#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ly2 s SER 142 N 0.00 7.05 0.00 -3.46 0.15 -1.26 -4.93 113.70 111.25 3ly2 s SER 142 Ca 0.00 1.59 0.21 0.00 0.70 0.00 0.00 55.95 58.45 3ly2 s SER 142 Cb 0.00 -2.49 1.09 0.00 -1.71 0.00 0.00 66.02 62.91 3ly2 s SER 142 CO 0.00 -0.15 1.66 0.61 1.20 0.00 0.00 173.24 176.55 3ly2 n GLY 143 N 0.08 -0.92 0.03 9.45 0.00 -1.26 -2.08 105.19 110.49 3ly2 n GLY 143 Ca 0.03 -0.10 0.13 0.00 0.00 0.00 0.00 46.02 46.07 3ly2 n GLY 143 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ly2 n LEU 144 N -1.23 0.34 -4.37 0.99 4.32 -1.26 -4.87 117.00 110.92 3ly2 n LEU 144 Ca 0.11 0.16 -0.20 0.00 -0.02 0.00 0.00 56.01 56.06 3ly2 n LEU 144 Cb 0.15 -0.32 -0.10 0.00 -1.62 0.00 0.00 43.42 41.53 3ly2 n LEU 144 CO 0.15 0.08 -0.46 0.68 -1.22 0.00 0.00 177.39 176.62 3ly2 s VAL 145 N -2.88 1.89 0.74 4.08 -7.23 -0.88 -4.92 120.40 111.18 3ly2 s VAL 145 Ca 0.16 -2.20 -0.15 0.00 -1.81 0.00 0.00 61.98 57.98 3ly2 s VAL 145 Cb 0.19 -2.05 0.03 0.00 0.56 0.00 0.00 36.38 35.10 3ly2 s VAL 145 CO 0.59 -0.51 1.15 -2.65 -0.31 0.00 0.00 175.10 173.37 3ly2 n PRO 146 N -0.30 0.55 -1.72 4.82 -0.02 -1.26 -4.85 135.00 132.22 3ly2 n PRO 146 Ca -0.08 0.25 -0.43 0.00 -2.02 0.00 0.00 63.50 61.22 3ly2 n PRO 146 Cb 0.60 -2.40 -0.02 0.00 -0.02 0.00 0.00 33.50 31.66 3ly2 n PRO 146 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 3ly2 n ARG 147 N -2.44 2.46 -0.90 -0.52 0.00 -1.26 -1.81 116.66 112.20 3ly2 n ARG 147 Ca 0.14 0.88 0.00 0.00 -0.00 0.00 0.00 57.85 58.87 3ly2 n ARG 147 Cb 0.49 -2.61 0.00 0.00 -0.00 0.00 0.00 32.46 30.34 3ly2 n ARG 147 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3ly2 n GLY 148 N 2.12 0.58 3.80 2.89 0.00 -1.26 -5.01 105.19 108.31 3ly2 n GLY 148 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 3ly2 n GLY 148 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3ly2 s SER 149 N -2.46 7.10 0.00 1.61 0.15 -0.75 -4.96 113.70 114.39 3ly2 s SER 149 Ca 0.00 1.79 0.26 0.00 0.70 0.00 0.00 55.95 58.69 3ly2 s SER 149 Cb 0.00 -2.56 0.60 0.00 -1.71 0.00 0.00 66.02 62.35 3ly2 s SER 149 CO 0.00 -0.24 1.47 1.41 1.20 0.00 0.00 173.24 177.08 3ly2 n HIS 150 N -0.06 0.00 -1.69 3.44 8.25 -1.26 -4.94 115.22 118.96 3ly2 n HIS 150 Ca 0.05 0.00 -0.44 0.00 -0.26 0.00 0.00 57.72 57.06 3ly2 n HIS 150 Cb 0.52 -0.14 -0.03 0.00 1.12 0.00 0.00 29.99 31.46 3ly2 n HIS 150 CO 0.00 0.00 0.00 -0.12 0.64 0.00 0.00 176.34 176.86 3ly2 n MET 151 N -0.81 2.27 -3.59 -0.41 0.00 -1.26 -4.96 117.12 108.35 3ly2 n MET 151 Ca 0.10 0.81 -0.36 0.00 0.00 0.00 0.00 57.70 58.26 3ly2 n MET 151 Cb 0.35 -2.55 -0.07 0.00 0.00 0.00 0.00 33.22 30.95 3ly2 n MET 151 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 3ly2 s SER 152 N 0.64 6.37 0.56 6.12 0.15 -1.26 -4.94 113.70 121.34 3ly2 s SER 152 Ca 0.72 0.43 0.37 0.00 0.70 0.00 0.00 55.95 58.17 3ly2 s SER 152 Cb -0.62 -2.16 1.89 0.00 -1.71 0.00 0.00 66.02 63.42 3ly2 s SER 152 CO 0.43 0.13 2.12 0.16 1.20 0.00 0.00 173.24 177.28 3ly2 h ILE 153 N 4.67 0.00 0.00 6.45 3.07 -1.93 0.68 117.51 130.45 3ly2 h ILE 153 Ca -0.41 -0.13 -0.01 0.00 1.55 0.00 0.00 64.86 65.85 3ly2 h ILE 153 Cb 1.16 1.03 -0.00 0.00 -0.27 0.00 0.00 36.82 38.74 3ly2 h ILE 153 CO 0.75 0.00 -0.07 0.77 -1.05 0.00 0.00 178.15 178.55 3ly2 h SER 154 N 0.00 0.00 -0.55 2.16 4.64 -1.93 -2.11 113.55 115.77 3ly2 h SER 154 Ca 0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 3ly2 h SER 154 Cb 0.14 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.21 3ly2 h SER 154 CO 0.00 0.07 0.11 -0.09 -0.87 0.00 0.00 176.83 176.06 3ly2 h ARG 155 N 0.00 0.94 -0.96 4.77 2.43 -1.18 -2.66 114.38 117.73 3ly2 h ARG 155 Ca -0.00 -0.22 -0.58 0.00 -0.81 0.00 0.00 59.98 58.37 3ly2 h ARG 155 Cb 0.69 -0.13 -0.29 0.00 -0.42 0.00 0.00 29.97 29.82 3ly2 h ARG 155 CO 0.01 0.85 0.67 1.97 -1.51 0.00 0.00 179.97 181.96 3ly2 n PHE 156 N -4.24 3.03 -1.04 2.20 -1.74 -1.13 -4.93 117.46 109.60 3ly2 n PHE 156 Ca 0.04 -2.40 -0.02 0.00 -0.56 0.00 0.00 57.45 54.51 3ly2 n PHE 156 Cb 0.26 -1.14 -0.01 0.00 1.52 0.00 0.00 39.48 40.11 3ly2 n PHE 156 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 3ly2 n GLY 157 N -1.03 0.51 3.53 4.97 0.00 -1.00 -4.84 105.19 107.34 3ly2 n GLY 157 Ca 0.59 -0.79 -0.35 0.00 0.00 0.00 0.00 46.02 45.47 3ly2 n GLY 157 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ly2 s VAL 158 N -2.04 4.34 0.41 1.61 1.01 -0.81 -2.93 120.40 122.00 3ly2 s VAL 158 Ca 0.00 -0.18 -0.02 0.00 0.00 0.00 0.00 61.98 61.78 3ly2 s VAL 158 Cb 0.00 -2.97 -0.03 0.00 0.00 0.00 0.00 36.38 33.38 3ly2 s VAL 158 CO 0.00 0.43 0.66 0.20 0.00 0.00 0.00 175.10 176.39 3ly2 s ASN 159 N 0.78 6.20 0.39 3.32 0.01 -1.26 -3.63 114.94 120.76 3ly2 s ASN 159 Ca 0.02 0.60 0.08 0.00 -0.71 0.00 0.00 52.86 52.85 3ly2 s ASN 159 Cb -0.14 -2.04 0.81 0.00 0.41 0.00 0.00 41.25 40.30 3ly2 s ASN 159 CO 0.02 -0.47 1.97 0.74 -1.51 0.00 0.00 177.10 177.86 3ly2 h THR 160 N 0.49 1.14 -0.05 1.60 2.02 -1.99 -2.20 112.91 113.93 3ly2 h THR 160 Ca -0.48 -0.52 0.01 0.00 0.77 0.00 0.00 66.41 66.19 3ly2 h THR 160 Cb 1.22 0.90 -0.00 0.00 -1.74 0.00 0.00 68.15 68.53 3ly2 h THR 160 CO 0.61 0.18 0.05 -0.33 0.37 0.00 0.00 175.52 176.40 3ly2 h GLU 161 N 0.38 0.00 -0.13 6.66 3.07 -2.01 -2.65 114.58 119.90 3ly2 h GLU 161 Ca 0.09 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.95 3ly2 h GLU 161 Cb 0.19 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.10 3ly2 h GLU 161 CO 0.00 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.70 3ly2 n ASN 162 N -3.96 2.29 -0.04 1.42 3.02 -0.85 -4.69 115.26 112.45 3ly2 n ASN 162 Ca -0.02 -1.65 -0.09 0.00 -0.03 0.00 0.00 54.58 52.78 3ly2 n ASN 162 Cb 0.14 -0.08 -0.03 0.00 -0.61 0.00 0.00 39.78 39.20 3ly2 n ASN 162 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 3ly2 h GLU 163 N 2.16 0.16 -0.20 3.52 4.81 -1.20 -0.34 114.58 123.48 3ly2 h GLU 163 Ca 0.00 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 3ly2 h GLU 163 Cb 0.56 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.90 3ly2 h GLU 163 CO 0.00 0.10 -0.04 -0.44 -0.73 0.00 0.00 179.01 177.91 3ly2 h ASP 164 N 0.16 0.39 -0.73 1.04 3.45 -1.84 -0.23 116.42 118.67 3ly2 h ASP 164 Ca 0.08 -0.35 0.09 0.00 0.43 0.00 0.00 57.03 57.27 3ly2 h ASP 164 Cb 0.05 -0.11 -0.07 0.00 -0.56 0.00 0.00 39.33 38.64 3ly2 h ASP 164 CO -0.08 0.65 0.38 0.45 -1.57 0.00 0.00 179.24 179.07 3ly2 h HIS 165 N 0.12 0.69 -0.24 4.55 3.86 -1.81 -0.35 115.15 121.97 3ly2 h HIS 165 Ca 0.05 0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.22 3ly2 h HIS 165 Cb 0.47 -0.20 -0.01 0.00 1.06 0.00 0.00 27.41 28.74 3ly2 h HIS 165 CO 0.05 0.27 -0.14 1.25 0.86 0.00 0.00 177.93 180.22 3ly2 h LEU 166 N 0.66 0.54 -1.59 2.43 5.85 -0.95 -2.07 115.31 120.17 3ly2 h LEU 166 Ca 0.35 -0.42 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 3ly2 h LEU 166 Cb 0.33 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 3ly2 h LEU 166 CO -0.25 0.85 0.17 0.00 -0.34 0.00 0.00 178.44 178.87 3ly2 h ALA 167 N 0.71 1.69 -0.11 1.25 0.00 -0.60 0.14 119.26 122.34 3ly2 h ALA 167 Ca 0.05 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 3ly2 h ALA 167 Cb 0.65 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 3ly2 h ALA 167 CO 0.04 0.26 -0.03 -0.22 0.00 0.00 0.00 179.25 179.30 3ly2 h LYS 168 N 0.44 0.22 -0.98 0.00 3.64 -0.94 -2.84 116.57 116.11 3ly2 h LYS 168 Ca 0.12 -0.09 0.06 0.00 -1.27 0.00 0.00 60.65 59.47 3ly2 h LYS 168 Cb 0.03 -0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 31.77 3ly2 h LYS 168 CO -0.02 0.53 0.63 1.49 -2.27 0.00 0.00 179.45 179.82 3ly2 h GLU 169 N -0.11 1.12 0.00 1.90 4.57 -0.61 -0.68 114.58 120.76 3ly2 h GLU 169 Ca 0.03 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 3ly2 h GLU 169 Cb 0.46 -0.25 0.00 0.00 -0.16 0.00 0.00 28.75 28.80 3ly2 h GLU 169 CO 0.01 0.74 0.00 1.28 -1.18 0.00 0.00 179.01 179.86 3ly2 n LEU 170 N -4.52 0.00 0.09 1.64 4.77 0.41 -1.79 117.00 117.60 3ly2 n LEU 170 Ca 0.15 0.06 0.12 0.00 -0.03 0.00 0.00 56.01 56.31 3ly2 n LEU 170 Cb 0.17 -0.06 0.45 0.00 -2.33 0.00 0.00 43.42 41.66 3ly2 n LEU 170 CO 0.32 -0.03 0.87 -0.62 -1.33 0.00 0.00 177.39 176.61 3ly2 n GLU 171 N -1.06 0.18 -0.36 3.23 1.02 -0.26 -2.01 120.64 121.38 3ly2 n GLU 171 Ca 0.12 0.26 0.12 0.00 -0.02 0.00 0.00 57.16 57.64 3ly2 n GLU 171 Cb 0.07 -1.76 0.32 0.00 -0.02 0.00 0.00 31.44 30.06 3ly2 n GLU 171 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3ly2 n ASP 172 N -2.08 3.95 -0.33 1.62 8.00 -0.74 -4.59 116.55 122.38 3ly2 n ASP 172 Ca 0.04 -2.00 0.17 0.00 0.71 0.00 0.00 54.79 53.71 3ly2 n ASP 172 Cb 0.32 -0.48 0.37 0.00 -0.02 0.00 0.00 41.12 41.31 3ly2 n ASP 172 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3ly2 h LEU 173 N 4.37 0.52 -1.97 0.64 5.85 -1.56 0.20 115.31 123.36 3ly2 h LEU 173 Ca 0.00 0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.87 3ly2 h LEU 173 Cb 1.00 0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.11 3ly2 h LEU 173 CO 0.00 0.03 0.00 0.59 -0.34 0.00 0.00 178.44 178.72 3ly2 n ASN 174 N -4.97 2.92 -4.43 1.25 3.02 -1.26 -4.80 115.26 106.98 3ly2 n ASN 174 Ca 0.26 -2.26 -0.28 0.00 -0.03 0.00 0.00 54.58 52.27 3ly2 n ASN 174 Cb 0.74 -0.44 -0.12 0.00 -0.61 0.00 0.00 39.78 39.35 3ly2 n ASN 174 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3ly2 s LYS 175 N -1.72 1.55 0.47 3.52 1.02 0.69 -4.86 119.74 120.42 3ly2 s LYS 175 Ca 0.29 -1.40 0.19 0.00 0.02 0.00 0.00 55.97 55.07 3ly2 s LYS 175 Cb 0.19 -1.92 1.17 0.00 -0.52 0.00 0.00 37.83 36.74 3ly2 s LYS 175 CO 0.14 0.43 2.02 2.35 -0.92 0.00 0.00 175.35 179.37 3ly2 h TRP 176 N 3.49 0.00 0.00 3.18 -0.00 -1.91 -2.88 115.95 117.83 3ly2 h TRP 176 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.41 3ly2 h TRP 176 Cb 1.19 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.35 3ly2 h TRP 176 CO 0.64 0.17 0.00 0.41 -0.00 0.00 0.00 178.44 179.66 3ly2 n GLY 177 N -0.89 -0.98 3.60 2.65 0.00 -1.26 -4.90 105.19 103.41 3ly2 n GLY 177 Ca -0.02 -0.10 -0.44 0.00 0.00 0.00 0.00 46.02 45.45 3ly2 n GLY 177 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3ly2 n LEU 178 N -1.27 2.02 -4.25 0.99 0.00 -1.09 -4.93 117.00 108.46 3ly2 n LEU 178 Ca 0.11 1.18 -0.43 0.00 0.00 0.00 0.00 56.01 56.86 3ly2 n LEU 178 Cb 0.17 -1.31 -0.07 0.00 0.00 0.00 0.00 43.42 42.21 3ly2 n LEU 178 CO 0.16 -1.26 0.06 0.21 0.00 0.00 0.00 177.39 176.56 3ly2 s ASN 179 N -0.48 5.94 0.53 1.96 3.84 -1.26 -4.92 114.94 120.54 3ly2 s ASN 179 Ca 0.59 -1.90 0.30 0.00 0.21 0.00 0.00 52.86 52.06 3ly2 s ASN 179 Cb -0.69 -2.10 1.47 