00 -0.18 0.35 0.00 0.50 0.00 0.00 58.65 59.32 3dkp h GLN 164 Cb 0.38 -0.22 -0.17 0.00 0.05 0.00 0.00 27.48 27.52 3dkp h GLN 164 CO 0.02 0.94 0.43 1.96 -1.50 0.00 0.00 178.83 180.67 3dkp h GLN 165 N 1.21 0.11 0.00 1.46 4.20 -1.95 -0.30 115.11 119.85 3dkp h GLN 165 Ca 0.29 -0.01 -0.05 0.00 0.06 0.00 0.00 58.65 58.94 3dkp h GLN 165 Cb 0.12 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.87 3dkp h GLN 165 CO -0.04 0.07 -0.26 -0.07 -0.67 0.00 0.00 178.83 177.87 3dkp h LEU 166 N 0.11 0.00 -0.08 1.46 3.38 -1.50 1.11 115.31 119.80 3dkp h LEU 166 Ca 0.74 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.58 3dkp h LEU 166 Cb 1.79 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.55 3dkp h LEU 166 CO -0.74 0.26 -0.46 -0.78 0.09 0.00 0.00 178.44 176.81 3dkp h ASP 167 N 0.00 0.54 -0.44 -0.43 3.58 -1.13 0.21 116.42 118.75 3dkp h ASP 167 Ca -0.00 -0.66 -0.06 0.00 0.42 0.00 0.00 57.03 56.72 3dkp h ASP 167 Cb 0.51 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 41.39 3dkp h ASP 167 CO 0.03 1.11 0.02 1.56 -2.88 0.00 0.00 179.24 179.09 3dkp h GLN 168 N 0.00 0.76 0.11 0.28 4.20 -0.76 -1.68 115.11 118.01 3dkp h GLN 168 Ca -0.04 -0.23 -0.37 0.00 0.06 0.00 0.00 58.65 58.08 3dkp h GLN 168 Cb 1.12 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.80 3dkp h GLN 168 CO 0.09 0.82 -2.06 0.39 -0.67 0.00 0.00 178.83 177.41 3dkp n GLU 169 N -4.42 0.74 0.00 1.46 1.02 0.37 -4.61 120.64 115.21 3dkp n GLU 169 Ca -0.00 0.25 0.02 0.00 -0.02 0.00 0.00 57.16 57.40 3dkp n GLU 169 Cb 0.28 -1.69 -0.00 0.00 -0.02 0.00 0.00 31.44 30.01 3dkp n GLU 169 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3dkp n TYR 170 N -3.44 0.00 -3.37 -0.32 4.01 -0.71 -5.03 117.16 108.30 3dkp n TYR 170 Ca -0.33 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.22 3dkp n TYR 170 Cb 1.04 0.00 0.06 0.00 -0.31 0.00 0.00 39.34 40.13 3dkp n TYR 170 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 3dkp n LYS 171 N -0.52 -6.33 -1.50 -0.72 4.81 0.66 -4.93 118.16 109.64 3dkp n LYS 171 Ca 0.01 0.66 -0.44 0.00 -0.87 0.00 0.00 58.31 57.67 3dkp n LYS 171 Cb 0.06 -5.19 -0.01 0.00 0.02 0.00 0.00 35.03 29.92 3dkp n LYS 171 CO 0.00 0.00 0.00 1.51 1.17 0.00 0.00 177.40 180.08 3dkp n ILE 172 N -4.48 1.91 -1.60 3.15 3.06 -1.14 -4.89 119.36 115.37 3dkp n ILE 172 Ca 0.00 -0.50 -0.52 0.00 -2.50 0.00 0.00 62.75 59.24 3dkp n ILE 172 Cb 0.55 -0.60 -0.06 0.00 0.54 0.00 0.00 39.64 40.07 3dkp n ILE 172 CO 0.00 0.00 0.00 -3.20 -2.50 0.00 0.00 176.55 170.85 3dkp n ASN 173 N 1.40 1.79 0.04 9.51 2.85 -1.26 -4.86 115.26 124.73 3dkp n ASN 173 Ca 0.12 1.11 -0.00 0.00 -0.11 0.00 0.00 54.58 55.70 3dkp n ASN 173 Cb 0.34 -1.21 0.30 0.00 1.24 0.00 0.00 39.78 40.45 3dkp n ASN 173 CO 0.00 0.00 0.00 0.77 -2.11 0.00 0.00 177.26 175.92 3dkp h SER 174 N 4.75 0.39 -0.16 1.20 4.64 -2.00 -1.71 113.55 120.66 3dkp h SER 174 Ca -0.47 -0.09 -0.05 0.00 -0.47 0.00 0.00 61.79 60.70 3dkp h SER 174 Cb 1.33 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 63.31 3dkp h SER 174 CO 0.79 0.55 -0.09 -0.09 -0.87 0.00 0.00 176.83 177.12 3dkp h ARG 175 N 0.39 0.34 -0.20 4.77 9.65 -1.97 -1.95 114.38 125.41 3dkp h ARG 175 Ca 0.07 -0.16 0.06 0.00 -1.10 0.00 0.00 59.98 58.86 3dkp h ARG 175 Cb 0.44 -0.01 -0.07 0.00 -1.39 0.00 0.00 29.97 28.95 3dkp h ARG 175 CO 0.03 0.67 -0.27 1.25 2.80 0.00 0.00 179.97 184.45 3dkp h LEU 176 N 0.01 -0.85 -1.02 3.80 5.85 -1.78 0.17 115.31 121.49 3dkp h LEU 176 Ca 0.03 0.14 0.06 0.00 0.84 0.00 0.00 57.88 58.95 3dkp h LEU 176 Cb 0.57 0.38 -0.06 0.00 0.37 0.00 0.00 40.66 41.92 3dkp h LEU 176 CO 0.03 -0.31 0.65 0.25 -0.34 0.00 0.00 178.44 178.72 3dkp h LEU 177 N -0.30 1.04 -0.73 2.25 5.85 -1.32 -1.05 115.31 121.04 3dkp h LEU 177 Ca 0.12 0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.73 3dkp h LEU 177 Cb 0.49 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 3dkp h LEU 177 CO -0.37 0.67 -0.27 -0.61 -0.34 0.00 0.00 178.44 177.52 3dkp h GLN 178 N 1.19 0.66 -0.26 1.25 5.75 -0.75 -1.82 115.11 121.13 3dkp h GLN 178 Ca 0.42 -0.28 0.00 0.00 -0.15 0.00 0.00 58.65 58.64 3dkp h GLN 178 Cb 0.14 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.65 3dkp h GLN 178 CO -0.16 0.87 0.17 -0.91 -2.65 0.00 0.00 178.83 176.15 3dkp h ASN 179 N 0.57 0.30 -0.11 -0.69 2.35 0.23 0.22 115.58 118.46 3dkp h ASN 179 Ca 0.07 -0.01 0.04 0.00 -0.55 0.00 0.00 56.30 55.85 3dkp h ASN 179 Cb 0.76 -0.07 -0.04 0.00 0.05 0.00 0.00 38.32 39.02 3dkp h ASN 179 CO 0.06 0.21 -0.13 0.40 -1.65 0.00 0.00 177.43 176.33 3dkp h ILE 180 N 0.35 0.65 -0.39 2.81 2.04 -1.10 -0.68 117.51 121.18 3dkp h ILE 180 Ca 0.10 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.90 3dkp h ILE 180 Cb -0.04 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 3dkp h ILE 180 CO -0.02 0.00 0.02 -0.07 0.00 0.00 0.00 178.15 178.08 3dkp h LEU 181 N -0.17 0.67 -2.09 1.44 3.38 -1.16 -2.60 115.31 114.78 3dkp h LEU 181 Ca 0.08 -0.30 0.07 0.00 0.09 0.00 0.00 57.88 57.83 3dkp h LEU 181 Cb 0.29 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 3dkp h LEU 181 CO -0.21 0.80 0.19 0.44 0.09 0.00 0.00 178.44 179.75 3dkp h ASP 182 N 0.52 0.00 0.37 -0.43 3.32 -0.40 -0.03 116.42 119.76 3dkp h ASP 182 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 3dkp h ASP 182 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 3dkp h ASP 182 CO 0.02 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.54 3dkp n ALA 183 N -2.50 2.23 -0.60 3.45 0.00 -0.28 -4.86 120.51 117.95 3dkp n ALA 183 Ca 0.03 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3dkp n ALA 183 Cb 0.34 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.40 3dkp n ALA 183 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dkp n GLY 184 N 0.67 0.69 3.52 0.00 0.00 -0.03 -4.97 105.19 105.08 3dkp n GLY 184 Ca 0.12 -0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 3dkp n GLY 184 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dkp s PHE 185 N -2.00 3.08 0.30 1.61 0.08 -1.04 -4.76 117.98 115.25 3dkp s PHE 185 Ca 0.00 -1.76 0.06 0.00 0.12 0.00 0.00 56.93 55.35 3dkp s PHE 185 Cb 0.00 -4.54 0.49 0.00 -0.57 0.00 0.00 43.02 38.40 3dkp s PHE 185 CO 0.00 -1.63 1.74 0.37 -0.10 0.00 0.00 175.22 175.60 3dkp h GLN 186 N 7.66 0.30 -3.35 0.44 -0.00 -1.85 -3.39 115.11 114.93 3dkp h GLN 186 Ca 0.35 -0.12 -0.20 0.00 -0.00 0.00 0.00 58.65 58.68 3dkp h GLN 186 Cb 0.89 -0.01 -0.28 0.00 0.00 0.00 0.00 27.48 28.08 3dkp h GLN 186 CO 1.34 0.60 -0.56 1.41 0.00 0.00 0.00 178.83 181.62 3dkp s MET 187 N -4.31 0.15 0.68 1.69 -2.45 -1.26 -4.70 119.30 109.10 3dkp s MET 187 Ca -0.05 0.24 -0.16 0.00 -1.25 0.00 0.00 55.69 54.47 3dkp s MET 187 Cb 0.14 0.02 0.01 0.00 1.25 0.00 0.00 34.83 36.25 3dkp s MET 187 CO 0.77 -0.05 1.19 -1.25 1.05 0.00 0.00 175.02 176.73 3dkp s PRO 188 N 0.33 2.46 0.70 4.11 0.04 -1.26 -5.00 135.00 136.38 3dkp s PRO 188 Ca -0.02 1.73 -0.11 0.00 0.04 0.00 0.00 61.00 62.63 3dkp s PRO 188 Cb -0.03 -1.88 0.01 0.00 0.04 0.00 0.00 34.50 32.64 3dkp s PRO 188 CO -0.01 -1.58 1.09 0.95 0.04 0.00 0.00 177.00 177.49 3dkp s THR 189 N -1.93 3.54 0.28 1.26 -4.23 -1.26 -4.74 115.64 108.56 3dkp s THR 189 Ca 0.74 0.50 0.02 0.00 -1.18 0.00 0.00 61.69 61.78 3dkp s THR 189 Cb -0.28 -3.48 0.27 0.00 1.34 0.00 0.00 72.50 70.35 3dkp s THR 189 CO 0.41 -0.65 1.77 -0.65 -0.54 0.00 0.00 174.62 174.96 3dkp h PRO 190 N -0.65 0.69 -0.28 3.99 0.11 -1.89 0.20 132.00 134.16 3dkp