0.00 -0.55 0.00 0.00 41.25 39.38 3ly2 s ASN 179 CO 0.60 -0.76 2.06 -0.29 -2.79 0.00 0.00 177.10 175.92 3ly2 h ILE 180 N 5.97 0.41 -0.40 -5.21 6.09 -1.98 -2.52 117.51 119.87 3ly2 h ILE 180 Ca -0.24 -0.56 -0.12 0.00 -1.37 0.00 0.00 64.86 62.58 3ly2 h ILE 180 Cb 1.08 1.39 -0.01 0.00 0.47 0.00 0.00 36.82 39.75 3ly2 h ILE 180 CO 0.93 0.10 -0.22 -0.26 -3.07 0.00 0.00 178.15 175.63 3ly2 h PHE 181 N 0.00 0.90 -0.30 2.19 0.04 -1.97 -1.50 116.94 116.31 3ly2 h PHE 181 Ca -0.00 -0.21 -0.13 0.00 2.80 0.00 0.00 57.97 60.43 3ly2 h PHE 181 Cb 0.39 -0.21 -0.00 0.00 2.20 0.00 0.00 35.95 38.32 3ly2 h PHE 181 CO 0.00 0.94 -0.34 -0.91 -0.60 0.00 0.00 178.31 177.40 3ly2 h ASN 182 N 0.69 0.81 -0.71 2.17 2.35 -1.88 -1.81 115.58 117.20 3ly2 h ASN 182 Ca 0.10 -0.48 0.06 0.00 -0.55 0.00 0.00 56.30 55.42 3ly2 h ASN 182 Cb 0.74 -0.23 -0.06 0.00 0.05 0.00 0.00 38.32 38.82 3ly2 h ASN 182 CO 0.06 1.13 0.40 0.58 -1.65 0.00 0.00 177.43 177.95 3ly2 h VAL 183 N 0.50 0.97 -0.53 2.81 2.07 -1.40 0.32 116.25 120.99 3ly2 h VAL 183 Ca 0.04 -0.25 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 3ly2 h VAL 183 Cb 0.92 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 3ly2 h VAL 183 CO 0.08 0.13 0.25 0.00 0.02 0.00 0.00 177.57 178.05 3ly2 h ALA 184 N 1.36 0.69 -0.12 1.67 0.00 -1.10 -2.57 119.26 119.19 3ly2 h ALA 184 Ca 0.32 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 3ly2 h ALA 184 Cb 0.20 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3ly2 h ALA 184 CO -0.19 0.26 -0.23 0.78 0.00 0.00 0.00 179.25 179.88 3ly2 h GLY 185 N 0.71 0.22 -0.66 0.00 0.00 -0.43 -0.64 103.07 102.27 3ly2 h GLY 185 Ca 0.18 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.36 3ly2 h GLY 185 CO -0.02 0.14 0.00 -1.72 0.00 0.00 0.00 176.54 174.94 3ly2 n TYR 186 N -4.20 0.24 -2.69 5.60 4.01 0.01 -4.07 117.16 116.07 3ly2 n TYR 186 Ca -0.01 -0.12 -0.00 0.00 -0.16 0.00 0.00 57.90 57.61 3ly2 n TYR 186 Cb 0.33 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.41 3ly2 n TYR 186 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 3ly2 n SER 187 N 0.12 1.60 -4.03 7.72 3.41 -0.98 -4.57 113.62 116.89 3ly2 n SER 187 Ca 0.12 -2.14 -0.33 0.00 -0.26 0.00 0.00 58.87 56.26 3ly2 n SER 187 Cb 0.24 -0.43 -0.01 0.00 -0.26 0.00 0.00 64.21 63.74 3ly2 n SER 187 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3ly2 n HIS 188 N -0.34 -1.85 -3.37 7.33 8.25 -1.15 -2.37 115.22 121.72 3ly2 n HIS 188 Ca 0.09 0.76 -0.17 0.00 -0.26 0.00 0.00 57.72 58.14 3ly2 n HIS 188 Cb 0.89 -3.10 0.08 0.00 1.12 0.00 0.00 29.99 28.98 3ly2 n HIS 188 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3ly2 n ASN 189 N -2.61 -3.99 -3.10 0.41 5.15 -0.29 -4.97 115.26 105.86 3ly2 n ASN 189 Ca 0.06 -0.67 -0.18 0.00 -0.60 0.00 0.00 54.58 53.19 3ly2 n ASN 189 Cb 0.50 -5.10 -0.02 0.00 -0.53 0.00 0.00 39.78 34.63 3ly2 n ASN 189 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3ly2 n ARG 190 N -3.76 1.23 0.19 1.20 5.12 -1.00 -4.95 116.66 114.69 3ly2 n ARG 190 Ca -0.20 -3.52 0.03 0.00 -1.93 0.00 0.00 57.85 52.24 3ly2 n ARG 190 Cb 0.65 -1.71 0.36 0.00 -1.16 0.00 0.00 32.46 30.60 3ly2 n ARG 190 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 3ly2 h PRO 191 N 2.99 0.00 0.31 5.56 0.13 -1.85 -2.38 132.00 136.77 3ly2 h PRO 191 Ca 0.08 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.20 3ly2 h PRO 191 Cb 0.95 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.08 3ly2 h PRO 191 CO 0.53 0.38 -0.15 1.25 -0.23 0.00 0.00 178.00 179.79 3ly2 h LEU 192 N 0.00 -0.35 -0.71 1.56 5.85 -1.93 0.26 115.31 119.99 3ly2 h LEU 192 Ca -0.00 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.56 3ly2 h LEU 192 Cb 0.72 0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.80 3ly2 h LEU 192 CO 0.05 -0.01 0.46 0.74 -0.34 0.00 0.00 178.44 179.34 3ly2 h THR 193 N -0.73 1.19 0.04 1.05 2.02 -1.85 0.09 112.91 114.72 3ly2 h THR 193 Ca -0.04 -0.35 -0.00 0.00 0.77 0.00 0.00 66.41 66.78 3ly2 h THR 193 Cb 0.49 0.16 0.00 0.00 -1.74 0.00 0.00 68.15 67.06 3ly2 h THR 193 CO 0.07 0.18 -0.02 0.00 0.37 0.00 0.00 175.52 176.12 3ly2 h ILE 195 N -0.22 1.27 -0.55 0.00 6.09 -0.33 -2.48 117.51 121.29 3ly2 h ILE 195 Ca -0.01 -1.38 -0.07 0.00 -1.37 0.00 0.00 64.86 62.04 3ly2 h ILE 195 Cb 0.21 1.25 -0.02 0.00 0.47 0.00 0.00 36.82 38.72 3ly2 h ILE 195 CO 0.01 0.46 0.08 0.24 -3.07 0.00 0.00 178.15 175.87 3ly2 h MET 196 N 0.69 0.88 -0.40 2.19 2.86 -0.94 -0.46 114.93 119.74 3ly2 h MET 196 Ca 0.09 -0.21 -0.08 0.00 -2.06 0.00 0.00 59.70 57.43 3ly2 h MET 196 Cb 0.78 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.31 3ly2 h MET 196 CO 0.06 0.82 -0.08 -0.92 1.06 0.00 0.00 176.91 177.86 3ly2 h TYR 197 N 0.83 0.84 -0.54 -0.22 3.20 -1.20 -0.22 116.97 119.66 3ly2 h TYR 197 Ca 0.17 -0.17 -0.04 0.00 3.14 0.00 0.00 58.73 61.82 3ly2 h TYR 197 Cb 0.39 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.42 3ly2 h TYR 197 CO 0.02 0.87 0.18 0.00 -1.64 0.00 0.00 178.16 177.59 3ly2 h ALA 198 N 0.85 0.71 -0.39 1.82 0.00 -1.18 -2.13 119.26 118.95 3ly2 h ALA 198 Ca 0.10 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 3ly2 h ALA 198 Cb 0.59 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3ly2 h ALA 198 CO 0.04 0.37 0.18 0.82 0.00 0.00 0.00 179.25 180.65 3ly2 h ILE 199 N 0.75 1.18 0.00 0.00 2.04 -0.87 0.07 117.51 120.69 3ly2 h ILE 199 Ca 0.18 -0.53 -0.06 0.00 1.00 0.00 0.00 64.86 65.45 3ly2 h ILE 199 Cb 0.27 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 3ly2 h ILE 199 CO -0.01 0.20 -0.29 -0.26 0.00 0.00 0.00 178.15 177.79 3ly2 h PHE 200 N 0.49 0.00 0.11 1.37 -1.00 -0.92 0.78 116.94 117.77 3ly2 h PHE 200 Ca 0.13 0.00 -0.19 0.00 2.81 0.00 0.00 57.97 60.72 3ly2 h PHE 200 Cb 0.14 0.00 0.02 0.00 3.61 0.00 0.00 35.95 39.73 3ly2 h PHE 200 CO -0.01 0.29 -0.82 1.96 -1.61 0.00 0.00 178.31 178.12 3ly2 h GLN 201 N 0.00 0.36 -0.51 1.51 4.20 -1.14 0.53 115.11 120.05 3ly2 h GLN 201 Ca -0.00 -0.54 0.06 0.00 0.06 0.00 0.00 58.65 58.23 3ly2 h GLN 201 Cb 0.54 0.19 -0.05 0.00 0.30 0.00 0.00 27.48 28.45 3ly2 h GLN 201 CO 0.04 1.23 0.21 1.49 -0.67 0.00 0.00 178.83 181.13 3ly2 h GLU 202 N -0.23 0.40 -0.13 1.46 4.57 -0.72 -1.58 114.58 118.35 3ly2 h GLU 202 Ca -0.13 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.02 3ly2 h GLU 202 Cb 1.60 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 30.10 3ly2 h GLU 202 CO 0.16 0.27 0.00 0.54 -1.18 0.00 0.00 179.01 178.79 3ly2 n ARG 203 N -4.96 1.56 -1.93 1.92 1.74 0.24 -4.92 116.66 110.31 3ly2 n ARG 203 Ca 0.05 -0.84 -0.20 0.00 -0.77 0.00 0.00 57.85 56.09 3ly2 n ARG 203 Cb 0.18 -1.37 -0.05 0.00 -1.02 0.00 0.00 32.46 30.20 3ly2 n ARG 203 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3ly2 n ASP 204 N 0.06 -5.43 0.21 0.55 4.64 -0.60 -4.89 116.55 111.10 3ly2 n ASP 204 Ca 0.16 0.28 0.06 0.00 -1.38 0.00 0.00 54.79 53.91 3ly2 n ASP 204 Cb 0.27 -4.69 0.45 0.00 -1.04 0.00 0.00 41.12 36.11 3ly2 n ASP 204 CO 0.00 0.00 0.00 -0.07 -0.82 0.00 0.00 177.20 176.31 3ly2 h LEU 205 N 0.00 0.00 -0.53 -2.67 3.38 -1.18 -2.04 115.31 112.27 3ly2 h LEU 205 Ca -0.44 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.48 3ly2 h LEU 205 Cb 1.32 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.05 3ly2 h LEU 205 CO 0.58 0.30 0.13 -0.07 0.09 0.00 0.00 178.44 179.46 3ly2 h LEU 206 N 0.00 0.81 -0.04 1.67 3.38 -1.84 -1.94 115.31 117.34 3ly2 h LEU 206 Ca -0.00 -0.24 -0.25 0.00 0.09 0.00 0.00 57.88 57.48 3ly2 h LEU 206 Cb 0.61 -0.21 0.02 0.00 0.09 0.00 0.00 40.66 41.17 3ly2 h LEU 206 CO 0.04 0.83 -0.95 0.11 0.09 0.00 0.00 178.44 178.57 3ly2 h LYS 207 N 0.75 0.72 -0.45 1.13 1.57 -1.79 0.37 116.57 118.87 3ly2 h LYS 207 Ca 0.17 -0.72 -0.00 0.00 -1.87 0.00 0.00 60.65 58.23 3ly2 h LYS 207 Cb 0.34 0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.82 3ly2 h LYS 207 CO 0.00 1.30 0.27 1.15 -0.57 0.00 0.00 179.45 181.61 3ly2 h THR 208 N 0.42 1.14 -0.53 -0.16 2.02 -1.31 -2.98 112.91 111.51 3ly2 h THR 208 Ca -0.11 -0.32 0.00 0.00 0.77 0.00 0.00 66.41 66.76 3ly2 h THR 208 Cb 1.60 0.53 0.00 0.00 -1.74 0.00 0.00 68.15 68.54 3ly2 h THR 208 CO 0.19 0.14 0.00 0.49 0.37 0.00 0.00 175.52 176.71 3ly2 n PHE 209 N -4.73 1.62 -3.83 3.16 3.72 -0.74 -4.97 117.46 111.69 3ly2 n PHE 209 Ca 0.01 -0.71 -0.29 0.00 -0.05 0.00 0.00 57.45 56.41 3ly2 n PHE 209 Cb 0.05 -0.37 0.01 0.00 -0.94 0.00 0.00 39.48 38.23 3ly2 n PHE 209 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3ly2 n ARG 210 N 0.55 -2.21 -3.94 -1.08 1.74 -0.73 -4.54 116.66 106.44 3ly2 n ARG 210 Ca 0.25 0.41 -0.35 0.00 -0.77 0.00 0.00 57.85 57.39 3ly2 n ARG 210 Cb 1.02 -4.23 -0.12 0.00 -1.02 0.00 0.00 32.46 28.11 3ly2 n ARG 210 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3ly2 s ILE 211 N -3.70 4.40 0.45 0.55 1.01 0.12 -4.74 121.20 119.29 3ly2 s ILE 211 Ca 0.25 -0.16 -0.20 0.00 0.00 0.00 0.00 60.65 60.54 3ly2 s ILE 211 Cb -0.09 -3.01 -0.10 0.00 0.01 0.00 0.00 42.46 39.26 3ly2 s ILE 211 CO 0.88 0.40 0.95 -0.94 0.00 0.00 0.00 174.94 176.23 3ly2 s SER 212 N 1.02 6.85 0.34 3.58 1.04 -1.26 -4.60 113.70 120.68 3ly2 s SER 212 Ca 0.03 1.64 0.06 0.00 0.48 0.00 0.00 55.95 58.17 3ly2 s SER 212 Cb -0.14 -2.53 0.73 0.00 0.10 0.00 0.00 66.02 64.18 3ly2 s SER 212 CO 0.03 -0.41 1.91 0.28 0.98 0.00 0.00 173.24 176.02 3ly2 h SER 213 N 1.67 0.71 0.05 7.02 0.02 -1.98 -1.17 113.55 119.87 3ly2 h SER 213 Ca -0.48 0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 60.48 3ly2 h SER 213 Cb 1.18 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.59 3ly2 h SER 213 CO 0.61 0.42 -0.02 -0.78 -1.14 0.00 0.00 176.83 175.92 3ly2 h ASP 214 N 0.79 -0.05 -0.26 3.07 3.58 -1.97 -0.12 116.42 121.45 3ly2 h ASP 214 Ca 0.39 -0.12 0.01 0.00 0.42 0.00 0.00 57.03 57.73 3ly2 h ASP 214 Cb 0.46 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.50 3ly2 h ASP 214 CO -0.16 0.09 0.16 0.74 -2.88 0.00 0.00 179.24 177.18 3ly2 h THR 215 N -0.19 1.04 0.44 2.25 2.02 -1.63 -0.94 112.91 115.89 3ly2 h THR 215 Ca -0.01 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 3ly2 h THR 215 Cb 0.17 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 3ly2 h THR 215 CO 0.01 0.06 -0.31 0.15 0.37 0.00 0.00 175.52 175.80 3ly2 h PHE 216 N 0.33 -0.81 -0.34 3.16 3.57 -1.10 -1.60 116.94 120.15 3ly2 h PHE 216 Ca 0.10 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.59 3ly2 h PHE 216 Cb -0.01 0.30 -0.02 0.00 2.79 0.00 0.00 35.95 39.01 3ly2 h PHE 216 CO -0.07 -0.46 0.19 0.82 -2.23 0.00 0.00 178.31 176.55 3ly2 h ILE 217 N -0.73 1.11 -0.31 1.41 1.08 -0.97 0.25 117.51 119.35 3ly2 h ILE 217 Ca -0.04 -0.26 -0.07 0.00 -0.39 0.00 0.00 64.86 64.09 3ly2 h ILE 217 Cb 0.61 0.65 -0.01 0.00 -3.07 0.00 0.00 36.82 35.00 3ly2 h ILE 217 CO 0.02 0.12 -0.07 0.74 -0.69 0.00 0.00 178.15 178.26 3ly2 h THR 218 N 0.46 1.28 -0.24 -0.27 2.02 -0.92 -1.64 112.91 113.60 3ly2 h THR 218 Ca 0.12 -1.11 -0.04 0.00 0.77 0.00 0.00 66.41 66.15 3ly2 h THR 218 Cb 0.01 1.37 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 3ly2 h THR 218 CO -0.02 0.36 -0.02 0.22 0.37 0.00 0.00 175.52 176.43 3ly2 h TYR 219 N 0.37 0.48 -0.44 3.16 3.20 -0.72 -2.33 116.97 120.69 3ly2 h TYR 219 Ca 0.08 -0.09 -0.02 0.00 3.14 0.00 0.00 58.73 61.84 3ly2 h TYR 219 Cb 0.56 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.69 3ly2 h TYR 219 CO 0.05 0.63 0.22 0.52 -1.64 0.00 0.00 178.16 177.93 3ly2 h MET 220 N 0.20 0.64 -0.44 1.82 2.86 -0.95 0.11 114.93 119.16 3ly2 h MET 220 Ca 0.07 -0.09 -0.06 0.00 -2.06 0.00 0.00 59.70 57.56 3ly2 h MET 220 Cb 0.44 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.97 3ly2 h MET 220 CO 0.02 0.54 0.04 0.52 1.06 0.00 0.00 176.91 179.09 3ly2 h MET 221 N 0.58 0.70 -0.28 1.72 2.86 -1.33 0.31 114.93 119.48 3ly2 h MET 221 Ca 0.15 -0.16 -0.05 0.00 -2.06 0.00 0.00 59.70 57.59 3ly2 h MET 221 Cb 0.11 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.66 3ly2 h MET 221 CO -0.02 0.69 -0.01 1.15 1.06 0.00 0.00 176.91 179.77 3ly2 h THR 222 N 0.67 1.26 0.02 2.22 2.02 -0.95 -0.94 112.91 117.20 3ly2 h THR 222 Ca 0.14 -0.96 -0.00 0.00 0.77 0.00 0.00 66.41 66.36 3ly2 h THR 222 Cb 0.35 1.32 0.00 0.00 -1.74 0.00 0.00 68.15 68.09 3ly2 h THR 222 CO 0.01 0.31 -0.01 0.25 0.37 0.00 0.00 175.52 176.45 3ly2 h LEU 223 N 0.29 -0.02 -1.04 2.58 5.85 -0.38 -2.78 115.31 119.81 3ly2 h LEU 223 Ca 0.08 -0.23 0.12 0.00 0.84 0.00 0.00 57.88 58.68 3ly2 h LEU 223 Cb 0.45 0.01 -0.08 0.00 0.37 0.00 0.00 40.66 41.40 3ly2 h LEU 223 CO 0.02 0.22 0.63 -0.08 -0.34 0.00 0.00 178.44 178.89 3ly2 h GLU 224 N -0.26 0.96 0.00 1.25 4.81 -0.36 0.33 114.58 121.30 3ly2 h GLU 224 Ca -0.00 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 3ly2 h GLU 224 Cb 0.25 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 29.42 3ly2 h GLU 224 CO 0.00 0.63 -0.01 0.22 -0.73 0.00 0.00 179.01 179.13 3ly2 h ASP 225 N 0.98 0.00 -0.23 1.04 -0.00 -0.96 -1.56 116.42 115.69 3ly2 h ASP 225 Ca 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.52 3ly2 h ASP 225 Cb 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.81 3ly2 h ASP 225 CO -0.25 0.01 0.00 1.41 -0.00 0.00 0.00 179.24 180.41 3ly2 n HIS 226 N -3.19 0.29 -3.44 0.28 8.25 0.11 -4.77 115.22 112.75 3ly2 n HIS 226 Ca -0.02 -0.15 -0.37 0.00 -0.26 0.00 0.00 57.72 56.92 3ly2 n HIS 226 Cb 0.11 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.16 3ly2 n HIS 226 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 3ly2 s TYR 227 N -1.71 3.49 -0.17 4.41 1.51 -0.59 -0.94 117.35 123.36 3ly2 s TYR 227 Ca 0.35 0.73 -0.29 0.00 -1.01 0.00 0.00 57.07 56.85 3ly2 s TYR 227 Cb 0.20 -2.43 -0.03 0.00 -0.11 0.00 0.00 41.96 39.60 3ly2 s TYR 227 CO 0.29 0.22 1.49 -1.01 -1.11 0.00 0.00 175.55 175.44 3ly2 s HIS 228 N 0.47 2.34 0.33 2.71 3.76 -1.26 -4.70 115.29 118.94 3ly2 s HIS 228 Ca 0.21 0.62 0.15 0.00 -0.15 0.00 0.00 55.06 55.88 3ly2 s HIS 228 Cb -0.14 -3.82 0.73 0.00 1.11 0.00 0.00 32.58 30.45 3ly2 s HIS 228 CO 0.07 -2.70 1.80 0.66 -0.85 0.00 0.00 174.74 173.73 3ly2 h SER 229 N 9.55 0.00 -0.08 1.40 4.64 -1.93 -2.88 113.55 124.26 3ly2 h SER 229 Ca -0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 3ly2 h SER 229 Cb 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 3ly2 h SER 229 CO 0.98 0.39 0.00 -0.90 -0.87 0.00 0.00 176.83 176.43 3ly2 n ASP 230 N -3.92 0.69 -4.65 4.97 3.85 -1.26 -4.72 116.55 111.50 3ly2 n ASP 230 Ca -0.02 -1.59 -0.38 0.00 -0.71 0.00 0.00 54.79 52.09 3ly2 n ASP 230 Cb 0.44 -0.05 -0.08 0.00 -1.35 0.00 0.00 41.12 40.08 3ly2 n ASP 230 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 3ly2 s VAL 231 N -1.90 5.20 0.20 2.12 1.01 -1.09 -5.00 120.40 120.94 3ly2 s VAL 231 Ca 0.27 0.64 -0.11 0.00 0.00 0.00 0.00 61.98 62.79 3ly2 s VAL 231 Cb 0.13 -3.71 0.14 0.00 0.00 0.00 0.00 36.38 32.94 3ly2 s VAL 231 CO 0.21 0.23 1.73 0.00 0.00 0.00 0.00 175.10 177.27 3ly2 h ALA 232 N 7.59 0.69 0.00 5.51 0.00 -1.85 -3.38 119.26 127.82 3ly2 h ALA 232 Ca -0.35 0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.53 3ly2 h ALA 232 Cb 1.16 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 3ly2 h ALA 232 CO 0.70 -0.26 -1.26 0.98 0.00 0.00 0.00 179.25 179.41 3ly2 n TYR 233 N -5.06 0.00 -0.79 0.00 9.36 -1.25 -4.76 117.16 114.66 3ly2 n TYR 233 Ca 0.08 0.00 -0.15 0.00 3.32 0.00 0.00 57.90 61.14 3ly2 n TYR 233 Cb 0.27 -0.49 -0.09 0.00 -0.63 0.00 0.00 39.34 38.41 3ly2 n TYR 233 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 3ly2 n HIS 234 N -4.06 0.61 -3.66 2.98 8.25 -1.26 -4.28 115.22 113.80 3ly2 n HIS 234 Ca -0.21 -1.52 -0.15 0.00 -0.26 0.00 0.00 57.72 55.58 3ly2 n HIS 234 Cb 0.53 -1.50 0.00 0.00 1.12 0.00 0.00 29.99 30.14 3ly2 n HIS 234 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 3ly2 n ASN 235 N 3.12 1.96 0.34 0.41 0.23 -1.26 -4.47 115.26 115.59 3ly2 n ASN 235 Ca 0.40 -2.10 0.22 0.00 -0.53 0.00 0.00 54.58 52.56 3ly2 n ASN 235 Cb 0.48 -0.05 1.17 0.00 -2.08 0.00 0.00 39.78 39.30 3ly2 n ASN 235 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 3ly2 h SER 236 N 0.36 0.00 -0.38 0.53 4.64 -1.84 -2.05 113.55 114.81 3ly2 h SER 236 Ca -0.20 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.02 3ly2 h SER 236 Cb 0.75 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.83 3ly2 h SER 236 CO 0.31 0.00 -0.13 0.25 -0.87 0.00 0.00 176.83 176.40 3ly2 h LEU 237 N 0.00 0.77 -0.51 5.97 5.85 -1.94 -1.28 115.31 124.16 3ly2 h LEU 237 Ca 0.00 -0.38 -0.01 0.00 0.84 0.00 0.00 57.88 58.33 3ly2 h LEU 237 Cb 0.10 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.89 3ly2 h LEU 237 CO 0.00 0.97 0.30 -0.74 -0.34 0.00 0.00 178.44 178.63 3ly2 h HIS 238 N 0.56 0.69 -0.59 1.25 2.76 -1.55 -1.33 115.15 116.94 3ly2 h HIS 238 Ca 0.09 -0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.24 3ly2 h HIS 238 Cb 0.66 -0.22 -0.03 0.00 1.55 0.00 0.00 27.41 29.36 3ly2 h HIS 238 CO 0.05 0.49 0.31 0.00 -1.30 0.00 0.00 177.93 177.48 3ly2 h ALA 239 N 1.14 0.76 -0.85 5.26 0.00 -1.50 -1.34 119.26 122.73 3ly2 h ALA 239 Ca 0.18 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3ly2 h ALA 239 Cb 0.01 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.53 3ly2 h ALA 239 CO -0.03 0.30 0.54 0.00 0.00 0.00 0.00 179.25 180.06 3ly2 h ALA 240 N 1.13 1.36 -0.32 0.00 0.00 -0.90 0.75 119.26 121.29 3ly2 h ALA 240 Ca 0.21 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 3ly2 h ALA 240 Cb 0.08 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3ly2 h ALA 240 CO -0.03 0.58 -0.05 0.22 0.00 0.00 0.00 179.25 179.97 3ly2 h ASP 241 N 1.16 0.59 -0.42 0.00 3.58 -0.83 -0.90 116.42 119.61 3ly2 h ASP 241 Ca 0.31 -0.34 -0.06 0.00 0.42 0.00 0.00 57.03 57.36 3ly2 h ASP 241 Cb -0.10 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 40.77 3ly2 h ASP 241 CO -0.06 0.80 0.04 0.58 -2.88 0.00 0.00 179.24 177.71 3ly2 h VAL 242 N 0.38 1.25 0.25 2.25 2.07 -0.77 0.31 116.25 121.99 3ly2 h VAL 242 Ca 0.08 -0.94 -0.01 0.00 0.82 0.00 0.00 66.70 66.66 3ly2 h VAL 242 Cb 0.52 1.04 -0.00 0.00 -1.52 0.00 0.00 31.29 31.33 3ly2 h VAL 242 CO 0.03 0.32 -0.16 0.00 0.02 0.00 0.00 177.57 177.78 3ly2 h ALA 243 N 0.92 -0.38 -0.75 1.67 0.00 -0.81 0.27 119.26 120.17 3ly2 h ALA 243 Ca 0.12 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.98 3ly2 h ALA 243 Cb 0.42 0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 3ly2 h ALA 243 CO 0.01 -0.73 0.49 0.37 0.00 0.00 0.00 179.25 179.40 3ly2 h GLN 244 N -0.40 0.95 -0.36 0.00 -0.00 -1.08 0.12 115.11 114.34 3ly2 h GLN 244 Ca -0.02 -0.06 -0.06 0.00 -0.00 0.00 0.00 58.65 58.51 3ly2 h GLN 244 Cb 0.33 -0.21 -0.01 0.00 0.00 0.00 0.00 27.48 27.59 3ly2 h GLN 244 CO 0.02 0.63 -0.02 0.77 0.00 0.00 0.00 178.83 180.23 3ly2 h SER 245 N 0.98 0.64 -0.70 -0.69 0.02 -0.69 -1.49 113.55 111.62 3ly2 h SER 245 Ca 0.29 -0.32 0.03 0.00 -0.84 0.00 0.00 61.79 60.95 3ly2 h SER 245 Cb -0.05 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.27 3ly2 h SER 245 CO -0.09 0.81 0.44 0.74 -1.14 0.00 0.00 176.83 177.60 3ly2 h THR 246 N 0.46 1.10 -0.82 -2.27 2.02 -0.04 -0.12 112.91 113.24 3ly2 h THR 246 Ca 0.10 -0.30 0.08 0.00 0.77 0.00 0.00 66.41 67.07 3ly2 h THR 246 Cb 0.49 0.16 -0.07 0.00 -1.74 0.00 0.00 68.15 66.99 3ly2 h THR 246 CO 0.02 0.16 0.48 -0.74 0.37 0.00 0.00 175.52 175.81 3ly2 h HIS 247 N 0.87 0.88 -0.28 3.16 -0.00 -0.39 -0.59 115.15 118.79 3ly2 h HIS 247 Ca 0.28 0.03 -0.13 0.00 -0.00 0.00 0.00 60.37 60.55 3ly2 h HIS 247 Cb 0.01 -0.27 -0.00 0.00 -0.00 0.00 0.00 27.41 27.15 3ly2 h HIS 247 CO -0.04 0.38 -0.33 0.28 -0.00 0.00 0.00 177.93 178.22 3ly2 h VAL 248 N 0.83 1.30 -0.74 5.26 2.07 -0.17 -3.22 116.25 121.58 3ly2 h VAL 248 Ca 0.39 -1.51 -0.02 0.00 0.82 0.00 0.00 66.70 66.38 3ly2 h VAL 248 Cb 0.30 1.61 -0.03 0.00 -1.52 0.00 0.00 31.29 31.65 3ly2 h VAL 248 CO -0.22 0.48 0.40 -0.07 0.02 0.00 0.00 177.57 178.18 3ly2 h LEU 249 N 0.47 0.93 -2.15 2.57 3.38 -0.57 -2.49 115.31 117.45 3ly2 h LEU 249 Ca 0.04 -0.10 0.06 0.00 0.09 0.00 0.00 57.88 57.97 3ly2 h LEU 249 Cb 0.91 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 3ly2 h LEU 249 CO 0.08 0.76 0.30 -0.07 0.09 0.00 0.00 178.44 179.60 3ly2 h LEU 250 N 1.02 0.00 -2.22 1.67 3.38 -1.13 -0.69 115.31 117.34 3ly2 h LEU 250 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 3ly2 h LEU 250 Cb 0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.80 3ly2 h LEU 250 CO -0.04 0.00 0.00 -1.20 0.09 0.00 0.00 178.44 177.29 3ly2 n SER 251 N -3.55 3.30 -4.70 -0.43 7.64 -0.94 -4.79 113.62 110.15 3ly2 n SER 251 Ca 0.02 -1.97 -0.43 0.00 1.01 0.00 0.00 58.87 57.50 3ly2 n SER 251 Cb 0.42 -0.27 -0.03 0.00 -1.01 0.00 0.00 64.21 63.32 3ly2 n SER 251 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 3ly2 n THR 252 N 1.37 0.36 -0.32 0.44 5.66 -0.27 -4.86 114.28 116.66 3ly2 n THR 252 Ca 0.20 -0.09 0.20 0.00 -3.05 0.00 0.00 64.05 61.30 3ly2 n THR 252 Cb 0.57 -1.79 0.39 0.00 -1.55 0.00 0.00 70.33 67.96 3ly2 n THR 252 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 175.07 171.37 3ly2 h PRO 253 N 5.74 0.11 0.00 1.09 0.11 -1.93 -0.20 132.00 136.91 3ly2 h PRO 253 Ca -0.45 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 3ly2 h PRO 253 Cb 