h PRO 190 Ca -0.45 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 65.49 3dkp h PRO 190 Cb 1.25 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 3dkp h PRO 190 CO 0.63 0.46 -0.31 0.97 -0.21 0.00 0.00 178.00 179.54 3dkp h ILE 191 N 0.71 1.30 -0.53 4.15 6.09 -1.93 -2.82 117.51 124.47 3dkp h ILE 191 Ca 0.52 -1.48 0.06 0.00 -1.37 0.00 0.00 64.86 62.59 3dkp h ILE 191 Cb 0.77 1.60 -0.05 0.00 0.47 0.00 0.00 36.82 39.60 3dkp h ILE 191 CO -0.37 0.48 0.24 1.56 -3.07 0.00 0.00 178.15 176.99 3dkp h GLN 192 N 0.46 0.46 -0.72 2.19 4.20 -1.67 0.64 115.11 120.66 3dkp h GLN 192 Ca 0.04 -0.03 0.15 0.00 0.06 0.00 0.00 58.65 58.87 3dkp h GLN 192 Cb 0.88 -0.10 -0.10 0.00 0.30 0.00 0.00 27.48 28.46 3dkp h GLN 192 CO 0.08 0.30 0.21 0.52 -0.67 0.00 0.00 178.83 179.27 3dkp h MET 193 N 0.47 0.32 0.00 1.46 2.86 -0.37 -2.44 114.93 117.22 3dkp h MET 193 Ca 0.25 -0.02 -0.37 0.00 -2.06 0.00 0.00 59.70 57.50 3dkp h MET 193 Cb 0.20 -0.07 -0.07 0.00 0.06 0.00 0.00 31.60 31.72 3dkp h MET 193 CO -0.20 0.21 -2.36 0.94 1.06 0.00 0.00 176.91 176.56 3dkp n GLN 194 N -5.10 0.68 -0.10 1.72 -0.06 -1.12 -0.72 117.38 112.69 3dkp n GLN 194 Ca 0.13 0.03 -0.13 0.00 -2.00 0.00 0.00 57.00 55.03 3dkp n GLN 194 Cb 0.42 -1.54 -0.02 0.00 -4.06 0.00 0.00 30.24 25.05 3dkp n GLN 194 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 3dkp h ALA 195 N 0.85 0.55 0.21 1.69 0.00 0.33 -3.07 119.26 119.83 3dkp h ALA 195 Ca -0.54 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 53.89 3dkp h ALA 195 Cb 2.18 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.87 3dkp h ALA 195 CO 0.02 0.68 -0.13 0.82 0.00 0.00 0.00 179.25 180.63 3dkp h ILE 196 N 0.72 0.72 0.00 0.00 2.04 -1.61 -2.07 117.51 117.31 3dkp h ILE 196 Ca 0.04 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.82 3dkp h ILE 196 Cb 1.04 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 37.83 3dkp h ILE 196 CO 0.10 0.00 -0.38 1.55 0.00 0.00 0.00 178.15 179.43 3dkp h PRO 197 N -0.33 0.00 -0.40 2.37 0.13 -1.78 -0.68 132.00 131.30 3dkp h PRO 197 Ca -0.02 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 65.14 3dkp h PRO 197 Cb 0.28 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.37 3dkp h PRO 197 CO 0.02 0.38 0.19 0.28 -0.23 0.00 0.00 178.00 178.64 3dkp h VAL 198 N 0.00 0.97 -0.21 1.56 2.07 -1.39 -1.61 116.25 117.64 3dkp h VAL 198 Ca -0.00 -0.14 -0.15 0.00 0.82 0.00 0.00 66.70 67.23 3dkp h VAL 198 Cb 0.71 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 3dkp h VAL 198 CO 0.05 0.07 -0.50 0.24 0.02 0.00 0.00 177.57 177.46 3dkp h MET 199 N 0.40 0.58 -0.14 1.57 2.86 -1.00 -2.50 114.93 116.70 3dkp h MET 199 Ca 0.17 -0.34 -0.04 0.00 -2.06 0.00 0.00 59.70 57.43 3dkp h MET 199 Cb 0.09 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 3dkp h MET 199 CO -0.13 0.94 -0.10 -0.07 1.06 0.00 0.00 176.91 178.62 3dkp h LEU 200 N 0.46 0.20 -0.57 1.22 3.38 -0.94 -0.61 115.31 118.45 3dkp h LEU 200 Ca 0.02 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3dkp h LEU 200 Cb 1.03 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.73 3dkp h LEU 200 CO 0.10 0.33 0.00 1.41 0.09 0.00 0.00 178.44 180.36 3dkp n HIS 201 N -4.31 0.15 -2.00 1.13 8.25 -0.62 -4.90 115.22 112.92 3dkp n HIS 201 Ca -0.01 -0.08 -0.09 0.00 -0.26 0.00 0.00 57.72 57.29 3dkp n HIS 201 Cb 0.24 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.34 3dkp n HIS 201 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3dkp n GLY 202 N 0.88 0.20 3.67 -1.41 0.00 -0.24 -5.02 105.19 103.27 3dkp n GLY 202 Ca 0.11 -0.55 -0.35 0.00 0.00 0.00 0.00 46.02 45.23 3dkp n GLY 202 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dkp s ARG 203 N -4.13 3.62 0.63 1.61 1.81 -0.96 -5.00 118.95 116.53 3dkp s ARG 203 Ca 0.00 -0.34 -0.18 0.00 -1.72 0.00 0.00 55.73 53.49 3dkp s ARG 203 Cb 0.00 -3.07 -0.01 0.00 -0.45 0.00 0.00 34.95 31.41 3dkp s ARG 203 CO 0.00 0.46 1.20 -1.21 -0.68 0.00 0.00 175.30 175.07 3dkp s GLU 204 N -0.16 2.76 -0.06 3.54 2.02 -1.26 -4.40 118.70 121.14 3dkp s GLU 204 Ca 0.07 1.77 -0.04 0.00 0.02 0.00 0.00 54.97 56.79 3dkp s GLU 204 Cb -0.12 -1.91 0.03 0.00 0.10 0.00 0.00 34.13 32.23 3dkp s GLU 204 CO 0.01 -1.36 0.15 -1.17 0.02 0.00 0.00 175.26 172.92 3dkp s LEU 205 N -4.40 1.02 -0.24 1.80 2.96 -1.01 -1.72 118.68 117.09 3dkp s LEU 205 Ca 0.76 0.31 -0.03 0.00 -0.22 0.00 0.00 54.13 54.95 3dkp s LEU 205 Cb -0.29 0.45 0.01 0.00 0.50 0.00 0.00 46.19 46.86 3dkp s LEU 205 CO 0.37 -0.11 -0.04 -0.22 -1.32 0.00 0.00 176.35 175.03 3dkp s LEU 206 N 0.70 3.13 -0.13 -0.68 2.96 -0.16 -0.15 118.68 124.35 3dkp s LEU 206 Ca -0.05 -0.68 0.02 0.00 -0.22 0.00 0.00 54.13 53.20 3dkp s LEU 206 Cb -0.07 -1.71 0.00 0.00 0.50 0.00 0.00 46.19 44.92 3dkp s LEU 206 CO -0.03 -0.10 -0.21 0.00 -1.32 0.00 0.00 176.35 174.69 3dkp s ALA 207 N 1.40 2.29 -0.07 5.97 0.00 0.47 -0.40 121.76 131.41 3dkp s ALA 207 Ca 0.03 -1.03 0.03 0.00 0.00 0.00 0.00 51.96 50.98 3dkp s ALA 207 Cb -0.16 -0.98 0.01 0.00 0.00 0.00 0.00 23.12 21.99 3dkp s ALA 207 CO -0.04 0.10 -0.14 -1.12 0.00 0.00 0.00 175.76 174.57 3dkp s SER 208 N 0.62 1.90 -0.17 0.00 0.01 0.35 -1.19 113.70 115.22 3dkp s SER 208 Ca -0.11 -0.32 -0.28 0.00 1.31 0.00 0.00 55.95 56.55 3dkp s SER 208 Cb -0.16 -0.86 0.08 0.00 0.21 0.00 0.00 66.02 65.29 3dkp s SER 208 CO 0.03 0.05 0.75 0.00 0.41 0.00 0.00 173.24 174.48 3dkp s ALA 209 N 0.59 -1.80 0.91 1.44 0.00 -0.85 -1.57 121.76 120.46 3dkp s ALA 209 Ca -0.14 1.69 -0.12 0.00 0.00 0.00 0.00 51.96 53.39 3dkp s ALA 209 Cb -0.16 -0.68 0.08 0.00 0.00 0.00 0.00 23.12 22.37 3dkp s ALA 209 CO 0.04 -0.34 0.79 -2.30 0.00 0.00 0.00 175.76 173.95 3dkp n PRO 210 N 1.76 -0.27 -1.51 0.00 -0.02 -1.20 -4.16 135.00 129.59 3dkp n PRO 210 Ca -0.16 -0.02 -0.49 0.00 -2.02 0.00 0.00 63.50 60.82 3dkp n PRO 210 Cb 0.56 -2.13 -0.03 0.00 -0.02 0.00 0.00 33.50 31.88 3dkp n PRO 210 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 3dkp n THR 211 N -3.75 1.46 -0.39 3.45 -1.04 -1.26 -2.60 114.28 110.16 3dkp n THR 211 Ca 0.10 -0.37 0.00 0.00 -2.04 0.00 0.00 64.05 61.74 3dkp n THR 211 Cb 0.52 -0.49 0.00 0.00 -1.82 0.00 0.00 70.33 68.54 3dkp n THR 211 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3dkp n GLY 212 N 1.75 0.79 0.03 3.41 0.00 -1.26 -4.96 105.19 104.94 3dkp n GLY 212 Ca 0.15 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.29 3dkp n GLY 212 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3dkp n SER 213 N 0.00 0.59 -0.23 1.61 7.64 -1.07 -4.95 113.62 117.21 3dkp n SER 213 Ca 0.00 -0.37 0.00 0.00 1.01 0.00 0.00 58.87 59.51 3dkp n SER 213 Cb 0.00 0.29 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 3dkp n SER 213 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3dkp n GLY 214 N 1.48 0.88 0.20 0.23 0.00 -1.26 -4.62 105.19 102.11 3dkp n GLY 214 Ca 0.06 -0.59 0.06 0.00 0.00 0.00 0.00 46.02 45.55 3dkp n GLY 214 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dkp h LYS 215 N 0.00 0.00 -0.17 1.61 1.57 -1.92 -2.74 116.57 114.92 3dkp h LYS 215 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3dkp h LYS 215 Cb 0.77 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.07 3dkp h LYS 215 CO 0.00 0.32 0.11 1.15 -0.57 0.00 0.00 179.45 180.46 3dkp h THR 216 N 0.00 1.04 -0.02 -0.16 2.02 -2.01 -2.80 112.91 110.98 3dkp h THR 216 Ca -0.00 -0.08 -0.13 0.00 0.77 0.00 0.00 66.41 66.97 3dkp h THR 216 Cb 0.67 0.79 -0.02 0.00 -1.74 0.00 0.00 