1.23 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 3ly2 h PRO 253 CO 0.87 0.07 -0.03 0.00 -0.21 0.00 0.00 178.00 178.70 3ly2 h ALA 254 N 1.91 1.60 -0.53 -0.75 0.00 -1.86 -2.53 119.26 117.09 3ly2 h ALA 254 Ca 0.67 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.55 3ly2 h ALA 254 Cb 1.52 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.30 3ly2 h ALA 254 CO -0.76 0.04 0.00 1.28 0.00 0.00 0.00 179.25 179.81 3ly2 n LEU 255 N -3.99 3.69 -4.65 0.00 4.77 -0.09 -0.20 117.00 116.52 3ly2 n LEU 255 Ca -0.03 -1.69 -0.46 0.00 -0.03 0.00 0.00 56.01 53.80 3ly2 n LEU 255 Cb 0.12 -0.35 -0.03 0.00 -2.33 0.00 0.00 43.42 40.83 3ly2 n LEU 255 CO 0.30 0.85 1.01 -0.67 -1.33 0.00 0.00 177.39 177.54 3ly2 n ASP 256 N 1.58 2.55 -0.48 -1.43 -0.08 -0.96 -1.88 116.55 115.85 3ly2 n ASP 256 Ca 0.22 1.13 -0.06 0.00 -1.51 0.00 0.00 54.79 54.56 3ly2 n ASP 256 Cb 0.62 -1.38 -0.03 0.00 2.34 0.00 0.00 41.12 42.67 3ly2 n ASP 256 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3ly2 n ALA 257 N 2.24 -0.10 -0.03 -1.67 0.00 -1.26 -4.88 120.51 114.82 3ly2 n ALA 257 Ca 0.14 0.10 -0.18 0.00 0.00 0.00 0.00 53.44 53.50 3ly2 n ALA 257 Cb 0.29 -1.35 -0.13 0.00 0.00 0.00 0.00 19.45 18.25 3ly2 n ALA 257 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3ly2 h VAL 258 N 0.00 1.40 -3.11 0.00 2.07 -1.72 -3.47 116.25 111.42 3ly2 h VAL 258 Ca -0.13 -2.37 -0.59 0.00 0.82 0.00 0.00 66.70 64.43 3ly2 h VAL 258 Cb 0.87 2.99 -0.04 0.00 -1.52 0.00 0.00 31.29 33.58 3ly2 h VAL 258 CO 0.19 0.60 -0.26 -0.36 0.02 0.00 0.00 177.57 177.76 3ly2 s PHE 259 N -2.35 3.56 0.73 1.57 0.08 -1.26 -4.99 117.98 115.32 3ly2 s PHE 259 Ca -0.20 0.74 -0.11 0.00 0.12 0.00 0.00 56.93 57.48 3ly2 s PHE 259 Cb 0.01 -2.13 0.03 0.00 -0.57 0.00 0.00 43.02 40.37 3ly2 s PHE 259 CO 0.72 0.51 1.09 0.95 -0.10 0.00 0.00 175.22 178.39 3ly2 s THR 260 N -1.44 3.46 0.44 0.64 -4.23 -1.26 -4.86 115.64 108.39 3ly2 s THR 260 Ca 0.34 0.48 0.11 0.00 -1.18 0.00 0.00 61.69 61.44 3ly2 s THR 260 Cb -0.14 -3.36 0.23 0.00 1.34 0.00 0.00 72.50 70.57 3ly2 s THR 260 CO 0.19 -0.62 2.04 0.44 -0.54 0.00 0.00 174.62 176.12 3ly2 h ASP 261 N -0.79 0.21 -0.55 3.99 3.32 -1.99 -1.46 116.42 119.16 3ly2 h ASP 261 Ca -0.45 -0.02 -0.07 0.00 0.02 0.00 0.00 57.03 56.50 3ly2 h ASP 261 Cb 1.25 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.73 3ly2 h ASP 261 CO 0.62 0.24 0.06 0.25 -1.72 0.00 0.00 179.24 178.69 3ly2 h LEU 262 N 0.24 0.90 -0.50 1.55 5.85 -1.98 0.19 115.31 121.55 3ly2 h LEU 262 Ca 0.06 -0.28 -0.12 0.00 0.84 0.00 0.00 57.88 58.38 3ly2 h LEU 262 Cb 0.13 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 3ly2 h LEU 262 CO -0.00 0.95 -0.16 -0.33 -0.34 0.00 0.00 178.44 178.56 3ly2 h GLU 263 N 0.82 0.98 -0.44 1.25 5.08 -1.74 -0.74 114.58 119.78 3ly2 h GLU 263 Ca 0.16 -0.39 -0.00 0.00 -1.00 0.00 0.00 59.36 58.13 3ly2 h GLU 263 Cb 0.45 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 3ly2 h GLU 263 CO 0.02 1.07 0.27 0.82 -1.00 0.00 0.00 179.01 180.18 3ly2 h ILE 264 N 0.84 1.14 -0.63 3.13 2.04 -1.05 -0.61 117.51 122.37 3ly2 h ILE 264 Ca 0.12 -0.31 0.04 0.00 1.00 0.00 0.00 64.86 65.71 3ly2 h ILE 264 Cb 0.73 0.55 -0.04 0.00 -0.74 0.00 0.00 36.82 37.31 3ly2 h ILE 264 CO 0.06 0.14 0.38 0.25 0.00 0.00 0.00 178.15 178.97 3ly2 h LEU 265 N 0.58 0.60 -0.66 1.44 5.85 -0.26 -2.43 115.31 120.42 3ly2 h LEU 265 Ca 0.16 0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.76 3ly2 h LEU 265 Cb -0.01 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 3ly2 h LEU 265 CO -0.03 0.41 -0.38 0.00 -0.34 0.00 0.00 178.44 178.10 3ly2 h ALA 266 N 1.29 0.84 -0.05 1.25 0.00 -0.78 -1.92 119.26 119.89 3ly2 h ALA 266 Ca 0.26 -0.43 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 3ly2 h ALA 266 Cb 0.07 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 3ly2 h ALA 266 CO -0.13 0.64 0.02 0.00 0.00 0.00 0.00 179.25 179.78 3ly2 h ALA 267 N 1.07 0.06 -0.62 0.00 0.00 -0.73 -0.10 119.26 118.95 3ly2 h ALA 267 Ca 0.05 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 3ly2 h ALA 267 Cb 0.89 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 3ly2 h ALA 267 CO 0.08 -0.33 0.03 0.82 0.00 0.00 0.00 179.25 179.85 3ly2 h ILE 268 N -0.11 1.27 -0.44 0.00 2.04 -1.47 -1.52 117.51 117.27 3ly2 h ILE 268 Ca 0.02 -1.12 -0.03 0.00 1.00 0.00 0.00 64.86 64.73 3ly2 h ILE 268 Cb 0.21 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 3ly2 h ILE 268 CO -0.00 0.41 0.17 0.15 0.00 0.00 0.00 178.15 178.88 3ly2 h PHE 269 N 0.98 0.69 -0.48 1.37 3.57 -1.28 -1.30 116.94 120.49 3ly2 h PHE 269 Ca 0.18 -0.06 0.03 0.00 3.53 0.00 0.00 57.97 61.65 3ly2 h PHE 269 Cb 0.52 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 39.03 3ly2 h PHE 269 CO 0.04 0.60 0.27 0.00 -2.23 0.00 0.00 178.31 176.99 3ly2 h ALA 270 N 1.02 0.61 -0.66 2.41 0.00 -0.81 -1.80 119.26 120.02 3ly2 h ALA 270 Ca 0.15 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.08 3ly2 h ALA 270 Cb 0.21 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 3ly2 h ALA 270 CO -0.01 -0.05 0.42 0.00 0.00 0.00 0.00 179.25 179.61 3ly2 h ALA 271 N 1.23 0.86 -0.24 0.00 0.00 -0.96 0.20 119.26 120.35 3ly2 h ALA 271 Ca 0.20 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 3ly2 h ALA 271 Cb 0.05 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3ly2 h ALA 271 CO -0.11 0.19 -0.11 0.00 0.00 0.00 0.00 179.25 179.22 3ly2 h ALA 272 N 1.28 1.36 -0.01 0.00 0.00 -0.65 -3.13 119.26 118.11 3ly2 h ALA 272 Ca 0.26 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3ly2 h ALA 272 Cb -0.01 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3ly2 h ALA 272 CO -0.09 0.43 -0.59 0.44 0.00 0.00 0.00 179.25 179.44 3ly2 n ILE 273 N -4.24 0.00 0.08 0.00 -5.35 -0.73 -4.69 119.36 104.43 3ly2 n ILE 273 Ca 0.00 -0.20 0.20 0.00 -0.27 0.00 0.00 62.75 62.48 3ly2 n ILE 273 Cb 0.29 1.13 0.62 0.00 -1.74 0.00 0.00 39.64 39.95 3ly2 n ILE 273 CO 0.00 0.00 0.00 1.12 -1.76 0.00 0.00 176.55 175.91 3ly2 h HIS 274 N 1.27 0.00 0.00 4.28 2.07 -0.54 -1.70 115.15 120.54 3ly2 h HIS 274 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 3ly2 h HIS 274 Cb 0.57 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.55 3ly2 h HIS 274 CO 0.00 0.00 -0.25 -0.25 -3.07 0.00 0.00 177.93 174.36 3ly2 n ASP 275 N -3.34 1.06 -4.73 3.10 8.00 -1.26 -4.87 116.55 114.51 3ly2 n ASP 275 Ca 0.09 -2.43 -0.42 0.00 0.71 0.00 0.00 54.79 52.74 3ly2 n ASP 275 Cb 0.84 -0.29 -0.01 0.00 -0.02 0.00 0.00 41.12 41.64 3ly2 n ASP 275 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 3ly2 n VAL 276 N -0.63 1.38 -2.76 2.53 3.14 -0.64 -2.31 118.33 119.05 3ly2 n VAL 276 Ca 0.07 -0.35 -0.19 0.00 -2.96 0.00 0.00 64.34 60.92 3ly2 n VAL 276 Cb 0.65 -1.82 0.02 0.00 -1.06 0.00 0.00 33.84 31.64 3ly2 n VAL 276 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 3ly2 n ASP 277 N 1.56 -5.39 -4.73 6.55 2.03 -0.11 -4.41 116.55 112.04 3ly2 n ASP 277 Ca 0.07 -0.19 -0.41 0.00 0.52 0.00 0.00 54.79 54.78 3ly2 n ASP 277 Cb 0.36 -4.29 -0.03 0.00 -0.72 0.00 0.00 41.12 36.44 3ly2 n ASP 277 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 3ly2 s HIS 278 N -3.03 3.40 -1.61 -0.67 5.65 -0.98 -4.94 115.29 113.10 3ly2 s HIS 278 Ca 0.19 1.33 0.28 0.00 0.25 0.00 0.00 55.06 57.11 3ly2 s HIS 278 Cb -0.08 -3.47 1.04 0.00 -1.18 0.00 0.00 32.58 28.89 3ly2 s HIS 278 CO 0.24 -1.40 1.75 -0.35 -0.65 0.00 0.00 174.74 174.32 3ly2 n PRO 279 N 2.98 0.66 -0.32 2.88 -0.04 -1.26 -4.51 135.00 135.38 3ly2 n PRO 279 Ca 0.06 -0.29 0.00 0.00 -0.04 0.00 0.00 63.50 63.24 3ly2 n PRO 279 Cb 0.45 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 3ly2 n PRO 279 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3ly2 n GLY 280 N 1.32 0.82 3.30 0.55 0.00 -1.26 -4.99 105.19 104.93 3ly2 n GLY 280 Ca 0.13 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.99 3ly2 n GLY 280 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3ly2 s VAL 281 N -2.08 1.24 0.77 1.61 -7.23 -1.26 -4.51 120.40 108.94 3ly2 s VAL 281 Ca 0.00 -2.08 -0.09 0.00 -1.81 0.00 0.00 61.98 58.00 3ly2 s VAL 281 Cb 0.00 -2.05 0.08 0.00 0.56 0.00 0.00 36.38 34.97 3ly2 s VAL 281 CO 0.00 -0.58 1.10 -0.94 -0.31 0.00 0.00 175.10 174.37 3ly2 s SER 282 N -3.24 4.54 0.24 4.85 1.04 -1.26 -4.93 113.70 114.94 3ly2 s SER 282 Ca 0.22 0.54 -0.07 0.00 0.48 0.00 0.00 55.95 57.12 3ly2 s SER 282 Cb 0.03 -1.07 0.23 0.00 0.10 0.00 0.00 66.02 65.31 3ly2 s SER 282 CO 0.04 -1.82 1.91 0.78 0.98 0.00 0.00 173.24 175.14 3ly2 h ASN 283 N -0.86 1.06 -0.41 7.02 2.35 -2.01 -1.90 115.58 120.82 3ly2 h ASN 283 Ca -0.45 -0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 55.27 3ly2 h ASN 283 Cb 1.31 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 39.40 3ly2 h ASN 283 CO 0.60 0.76 0.23 -0.61 -1.65 0.00 0.00 177.43 176.76 3ly2 h GLN 284 N 1.25 0.60 -0.24 0.81 5.75 -1.98 0.21 115.11 121.52 3ly2 h GLN 284 Ca 0.34 -0.06 -0.03 0.00 -0.15 0.00 0.00 58.65 58.75 3ly2 h GLN 284 Cb -0.13 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.29 3ly2 h GLN 284 CO -0.08 0.45 0.03 0.35 -2.65 0.00 0.00 178.83 176.94 3ly2 h PHE 285 N 0.61 0.42 -0.64 3.99 3.04 -1.73 0.14 116.94 122.78 3ly2 h PHE 285 Ca 0.16 -0.06 -0.04 0.00 3.98 0.00 0.00 57.97 62.01 3ly2 h PHE 285 Cb 0.03 -0.12 -0.03 0.00 2.56 0.00 0.00 35.95 38.40 3ly2 h PHE 285 CO 0.00 0.53 0.25 -0.07 -2.02 0.00 0.00 178.31 177.01 3ly2 h LEU 286 N 0.19 0.86 -0.26 0.59 3.38 -0.73 -1.59 115.31 117.75 3ly2 h LEU 286 Ca 0.07 -0.12 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 3ly2 h LEU 286 Cb 0.34 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3ly2 h LEU 286 CO 0.01 0.77 -0.08 0.40 0.09 0.00 0.00 178.44 179.62 3ly2 h ILE 287 N 0.92 1.29 -0.19 1.22 2.04 -0.36 -1.18 117.51 121.25 3ly2 h ILE 287 Ca 0.22 -1.11 -0.07 0.00 1.00 0.00 0.00 64.86 64.90 3ly2 h ILE 287 Cb 0.18 1.47 -0.01 0.00 -0.74 0.00 0.00 36.82 37.72 3ly2 h ILE 287 CO -0.02 0.35 -0.19 0.78 0.00 0.00 0.00 178.15 179.07 3ly2 h ASN 288 N 0.26 0.31 -0.20 1.72 2.35 -0.67 -2.74 115.58 116.61 3ly2 h ASN 288 Ca 0.06 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 3ly2 h ASN 288 Cb 0.56 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.84 3ly2 h ASN 288 CO 0.03 0.52 0.00 0.35 -1.65 0.00 0.00 177.43 176.68 3ly2 n THR 289 N -4.20 0.26 -3.64 2.81 -2.24 -0.62 -4.92 114.28 101.74 3ly2 n THR 289 Ca -0.00 -0.34 -0.22 0.00 -2.27 0.00 0.00 64.05 61.21 3ly2 n THR 289 Cb 0.33 0.26 0.06 0.00 -2.10 0.00 0.00 70.33 68.89 3ly2 n THR 289 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3ly2 n ASN 290 N 0.26 -3.41 -4.73 3.42 3.02 -1.03 -4.92 115.26 107.87 3ly2 n ASN 290 Ca 0.14 -0.68 -0.40 0.00 -0.03 0.00 0.00 54.58 53.60 3ly2 n ASN 290 Cb 0.29 -4.59 0.01 0.00 -0.61 0.00 0.00 39.78 34.89 3ly2 n ASN 290 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 3ly2 n SER 291 N -3.03 2.91 -0.29 6.41 2.88 -0.45 -4.85 113.62 117.19 3ly2 n SER 291 Ca -0.16 1.11 0.05 0.00 -1.33 0.00 0.00 58.87 58.55 3ly2 n SER 291 Cb 0.62 -1.55 0.20 0.00 -0.75 0.00 0.00 64.21 62.73 3ly2 n SER 291 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 3ly2 h GLU 292 N 2.18 0.66 -0.55 -1.46 4.81 -1.91 -0.95 114.58 117.35 3ly2 h GLU 292 Ca -0.49 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 58.70 3ly2 h GLU 292 Cb 1.28 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 30.49 3ly2 h GLU 292 CO 0.60 0.43 0.34 -0.07 -0.73 0.00 0.00 179.01 179.59 3ly2 h LEU 293 N 0.68 0.65 -1.30 1.64 3.38 -1.94 -0.94 115.31 117.47 3ly2 h LEU 293 Ca 0.44 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.34 3ly2 h LEU 293 Cb 0.55 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 3ly2 h LEU 293 CO -0.32 0.50 0.22 0.00 0.09 0.00 0.00 178.44 178.93 3ly2 h ALA 294 N 1.18 1.46 -0.03 1.53 0.00 -1.49 -0.97 119.26 120.93 3ly2 h ALA 294 Ca 0.20 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3ly2 h ALA 294 Cb -0.04 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 3ly2 h ALA 294 CO -0.04 0.42 -0.03 1.25 0.00 0.00 0.00 179.25 180.85 3ly2 h LEU 295 N 0.70 0.09 -0.69 0.00 6.46 -0.90 0.88 115.31 121.84 3ly2 h LEU 295 Ca 0.17 -0.48 0.14 0.00 -0.12 0.00 0.00 57.88 57.60 3ly2 h LEU 295 Cb 0.10 -0.02 -0.10 0.00 -0.73 0.00 0.00 40.66 39.91 3ly2 h LEU 295 CO -0.02 0.54 0.16 -0.03 -0.62 0.00 0.00 178.44 178.47 3ly2 h MET 296 N -0.37 0.26 -0.65 1.25 4.05 -0.79 -2.08 114.93 116.59 3ly2 h MET 296 Ca 0.01 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.41 3ly2 h MET 296 Cb 0.52 -0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.26 3ly2 h MET 296 CO 0.01 0.17 0.00 0.66 0.23 0.00 0.00 176.91 177.98 3ly2 n TYR 297 N -5.15 1.48 -3.90 1.39 4.01 -0.40 -4.96 117.16 109.63 3ly2 n TYR 297 Ca 0.12 -0.61 -0.28 0.00 -0.16 0.00 0.00 57.90 56.97 3ly2 n TYR 297 Cb 0.40 -0.24 0.01 0.00 -0.31 0.00 0.00 39.34 39.21 3ly2 n TYR 297 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3ly2 n ASN 298 N 1.13 -2.92 -0.37 7.72 3.02 -0.61 -1.75 115.26 121.48 3ly2 n ASN 298 Ca 0.26 -0.85 -0.04 0.00 -0.03 0.00 0.00 54.58 53.91 3ly2 n ASN 298 Cb 0.89 -3.67 -0.02 0.00 -0.61 0.00 0.00 39.78 36.37 3ly2 n ASN 298 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3ly2 n ASP 299 N -2.90 -4.97 -4.42 6.41 8.00 0.21 -4.94 116.55 113.94 3ly2 n ASP 299 Ca -0.10 0.11 -0.40 0.00 0.71 0.00 0.00 54.79 55.11 3ly2 n ASP 299 Cb 0.59 -3.32 -0.11 0.00 -0.02 0.00 0.00 41.12 38.26 3ly2 n ASP 299 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3ly2 s GLU 300 N -2.13 3.12 -1.42 -1.24 2.56 -0.71 -4.58 118.70 114.30 3ly2 s GLU 300 Ca 0.00 -0.87 -0.01 0.00 0.00 0.00 0.00 54.97 54.08 3ly2 s GLU 300 Cb 0.00 -3.66 0.00 0.00 2.00 0.00 0.00 34.13 32.47 3ly2 s GLU 300 CO 0.00 -0.55 0.37 0.43 -0.56 0.00 0.00 175.26 174.95 3ly2 n SER 301 N 5.00 -0.30 -0.03 -1.70 7.64 -1.26 -4.85 113.62 118.12 3ly2 n SER 301 Ca -0.13 -1.05 -0.14 0.00 1.01 0.00 0.00 58.87 58.56 3ly2 n SER 301 Cb 0.48 -2.83 -0.09 0.00 -1.01 0.00 0.00 64.21 60.76 3ly2 n SER 301 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3ly2 h VAL 302 N -1.84 0.03 0.14 0.44 2.07 -1.90 -1.72 116.25 113.47 3ly2 h VAL 302 Ca -0.64 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 66.88 3ly2 h VAL 302 Cb 1.38 0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 31.17 3ly2 h VAL 302 CO 0.63 0.00 -0.10 -0.07 0.02 0.00 0.00 177.57 178.05 3ly2 h LEU 303 N -0.53 -0.24 -0.73 2.57 3.38 -1.95 -2.39 115.31 115.42 3ly2 h LEU 303 Ca 0.05 0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.12 3ly2 h LEU 303 Cb 0.66 0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.42 3ly2 h LEU 303 CO -0.46 -0.15 0.40 -0.33 0.09 0.00 0.00 178.44 177.98 3ly2 h GLU 304 N -0.24 0.68 -0.74 1.13 3.07 -1.87 0.33 114.58 116.94 3ly2 h GLU 304 Ca -0.01 -0.04 -0.04 0.00 -0.50 0.00 0.00 59.36 58.77 3ly2 h GLU 304 Cb 0.21 -0.15 -0.03 0.00 -0.84 0.00 0.00 28.75 27.93 3ly2 h GLU 304 CO 0.00 0.45 0.30 -0.91 -1.40 0.00 0.00 179.01 177.45 3ly2 h ASN 305 N 0.70 1.02 -0.45 1.42 2.35 -1.24 -1.86 115.58 117.52 3ly2 h ASN 305 Ca 0.34 -0.17 -0.06 0.00 -0.55 0.00 0.00 56.30 55.87 3ly2 h ASN 305 Cb 0.28 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.37 3ly2 h ASN 305 CO -0.22 0.91 0.06 -0.74 -1.65 0.00 0.00 177.43 175.79 3ly2 h HIS 306 N 1.07 0.80 -0.81 1.19 2.76 -0.62 -0.64 115.15 118.89 3ly2 h HIS 306 Ca 0.25 -0.12 0.06 0.00 -2.20 0.00 0.00 60.37 58.37 3ly2 h HIS 306 Cb 0.21 -0.22 -0.06 0.00 1.55 0.00 0.00 27.41 28.89 3ly2 h HIS 306 CO 0.02 0.76 0.49 0.45 -1.30 0.00 0.00 177.93 178.35 3ly2 h HIS 307 N 0.60 0.90 -0.32 5.26 3.86 -0.11 -0.80 115.15 124.54 3ly2 h HIS 307 Ca 0.13 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.35 3ly2 h HIS 307 Cb 0.40 -0.29 -0.01 0.00 1.06 0.00 0.00 27.41 28.57 3ly2 h HIS 307 CO 0.03 0.44 0.11 -0.07 0.86 0.00 0.00 177.93 179.30 3ly2 h LEU 308 N 0.89 0.46 -0.51 2.43 3.38 -0.92 0.52 115.31 121.56 3ly2 h LEU 308 Ca 0.36 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 58.14 3ly2 h LEU 308 Cb 0.20 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 3ly2 h LEU 308 CO -0.18 0.54 0.33 0.00 0.09 0.00 0.00 178.44 179.21 3ly2 h ALA 309 N 0.95 0.64 0.01 1.53 0.00 -0.50 -2.37 119.26 119.52 3ly2 h ALA 309 Ca 0.10 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 3ly2 h ALA 309 Cb 0.23 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3ly2 h ALA 309 CO -0.00 0.09 -0.01 0.28 0.00 0.00 0.00 179.25 179.61 3ly2 h VAL 310 N 0.68 1.30 -0.84 0.00 2.07 -1.07 -0.58 116.25 117.81 3ly2 h VAL 310 Ca 0.18 -0.97 0.20 0.00 0.82 0.00 0.00 66.70 66.93 3ly2 h VAL 310 Cb -0.07 1.96 -0.12 0.00 -1.52 0.00 0.00 31.29 31.54 3ly2 h VAL 310 CO -0.04 0.25 0.32 1.23 0.02 0.00 0.00 177.57 179.35 3ly2 h GLY 311 N -0.44 1.35 1.44 2.17 0.00 -0.79 -1.52 103.07 105.29 3ly2 h GLY 311 Ca -0.00 -0.13 -0.29 0.00 0.00 0.00 0.00 47.33 46.91 3ly2 h GLY 311 CO 0.00 -0.23 -1.38 0.74 0.00 0.00 0.00 176.54 175.67 3ly2 h PHE 312 N 0.37 0.51 -0.66 5.60 0.04 -1.43 -3.34 116.94 118.03 3ly2 h PHE 312 Ca 0.51 -0.37 0.00 0.00 2.80 0.00 0.00 57.97 60.90 3ly2 h PHE 312 Cb 0.92 -0.02 -0.03 0.00 2.20 0.00 0.00 35.95 39.01 3ly2 h PHE 312 CO -0.18 1.34 0.41 -0.22 -0.60 0.00 0.00 178.31 179.07 3ly2 h LYS 313 N 0.08 0.89 0.00 1.51 1.63 -0.35 -1.56 116.57 118.76 3ly2 h LYS 313 Ca -0.19 -0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.54 3ly2 h LYS 313 Cb 2.01 -0.19 0.00 0.00 -0.60 0.00 0.00 32.23 33.44 3ly2 h LYS 313 CO 0.19 0.61 0.00 -0.07 -3.45 0.00 0.00 179.45 176.73 3ly2 h LEU 314 N 0.91 0.00 -1.79 5.20 3.38 -1.42 -1.78 115.31 119.82 3ly2 h LEU 314 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 3ly2 h LEU 314 Cb -0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.69 3ly2 h LEU 314 CO -0.05 0.00 0.00 -0.07 0.09 0.00 0.00 178.44 178.41 3ly2 h LEU 315 N 0.00 0.00 -0.78 1.67 3.38 -1.44 -2.56 115.31 115.58 3ly2 h LEU 315 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3ly2 h LEU 315 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 3ly2 h LEU 315 CO 0.00 0.00 -0.17 0.00 0.09 0.00 0.00 178.44 178.36 3ly2 n GLN 316 N -2.86 1.25 -1.61 1.13 6.02 -0.67 -2.80 117.38 117.84 3ly2 n GLN 316 Ca -0.00 -0.78 -0.29 0.00 -0.01 0.00 0.00 57.00 55.91 3ly2 n GLN 316 Cb 0.20 -1.48 0.11 0.00 1.02 0.00 0.00 30.24 30.08 3ly2 n GLN 316 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 3ly2 s GLU 317 N -2.29 1.69 -0.18 -1.09 2.02 -0.97 -4.91 118.70 112.97 3ly2 s GLU 317 Ca 0.29 0.40 -0.38 0.00 0.02 0.00 0.00 54.97 55.31 3ly2 s GLU 317 Cb 0.20 -1.89 -0.14 0.00 0.10 0.00 0.00 34.13 32.39 3ly2 s GLU 317 CO 0.44 -1.84 1.75 -1.91 0.02 0.00 0.00 175.26 173.72 3ly2 n GLU 318 N -3.54 1.49 -2.63 1.61 4.07 -1.26 -1.83 120.64 118.56 3ly2 n GLU 318 Ca 0.07 0.55 -0.21 0.00 -0.06 0.00 0.00 57.16 57.51 3ly2 n GLU 318 Cb 0.58 -2.28 0.00 0.00 -0.06 0.00 0.00 31.44 29.69 3ly2 n GLU 318 CO 0.00 0.00 0.00 0.72 -0.06 0.00 0.00 177.13 177.79 3ly2 n HIS 319 N 5.47 -1.36 0.20 4.31 8.25 -1.26 -4.91 115.22 125.91 3ly2 n HIS 319 Ca 0.24 0.17 0.06 0.00 -0.26 0.00 0.00 57.72 57.94 3ly2 n HIS 319 Cb 0.19 -3.99 0.10 0.00 1.12 0.00 0.00 29.99 27.40 3ly2 n HIS 319 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3ly2 s ASP 321 N -0.99 6.77 0.00 0.00 2.15 -1.12 -4.57 116.67 118.90 3ly2 s ASP 321 Ca 0.18 -2.25 0.17 0.00 0.43 0.00 0.00 52.55 51.08 3ly2 s ASP 321 Cb 0.11 -2.53 0.74 0.00 -0.30 0.00 0.00 42.92 40.94 3ly2 s ASP 321 CO 0.16 -1.17 1.52 2.30 -0.17 0.00 0.00 175.17 177.81 3ly2 n ILE 322 N 6.11 0.79 -0.14 4.11 -5.35 -1.26 -2.52 119.36 121.09 3ly2 n ILE 322 Ca 0.40 0.20 0.08 0.00 -0.27 0.00 0.00 62.75 63.15 3ly2 n ILE 322 Cb 0.47 -0.91 0.19 0.00 -1.74 0.00 0.00 39.64 37.65 3ly2 n ILE 322 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 3ly2 n PHE 323 N -1.46 0.56 -0.34 4.28 3.72 -1.26 -4.66 117.46 118.31 3ly2 n PHE 323 Ca 0.05 -0.44 0.16 0.00 -0.05 0.00 0.00 57.45 57.17 3ly2 n PHE 323 Cb 0.18 -0.02 0.38 0.00 -0.94 0.00 0.00 39.48 39.09 3ly2 n PHE 323 CO 0.00 0.00 0.00 1.98 -0.05 0.00 0.00 176.76 178.69 3ly2 h MET 324 N 2.80 0.61 -0.52 -1.08 4.05 -1.85 -2.11 114.93 116.84 3ly2 h MET 324 Ca 0.00 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.38 3ly2 h MET 324 Cb 0.80 -0.14 0.00 0.00 -0.80 0.00 0.00 31.60 31.46 3ly2 h MET 324 CO 0.00 0.40 0.00 0.09 0.23 0.00 0.00 176.91 177.63 3ly2 n ASN 325 N -4.78 2.75 -4.89 1.39 3.02 -1.26 -4.88 115.26 106.61 3ly2 n ASN 325 Ca 0.25 -2.01 -0.29 0.00 -0.03 0.00 0.00 54.58 52.50 3ly2 n ASN 325 Cb 0.69 -0.35 0.02 0.00 -0.61 0.00 0.00 39.78 39.53 3ly2 n ASN 325 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3ly2 s LEU 326 N -1.01 3.23 0.88 3.41 1.43 -0.79 -4.91 118.68 120.91 3ly2 s LEU 326 Ca 0.34 1.11 -0.13 0.00 -1.03 0.00 0.00 54.13 54.42 3ly2 s LEU 326 Cb 0.18 -4.03 0.12 0.00 0.03 0.00 0.00 46.19 42.49 3ly2 s LEU 326 CO 0.23 -0.96 1.17 0.42 0.23 0.00 0.00 176.35 177.44 3ly2 s THR 327 N -3.10 1.99 0.16 5.49 -4.23 -1.26 -4.82 115.64 109.87 3ly2 s THR 327 Ca 0.54 0.00 -0.14 0.00 -1.18 0.00 0.00 61.69 60.91 3ly2 s THR 327 Cb -0.11 -2.88 0.04 0.00 1.34 0.00 0.00 72.50 70.89 3ly2 s THR 