68.15 67.85 3dkp h THR 216 CO 0.04 0.04 -0.58 0.25 0.37 0.00 0.00 175.52 175.65 3dkp h LEU 217 N 0.23 0.08 -1.35 2.58 5.85 -1.96 -1.47 115.31 119.26 3dkp h LEU 217 Ca 0.06 -0.04 0.15 0.00 0.84 0.00 0.00 57.88 58.89 3dkp h LEU 217 Cb -0.02 -0.02 -0.07 0.00 0.37 0.00 0.00 40.66 40.92 3dkp h LEU 217 CO -0.02 0.64 0.56 0.00 -0.34 0.00 0.00 178.44 179.29 3dkp h ALA 218 N 1.36 1.91 0.00 1.25 0.00 -1.25 -2.05 119.26 120.48 3dkp h ALA 218 Ca -0.00 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 3dkp h ALA 218 Cb 1.03 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 3dkp h ALA 218 CO 0.08 -0.15 -1.71 1.97 0.00 0.00 0.00 179.25 179.44 3dkp n PHE 219 N -4.55 0.34 0.09 0.00 1.16 -1.08 -4.20 117.46 109.23 3dkp n PHE 219 Ca 0.17 0.10 -0.22 0.00 -1.87 0.00 0.00 57.45 55.63 3dkp n PHE 219 Cb 0.50 -0.70 -0.13 0.00 -1.61 0.00 0.00 39.48 37.54 3dkp n PHE 219 CO 0.00 0.00 0.00 0.77 -1.87 0.00 0.00 176.76 175.66 3dkp h SER 220 N 0.00 0.87 0.21 5.98 0.02 -0.96 -2.93 113.55 116.74 3dkp h SER 220 Ca -0.05 -0.83 -0.01 0.00 -0.84 0.00 0.00 61.79 60.06 3dkp h SER 220 Cb 1.12 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.39 3dkp h SER 220 CO 0.00 1.61 -0.10 0.40 -1.14 0.00 0.00 176.83 177.61 3dkp h ILE 221 N 0.24 0.82 -0.40 3.27 2.04 -1.64 -0.44 117.51 121.40 3dkp h ILE 221 Ca -0.19 -0.12 -0.07 0.00 1.00 0.00 0.00 64.86 65.48 3dkp h ILE 221 Cb 1.91 0.89 -0.02 0.00 -0.74 0.00 0.00 36.82 38.87 3dkp h ILE 221 CO 0.24 0.03 -0.03 1.55 0.00 0.00 0.00 178.15 179.93 3dkp h PRO 222 N -0.34 0.66 0.18 2.37 0.13 -1.79 0.93 132.00 134.14 3dkp h PRO 222 Ca -0.03 -0.17 -0.00 0.00 -0.87 0.00 0.00 66.00 64.92 3dkp h PRO 222 Cb 0.26 -0.08 -0.00 0.00 0.13 0.00 0.00 31.00 31.31 3dkp h PRO 222 CO 0.05 0.70 -0.12 0.82 -0.23 0.00 0.00 178.00 179.22 3dkp h ILE 223 N 0.62 0.74 -0.70 -3.56 2.04 -1.42 0.97 117.51 116.20 3dkp h ILE 223 Ca 0.12 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.02 3dkp h ILE 223 Cb 0.44 0.74 -0.05 0.00 -0.74 0.00 0.00 36.82 37.21 3dkp h ILE 223 CO 0.02 0.00 0.43 -0.07 0.00 0.00 0.00 178.15 178.53 3dkp h LEU 224 N -0.30 0.70 -0.46 1.44 3.38 -0.82 -1.56 115.31 117.69 3dkp h LEU 224 Ca -0.01 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3dkp h LEU 224 Cb 0.25 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 3dkp h LEU 224 CO 0.01 0.48 0.20 0.24 0.09 0.00 0.00 178.44 179.46 3dkp h MET 225 N 0.84 0.69 -0.55 1.13 2.86 -0.66 -2.51 114.93 116.72 3dkp h MET 225 Ca 0.28 -0.12 -0.03 0.00 -2.06 0.00 0.00 59.70 57.78 3dkp h MET 225 Cb 0.04 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.56 3dkp h MET 225 CO -0.12 0.61 0.23 0.37 1.06 0.00 0.00 176.91 179.06 3dkp h GLN 226 N 0.61 0.82 0.00 1.72 4.15 -0.68 -2.86 115.11 118.87 3dkp h GLN 226 Ca 0.16 -0.14 -0.03 0.00 0.77 0.00 0.00 58.65 59.41 3dkp h GLN 226 Cb 0.17 -0.14 -0.00 0.00 0.21 0.00 0.00 27.48 27.72 3dkp h GLN 226 CO -0.02 0.70 -0.12 -0.07 -1.93 0.00 0.00 178.83 177.39 3dkp h LEU 227 N 0.75 0.00 0.00 -2.39 3.38 -1.18 -3.46 115.31 112.41 3dkp h LEU 227 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3dkp h LEU 227 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3dkp h LEU 227 CO -0.02 0.12 0.00 0.29 0.09 0.00 0.00 178.44 178.92 3dkp n LYS 228 N -3.32 0.00 -3.89 1.13 5.02 -0.95 -4.73 118.16 111.42 3dkp n LYS 228 Ca -0.00 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.18 3dkp n LYS 228 Cb 0.34 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.25 3dkp n LYS 228 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 3dkp s GLN 229 N 0.00 0.48 0.55 1.97 -0.21 -1.26 -4.99 119.66 116.19 3dkp s GLN 229 Ca 0.00 -0.47 -0.20 0.00 0.02 0.00 0.00 55.36 54.70 3dkp s GLN 229 Cb 0.00 0.19 -0.07 0.00 1.00 0.00 0.00 33.01 34.14 3dkp s GLN 229 CO 0.00 -0.11 0.97 -2.30 -2.12 0.00 0.00 175.29 171.73 3dkp n PRO 230 N 1.37 1.06 -3.99 2.91 -0.01 -1.26 -5.00 135.00 130.07 3dkp n PRO 230 Ca -0.22 0.40 -0.10 0.00 -0.01 0.00 0.00 63.50 63.57 3dkp n PRO 230 Cb 0.56 -2.13 -0.06 0.00 -0.01 0.00 0.00 33.50 31.85 3dkp n PRO 230 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 3dkp s ALA 231 N -1.45 -0.05 -0.49 3.55 0.00 -1.26 -5.05 121.76 117.01 3dkp s ALA 231 Ca 0.71 -0.93 0.03 0.00 0.00 0.00 0.00 51.96 51.77 3dkp s ALA 231 Cb -0.45 1.02 0.48 0.00 0.00 0.00 0.00 23.12 24.17 3dkp s ALA 231 CO 0.50 -0.75 1.70 0.09 0.00 0.00 0.00 175.76 177.31 3dkp n ASN 232 N -0.31 5.81 -1.03 0.00 4.13 -1.26 -4.11 115.26 118.49 3dkp n ASN 232 Ca -0.04 -3.76 0.10 0.00 1.68 0.00 0.00 54.58 52.56 3dkp n ASN 232 Cb 0.63 -0.73 0.20 0.00 -1.54 0.00 0.00 39.78 38.34 3dkp n ASN 232 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 3dkp n LYS 233 N -0.91 2.39 -0.10 3.52 4.01 -1.15 -4.61 118.16 121.31 3dkp n LYS 233 Ca 0.53 -2.19 0.01 0.00 -0.51 0.00 0.00 58.31 56.15 3dkp n LYS 233 Cb 0.90 -1.45 -0.00 0.00 -0.51 0.00 0.00 35.03 33.96 3dkp n LYS 233 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3dkp n GLY 234 N 1.28 -2.21 3.71 0.72 0.00 -0.30 -4.77 105.19 103.63 3dkp n GLY 234 Ca 0.18 -1.49 -0.42 0.00 0.00 0.00 0.00 46.02 44.28 3dkp n GLY 234 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dkp s PHE 235 N -0.95 2.65 -1.74 1.61 0.08 -1.22 -4.57 117.98 113.86 3dkp s PHE 235 Ca 0.00 0.26 0.14 0.00 0.12 0.00 0.00 56.93 57.46 3dkp s PHE 235 Cb 0.00 -4.11 0.10 0.00 -0.57 0.00 0.00 43.02 38.44 3dkp s PHE 235 CO 0.00 -4.33 0.93 0.54 -0.10 0.00 0.00 175.22 172.26 3dkp n ARG 236 N 4.64 1.13 -3.64 0.44 1.74 0.15 -3.14 116.66 117.97 3dkp n ARG 236 Ca 0.16 -1.28 -0.15 0.00 -0.77 0.00 0.00 57.85 55.81 3dkp n ARG 236 Cb 0.37 -1.27 -0.07 0.00 -1.02 0.00 0.00 32.46 30.47 3dkp n ARG 236 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3dkp s ALA 237 N -1.27 -1.29 -0.06 7.54 0.00 -1.12 -0.21 121.76 125.35 3dkp s ALA 237 Ca 0.16 0.92 -0.02 0.00 0.00 0.00 0.00 51.96 53.01 3dkp s ALA 237 Cb 0.12 -0.08 0.04 0.00 0.00 0.00 0.00 23.12 23.20 3dkp s ALA 237 CO 0.20 -0.31 0.12 -1.17 0.00 0.00 0.00 175.76 174.60 3dkp s LEU 238 N -1.06 0.32 -0.13 0.00 2.96 -0.22 -1.57 118.68 118.97 3dkp s LEU 238 Ca -0.11 0.23 0.02 0.00 -0.22 0.00 0.00 54.13 54.06 3dkp s LEU 238 Cb -0.03 0.16 0.00 0.00 0.50 0.00 0.00 46.19 46.83 3dkp s LEU 238 CO 0.06 -0.21 -0.21 -0.63 -1.32 0.00 0.00 176.35 174.05 3dkp s ILE 239 N 1.82 2.23 -0.16 6.68 1.01 -0.10 -0.66 121.20 132.02 3dkp s ILE 239 Ca -0.01 -0.94 -0.04 0.00 0.00 0.00 0.00 60.65 59.66 3dkp s ILE 239 Cb -0.12 -1.89 -0.03 0.00 0.01 0.00 0.00 42.46 40.43 3dkp s ILE 239 CO -0.05 0.54 -0.03 -0.63 0.00 0.00 0.00 174.94 174.77 3dkp s ILE 240 N 0.65 3.92 0.10 2.92 1.01 0.17 -1.06 121.20 128.90 3dkp s ILE 240 Ca -0.10 -0.35 0.03 0.00 0.00 0.00 0.00 60.65 60.23 3dkp s ILE 240 Cb -0.16 -2.72 -0.04 0.00 0.01 0.00 0.00 42.46 39.55 3dkp s ILE 240 CO 0.02 0.49 -0.09 -0.55 0.00 0.00 0.00 174.94 174.81 3dkp s SER 241 N 0.39 1.30 0.30 3.58 0.15 0.19 -0.33 113.70 119.28 3dkp s SER 241 Ca -0.04 -0.87 0.01 0.00 0.70 0.00 0.00 55.95 55.75 3dkp s SER 241 Cb -0.14 0.04 0.48 0.00 -1.71 0.00 0.00 66.02 64.69 3dkp s SER 241 CO 0.03 -0.34 1.84 -0.65 1.20 0.00 0.00 173.24 175.32 3dkp h PRO 242 N 3.37 0.69 -4.58 5.44 0.11 -1.86 -3.35 132.00 131.82 3dkp h PRO 242 Ca -0.36 -0.15 -0.21 0.00 0.11 0.00 0.00 66.00 65.39 3dkp h PRO 242 Cb 1.18 -0.10 -0.15 0.00 0.11 0.00 0.00 31.00 32.04 3dkp h PRO 242 CO 0.57 0.67 -0.69 0.95 -0.21 0.00 0.00 178.00 179.28 3dkp