327 CO 0.50 0.00 1.76 0.50 -0.54 0.00 0.00 174.62 176.84 3ly2 h LYS 328 N -1.34 0.70 -0.83 3.99 3.64 -1.97 -1.08 116.57 119.68 3ly2 h LYS 328 Ca -0.48 -0.09 -0.00 0.00 -1.27 0.00 0.00 60.65 58.81 3ly2 h LYS 328 Cb 1.32 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 32.97 3ly2 h LYS 328 CO 0.61 0.56 0.52 -0.22 -2.27 0.00 0.00 179.45 178.65 3ly2 h LYS 329 N 0.66 1.12 -0.39 1.90 1.63 -2.00 -1.38 116.57 118.11 3ly2 h LYS 329 Ca 0.17 -0.09 -0.12 0.00 -0.85 0.00 0.00 60.65 59.77 3ly2 h LYS 329 Cb 0.07 -0.24 -0.01 0.00 -0.60 0.00 0.00 32.23 31.45 3ly2 h LYS 329 CO -0.03 0.77 -0.23 1.96 -3.45 0.00 0.00 179.45 178.47 3ly2 h GLN 330 N 1.14 0.79 -0.16 1.90 4.20 -1.80 -1.77 115.11 119.40 3ly2 h GLN 330 Ca 0.30 -0.32 -0.13 0.00 0.06 0.00 0.00 58.65 58.56 3ly2 h GLN 330 Cb -0.07 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.66 3ly2 h GLN 330 CO -0.06 0.94 -0.45 0.00 -0.67 0.00 0.00 178.83 178.60 3ly2 h ARG 331 N 0.68 0.38 -0.16 1.46 3.08 -0.87 -0.10 114.38 118.86 3ly2 h ARG 331 Ca 0.09 -0.20 -0.05 0.00 0.07 0.00 0.00 59.98 59.89 3ly2 h ARG 331 Cb 0.75 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.80 3ly2 h ARG 331 CO 0.06 0.76 -0.07 0.37 -1.07 0.00 0.00 179.97 180.01 3ly2 h GLN 332 N 0.31 0.34 -0.52 0.04 5.75 -1.09 -1.36 115.11 118.59 3ly2 h GLN 332 Ca 0.02 -0.15 -0.07 0.00 -0.15 0.00 0.00 58.65 58.30 3ly2 h GLN 332 Cb 0.91 -0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.43 3ly2 h GLN 332 CO 0.08 0.65 0.02 1.15 -2.65 0.00 0.00 178.83 178.08 3ly2 h THR 333 N 0.01 1.25 -0.42 2.39 2.02 -1.21 -2.45 112.91 114.50 3ly2 h THR 333 Ca 0.04 -1.01 -0.11 0.00 0.77 0.00 0.00 66.41 66.10 3ly2 h THR 333 Cb 0.55 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 3ly2 h THR 333 CO 0.02 0.36 -0.18 0.25 0.37 0.00 0.00 175.52 176.34 3ly2 h LEU 334 N 0.80 0.88 -0.24 2.58 6.46 -0.97 -2.28 115.31 122.53 3ly2 h LEU 334 Ca 0.16 -0.40 0.03 0.00 -0.12 0.00 0.00 57.88 57.55 3ly2 h LEU 334 Cb 0.45 -0.24 -0.03 0.00 -0.73 0.00 0.00 40.66 40.11 3ly2 h LEU 334 CO 0.02 1.08 0.05 -0.09 -0.62 0.00 0.00 178.44 178.88 3ly2 h ARG 335 N 0.67 0.14 -0.73 1.25 2.43 -0.98 -0.62 114.38 116.55 3ly2 h ARG 335 Ca 0.10 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.26 3ly2 h ARG 335 Cb 0.73 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.22 3ly2 h ARG 335 CO 0.06 0.09 0.48 -0.22 -1.51 0.00 0.00 179.97 178.87 3ly2 h LYS 336 N 0.15 0.96 -0.42 0.20 3.64 -1.41 -0.79 116.57 118.89 3ly2 h LYS 336 Ca 0.11 -0.06 -0.12 0.00 -1.27 0.00 0.00 60.65 59.31 3ly2 h LYS 336 Cb 0.10 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.69 3ly2 h LYS 336 CO -0.14 0.64 -0.22 0.52 -2.27 0.00 0.00 179.45 177.98 3ly2 h MET 337 N 0.99 0.85 -0.20 1.90 2.86 -0.97 -2.18 114.93 118.17 3ly2 h MET 337 Ca 0.27 -0.35 -0.04 0.00 -2.06 0.00 0.00 59.70 57.52 3ly2 h MET 337 Cb -0.11 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.50 3ly2 h MET 337 CO -0.06 0.99 -0.04 0.28 1.06 0.00 0.00 176.91 179.14 3ly2 h VAL 338 N 0.74 1.28 -0.53 -2.22 2.07 -0.82 -1.79 116.25 114.98 3ly2 h VAL 338 Ca 0.10 -1.00 0.08 0.00 0.82 0.00 0.00 66.70 66.70 3ly2 h VAL 338 Cb 0.75 1.54 -0.07 0.00 -1.52 0.00 0.00 31.29 31.99 3ly2 h VAL 338 CO 0.06 0.30 0.15 0.40 0.02 0.00 0.00 177.57 178.51 3ly2 h ILE 339 N 0.11 0.76 -0.15 4.57 2.04 -1.11 -0.50 117.51 123.22 3ly2 h ILE 339 Ca 0.05 -0.11 0.01 0.00 1.00 0.00 0.00 64.86 65.82 3ly2 h ILE 339 Cb 0.48 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 3ly2 h ILE 339 CO 0.02 0.06 0.06 -0.78 0.00 0.00 0.00 178.15 177.50 3ly2 h ASP 340 N 0.31 0.07 -0.50 1.72 1.82 -1.26 -1.87 116.42 116.71 3ly2 h ASP 340 Ca 0.26 0.01 -0.11 0.00 -0.39 0.00 0.00 57.03 56.81 3ly2 h ASP 340 Cb 0.33 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.33 3ly2 h ASP 340 CO -0.30 0.06 -0.11 0.24 -1.61 0.00 0.00 179.24 177.52 3ly2 h MET 341 N 0.13 0.96 -0.13 0.28 2.86 -0.85 -2.71 114.93 115.48 3ly2 h MET 341 Ca 0.06 -0.36 -0.17 0.00 -2.06 0.00 0.00 59.70 57.18 3ly2 h MET 341 Cb 0.03 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.63 3ly2 h MET 341 CO -0.06 1.03 -0.62 0.28 1.06 0.00 0.00 176.91 178.60 3ly2 h VAL 342 N 0.82 1.35 -0.03 -2.22 2.07 -1.03 -2.88 116.25 114.33 3ly2 h VAL 342 Ca 0.13 -1.93 -0.09 0.00 0.82 0.00 0.00 66.70 65.63 3ly2 h VAL 342 Cb 0.67 1.92 -0.01 0.00 -1.52 0.00 0.00 31.29 32.35 3ly2 h VAL 342 CO 0.05 0.59 -0.38 -0.07 0.02 0.00 0.00 177.57 177.77 3ly2 h LEU 343 N 0.33 0.05 0.00 2.57 3.38 -1.34 -2.16 115.31 118.14 3ly2 h LEU 343 Ca -0.01 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3ly2 h LEU 343 Cb 1.16 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.90 3ly2 h LEU 343 CO 0.11 0.43 0.00 0.00 0.09 0.00 0.00 178.44 179.07 3ly2 n ALA 344 N -2.47 1.86 1.73 1.53 0.00 -1.02 -2.01 120.51 120.12 3ly2 n ALA 344 Ca -0.02 -0.07 0.15 0.00 0.00 0.00 0.00 53.44 53.50 3ly2 n ALA 344 Cb 0.43 -1.28 0.76 0.00 0.00 0.00 0.00 19.45 19.36 3ly2 n ALA 344 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3ly2 n THR 345 N -1.40 0.00 -2.31 0.00 -2.24 -0.81 -4.74 114.28 102.77 3ly2 n THR 345 Ca 0.06 -0.08 -0.43 0.00 -2.27 0.00 0.00 64.05 61.33 3ly2 n THR 345 Cb 0.17 -0.13 -0.02 0.00 -2.10 0.00 0.00 70.33 68.25 3ly2 n THR 345 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3ly2 s ASP 346 N -2.10 6.65 0.44 3.42 -1.08 -0.85 -4.90 116.67 118.25 3ly2 s ASP 346 Ca 0.41 1.50 0.16 0.00 -0.52 0.00 0.00 52.55 54.10 3ly2 s ASP 346 Cb 0.21 -2.54 1.09 0.00 -1.46 0.00 0.00 42.92 40.22 3ly2 s ASP 346 CO 0.38 -1.05 1.95 0.24 0.52 0.00 0.00 175.17 177.21 3ly2 h MET 347 N 9.46 0.35 0.00 4.34 2.86 -1.90 -0.09 114.93 129.95 3ly2 h MET 347 Ca -0.29 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.33 3ly2 h MET 347 Cb 1.12 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.70 3ly2 h MET 347 CO 1.00 0.23 0.00 -1.13 1.06 0.00 0.00 176.91 178.08 3ly2 n SER 348 N -4.46 0.43 -0.21 1.22 3.41 -1.26 -0.71 113.62 112.04 3ly2 n SER 348 Ca 0.12 0.67 0.11 0.00 -0.26 0.00 0.00 58.87 59.51 3ly2 n SER 348 Cb 0.49 -0.74 -0.03 0.00 -0.26 0.00 0.00 64.21 63.67 3ly2 n SER 348 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3ly2 n LYS 349 N -2.04 0.52 -0.17 4.33 4.76 -0.05 -4.59 118.16 120.92 3ly2 n LYS 349 Ca -0.00 -0.42 -0.04 0.00 -2.87 0.00 0.00 58.31 54.98 3ly2 n LYS 349 Cb 0.08 -1.49 0.02 0.00 -1.84 0.00 0.00 35.03 31.80 3ly2 n LYS 349 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 3ly2 h HIS 350 N 1.02 -0.65 -0.03 2.13 -0.00 -0.95 -0.40 115.15 116.28 3ly2 h HIS 350 Ca 0.00 0.06 0.03 0.00 -0.00 0.00 0.00 60.37 60.46 3ly2 h HIS 350 Cb 0.60 0.36 -0.04 0.00 -0.00 0.00 0.00 27.41 28.34 3ly2 h HIS 350 CO 0.00 -0.33 -0.16 0.52 -0.00 0.00 0.00 177.93 177.96 3ly2 h MET 351 N -0.13 -0.25 -0.97 5.26 2.07 -1.81 0.25 114.93 119.36 3ly2 h MET 351 Ca 0.23 0.02 0.01 0.00 -2.07 0.00 0.00 59.70 57.89 3ly2 h MET 351 Cb 0.50 0.06 -0.05 0.00 -1.87 0.00 0.00 31.60 30.23 3ly2 h MET 351 CO -0.59 -0.16 0.64 1.03 1.07 0.00 0.00 176.91 178.89 3ly2 h SER 352 N -0.25 1.10 -0.26 1.22 0.87 -1.79 -1.25 113.55 113.19 3ly2 h SER 352 Ca 0.06 -0.03 -0.05 0.00 -1.23 0.00 0.00 61.79 60.55 3ly2 h SER 352 Cb 0.34 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 3ly2 h SER 352 CO -0.18 0.79 -0.02 0.25 -0.53 0.00 0.00 176.83 177.15 3ly2 h LEU 353 N 1.30 0.46 -1.08 2.23 5.85 -0.41 -2.56 115.31 121.09 3ly2 h LEU 353 Ca 0.36 -0.32 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 3ly2 h LEU 353 Cb -0.13 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 40.75 3ly2 h LEU 353 CO -0.08 0.67 0.24 0.25 -0.34 0.00 0.00 178.44 179.18 3ly2 h LEU 354 N 0.23 0.82 0.06 2.25 5.85 -0.19 -2.33 115.31 122.00 3ly2 h LEU 354 Ca 0.07 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.68 3ly2 h LEU 354 Cb 0.45 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.27 3ly2 h LEU 354 CO 0.02 0.74 -0.03 0.00 -0.34 0.00 0.00 178.44 178.83 3ly2 h ALA 355 N 1.38 -0.08 -0.93 1.25 0.00 -1.14 -2.11 119.26 117.63 3ly2 h ALA 355 Ca 0.21 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.06 3ly2 h ALA 355 Cb 0.18 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.94 3ly2 h ALA 355 CO -0.02 -0.44 0.61 -0.44 0.00 0.00 0.00 179.25 178.97 3ly2 h ASP 356 N -0.29 0.97 -0.49 0.00 3.45 -1.34 -2.11 116.42 116.60 3ly2 h ASP 356 Ca -0.01 0.00 -0.02 0.00 0.43 0.00 0.00 57.03 57.43 3ly2 h ASP 356 Cb 0.26 -0.21 -0.02 0.00 -0.56 0.00 0.00 39.33 38.80 3ly2 h ASP 356 CO 0.01 0.64 0.22 0.25 -1.57 0.00 0.00 179.24 178.79 3ly2 h LEU 357 N 1.11 0.66 -1.39 1.55 5.85 -1.26 -1.79 115.31 120.03 3ly2 h LEU 357 Ca 0.39 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.97 3ly2 h LEU 357 Cb 0.13 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.96 3ly2 h LEU 357 CO -0.14 0.62 0.40 0.11 -0.34 0.00 0.00 178.44 179.09 3ly2 h LYS 358 N 0.65 0.80 -0.46 1.25 1.57 -0.75 -0.71 116.57 118.93 3ly2 h LYS 358 Ca 0.17 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.85 3ly2 h LYS 358 Cb 0.15 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 3ly2 h LYS 358 CO -0.02 0.54 0.10 1.15 -0.57 0.00 0.00 179.45 180.65 3ly2 h THR 359 N 0.83 1.24 -0.63 -0.16 2.02 -0.95 -2.57 112.91 112.68 3ly2 h THR 359 Ca 0.22 -0.84 -0.04 0.00 0.77 0.00 0.00 66.41 66.53 3ly2 h THR 359 Cb -0.09 0.91 -0.03 0.00 -1.74 0.00 0.00 68.15 67.21 3ly2 h THR 359 CO -0.05 0.30 0.25 -0.03 0.37 0.00 0.00 175.52 176.36 3ly2 h MET 360 N 0.61 0.94 -0.78 6.66 1.85 -0.51 -2.46 114.93 121.24 3ly2 h MET 360 Ca 0.14 -0.17 0.09 0.00 -0.61 0.00 0.00 59.70 59.15 3ly2 h MET 360 Cb 0.34 -0.15 -0.05 0.00 0.43 0.00 0.00 31.60 32.16 3ly2 h MET 360 CO 0.00 0.79 0.51 0.28 -0.40 0.00 0.00 176.91 178.10 3ly2 h VAL 361 N 0.88 0.96 -0.22 -5.77 2.07 -0.93 -0.52 116.25 112.72 3ly2 h VAL 361 Ca 0.21 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.48 3ly2 h VAL 361 Cb 0.20 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 3ly2 h VAL 361 CO -0.02 0.13 0.14 -0.33 0.02 0.00 0.00 177.57 177.52 3ly2 h GLU 362 N 0.74 0.29 -0.55 1.57 5.08 -1.05 -3.00 114.58 117.66 3ly2 h GLU 362 Ca 0.35 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 3ly2 h GLU 362 Cb 0.40 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.59 3ly2 h GLU 362 CO -0.13 0.20 0.00 0.25 -1.00 0.00 0.00 179.01 178.33 3ly2 n THR 363 N -4.93 0.74 -1.70 1.13 -2.24 -0.95 -5.00 114.28 101.34 3ly2 n THR 363 Ca -0.03 -0.76 -0.43 0.00 -2.27 0.00 0.00 64.05 60.56 3ly2 n THR 363 Cb 0.03 0.43 -0.01 0.00 -2.10 0.00 0.00 70.33 68.67 3ly2 n THR 363 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 3ly2 n LYS 364 N 1.19 2.16 -4.27 -0.78 2.85 -0.24 -4.99 118.16 114.07 3ly2 n LYS 364 Ca 0.19 0.76 -0.32 0.00 -1.05 0.00 0.00 58.31 57.90 3ly2 n LYS 364 Cb 0.49 -2.39 -0.09 0.00 -0.65 0.00 0.00 35.03 32.39 3ly2 n LYS 364 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 3ly2 s LYS 365 N -1.33 2.62 0.05 -1.58 1.02 -1.26 -5.07 119.74 114.19 3ly2 s LYS 365 Ca 0.60 -0.73 -0.02 0.00 0.02 0.00 0.00 55.97 55.84 3ly2 s LYS 365 Cb -0.58 -2.57 -0.04 0.00 -0.52 0.00 0.00 37.83 34.12 3ly2 s LYS 365 CO 0.57 0.59 -0.01 0.54 -0.92 0.00 0.00 175.35 176.12 3ly2 s VAL 366 N -1.14 0.21 0.72 3.17 0.11 -1.26 -1.81 120.40 120.39 3ly2 s VAL 366 Ca 0.21 -1.73 -0.04 0.00 -2.93 0.00 0.00 61.98 57.49 3ly2 s VAL 366 Cb -0.11 -1.46 0.10 0.00 -1.53 0.00 0.00 36.38 33.38 3ly2 s VAL 366 CO 0.12 -0.96 1.00 0.42 -3.33 0.00 0.00 175.10 172.36 3ly2 s THR 367 N -3.82 2.25 0.22 5.04 -4.23 0.10 -4.90 115.64 110.29 3ly2 s THR 367 Ca 0.06 -0.46 -0.08 0.00 -1.18 0.00 0.00 61.69 60.03 3ly2 s THR 367 Cb 0.07 -2.78 0.16 0.00 1.34 0.00 0.00 72.50 71.29 3ly2 s THR 367 CO -0.10 0.00 1.78 0.77 -0.54 0.00 0.00 174.62 176.53 3ly2 h SER 368 N -0.57 0.45 0.71 3.99 4.64 -2.02 0.81 113.55 121.56 3ly2 h SER 368 Ca -0.40 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 3ly2 h SER 368 Cb 1.28 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 3ly2 h SER 368 CO 0.46 0.27 0.00 -1.54 -0.87 0.00 0.00 176.83 175.15 3ly2 n SER 369 N -4.86 0.18 0.00 4.97 3.41 -1.26 -4.89 113.62 111.17 3ly2 n SER 369 Ca 0.10 0.54 0.00 0.00 -0.26 0.00 0.00 58.87 59.25 3ly2 n SER 369 Cb 0.25 -0.58 0.00 0.00 -0.26 0.00 0.00 64.21 63.62 3ly2 n SER 369 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ly2 n GLY 370 N 0.39 0.93 3.78 5.00 0.00 0.28 -5.08 105.19 110.49 3ly2 n GLY 370 Ca 0.04 -0.05 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 3ly2 n GLY 370 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ly2 s VAL 371 N -2.00 4.87 0.49 1.61 1.01 -1.26 -4.71 120.40 120.41 3ly2 s VAL 371 Ca 0.00 1.23 -0.24 0.00 0.00 0.00 0.00 61.98 62.97 3ly2 s VAL 371 Cb 0.00 -3.92 -0.07 0.00 0.00 0.00 0.00 36.38 32.39 3ly2 s VAL 371 CO 0.00 0.46 1.36 0.18 0.00 0.00 0.00 175.10 177.10 3ly2 n LEU 372 N 2.46 5.03 -4.11 3.92 4.77 0.72 -0.72 117.00 129.06 3ly2 n LEU 372 Ca -0.08 1.05 -0.35 0.00 -0.03 0.00 0.00 56.01 56.60 3ly2 n LEU 372 Cb 0.51 -1.57 -0.12 0.00 -2.33 0.00 0.00 43.42 39.91 3ly2 n LEU 372 CO 0.43 -0.46 -0.23 -0.76 -1.33 0.00 0.00 177.39 175.04 3ly2 s LEU 373 N -2.76 4.93 -0.95 2.23 1.43 -0.75 -4.83 118.68 117.98 3ly2 s LEU 373 Ca 0.65 -1.91 -0.03 0.00 -1.03 0.00 0.00 54.13 51.81 3ly2 s LEU 373 Cb -0.45 -1.78 0.24 0.00 0.03 0.00 0.00 46.19 44.23 3ly2 s LEU 373 CO 0.54 -0.47 0.89 0.18 0.23 0.00 0.00 176.35 177.72 3ly2 n LEU 374 N 4.55 4.57 -0.13 1.79 4.77 -1.26 -4.57 117.00 126.72 3ly2 n LEU 374 Ca -0.03 -5.12 -0.06 0.00 -0.03 0.00 0.00 56.01 50.77 3ly2 n LEU 374 Cb 0.42 -1.18 0.01 0.00 -2.33 0.00 0.00 43.42 40.34 3ly2 n LEU 374 CO 0.30 1.54 0.70 -2.24 -1.33 0.00 0.00 177.39 176.36 3ly2 h ASP 375 N 6.05 -0.77 -2.08 -1.43 3.04 -1.98 -3.44 116.42 115.81 3ly2 h ASP 375 Ca 0.17 0.17 -0.53 0.00 -3.24 0.00 0.00 57.03 53.60 3ly2 h ASP 375 Cb 0.81 0.40 -0.07 0.00 -1.04 0.00 0.00 39.33 39.43 3ly2 h ASP 375 CO 0.91 -0.25 -0.56 0.54 -2.04 0.00 0.00 179.24 177.84 3ly2 s ASN 376 N -5.13 4.97 0.26 4.15 4.22 -1.26 -5.03 114.94 117.13 3ly2 s ASN 376 Ca -0.14 -0.54 -0.01 0.00 -2.14 0.00 0.00 52.86 50.03 3ly2 s ASN 376 Cb 0.15 -1.00 0.57 0.00 1.28 0.00 0.00 41.25 42.24 3ly2 s ASN 376 CO 0.70 -0.13 1.72 0.22 -2.04 0.00 0.00 177.10 177.57 3ly2 h TYR 377 N 1.60 0.58 -0.49 1.54 3.20 -2.00 -2.40 116.97 119.01 3ly2 h TYR 377 Ca -0.45 0.04 0.09 0.00 3.14 0.00 0.00 58.73 61.54 3ly2 h TYR 377 Cb 1.25 -0.13 -0.07 0.00 1.54 0.00 0.00 36.73 39.32 3ly2 h TYR 377 CO 0.61 0.03 0.08 1.15 -1.64 0.00 0.00 178.16 178.39 3ly2 h THR 378 N 0.44 0.70 -0.19 1.81 2.02 -1.97 -0.80 112.91 114.93 3ly2 h THR 378 Ca 0.47 -0.07 -0.13 0.00 0.77 0.00 0.00 66.41 67.45 3ly2 h THR 378 Cb 0.79 0.48 -0.01 0.00 -1.74 0.00 0.00 68.15 67.67 3ly2 h THR 378 CO -0.45 0.04 -0.44 0.44 0.37 0.00 0.00 175.52 175.47 3ly2 h ASP 379 N 0.21 0.51 -0.21 4.18 3.32 -1.81 -2.34 116.42 120.27 3ly2 h ASP 379 Ca 0.24 -0.23 -0.04 0.00 0.02 0.00 0.00 57.03 57.02 3ly2 h ASP 379 Cb 0.34 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 3ly2 h ASP 379 CO -0.34 0.88 -0.04 0.03 -1.72 0.00 0.00 179.24 178.06 3ly2 h ARG 380 N 0.39 0.40 0.00 3.56 3.08 -1.12 -1.95 114.38 118.73 3ly2 h ARG 380 Ca 0.03 -0.15 -0.05 0.00 0.07 0.00 0.00 59.98 59.89 3ly2 h ARG 380 Cb 0.93 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.95 3ly2 h ARG 380 CO 0.08 0.63 -0.22 0.97 -1.07 0.00 0.00 179.97 180.36 3ly2 h ILE 381 N 0.14 0.53 -0.14 2.04 6.09 -1.20 -1.03 117.51 123.94 3ly2 h ILE 381 Ca 0.06 -1.13 -0.19 0.00 -1.37 0.00 0.00 64.86 62.22 3ly2 h ILE 381 Cb 0.47 1.78 0.01 0.00 0.47 0.00 0.00 36.82 39.55 3ly2 h ILE 381 CO 0.02 0.22 -0.66 -0.61 -3.07 0.00 0.00 178.15 174.05 3ly2 h GLN 382 N 0.00 0.70 -0.42 2.19 4.15 -1.28 -0.13 115.11 120.32 3ly2 h GLN 382 Ca -0.00 -0.56 -0.03 0.00 0.77 0.00 0.00 58.65 58.82 3ly2 h GLN 382 Cb 0.77 0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.55 3ly2 h GLN 382 CO 0.03 1.18 0.13 0.28 -1.93 0.00 0.00 178.83 178.51 3ly2 h VAL 383 N 0.39 1.22 -0.33 2.39 2.07 -1.05 -2.14 116.25 118.80 3ly2 h VAL 383 Ca -0.04 -0.73 -0.05 0.00 0.82 0.00 0.00 66.70 66.70 3ly2 h VAL 383 Cb 1.29 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 31.95 3ly2 h VAL 383 CO 0.14 0.26 0.00 -0.07 0.02 0.00 0.00 177.57 177.92 3ly2 h LEU 384 N 0.53 0.48 -0.19 2.57 3.38 -1.14 0.29 115.31 121.23 3ly2 h LEU 384 Ca 0.13 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 3ly2 h LEU 384 Cb 0.27 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 3ly2 h LEU 384 CO -0.00 0.55 0.11 0.03 0.09 0.00 0.00 178.44 179.22 3ly2 h ARG 385 N 0.50 0.27 -0.10 1.13 3.08 -0.72 -2.39 114.38 116.15 3ly2 h ARG 385 Ca 0.11 -0.03 -0.11 0.00 0.07 0.00 0.00 59.98 60.02 3ly2 h ARG 385 Cb 0.32 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 3ly2 h ARG 385 CO 0.01 0.24 -0.44 -0.91 -1.07 0.00 0.00 179.97 177.80 3ly2 h ASN 386 N 0.22 0.24 -0.13 7.04 2.35 -0.80 -2.56 115.58 121.94 3ly2 h ASN 386 Ca 0.07 -0.11 -0.01 0.00 -0.55 0.00 0.00 56.30 55.71 3ly2 h ASN 386 Cb 0.05 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 3ly2 h ASN 386 CO -0.01 0.66 0.06 -0.03 -1.65 0.00 0.00 177.43 176.46 3ly2 h MET 387 N 0.19 0.19 -0.17 0.81 4.05 -0.16 0.15 114.93 120.00 3ly2 h MET 387 Ca 0.01 -0.03 -0.11 0.00 -0.28 0.00 0.00 59.70 59.30 3ly2 h MET 387 Cb 0.86 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.62 3ly2 h MET 387 CO 0.07 0.26 -0.37 0.28 0.23 0.00 0.00 176.91 177.38 3ly2 h VAL 388 N 0.08 1.29 -0.51 -5.77 2.07 -1.44 -0.32 116.25 111.66 3ly2 h VAL 388 Ca 0.05 -1.46 -0.09 0.00 0.82 0.00 0.00 66.70 66.02 3ly2 h VAL 388 Cb 0.13 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 3ly2 h VAL 388 CO -0.01 0.45 -0.04 -0.74 0.02 0.00 0.00 177.57 177.25 3ly2 h HIS 389 N 0.30 0.97 -0.44 1.57 6.17 -1.19 0.49 115.15 123.02 3ly2 h HIS 389 Ca 0.03 -0.16 -0.14 0.00 0.71 0.00 0.00 60.37 60.81 3ly2 h HIS 389 Cb 0.79 -0.25 -0.01 0.00 2.52 0.00 0.00 27.41 30.46 3ly2 h HIS 389 CO 0.02 0.90 -0.26 0.00 0.71 0.00 0.00 177.93 179.30 3ly2 h ALA 391 N 0.83 0.87 -0.44 0.00 0.00 -0.78 -1.54 119.26 118.20 3ly2 h ALA 391 Ca 0.09 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 3ly2 h ALA 391 Cb 0.84 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 3ly2 h ALA 391 CO 0.07 0.52 0.16 0.22 0.00 0.00 0.00 179.25 180.21 3ly2 h ASP 392 N 0.96 0.57 -1.21 0.00 -0.00 -0.72 -2.69 116.42 113.33 3ly2 h ASP 392 Ca 0.22 -0.07 -0.66 0.00 -0.00 0.00 0.00 57.03 56.52 3ly2 h ASP 392 Cb 0.25 -0.15 -0.33 0.00 -0.00 0.00 0.00 39.33 39.10 3ly2 h ASP 392 CO -0.01 0.54 0.39 0.18 -0.00 0.00 0.00 179.24 180.33 3ly2 n LEU 393 N -4.35 6.78 -0.62 2.28 4.77 -0.64 -4.61 117.00 120.61 3ly2 n LEU 393 Ca 0.03 -4.60 0.10 0.00 -0.03 0.00 0.00 56.01 51.51 3ly2 n LEU 393 Cb 0.16 -0.81 0.04 0.00 -2.33 0.00 0.00 43.42 40.48 3ly2 n LEU 393 CO 0.38 1.75 0.42 -1.54 -1.33 0.00 0.00 177.39 177.07 3ly2 n SER 394 N -0.75 2.24 -0.13 -1.43 3.41 -0.64 -4.66 113.62 111.67 3ly2 n SER 394 Ca 0.55 -1.62 -0.05 0.00 -0.26 0.00 0.00 58.87 57.48 3ly2 n SER 394 Cb 0.64 0.24 0.01 0.00 -0.26 0.00 0.00 64.21 64.84 3ly2 n SER 394 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 3ly2 h ASN 395 N 3.02 -0.70 0.40 4.04 -0.26 -1.82 -1.49 115.58 118.76 3ly2 h ASN 395 Ca 0.00 0.16 0.00 0.00 -0.56 0.00 0.00 56.30 55.90 3ly2 h ASN 395 Cb 0.74 0.38 0.00 0.00 -1.06 0.00 0.00 38.32 38.38 3ly2 h ASN 395 CO 0.00 -0.24 0.00 -2.65 -1.06 0.00 0.00 177.43 173.48 3ly2 n PRO 396 N -5.38 0.10 -0.10 0.81 -0.02 -1.26 -2.28 135.00 126.86 3ly2 n PRO 396 Ca 0.03 0.43 0.12 0.00 -2.02 0.00 0.00 63.50 62.06 3ly2 n PRO 396 Cb 0.30 -1.73 0.23 0.00 -0.02 0.00 0.00 33.50 32.27 3ly2 n PRO 396 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3ly2 n THR 397 N -1.93 0.26 -2.69 3.45 -2.24 -0.57 -4.30 114.28 106.27 3ly2 n THR 397 Ca 0.01 -0.57 -0.21 0.00 -2.27 0.00 0.00 64.05 61.01 3ly2 n THR 397 Cb 0.14 1.01 0.06 0.00 -2.10 0.00 0.00 70.33 69.43 3ly2 n THR 397 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3ly2 s LYS 398 N -1.74 2.27 0.60 -0.78 -0.14 -0.97 -4.68 119.74 114.31 3ly2 s LYS 398 Ca 0.34 -1.01 -0.18 0.00 -1.36 0.00 0.00 55.97 53.77 3ly2 s LYS 398 Cb 0.21 -2.48 -0.06 0.00 -1.68 0.00 0.00 37.83 33.83 3ly2 s LYS 398 CO 0.31 -0.92 0.83 -1.13 -0.76 0.00 0.00 175.35 173.67 3ly2 n SER 399 N -2.45 0.20 -0.14 2.83 3.41 -1.26 -4.58 113.62 111.63 3ly2 n SER 399 Ca 0.11 0.78 0.12 0.00 -0.26 0.00 0.00 58.87 59.61 3ly2 n SER 399 Cb 0.60 -1.32 0.47 0.00 -0.26 0.00 0.00 64.21 63.69 3ly2 n SER 399 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3ly2 h LEU 400 N 0.36 0.45 -0.60 1.04 5.85 -1.94 -0.35 115.31 120.12 3ly2 h LEU 400 Ca -0.48 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.31 3ly2 h LEU 400 Cb 1.38 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 42.28 3ly2 h LEU 400 CO 0.49 0.26 0.32 -0.08 -0.34 0.00 0.00 178.44 179.10 3ly2 h GLU 401 N 0.49 0.59 0.00 1.25 4.81 -2.01 -1.42 114.58 118.30 3ly2 h GLU 401 Ca 0.32 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.50 3ly2 h GLU 401 Cb 0.59 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.84 3ly2 