s THR 243 N -5.08 0.61 0.24 -1.15 -4.23 -1.26 -4.80 115.64 99.97 3dkp s THR 243 Ca -0.09 -1.89 -0.06 0.00 -1.18 0.00 0.00 61.69 58.47 3dkp s THR 243 Cb 0.15 -1.62 0.25 0.00 1.34 0.00 0.00 72.50 72.62 3dkp s THR 243 CO 0.79 -0.88 1.66 -0.09 -0.54 0.00 0.00 174.62 175.56 3dkp h ARG 244 N 3.04 0.17 0.18 3.99 2.43 -1.96 0.97 114.38 123.22 3dkp h ARG 244 Ca -0.35 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 58.82 3dkp h ARG 244 Cb 1.16 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.65 3dkp h ARG 244 CO 0.64 0.12 -0.26 0.93 -1.51 0.00 0.00 179.97 179.89 3dkp h GLU 245 N 0.18 -0.48 -0.49 0.20 3.07 -1.99 0.30 114.58 115.36 3dkp h GLU 245 Ca 0.41 0.03 -0.12 0.00 -0.50 0.00 0.00 59.36 59.18 3dkp h GLU 245 Cb 0.71 0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.71 3dkp h GLU 245 CO -0.57 -0.32 -0.15 -0.07 -1.40 0.00 0.00 179.01 176.49 3dkp h LEU 246 N -0.50 0.96 -0.42 1.33 3.38 -1.92 -2.55 115.31 115.58 3dkp h LEU 246 Ca 0.01 -0.33 0.02 0.00 0.09 0.00 0.00 57.88 57.67 3dkp h LEU 246 Cb 0.50 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 3dkp h LEU 246 CO -0.10 1.10 0.25 0.00 0.09 0.00 0.00 178.44 179.77 3dkp h ALA 247 N 0.98 0.53 -0.99 1.53 0.00 -0.59 -2.40 119.26 118.32 3dkp h ALA 247 Ca 0.12 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.04 3dkp h ALA 247 Cb 0.70 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 3dkp h ALA 247 CO 0.05 -0.08 0.66 0.66 0.00 0.00 0.00 179.25 180.54 3dkp h SER 248 N 0.50 1.13 -0.63 0.00 4.64 -0.14 -0.03 113.55 119.00 3dkp h SER 248 Ca 0.17 -0.03 -0.05 0.00 -0.47 0.00 0.00 61.79 61.42 3dkp h SER 248 Cb 0.01 -0.28 -0.03 0.00 -0.31 0.00 0.00 62.40 61.80 3dkp h SER 248 CO -0.08 0.81 0.21 1.56 -0.87 0.00 0.00 176.83 178.46 3dkp h GLN 249 N 1.32 0.97 -0.69 4.77 4.20 -1.27 -1.09 115.11 123.31 3dkp h GLN 249 Ca 0.37 -0.20 0.00 0.00 0.06 0.00 0.00 58.65 58.88 3dkp h GLN 249 Cb -0.12 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 27.48 3dkp h GLN 249 CO -0.09 0.84 0.43 0.82 -0.67 0.00 0.00 178.83 180.17 3dkp h ILE 250 N 0.90 1.19 -0.46 2.54 2.04 -0.91 -2.13 117.51 120.67 3dkp h ILE 250 Ca 0.20 -0.40 0.02 0.00 1.00 0.00 0.00 64.86 65.69 3dkp h ILE 250 Cb 0.27 0.21 -0.03 0.00 -0.74 0.00 0.00 36.82 36.53 3dkp h ILE 250 CO -0.01 0.19 0.28 -0.74 0.00 0.00 0.00 178.15 177.87 3dkp h HIS 251 N 0.94 0.53 -0.68 1.37 2.76 -0.56 -1.45 115.15 118.05 3dkp h HIS 251 Ca 0.25 0.02 -0.06 0.00 -2.20 0.00 0.00 60.37 58.37 3dkp h HIS 251 Cb -0.06 -0.17 -0.03 0.00 1.55 0.00 0.00 27.41 28.70 3dkp h HIS 251 CO -0.02 0.31 0.18 0.00 -1.30 0.00 0.00 177.93 177.10 3dkp h ARG 252 N 0.57 1.08 -0.60 5.26 3.08 -1.07 -0.82 114.38 121.89 3dkp h ARG 252 Ca 0.18 -0.25 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 3dkp h ARG 252 Cb -0.01 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 29.87 3dkp h ARG 252 CO -0.07 0.96 0.35 1.49 -1.07 0.00 0.00 179.97 181.62 3dkp h GLU 253 N 1.02 0.82 -0.48 0.04 4.57 -1.11 -0.40 114.58 119.03 3dkp h GLU 253 Ca 0.22 -0.08 -0.02 0.00 -1.18 0.00 0.00 59.36 58.30 3dkp h GLU 253 Cb 0.35 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 28.75 3dkp h GLU 253 CO -0.00 0.60 0.24 -0.07 -1.18 0.00 0.00 179.01 178.60 3dkp h LEU 254 N 0.81 0.63 -0.35 1.64 3.38 -1.02 -0.74 115.31 119.65 3dkp h LEU 254 Ca 0.21 -0.12 0.02 0.00 0.09 0.00 0.00 57.88 58.08 3dkp h LEU 254 Cb 0.01 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 3dkp h LEU 254 CO -0.04 0.57 0.19 0.40 0.09 0.00 0.00 178.44 179.65 3dkp h ILE 255 N 0.64 1.01 -0.11 1.22 1.08 -0.85 -1.67 117.51 118.83 3dkp h ILE 255 Ca 0.17 -0.13 -0.03 0.00 -0.39 0.00 0.00 64.86 64.47 3dkp h ILE 255 Cb 0.10 0.59 -0.00 0.00 -3.07 0.00 0.00 36.82 34.44 3dkp h ILE 255 CO -0.02 0.07 -0.05 0.50 -0.69 0.00 0.00 178.15 177.96 3dkp h LYS 256 N 0.39 0.23 0.00 2.37 3.64 -0.76 -2.40 116.57 120.04 3dkp h LYS 256 Ca 0.14 -0.10 -0.02 0.00 -1.27 0.00 0.00 60.65 59.41 3dkp h LYS 256 Cb 0.03 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.84 3dkp h LYS 256 CO -0.08 0.56 -0.08 0.97 -2.27 0.00 0.00 179.45 178.55 3dkp h ILE 257 N -0.11 0.24 -0.42 2.00 6.09 -1.10 -2.84 117.51 121.37 3dkp h ILE 257 Ca 0.03 -0.60 0.00 0.00 -1.37 0.00 0.00 64.86 62.92 3dkp h ILE 257 Cb 0.49 1.48 0.00 0.00 0.47 0.00 0.00 36.82 39.26 3dkp h ILE 257 CO 0.01 0.08 0.00 -1.54 -3.07 0.00 0.00 178.15 173.63 3dkp n SER 258 N -3.27 3.25 -4.59 2.19 3.41 -0.63 -4.71 113.62 109.27 3dkp n SER 258 Ca -0.00 -1.94 -0.49 0.00 -0.26 0.00 0.00 58.87 56.18 3dkp n SER 258 Cb 0.29 -0.28 -0.04 0.00 -0.26 0.00 0.00 64.21 63.92 3dkp n SER 258 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3dkp n GLU 259 N 1.13 1.23 -0.99 4.33 1.02 -0.92 -1.33 120.64 125.12 3dkp n GLU 259 Ca 0.17 0.44 0.00 0.00 -0.02 0.00 0.00 57.16 57.75 3dkp n GLU 259 Cb 0.52 -1.96 0.00 0.00 -0.02 0.00 0.00 31.44 29.97 3dkp n GLU 259 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dkp n GLY 260 N 2.08 0.98 0.03 0.62 0.00 -1.26 -4.85 105.19 102.79 3dkp n GLY 260 Ca 0.15 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.28 3dkp n GLY 260 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3dkp n THR 261 N -2.00 0.16 -0.95 2.61 -2.24 -0.44 -4.99 114.28 106.42 3dkp n THR 261 Ca 0.00 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 3dkp n THR 261 Cb 0.00 0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.47 3dkp n THR 261 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dkp n GLY 262 N 1.37 0.94 3.76 3.38 0.00 -1.26 -4.59 105.19 108.80 3dkp n GLY 262 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 3dkp n GLY 262 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dkp s PHE 263 N -3.77 3.05 -0.29 1.61 0.08 -1.26 -4.69 117.98 112.71 3dkp s PHE 263 Ca 0.00 1.30 -0.08 0.00 0.12 0.00 0.00 56.93 58.27 3dkp s PHE 263 Cb 0.00 -3.71 -0.01 0.00 -0.57 0.00 0.00 43.02 38.73 3dkp s PHE 263 CO 0.00 -2.06 0.12 1.03 -0.10 0.00 0.00 175.22 174.20 3dkp s ARG 264 N -1.31 3.35 -0.08 0.44 0.52 -1.26 -5.03 118.95 115.59 3dkp s ARG 264 Ca 0.52 -0.70 0.05 0.00 -0.52 0.00 0.00 55.73 55.08 3dkp s ARG 264 Cb -0.40 -3.47 -0.00 0.00 0.52 0.00 0.00 34.95 31.60 3dkp s ARG 264 CO 0.49 -0.37 -0.24 0.42 0.02 0.00 0.00 175.30 175.63 3dkp s ILE 265 N 1.59 1.98 0.07 1.52 1.01 -1.26 -1.66 121.20 124.45 3dkp s ILE 265 Ca 0.05 -1.00 0.03 0.00 0.00 0.00 0.00 60.65 59.72 3dkp s ILE 265 Cb -0.17 -1.69 -0.03 0.00 0.01 0.00 0.00 42.46 40.58 3dkp s ILE 265 CO 0.05 0.55 -0.09 -1.00 0.00 0.00 0.00 174.94 174.45 3dkp s HIS 266 N 0.11 0.86 0.10 3.97 3.76 -0.38 -5.00 115.29 118.71 3dkp s HIS 266 Ca -0.11 -0.64 0.06 0.00 -0.15 0.00 0.00 55.06 54.23 3dkp s HIS 266 Cb -0.16 -0.50 -0.04 0.00 1.11 0.00 0.00 32.58 33.00 3dkp s HIS 266 CO 0.06 -0.07 -0.07 -1.64 -0.85 0.00 0.00 174.74 172.17 3dkp s MET 267 N -2.44 2.27 -0.44 1.40 -1.94 -1.26 -0.96 119.30 115.93 3dkp s MET 267 Ca -0.00 -0.96 -0.11 0.00 -1.71 0.00 0.00 55.69 52.91 3dkp s MET 267 Cb -0.05 -2.38 0.08 0.00 2.01 0.00 0.00 34.83 34.49 3dkp s MET 267 CO -0.01 0.52 0.30 0.42 -0.01 0.00 0.00 175.02 176.25 3dkp s ILE 268 N -1.24 4.50 0.66 2.53 1.01 -1.26 -5.01 121.20 122.38 3dkp s ILE 268 Ca 0.23 -1.34 -0.04 0.00 0.00 0.00 0.00 60.65 59.49 3dkp s ILE 268 Cb -0.11 -3.75 0.05 0.00 0.01 0.00 0.00 42.46 38.66 3dkp s ILE 268 CO 0.15 -0.55 0.95 -1.00 0.00 0.00 0.00 174.94 174.49 3dkp s HIS 269 N 1.48 2.88 0.18 3.97 3.76 -1.26 -4.82 115.29 121.47 3dkp s HIS 269 Ca 0.03 0.30 -0.19 0.00 -0.15 0.00 0.00 55.06 55.06 3dkp s HIS 269 Cb -0.24 -3.07 0.12 0.00 1.11 0.00 0.00 32.58 30.50 3dkp s HIS 269 CO 0.03 -1.27 1.62 0.87 -0.85 0.00 0.00 174.74 175.14 3dkp h LYS 270 N -0.41 -0.13 -0.55 1.40 1.57 -1.99 0.06 116.57 116.51 3dkp h LYS 270 Ca -0.44 0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.30 3dkp h LYS 270 Cb 1.31 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 33.62 3dkp h LYS 270 CO 0.58 -0.09 0.15 0.00 -0.57 0.00 0.00 179.45 179.52 3dkp h ALA 271 N 1.13 1.22 -0.51 3.86 0.00 -1.98 0.78 119.26 123.76 3dkp h ALA 271 Ca 0.22 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 3dkp h ALA 271 Cb 0.48 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 3dkp h ALA 271 CO -0.55 0.54 0.09 0.00 0.00 0.00 0.00 179.25 179.33 3dkp h ALA 272 N 1.35 1.20 0.12 0.00 0.00 -1.65 0.30 119.26 120.57 3dkp h ALA 272 Ca 0.18 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3dkp h ALA 272 Cb 0.27 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3dkp h ALA 272 CO -0.00 0.54 -0.06 0.28 0.00 0.00 0.00 179.25 180.01 3dkp h VAL 273 N 0.77 0.98 -0.67 0.00 2.07 -0.40 0.28 116.25 119.27 3dkp h VAL 273 Ca 0.16 -0.40 0.11 0.00 0.82 0.00 0.00 66.70 67.39 3dkp h VAL 273 Cb 0.33 1.24 -0.08 0.00 -1.52 0.00 0.00 31.29 31.26 3dkp h VAL 273 CO 0.00 0.10 0.26 0.00 0.02 0.00 0.00 177.57 177.95 3dkp h ALA 274 N 0.51 0.90 0.00 1.67 0.00 -0.61 -2.37 119.26 119.36 3dkp h ALA 274 Ca -0.02 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3dkp h ALA 274 Cb 0.28 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3dkp h ALA 274 CO 0.03 -0.20 0.00 0.00 0.00 0.00 0.00 179.25 179.08 3dkp n ALA 275 N -2.50 2.16 -2.53 0.00 0.00 0.10 -4.90 120.51 112.85 3dkp n ALA 275 Ca 0.11 -0.07 -0.19 0.00 0.00 0.00 0.00 53.44 53.29 3dkp n ALA 275 Cb 0.33 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.36 3dkp n ALA 275 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3dkp n LYS 276 N -1.66 -2.38 0.28 0.00 4.76 0.04 -4.86 118.16 114.34 3dkp n LYS 276 Ca 0.06 0.87 0.13 0.00 -2.87 0.00 0.00 58.31 56.50 3dkp n LYS 276 Cb 0.32 -5.43 0.80 0.00 -1.84 0.00 0.00 35.03 28.87 3dkp n LYS 276 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 3dkp h LYS 277 N -0.39 0.00 -0.19 1.97 3.64 -1.73 -1.87 116.57 118.00 3dkp h LYS 277 Ca -0.45 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 3dkp h LYS 277 Cb 1.33 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.15 3dkp h LYS 277 CO 0.51 0.06 0.00 1.19 -2.27 0.00 0.00 179.45 178.94 3dkp n PHE 278 N -3.87 0.62 -0.73 1.91 3.01 -1.26 -4.75 117.46 112.39 3dkp n PHE 278 Ca -0.03 -0.86 -0.32 0.00 1.01 0.00 0.00 57.45 57.26 3dkp n PHE 278 Cb 0.15 -0.24 0.16 0.00 -0.01 0.00 0.00 39.48 39.54 3dkp n PHE 278 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3dkp n GLY 279 N -0.65 -0.75 0.45 1.37 0.00 -0.70 -4.56 105.19 100.34 3dkp n GLY 279 Ca 0.18 -0.71 0.27 0.00 0.00 0.00 0.00 46.02 45.76 3dkp n GLY 279 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3dkp h PRO 280 N -1.76 0.02 -0.83 1.61 0.11 -1.83 -1.36 132.00 127.96 3dkp h PRO 280 Ca -0.43 -0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.55 3dkp h PRO 280 Cb 1.27 -0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.31 3dkp h PRO 280 CO 0.40 0.01 0.16 1.63 -0.21 0.00 0.00 178.00 179.99 3dkp n LYS 281 N -4.30 2.94 -1.41 1.05 4.01 -1.26 -4.93 118.16 114.26 3dkp n LYS 281 Ca 0.17 -2.05 -0.07 0.00 -0.51 0.00 0.00 58.31 55.85 3dkp n LYS 281 Cb 0.88 -1.93 0.03 0.00 -0.51 0.00 0.00 35.03 33.51 3dkp n LYS 281 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 3dkp n SER 282 N 0.05 0.54 0.03 4.39 3.41 -0.51 -5.01 113.62 116.52 3dkp n SER 282 Ca 0.26 -1.43 0.04 0.00 -0.26 0.00 0.00 58.87 57.48 3dkp n SER 282 Cb 1.03 -0.19 0.42 0.00 -0.26 0.00 0.00 64.21 65.21 3dkp n SER 282 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3dkp h SER 283 N -0.11 0.42 -0.16 4.04 4.64 -1.85 -3.47 113.55 117.06 3dkp h SER 283 Ca -0.10 -0.02 -0.07 0.00 -0.47 0.00 0.00 61.79 61.13 3dkp h SER 283 Cb 0.41 -0.11 -0.03 0.00 -0.31 0.00 0.00 62.40 62.37 3dkp h SER 283 CO 0.12 0.34 -0.06 0.29 -0.87 0.00 0.00 176.83 176.65 3dkp n LYS 284 N -4.45 -0.85 -2.18 4.77 5.02 -1.26 -4.90 118.16 114.31 3dkp n LYS 284 Ca 0.02 0.44 -0.42 0.00 -2.02 0.00 0.00 58.31 56.33 3dkp n LYS 284 Cb 0.09 -4.21 0.00 0.00 -0.02 0.00 0.00 35.03 30.89 3dkp n LYS 284 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3dkp n LYS 285 N -1.66 3.39 -3.65 1.97 5.02 -1.26 -1.15 118.16 120.81 3dkp n LYS 285 Ca -0.03 -3.27 -0.15 0.00 -2.02 0.00 0.00 58.31 52.84 3dkp n LYS 285 Cb 0.26 -3.04 -0.08 0.00 -0.02 0.00 0.00 35.03 32.16 3dkp n LYS 285 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 3dkp s PHE 286 N 1.29 -0.42 -0.06 2.13 -0.12 -1.26 -4.95 117.98 114.59 3dkp s PHE 286 Ca 0.42 0.73 -0.02 0.00 -0.05 0.00 0.00 56.93 58.01 3dkp s PHE 286 Cb 0.10 0.24 -0.03 0.00 -0.63 0.00 0.00 43.02 42.71 3dkp s PHE 286 CO -0.02 -0.48 -0.07 -0.25 -0.05 0.00 0.00 175.22 174.36 3dkp n ASP 287 N 1.24 1.31 -3.92 1.98 8.00 -0.66 -3.37 116.55 121.14 3dkp n ASP 287 Ca -0.20 0.04 -0.20 0.00 0.71 0.00 0.00 54.79 55.14 3dkp n ASP 287 Cb 0.56 -0.15 -0.16 0.00 -0.02 0.00 0.00 41.12 41.36 3dkp n ASP 287 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3dkp s ILE 288 N -2.11 0.60 -0.16 0.53 1.01 -0.91 0.34 121.20 120.50 3dkp s ILE 288 Ca -0.08 -0.18 -0.02 0.00 0.00 0.00 0.00 60.65 60.37 3dkp s ILE 288 Cb 0.03 -0.60 -0.02 0.00 0.01 0.00 0.00 42.46 41.87 3dkp s ILE 288 CO 0.11 0.23 -0.07 -0.22 0.00 0.00 0.00 174.94 174.99 3dkp s LEU 289 N 0.79 3.00 -0.16 2.97 2.96 -0.61 -1.25 118.68 126.37 3dkp s LEU 289 Ca -0.11 -0.25 -0.05 0.00 -0.22 0.00 0.00 54.13 53.50 3dkp s LEU 289 Cb -0.14 -1.72 -0.03 0.00 0.50 0.00 0.00 46.19 44.80 3dkp s LEU 289 CO 0.01 0.13 0.01 -0.69 -1.32 0.00 0.00 176.35 174.49 3dkp s VAL 290 N 0.58 4.35 0.37 1.68 1.01 -0.14 -0.92 120.40 127.33 3dkp s VAL 290 Ca -0.05 -0.20 -0.15 0.00 0.00 0.00 0.00 61.98 61.59 3dkp s VAL 290 Cb -0.15 -2.92 0.05 0.00 0.00 0.00 0.00 36.38 33.36 3dkp s VAL 290 CO 0.03 0.50 0.75 0.28 0.00 0.00 0.00 175.10 176.65 3dkp s THR 291 N 0.19 0.00 0.29 3.92 -1.32 -0.23 -4.35 115.64 114.14 3dkp s THR 291 Ca 0.01 -1.06 0.07 0.00 -1.21 0.00 0.00 61.69 59.50 3dkp s THR 291 Cb -0.13 -2.78 -0.03 0.00 -1.51 0.00 0.00 72.50 68.05 3dkp s THR 291 CO 0.02 0.00 0.28 0.42 -2.21 0.00 0.00 174.62 173.12 3dkp s THR 292 N -2.53 4.17 0.15 5.08 -4.23 -1.26 -0.64 115.64 116.39 3dkp s THR 292 Ca 0.17 -1.31 -0.17 0.00 -1.18 0.00 0.00 61.69 59.20 3dkp s THR 292 Cb -0.05 -3.37 0.00 0.00 1.34 0.00 0.00 72.50 70.42 3dkp s THR 292 CO 0.12 -0.27 1.80 -0.65 -0.54 0.00 0.00 174.62 175.08 3dkp h PRO 293 N 1.31 0.43 -0.40 3.99 0.11 -1.87 -2.46 132.00 133.11 3dkp h PRO 293 Ca -0.47 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 65.50 3dkp h PRO 293 Cb 1.24 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 3dkp h PRO 293 CO 0.59 0.29 -0.22 -0.91 -0.21 0.00 0.00 178.00 177.54 3dkp h ASN 294 N 0.44 0.82 -0.47 -2.05 2.35 -1.94 -1.16 115.58 113.57 3dkp h ASN 294 Ca 0.14 -0.30 -0.08 0.00 -0.55 0.00 0.00 56.30 55.52 3dkp h ASN 294 Cb -0.01 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.12 3dkp h ASN 294 CO -0.06 1.01 -0.00 -0.09 -1.65 0.00 0.00 177.43 176.64 3dkp h ARG 295 N 0.70 0.83 -0.44 0.81 9.65 -1.97 -0.10 114.38 123.86 3dkp h ARG 295 Ca 0.10 -0.27 -0.12 0.00 -1.10 0.00 0.00 59.98 58.59 3dkp h ARG 295 Cb 0.74 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 29.23 3dkp h ARG 295 CO 0.06 0.88 -0.19 1.25 2.80 0.00 0.00 179.97 184.77 3dkp h LEU 296 N 0.68 0.88 -0.35 3.80 5.85 -1.29 -2.19 115.31 122.69 3dkp h LEU 296 Ca 0.13 -0.31 -0.18 0.00 0.84 0.00 0.00 57.88 58.36 3dkp h LEU 296 Cb 0.51 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.30 3dkp h LEU 296 CO 0.02 1.05 -0.54 0.40 -0.34 0.00 0.00 178.44 179.03 3dkp h ILE 297 N 0.76 1.28 -0.49 4.05 1.08 -1.08 -1.71 117.51 121.41 3dkp h ILE 297 Ca 0.11 -1.74 0.07 0.00 -0.39 0.00 0.00 64.86 62.91 3dkp h ILE 297 Cb 0.72 1.65 -0.06 0.00 -3.07 0.00 0.00 36.82 36.06 3dkp h ILE 297 CO 0.06 0.56 0.14 0.22 -0.69 0.00 0.00 178.15 178.44 3dkp h TYR 298 N 0.63 0.24 -0.36 1.37 3.20 -0.85 -1.35 116.97 119.85 3dkp h TYR 298 Ca 0.01 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.91 3dkp h TYR 298 Cb 1.14 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 39.36 3dkp h TYR 298 CO 0.07 0.05 0.21 -0.07 -1.64 0.00 0.00 178.16 176.78 3dkp h LEU 299 N 0.30 0.44 -1.84 2.82 3.38 -1.07 -2.36 115.31 116.98 3dkp h LEU 299 Ca 0.24 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 3dkp h LEU 299 Cb 0.28 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 3dkp h LEU 299 CO -0.27 0.37 0.04 -0.07 0.09 0.00 0.00 178.44 178.60 3dkp h LEU 300 N 0.47 0.13 -0.09 1.67 3.38 -1.03 0.18 115.31 120.02 3dkp h LEU 300 Ca 0.13 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3dkp h LEU 300 Cb 0.02 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.74 3dkp h LEU 300 CO -0.02 0.12 -0.72 0.29 0.09 0.00 0.00 178.44 178.19 3dkp n LYS 301 N -4.49 0.12 -1.14 1.13 4.76 -0.53 -4.63 118.16 113.38 3dkp n LYS 301 Ca -0.01 -0.09 -0.34 0.00 -2.87 0.00 0.00 58.31 54.99 3dkp n LYS 301 Cb 0.11 -1.50 0.12 0.00 -1.84 0.00 0.00 35.03 31.91 3dkp n LYS 301 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 3dkp n GLN 302 N -1.36 0.22 -4.02 1.97 6.02 -0.92 -4.91 117.38 114.37 3dkp n GLN 302 Ca 0.05 0.14 -0.31 0.00 -0.01 0.00 0.00 57.00 56.87 3dkp n GLN 302 Cb 0.34 -2.31 -0.15 0.00 1.02 0.00 0.00 30.24 29.14 3dkp n GLN 302 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3dkp s ASP 303 N -1.97 4.70 0.75 1.08 2.15 -1.26 -1.78 116.67 120.34 3dkp s ASP 303 Ca 0.72 -1.95 -0.06 0.00 0.43 0.00 0.00 52.55 51.69 3dkp s ASP 303 Cb -0.30 -1.62 0.11 0.00 -0.30 0.00 0.00 42.92 40.81 3dkp s ASP 303 CO 0.52 -0.33 1.05 -2.16 -0.17 0.00 0.00 175.17 174.08 3dkp s PRO 304 N 0.96 1.75 0.21 4.34 0.04 -1.26 -5.08 135.00 135.95 3dkp s PRO 304 Ca 0.06 -0.60 -0.32 0.00 0.04 0.00 0.00 61.00 60.18 3dkp s PRO 304 Cb -0.19 -2.18 -0.13 0.00 0.04 0.00 0.00 34.50 32.03 3dkp s PRO 304 CO -0.07 -1.50 1.50 -2.30 0.04 0.00 0.00 177.00 174.67 3dkp n PRO 305 N -3.02 2.14 -0.01 0.56 -0.02 -0.73 -4.89 135.00 129.04 3dkp n PRO 305 Ca 0.12 0.77 0.11 0.00 -2.02 0.00 0.00 63.50 62.47 3dkp n PRO 305 Cb 0.60 -2.49 0.62 0.00 -0.02 0.00 0.00 33.50 32.22 3dkp n PRO 305 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dkp n GLY 306 N 2.74 -0.88 3.41 -1.23 0.00 0.63 -4.51 105.19 105.35 3dkp n GLY 306 Ca 0.14 -0.17 -0.15 0.00 0.00 0.00 0.00 46.02 45.85 3dkp n GLY 306 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3dkp s ILE 307 N -1.98 0.02 -0.12 -0.61 2.07 -1.26 -3.77 121.20 115.56 3dkp s ILE 307 Ca 0.33 -0.20 0.02 0.00 -1.41 0.00 0.00 60.65 59.38 3dkp s ILE 307 Cb 0.15 -0.95 0.01 0.00 0.13 0.00 0.00 42.46 41.81 3dkp s ILE 307 CO 0.25 -0.11 -0.17 -0.62 -1.91 0.00 0.00 174.94 172.38 3dkp s ASP 308 N -1.77 2.61 -0.07 4.50 2.15 -1.26 -4.81 116.67 118.02 3dkp s ASP 308 Ca -0.07 -0.47 0.16 0.00 0.43 0.00 0.00 52.55 52.59 3dkp s ASP 308 Cb -0.01 -1.18 0.52 0.00 -0.30 0.00 0.00 42.92 41.95 3dkp s ASP 308 CO 0.01 0.03 1.44 0.18 -0.17 0.00 0.00 175.17 176.66 3dkp n LEU 309 N 4.18 3.79 0.29 -1.34 4.77 -1.26 -4.65 117.00 122.79 3dkp n LEU 309 Ca -0.19 -2.32 0.15 0.00 -0.03 0.00 0.00 56.01 53.62 3dkp n LEU 309 Cb 0.51 -0.43 0.87 0.00 -2.33 0.00 0.00 43.42 42.04 3dkp n LEU 309 CO 0.25 0.78 1.08 0.00 -1.33 0.00 0.00 177.39 178.17 3dkp h ALA 310 N 2.91 1.44 -0.30 -1.18 0.00 -1.90 -2.27 119.26 117.95 3dkp h ALA 310 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3dkp h ALA 310 Cb 1.11 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3dkp h ALA 310 CO 0.11 0.05 0.00 0.43 0.00 0.00 0.00 179.25 179.84 3dkp n SER 311 N -3.77 3.19 -4.68 0.00 7.64 -1.26 -3.17 113.62 111.56 3dkp n SER 311 Ca -0.03 -1.93 -0.42 0.00 1.01 0.00 0.00 58.87 57.50 3dkp n SER 311 Cb 0.13 -0.19 -0.03 0.00 -1.01 0.00 0.00 64.21 63.11 3dkp n SER 311 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3dkp s VAL 312 N -1.42 3.11 -0.12 0.44 1.01 -0.85 -4.37 120.40 118.20 3dkp s VAL 312 Ca 0.33 0.43 0.17 0.00 0.00 0.00 0.00 61.98 62.91 3dkp s VAL 312 Cb 0.20 -3.28 -0.25 0.00 0.00 0.00 0.00 36.38 33.05 3dkp s VAL 312 CO 0.28 -0.01 0.19 -0.62 0.00 0.00 0.00 175.10 174.94 3dkp n GLU 313 N 6.19 0.91 -4.31 2.72 1.02 0.71 -4.24 120.64 123.63 3dkp n GLU 313 Ca 0.17 -0.07 -0.26 0.00 -0.02 0.00 0.00 57.16 56.98 3dkp n GLU 313 Cb 0.41 -1.46 -0.17 0.00 -0.02 0.00 0.00 31.44 30.20 3dkp n GLU 313 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 3dkp s TRP 314 N -2.76 1.56 -0.26 -0.32 0.52 -1.16 -0.30 118.94 116.23 3dkp s TRP 314 Ca -0.08 -0.69 -0.02 0.00 0.02 0.00 0.00 56.10 55.34 3dkp s TRP 314 Cb 0.08 -1.19 0.03 0.00 -1.15 0.00 0.00 33.47 31.24 3dkp s TRP 314 CO 0.75 -0.40 -0.05 -1.17 0.02 0.00 0.00 176.95 176.11 3dkp s LEU 315 N 1.09 3.38 -0.14 2.99 2.96 -0.34 -1.06 118.68 127.56 3dkp s LEU 315 Ca -0.06 -0.98 -0.01 0.00 -0.22 0.00 0.00 54.13 52.86 3dkp s LEU 315 Cb -0.14 -1.68 -0.01 0.00 0.50 0.00 0.00 46.19 44.86 3dkp s LEU 315 CO -0.02 -0.16 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.04 3dkp s VAL 316 N 1.30 3.11 -0.27 1.68 1.01 0.17 -1.42 120.40 125.98 3dkp s VAL 316 Ca -0.01 -0.63 -0.07 0.00 0.00 0.00 0.00 61.98 61.26 3dkp s VAL 316 Cb -0.17 -2.32 -0.01 0.00 0.00 0.00 0.00 36.38 33.87 3dkp s VAL 316 CO -0.04 0.51 0.07 -0.69 0.00 0.00 0.00 175.10 174.96 3dkp s VAL 317 N 0.51 4.13 -0.06 2.92 1.01 -0.43 0.41 120.40 128.89 3dkp s VAL 317 Ca -0.08 -0.44 -0.05 0.00 0.00 0.00 0.00 61.98 61.41 3dkp s VAL 317 Cb -0.16 -3.03 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 3dkp s VAL 317 CO 0.04 0.21 0.17 -0.62 0.00 0.00 0.00 175.10 174.89 3dkp s ASP 318 N 1.56 6.39 -1.31 3.32 2.15 0.55 0.21 116.67 129.54 3dkp s ASP 318 Ca 0.05 0.42 -0.00 0.00 0.43 0.00 0.00 52.55 53.44 3dkp s ASP 318 Cb -0.16 -2.04 -0.00 0.00 -0.30 0.00 0.00 42.92 40.42 3dkp s ASP 318 CO 0.03 0.34 0.69 -0.62 -0.17 0.00 0.00 175.17 175.43 3dkp n GLU 319 N 1.47 -4.82 -0.34 4.34 -0.58 -0.76 -4.34 120.64 115.62 3dkp n GLU 319 Ca -0.15 0.61 0.07 0.00 -0.42 0.00 0.00 57.16 57.27 3dkp n GLU 319 Cb 0.54 -5.15 0.26 0.00 -0.57 0.00 0.00 31.44 26.52 3dkp n GLU 319 CO 0.00 0.00 0.00 0.77 -0.48 0.00 0.00 177.13 177.42 3dkp h SER 320 N -1.86 0.89 -0.59 1.62 0.02 -0.67 -2.21 113.55 110.75 3dkp h SER 320 Ca -0.61 0.04 0.03 0.00 -0.84 0.00 0.00 61.79 60.40 3dkp h SER 320 Cb 1.36 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 63.71 3dkp h SER 320 CO 0.56 0.50 0.36 -2.24 -1.14 0.00 0.00 176.83 174.87 3dkp h ASP 321 N 0.97 0.59 0.16 3.07 -0.00 -1.89 -0.40 116.42 118.91 3dkp h ASP 321 Ca 0.46 0.00 -0.01 0.00 -0.00 0.00 0.00 57.03 57.49 3dkp h ASP 321 Cb 0.44 -0.12 0.00 0.00 -0.00 0.00 0.00 39.33 39.65 3dkp h ASP 321 CO -0.22 0.41 -0.08 0.11 -0.00 0.00 0.00 179.24 179.46 3dkp h LYS 322 N 0.71 -0.20 -0.82 4.15 1.79 -1.80 -2.89 116.57 117.51 3dkp h LYS 322 Ca 0.24 0.01 0.12 0.00 -2.18 0.00 0.00 60.65 58.84 3dkp h LYS 322 Cb 0.03 0.05 -0.08 0.00 -1.58 0.00 0.00 32.23 30.64 3dkp h LYS 322 CO -0.10 0.06 0.44 -0.07 -1.08 0.00 0.00 179.45 178.69 3dkp h LEU 323 N -0.46 0.57 0.00 2.94 3.38 -1.24 0.17 115.31 120.67 3dkp h LEU 323 Ca -0.02 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3dkp h LEU 323 Cb 0.36 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3dkp h LEU 323 CO 0.04 0.29 0.00 0.49 0.09 0.00 0.00 178.44 179.35 3dkp n PHE 324 N -4.82 0.00 -0.02 1.13 3.72 -0.18 -3.15 117.46 114.15 3dkp n PHE 324 Ca 0.15 0.00 0.02 0.00 -0.05 0.00 0.00 57.45 57.56 3dkp n PHE 324 Cb 0.35 -0.16 -0.08 0.00 -0.94 0.00 0.00 39.48 38.65 3dkp n PHE 324 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 3dkp n GLU 325 N -1.16 1.08 -0.01 -1.08 2.13 0.44 -4.69 120.64 117.35 3dkp n GLU 325 Ca 0.14 -0.06 -0.06 0.00 0.66 0.00 0.00 57.16 57.83 3dkp n GLU 325 Cb 0.13 -1.26 -0.05 0.00 0.27 0.00 0.00 31.44 30.53 3dkp n GLU 325 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 3dkp h ASP 326 N 0.00 -0.08 -0.78 4.31 3.45 -1.08 -3.51 116.42 118.73 3dkp h ASP 326 Ca -0.10 -0.32 0.00 0.00 0.43 0.00 0.00 57.03 57.04 3dkp h ASP 326 Cb 0.92 0.02 0.00 0.00 -0.56 0.00 0.00 39.33 39.71 3dkp h ASP 326 CO 0.01 0.56 0.00 0.61 -1.57 0.00 0.00 179.24 178.84 3dkp n GLY 327 N 1.40 1.97 2.14 2.75 0.00 -1.19 -5.04 105.19 107.21 3dkp n GLY 327 Ca -0.05 -1.95 0.00 0.00 0.00 0.00 0.00 46.02 44.02 3dkp n GLY 327 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dkp n GLY 330 N 5.00 2.14 0.32 -0.02 0.00 -1.26 -4.62 105.19 106.76 3dkp n GLY 330 Ca 0.00 -0.39 -0.03 0.00 0.00 0.00 0.00 46.02 45.60 3dkp n GLY 330 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3dkp h PHE 331 N 0.00 0.96 -0.93 1.61 3.57 -1.96 -2.71 116.94 117.48 3dkp h PHE 331 Ca 0.00 -0.06 0.11 0.00 3.53 0.00 0.00 57.97 61.55 3dkp h PHE 331 Cb 0.00 -0.29 -0.08 0.00 2.79 0.00 0.00 35.95 38.37 3dkp h PHE 331 CO 0.00 0.73 0.57 0.00 -2.23 0.00 0.00 178.31 177.38 3dkp h ARG 332 N 0.94 0.89 -0.07 1.11 3.08 -1.91 -0.06 114.38 118.35 3dkp h ARG 332 Ca 0.22 -0.05 -0.22 0.00 0.07 0.00 0.00 59.98 59.99 3dkp h ARG 332 Cb 0.18 -0.20 0.01 0.00 0.08 0.00 0.00 29.97 30.03 3dkp h ARG 332 CO -0.02 0.59 -0.86 -0.44 -1.07 0.00 0.00 179.97 178.17 3dkp h ASP 333 N 0.92 0.74 -0.06 7.04 3.32 -1.96 -2.16 116.42 124.26 3dkp h ASP 333 Ca 0.46 -0.53 0.03 0.00 0.02 0.00 0.00 57.03 57.01 3dkp h ASP 333 Cb 0.43 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.73 3dkp h ASP 333 CO -0.26 1.31 -0.12 1.56 -1.72 0.00 0.00 179.24 180.02 3dkp h GLN 334 N 0.38 -0.17 -0.24 3.56 4.20 -1.05 -1.71 115.11 120.09 3dkp h GLN 334 Ca -0.07 0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 3dkp h GLN 334 Cb 1.48 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 29.28 3dkp h GLN 334 CO 0.16 -0.11 0.08 1.25 -0.67 0.00 0.00 178.83 179.54 3dkp h LEU 335 N -0.18 0.29 -0.34 1.46 5.85 -1.02 0.19 115.31 121.57 3dkp h LEU 335 Ca 0.06 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 3dkp h LEU 335 Cb 0.26 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 3dkp h LEU 335 CO -0.16 0.28 0.14 0.00 -0.34 0.00 0.00 178.44 178.36 3dkp h ALA 336 N 1.77 0.45 -0.25 1.25 0.00 -0.91 -0.56 119.26 121.00 3dkp h ALA 336 Ca 0.08 -0.13 -0.17 0.00 0.00 0.00 0.00 54.91 54.70 3dkp h ALA 336 Cb 0.09 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3dkp h ALA 336 CO -0.01 0.04 -0.50 0.66 0.00 0.00 0.00 179.25 179.44 3dkp h SER 337 N 0.41 0.88 0.16 0.00 4.64 -0.38 -0.54 113.55 118.72 3dkp h SER 337 Ca 0.12 -0.54 0.01 0.00 -0.47 0.00 0.00 61.79 60.91 3dkp h SER 337 Cb 0.17 -0.25 -0.04 0.00 -0.31 0.00 0.00 62.40 61.97 3dkp h SER 337 CO -0.01 1.26 -0.46 0.40 -0.87 0.00 0.00 176.83 177.15 3dkp h ILE 338 N 0.53 0.10 -0.73 0.95 2.04 -0.67 -2.16 117.51 117.58 3dkp h ILE 338 Ca 0.01 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.03 3dkp h ILE 338 Cb 1.11 0.10 -0.13 0.00 -0.74 0.00 0.00 36.82 37.17 3dkp h ILE 338 CO 0.11 0.00 -0.00 -0.26 0.00 0.00 0.00 178.15 178.00 3dkp h PHE 339 N -0.72 -0.06 -0.02 1.37 -1.00 -0.99 0.96 116.94 116.47 3dkp h PHE 339 Ca 0.01 0.05 -0.02 0.00 2.81 0.00 0.00 57.97 60.82 3dkp h PHE 339 Cb 0.72 0.14 -0.00 0.00 3.61 0.00 0.00 35.95 40.42 3dkp h PHE 339 CO -0.38 -0.23 -0.07 1.25 -1.61 0.00 0.00 178.31 177.28 3dkp h LEU 340 N 0.10 0.03 -0.26 1.54 5.85 -0.76 -1.29 115.31 120.52 3dkp h LEU 340 Ca 0.40 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 59.10 3dkp h LEU 340 Cb 0.69 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.71 3dkp h LEU 340 CO -0.65 0.10 -0.05 0.00 -0.34 0.00 0.00 178.44 177.51 3dkp h ALA 341 N 1.90 0.97 -1.64 1.25 0.00 -0.17 -3.40 119.26 118.17 3dkp h ALA 341 Ca 0.01 -0.05 -0.69 0.00 0.00 0.00 0.00 54.91 54.18 3dkp h ALA 341 Cb 0.14 -0.01 -0.16 0.00 0.00 0.00 0.00 17.79 17.77 3dkp h ALA 341 CO 0.01 0.07 1.20 0.00 0.00 0.00 0.00 179.25 180.53 3dkp n THR 343 N 5.56 0.28 -1.76 0.00 -2.24 -1.26 -4.89 114.28 109.97 3dkp n THR 343 Ca 0.31 -0.56 -0.41 0.00 -2.27 0.00 0.00 64.05 61.12 3dkp n THR 343 Cb 0.47 0.93 -0.01 0.00 -2.10 0.00 0.00 70.33 69.63 3dkp n THR 343 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 3dkp n SER 344 N 1.10 3.88 0.27 3.42 2.88 -1.19 -4.84 113.62 119.14 3dkp n SER 344 Ca 0.17 1.18 0.18 0.00 -1.33 0.00 0.00 58.87 59.08 3dkp n SER 344 Cb 0.53 -1.61 0.96 0.00 -0.75 0.00 0.00 64.21 63.33 3dkp n SER 344 CO 0.00 0.00 0.00 1.12 -1.23 0.00 0.00 175.04 174.93 3dkp h HIS 345 N 4.01 0.00 -0.01 0.66 2.07 -1.92 -2.39 115.15 117.56 3dkp h HIS 345 Ca -0.49 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.03 3dkp h HIS 345 Cb 1.23 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.21 3dkp h HIS 345 CO 0.56 0.00 -0.47 1.63 -3.07 0.00 0.00 177.93 176.58 3dkp n LYS 346 N -2.76 0.78 -1.75 5.12 5.02 -1.26 -5.00 118.16 118.31 3dkp n LYS 346 Ca -0.02 -0.57 -0.42 0.00 -2.02 0.00 0.00 58.31 55.28 3dkp n LYS 346 Cb 0.09 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.59 3dkp n LYS 346 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3dkp s VAL 347 N -2.62 2.04 0.12 -0.18 0.11 -0.90 -4.82 120.40 114.15 3dkp s VAL 347 Ca 0.18 0.03 0.06 0.00 -2.93 0.00 0.00 61.98 59.33 3dkp s VAL 347 Cb 0.18 -3.02 -0.04 0.00 -1.53 0.00 0.00 36.38 31.97 3dkp s VAL 347 CO 0.61 0.00 -0.14 -0.13 -3.33 0.00 0.00 175.10 172.11 3dkp s ARG 348 N 0.35 1.02 -0.02 1.54 1.81 0.59 -4.99 118.95 119.24 3dkp s ARG 348 Ca 0.69 -1.23 0.06 0.00 -1.72 0.00 0.00 55.73 53.54 3dkp s ARG 348 Cb -0.49 -0.92 -0.02 0.00 -0.45 0.00 0.00 34.95 33.07 3dkp s ARG 348 CO 0.40 0.18 -0.20 1.03 -0.68 0.00 0.00 175.30 176.03 3dkp s ARG 349 N -2.61 2.24 -0.04 3.54 0.52 -1.26 -1.19 118.95 120.14 3dkp s ARG 349 Ca 0.08 -0.86 0.01 0.00 -0.52 0.00 0.00 55.73 54.45 3dkp s ARG 349 Cb -0.05 -2.19 0.02 0.00 0.52 0.00 0.00 34.95 33.25 3dkp s ARG 349 CO 0.03 0.58 -0.06 0.00 0.02 0.00 0.00 175.30 175.87 3dkp s ALA 350 N -0.72 0.73 -0.19 2.13 0.00 -0.50 -2.40 121.76 120.80 3dkp s ALA 350 Ca 0.11 -0.11 -0.04 0.00 0.00 0.00 0.00 51.96 51.92 3dkp s ALA 350 Cb -0.10 -0.41 -0.02 0.00 0.00 0.00 0.00 23.12 22.59 3dkp s ALA 350 CO 0.01 0.03 -0.02 -1.64 0.00 0.00 0.00 175.76 174.13 3dkp s MET 351 N 0.77 3.55 -0.07 0.00 1.00 0.78 -1.31 119.30 124.02 3dkp s MET 351 Ca -0.11 -0.56 0.01 0.00 0.00 0.00 0.00 55.69 55.03 3dkp s MET 351 Cb -0.14 -3.01 -0.03 0.00 0.00 0.00 0.00 34.83 31.65 3dkp s MET 351 CO 0.01 0.01 -0.06 -0.06 0.00 0.00 0.00 175.02 174.91 3dkp s PHE 352 N 0.99 2.95 0.02 -0.03 0.08 0.13 -0.40 117.98 121.73 3dkp s PHE 352 Ca 0.01 0.02 -0.10 0.00 0.12 0.00 0.00 56.93 56.98 3dkp s PHE 352 Cb -0.14 -1.72 0.01 0.00 -0.57 0.00 0.00 43.02 40.59 3dkp s PHE 352 CO 0.01 0.33 0.21 0.45 -0.10 0.00 0.00 175.22 176.12 3dkp s SER 353 N -0.78 -0.02 0.17 1.36 0.15 -0.33 -0.05 113.70 114.20 3dkp s SER 353 Ca 0.12 -0.23 0.07 0.00 0.70 0.00 0.00 55.95 56.61 3dkp s SER 353 Cb -0.11 0.27 -0.03 0.00 -1.71 0.00 0.00 66.02 64.45 3dkp s SER 353 CO 0.02 -0.49 1.38 0.00 1.20 0.00 0.00 173.24 175.35 3dkp h ALA 354 N 3.74 0.55 -4.07 5.45 0.00 -1.87 -2.27 119.26 120.79 3dkp h ALA 354 Ca -0.31 -0.79 -0.47 0.00 0.00 0.00 0.00 54.91 53.34 3dkp h ALA 354 Cb 1.19 -0.13 -0.28 0.00 0.00 0.00 0.00 17.79 18.57 3dkp h ALA 354 CO 0.44 1.07 -0.81 0.95 0.00 0.00 0.00 179.25 180.91 3dkp s THR 355 N -3.02 1.10 -0.94 0.00 -4.23 -1.26 -3.24 115.64 104.04 3dkp s THR 355 Ca -0.00 -0.71 -0.24 0.00 -1.18 0.00 0.00 61.69 59.55 3dkp s THR 355 Cb 0.11 -0.94 0.04 0.00 1.34 0.00 0.00 72.50 73.04 3dkp s THR 355 CO 0.81 0.22 1.46 0.12 -0.54 0.00 0.00 174.62 176.68 3dkp s PHE 356 N -0.48 2.41 0.21 3.99 5.36 -1.26 -4.84 117.98 123.36 3dkp s PHE 356 Ca 0.04 -0.54 0.09 0.00 -0.96 0.00 0.00 56.93 55.57 3dkp s PHE 356 Cb -0.06 -4.63 -0.04 0.00 -0.34 0.00 0.00 43.02 37.95 3dkp s PHE 356 CO 0.00 -1.96 -0.09 0.00 -1.46 0.00 0.00 175.22 171.71 3dkp s ALA 357 N 5.58 2.97 0.01 11.12 0.00 -1.26 -5.04 121.76 135.13 3dkp s ALA 357 Ca 0.46 -1.55 -0.25 0.00 0.00 0.00 0.00 51.96 50.61 3dkp s ALA 357 Cb -0.02 -0.69 -0.17 0.00 0.00 0.00 0.00 23.12 22.24 3dkp s ALA 357 CO -0.03 0.40 1.26 -0.92 0.00 0.00 0.00 175.76 176.47 3dkp h TYR 358 N 2.62 -0.35 -0.00 0.00 5.03 -1.99 -0.39 116.97 121.89 3dkp h TYR 358 Ca -0.46 -0.01 0.00 0.00 2.58 0.00 0.00 58.73 60.85 3dkp h TYR 358 Cb 1.22 0.12 0.00 0.00 1.55 0.00 0.00 36.73 39.62 3dkp h TYR 358 CO 0.67 -0.03 -0.08 -0.25 -1.32 0.00 0.00 178.16 177.15 3dkp n ASP 359 N -5.12 0.19 -0.02 -2.11 9.92 -1.26 -0.74 116.55 117.41 3dkp n ASP 359 Ca -0.09 -0.11 -0.20 0.00 -0.53 0.00 0.00 54.79 53.86 3dkp n ASP 359 Cb 0.26 -0.23 -0.13 0.00 -0.64 0.00 0.00 41.12 40.38 3dkp n ASP 359 CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 3dkp h VAL 360 N 0.17 1.28 -0.22 2.53 2.07 -1.93 -2.60 116.25 117.55 3dkp h VAL 360 Ca 0.00 -2.38 0.04 0.00 0.82 0.00 0.00 66.70 65.19 3dkp h VAL 360 Cb 0.39 2.88 -0.04 0.00 -1.52 0.00 0.00 31.29 32.99 3dkp h VAL 360 CO 0.00 0.62 -0.06 -0.08 0.02 0.00 0.00 177.57 178.07 3dkp h GLU 361 N -0.59 -0.01 -0.02 1.57 4.22 -0.77 -1.35 114.58 117.63 3dkp h GLU 361 Ca -0.21 0.00 -0.16 0.00 0.08 0.00 0.00 59.36 59.07 3dkp h GLU 361 Cb 1.49 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.73 3dkp h GLU 361 CO 0.02 -0.01 -0.73 1.96 -2.18 0.00 0.00 179.01 178.08 3dkp h GLN 362 N -0.01 0.12 -0.52 1.92 1.08 -1.08 -1.80 115.11 114.82 3dkp h GLN 362 Ca 0.11 -0.10 -0.02 0.00 -1.45 0.00 0.00 58.65 57.18 3dkp h GLN 362 Cb 0.17 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.60 3dkp h GLN 362 CO -0.23 0.79 0.24 2.35 -0.95 0.00 0.00 178.83 181.03 3dkp h TRP 363 N 0.08 0.76 -0.14 2.96 7.01 -1.29 -2.54 115.95 122.79 3dkp h TRP 363 Ca -0.02 -0.04 -0.04 0.00 2.11 0.00 0.00 58.89 60.90 3dkp h TRP 363 Cb 1.28 -0.23 -0.00 0.00 -2.10 0.00 0.00 29.16 28.11 3dkp h TRP 363 CO 0.01 0.60 -0.06 0.00 -2.79 0.00 0.00 178.44 176.21 3dkp h LYS 365 N -0.05 0.00 0.05 0.00 1.79 -1.36 0.76 116.57 117.77 3dkp h LYS 365 Ca 0.03 0.00 -0.36 0.00 -2.18 0.00 0.00 60.65 58.14 3dkp h LYS 365 Cb 0.52 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.13 3dkp h LYS 365 CO 0.02 0.00 -2.16 -0.11 -1.08 0.00 0.00 179.45 176.12 3dkp n LEU 366 N -3.63 2.26 -0.10 2.94 7.94 -0.96 -4.68 117.00 120.76 3dkp n LEU 366 Ca -0.03 0.10 -0.13 0.00 -1.11 0.00 0.00 56.01 54.84 3dkp n LEU 366 Cb 0.08 -0.72 -0.13 0.00 0.53 0.00 0.00 43.42 43.18 3dkp n LEU 366 CO 0.25 0.79 -1.18 0.59 -1.11 0.00 0.00 177.39 176.73 3dkp n ASN 367 N -3.28 1.23 -4.88 1.96 3.02 0.12 -5.00 115.26 108.43 3dkp n ASN 367 Ca -0.35 -0.06 -0.30 0.00 -0.03 0.00 0.00 54.58 53.85 3dkp n ASN 367 Cb 1.04 0.34 -0.01 0.00 -0.61 0.00 0.00 39.78 40.54 3dkp n ASN 367 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3dkp s LEU 368 N -5.84 3.55 -0.25 3.41 1.43 0.24 -5.02 118.68 116.20 3dkp s LEU 368 Ca -0.20 1.22 -0.17 0.00 -1.03 0.00 0.00 54.13 53.95 3dkp s LEU 368 Cb 0.07 -4.18 -0.03 0.00 0.03 0.00 0.00 46.19 42.07 3dkp s LEU 368 CO 0.66 -0.63 0.45 -0.62 0.23 0.00 0.00 176.35 176.44 3dkp s ASP 369 N -3.77 6.37 -1.43 2.29 2.15 -1.26 -4.39 116.67 116.62 3dkp s ASP 369 Ca 0.52 0.44 -0.06 0.00 0.43 0.00 0.00 52.55 53.88 3dkp s ASP 369 Cb -0.10 -2.25 0.04 0.00 -0.30 0.00 0.00 42.92 40.31 3dkp s ASP 369 CO 0.43 -0.22 0.77 -3.20 -0.17 0.00 0.00 175.17 172.77 3dkp n ASN 370 N 5.30 -2.50 -4.73 -0.34 5.15 -1.26 -4.43 115.26 112.44 3dkp n ASN 370 Ca -0.06 -0.85 -0.38 0.00 -0.60 0.00 0.00 54.58 52.69 3dkp n ASN 370 Cb 0.50 -3.75 0.05 0.00 -0.53 0.00 0.00 39.78 36.05 3dkp n ASN 370 CO 0.00 0.00 0.00 0.55 1.40 0.00 0.00 177.26 179.21 3dkp n VAL 371 N -4.45 4.02 -4.34 3.44 3.14 -1.26 -4.68 118.33 114.19 3dkp n VAL 371 Ca -0.15 -0.50 -0.34 0.00 -2.96 0.00 0.00 64.34 60.39 3dkp n VAL 371 Cb 0.61 -1.60 -0.13 0.00 -1.06 0.00 0.00 33.84 31.66 3dkp n VAL 371 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 3dkp s ILE 372 N -1.31 3.57 -0.18 1.55 1.01 -0.70 -4.57 121.20 120.57 3dkp s ILE 372 Ca 0.74 -0.46 -0.08 0.00 0.00 0.00 0.00 60.65 60.85 3dkp s ILE 372 Cb -0.41 -2.57 -0.04 0.00 0.01 0.00 0.00 42.46 39.44 3dkp s ILE 372 CO 0.47 0.48 0.07 -0.94 0.00 0.00 0.00 174.94 175.02 3dkp s SER 373 N 0.69 5.68 -0.08 3.58 1.04 0.12 -0.99 113.70 123.74 3dkp s SER 373 Ca -0.03 0.10 0.04 0.00 0.48 0.00 0.00 55.95 56.54 3dkp s SER 373 Cb -0.15 -1.97 0.00 0.00 0.10 0.00 0.00 66.02 64.00 3dkp s SER 373 CO 0.02 0.18 -0.20 -0.69 0.98 0.00 0.00 173.24 173.53 3dkp s VAL 374 N 0.35 1.72 -0.01 5.02 1.01 0.46 -0.67 120.40 128.28 3dkp s VAL 374 Ca 0.03 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.18 3dkp s VAL 374 Cb -0.12 -1.50 0.01 0.00 0.00 0.00 0.00 36.38 34.77 3dkp s VAL 374 CO -0.00 0.49 -0.01 -0.55 0.00 0.00 0.00 175.10 175.02 3dkp s SER 375 N 0.31 0.23 -0.27 3.32 0.15 0.16 -0.49 113.70 117.10 3dkp s SER 375 Ca -0.13 -0.02 -0.13 0.00 0.70 0.00 0.00 55.95 56.36 3dkp s SER 375 Cb -0.16 -0.06 -0.04 0.00 -1.71 0.00 0.00 66.02 64.05 3dkp s SER 375 CO 0.06 -0.01 0.30 -0.63 1.20 0.00 0.00 173.24 174.15 3dkp s ILE 376 N 0.25 5.23 0.70 6.45 -1.09 -0.61 -0.27 121.20 131.86 3dkp s ILE 376 Ca -0.02 0.41 -0.11 0.00 -2.23 0.00 0.00 60.65 58.69 3dkp s ILE 376 Cb -0.04 -3.63 0.02 0.00 -1.58 0.00 0.00 42.46 37.23 3dkp s ILE 376 CO -0.01 0.20 1.07 -0.83 -1.23 0.00 0.00 174.94 174.14 3dkp s GLY 377 N 1.67 1.72 0.00 6.18 0.00 -0.44 -4.77 107.32 111.69 3dkp s GLY 377 Ca 0.12 0.17 0.29 0.00 0.00 0.00 0.00 44.72 45.29 3dkp s GLY 377 CO 0.10 0.49 2.04 0.00 0.00 0.00 0.00 173.10 175.73