h GLU 401 CO -0.10 0.39 -0.07 -0.07 -0.73 0.00 0.00 179.01 178.42 3ly2 h LEU 402 N 0.60 0.06 -0.68 1.64 3.38 -1.65 -3.29 115.31 115.37 3ly2 h LEU 402 Ca 0.27 -0.85 0.14 0.00 0.09 0.00 0.00 57.88 57.54 3ly2 h LEU 402 Cb 0.17 -0.02 -0.12 0.00 0.09 0.00 0.00 40.66 40.78 3ly2 h LEU 402 CO -0.18 0.90 -0.09 0.22 0.09 0.00 0.00 178.44 179.39 3ly2 h TYR 403 N -0.78 -0.21 -0.86 1.13 3.20 -0.99 0.31 116.97 118.78 3ly2 h TYR 403 Ca -0.01 0.06 0.03 0.00 3.14 0.00 0.00 58.73 61.95 3ly2 h TYR 403 Cb 0.91 0.20 -0.05 0.00 1.54 0.00 0.00 36.73 39.33 3ly2 h TYR 403 CO 0.22 -0.25 0.56 0.00 -1.64 0.00 0.00 178.16 177.05 3ly2 h ARG 404 N 0.05 1.04 -0.46 1.82 3.08 -1.38 0.04 114.38 118.58 3ly2 h ARG 404 Ca 0.35 -0.06 -0.10 0.00 0.07 0.00 0.00 59.98 60.23 3ly2 h ARG 404 Cb 0.56 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 3ly2 h ARG 404 CO -0.65 0.69 -0.11 1.96 -1.07 0.00 0.00 179.97 180.79 3ly2 h GLN 405 N 1.08 0.89 -0.61 0.04 4.20 -1.06 -2.00 115.11 117.64 3ly2 h GLN 405 Ca 0.34 -0.34 -0.03 0.00 0.06 0.00 0.00 58.65 58.67 3ly2 h GLN 405 Cb 0.01 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.71 3ly2 h GLN 405 CO -0.10 0.98 0.24 -1.49 -0.67 0.00 0.00 178.83 177.80 3ly2 h TRP 406 N 0.73 0.90 -0.52 2.96 -0.00 -0.42 -2.39 115.95 117.20 3ly2 h TRP 406 Ca 0.12 -0.05 -0.10 0.00 -0.00 0.00 0.00 58.89 58.85 3ly2 h TRP 406 Cb 0.66 -0.27 -0.02 0.00 -0.00 0.00 0.00 29.16 29.52 3ly2 h TRP 406 CO 0.05 0.69 -0.08 1.15 -0.00 0.00 0.00 178.44 180.25 3ly2 h THR 407 N 0.88 1.26 -0.71 1.49 2.02 -0.71 -2.22 112.91 114.92 3ly2 h THR 407 Ca 0.21 -1.21 -0.06 0.00 0.77 0.00 0.00 66.41 66.13 3ly2 h THR 407 Cb 0.17 0.94 -0.03 0.00 -1.74 0.00 0.00 68.15 67.50 3ly2 h THR 407 CO -0.02 0.42 0.23 0.44 0.37 0.00 0.00 175.52 176.97 3ly2 h ASP 408 N 0.86 1.03 -0.43 4.18 3.32 -0.98 -2.33 116.42 122.08 3ly2 h ASP 408 Ca 0.14 -0.20 -0.05 0.00 0.02 0.00 0.00 57.03 56.94 3ly2 h ASP 408 Cb 0.62 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.88 3ly2 h ASP 408 CO 0.04 0.96 0.08 0.03 -1.72 0.00 0.00 179.24 178.63 3ly2 h ARG 409 N 1.05 0.70 -0.35 3.56 3.08 -1.26 -1.18 114.38 119.98 3ly2 h ARG 409 Ca 0.23 -0.18 -0.11 0.00 0.07 0.00 0.00 59.98 59.98 3ly2 h ARG 409 Cb 0.30 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 3ly2 h ARG 409 CO -0.01 0.73 -0.24 0.97 -1.07 0.00 0.00 179.97 180.35 3ly2 h ILE 410 N 0.56 1.27 -0.53 2.04 6.09 -1.34 -1.70 117.51 123.91 3ly2 h ILE 410 Ca 0.13 -1.34 -0.12 0.00 -1.37 0.00 0.00 64.86 62.16 3ly2 h ILE 410 Cb 0.36 1.27 -0.02 0.00 0.47 0.00 0.00 36.82 38.90 3ly2 h ILE 410 CO 0.01 0.44 -0.15 0.24 -3.07 0.00 0.00 178.15 175.62 3ly2 h MET 411 N 0.61 1.03 -0.58 2.19 2.86 -1.33 -1.06 114.93 118.64 3ly2 h MET 411 Ca 0.08 -0.40 -0.01 0.00 -2.06 0.00 0.00 59.70 57.31 3ly2 h MET 411 Cb 0.73 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.31 3ly2 h MET 411 CO 0.06 1.09 0.33 1.49 1.06 0.00 0.00 176.91 180.94 3ly2 h GLU 412 N 0.90 0.80 -0.40 1.72 4.81 -1.00 -0.91 114.58 120.50 3ly2 h GLU 412 Ca 0.13 -0.08 -0.08 0.00 -0.13 0.00 0.00 59.36 59.19 3ly2 h GLU 412 Cb 0.72 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 3ly2 h GLU 412 CO 0.06 0.60 -0.07 1.49 -0.73 0.00 0.00 179.01 180.35 3ly2 h GLU 413 N 0.79 0.75 -0.87 1.92 4.81 -1.12 -1.45 114.58 119.41 3ly2 h GLU 413 Ca 0.21 -0.28 0.02 0.00 -0.13 0.00 0.00 59.36 59.18 3ly2 h GLU 413 Cb 0.01 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.30 3ly2 h GLU 413 CO -0.04 0.88 0.57 0.74 -0.73 0.00 0.00 179.01 180.44 3ly2 h PHE 414 N 0.57 1.08 -0.23 0.92 -1.00 -0.96 -1.09 116.94 116.24 3ly2 h PHE 414 Ca 0.10 0.03 -0.10 0.00 2.81 0.00 0.00 57.97 60.81 3ly2 h PHE 414 Cb 0.59 -0.36 -0.01 0.00 3.61 0.00 0.00 35.95 39.77 3ly2 h PHE 414 CO 0.05 0.66 -0.31 0.74 -1.61 0.00 0.00 178.31 177.84 3ly2 h PHE 415 N 1.15 0.52 -0.72 -0.55 0.04 -0.87 -0.06 116.94 116.45 3ly2 h PHE 415 Ca 0.33 -0.12 0.03 0.00 2.80 0.00 0.00 57.97 61.00 3ly2 h PHE 415 Cb -0.09 -0.12 -0.04 0.00 2.20 0.00 0.00 35.95 37.90 3ly2 h PHE 415 CO -0.00 0.71 0.46 1.96 -0.60 0.00 0.00 178.31 180.84 3ly2 h GLN 416 N 0.39 0.88 -0.57 1.51 1.08 -0.14 0.15 115.11 118.40 3ly2 h GLN 416 Ca 0.05 -0.05 -0.09 0.00 -1.45 0.00 0.00 58.65 57.10 3ly2 h GLN 416 Cb 0.73 -0.20 -0.02 0.00 -0.05 0.00 0.00 27.48 27.95 3ly2 h GLN 416 CO 0.06 0.58 -0.02 0.37 -0.95 0.00 0.00 178.83 178.87 3ly2 h GLN 417 N 0.90 1.00 -0.23 1.46 4.15 -0.74 -1.16 115.11 120.50 3ly2 h GLN 417 Ca 0.28 -0.31 0.04 0.00 0.77 0.00 0.00 58.65 59.43 3ly2 h GLN 417 Cb -0.01 -0.09 -0.04 0.00 0.21 0.00 0.00 27.48 27.55 3ly2 h GLN 417 CO -0.10 0.99 -0.01 0.78 -1.93 0.00 0.00 178.83 178.56 3ly2 h GLY 418 N 0.99 0.20 0.94 2.39 0.00 0.45 0.69 103.07 108.74 3ly2 h GLY 418 Ca 0.16 0.04 -0.00 0.00 0.00 0.00 0.00 47.33 47.53 3ly2 h GLY 418 CO 0.03 -0.06 0.11 -0.55 0.00 0.00 0.00 176.54 176.08 3ly2 h ASP 419 N 0.05 0.26 -1.00 0.19 3.32 -0.52 -2.00 116.42 116.72 3ly2 h ASP 419 Ca 0.11 -0.09 0.14 0.00 0.02 0.00 0.00 57.03 57.21 3ly2 h ASP 419 Cb 0.14 -0.07 -0.09 0.00 0.22 0.00 0.00 39.33 39.54 3ly2 h ASP 419 CO -0.19 0.27 0.63 0.11 -1.72 0.00 0.00 179.24 178.33 3ly2 h LYS 420 N 0.22 0.92 -0.54 3.56 1.57 -0.70 0.33 116.57 121.92 3ly2 h LYS 420 Ca 0.07 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.75 3ly2 h LYS 420 Cb 0.07 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.15 3ly2 h LYS 420 CO -0.01 0.61 0.15 0.93 -0.57 0.00 0.00 179.45 180.55 3ly2 h GLU 421 N 0.94 0.85 -0.13 3.15 5.08 -0.42 -2.12 114.58 121.94 3ly2 h GLU 421 Ca 0.52 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.67 3ly2 h GLU 421 Cb 0.58 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 3ly2 h GLU 421 CO -0.29 0.79 0.05 -0.09 -1.00 0.00 0.00 179.01 178.47 3ly2 h ARG 422 N 0.75 0.19 -0.42 2.33 2.43 -0.44 0.17 114.38 119.40 3ly2 h ARG 422 Ca 0.17 -0.04 0.09 0.00 -0.81 0.00 0.00 59.98 59.40 3ly2 h ARG 422 Cb 0.31 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.81 3ly2 h ARG 422 CO -0.00 0.31 0.29 0.93 -1.51 0.00 0.00 179.97 179.98 3ly2 h GLU 423 N 0.03 0.16 -0.45 0.20 5.08 -0.87 -0.62 114.58 118.11 3ly2 h GLU 423 Ca 0.04 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3ly2 h GLU 423 Cb 0.19 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.40 3ly2 h GLU 423 CO -0.00 0.10 0.00 0.54 -1.00 0.00 0.00 179.01 178.65 3ly2 n ARG 424 N -4.45 2.35 -3.28 2.33 1.74 -0.81 -4.95 116.66 109.58 3ly2 n ARG 424 Ca 0.06 -2.06 -0.17 0.00 -0.77 0.00 0.00 57.85 54.92 3ly2 n ARG 424 Cb 0.38 -1.48 0.06 0.00 -1.02 0.00 0.00 32.46 30.40 3ly2 n ARG 424 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ly2 n GLY 425 N 1.43 -0.20 3.74 -0.13 0.00 -0.24 -5.03 105.19 104.76 3ly2 n GLY 425 Ca 0.19 0.02 -0.23 0.00 0.00 0.00 0.00 46.02 46.01 3ly2 n GLY 425 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3ly2 s MET 426 N -5.73 2.37 0.11 1.61 -1.94 0.55 -5.02 119.30 111.25 3ly2 s MET 426 Ca 0.32 -1.56 -0.30 0.00 -1.71 0.00 0.00 55.69 52.43 3ly2 s MET 426 Cb -0.14 -2.17 -0.07 0.00 2.01 0.00 0.00 34.83 34.46 3ly2 s MET 426 CO 0.56 0.09 1.18 -1.83 -0.01 0.00 0.00 175.02 175.01 3ly2 s GLU 427 N -3.86 4.48 -0.06 2.03 4.04 -1.26 -4.38 118.70 119.68 3ly2 s GLU 427 Ca 0.38 1.78 -0.30 0.00 0.04 0.00 0.00 54.97 56.88 3ly2 s GLU 427 Cb -0.02 -3.31 -0.05 0.00 0.02 0.00 0.00 34.13 30.77 3ly2 s GLU 427 CO 0.23 -0.16 1.61 0.42 -1.84 0.00 0.00 175.26 175.52 3ly2 s ILE 428 N 0.57 3.65 0.73 1.83 -1.09 -1.26 -4.95 121.20 120.68 3ly2 s ILE 428 Ca 0.56 0.80 -0.15 0.00 -2.23 0.00 0.00 60.65 59.63 3ly2 s ILE 428 Cb -0.30 -3.51 0.04 0.00 -1.58 0.00 0.00 42.46 37.10 3ly2 s ILE 428 CO 0.32 -0.07 1.19 -0.44 -1.23 0.00 0.00 174.94 174.72 3ly2 s SER 429 N 3.16 4.24 0.20 3.58 0.01 -1.26 -4.91 113.70 118.72 3ly2 s SER 429 Ca 0.71 2.31 -0.33 0.00 1.31 0.00 0.00 55.95 59.96 3ly2 s SER 429 Cb -0.32 -2.58 -0.13 0.00 0.21 0.00 0.00 66.02 63.19 3ly2 s SER 429 CO 0.28 -2.23 1.53 -2.65 0.41 0.00 0.00 173.24 170.58 3ly2 n PRO 430 N -2.75 2.18 -0.86 12.44 -0.02 -1.26 -1.30 135.00 143.43 3ly2 n PRO 430 Ca 0.13 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 3ly2 n PRO 430 Cb 0.50 -2.52 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 3ly2 n PRO 430 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 3ly2 n MET 431 N 2.91 -0.14 -0.19 -0.52 2.81 -1.26 -4.79 117.12 115.94 3ly2 n MET 431 Ca 0.15 0.04 0.12 0.00 -1.81 0.00 0.00 57.70 56.19 3ly2 n MET 431 Cb 0.30 -3.30 0.23 0.00 -0.71 0.00 0.00 33.22 29.75 3ly2 n MET 431 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3ly2 s ASP 433 N -1.48 5.94 0.53 0.00 -1.08 -1.25 -3.49 116.67 115.83 3ly2 s ASP 433 Ca 0.38 -1.41 0.19 0.00 -0.52 0.00 0.00 52.55 51.20 3ly2 s ASP 433 Cb 0.22 -2.10 1.33 0.00 -1.46 0.00 0.00 42.92 40.91 3ly2 s ASP 433 CO 0.31 -0.61 2.10 0.07 0.52 0.00 0.00 175.17 177.57 3ly2 h LYS 434 N 8.62 0.00 -0.11 4.34 2.10 -1.91 -2.26 116.57 127.35 3ly2 h LYS 434 Ca -0.26 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.31 3ly2 h LYS 434 Cb 1.10 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.43 3ly2 h LYS 434 CO 0.83 0.00 -0.24 0.45 -2.00 0.00 0.00 179.45 178.50 3ly2 h HIS 435 N 0.00 0.45 -0.72 0.07 3.86 -1.99 -3.29 115.15 113.52 3ly2 h HIS 435 Ca 0.08 -0.17 -0.20 0.00 -1.16 0.00 0.00 60.37 58.93 3ly2 h HIS 435 Cb 0.33 -0.08 -0.12 0.00 1.06 0.00 0.00 27.41 28.60 3ly2 h HIS 435 CO 0.00 0.85 0.25 0.25 0.86 0.00 0.00 177.93 180.14 3ly2 n THR 436 N -4.48 2.93 -2.48 2.45 -2.24 -1.08 -4.99 114.28 104.38 3ly2 n THR 436 Ca -0.07 -1.65 -0.31 0.00 -2.27 0.00 0.00 64.05 59.75 3ly2 n THR 436 Cb 0.44 -0.35 -0.03 0.00 -2.10 0.00 0.00 70.33 68.29 3ly2 n THR 436 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ly2 s ALA 437 N -2.99 3.17 -0.41 6.98 0.00 -0.87 -4.96 121.76 122.67 3ly2 s ALA 437 Ca 0.55 0.01 0.06 0.00 0.00 0.00 0.00 51.96 52.58 3ly2 s ALA 437 Cb 0.44 -2.97 0.21 0.00 0.00 0.00 0.00 23.12 20.79 3ly2 s ALA 437 CO 0.14 -0.23 0.47 -1.13 0.00 0.00 0.00 175.76 175.01 3ly2 n SER 438 N -1.66 -0.56 -0.20 0.00 3.41 -1.26 -5.04 113.62 108.31 3ly2 n SER 438 Ca 0.05 -2.58 -0.12 0.00 -0.26 0.00 0.00 58.87 55.96 3ly2 n SER 438 Cb 0.54 -0.30 -0.08 0.00 -0.26 0.00 0.00 64.21 64.10 3ly2 n SER 438 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 3ly2 h VAL 439 N 3.54 0.02 -0.22 -3.33 2.07 -1.99 -1.10 116.25 115.24 3ly2 h VAL 439 Ca 0.16 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.72 3ly2 h VAL 439 Cb 0.92 0.02 -0.05 0.00 -1.52 0.00 0.00 31.29 30.66 3ly2 h VAL 439 CO 0.38 0.00 -0.10 -0.33 0.02 0.00 0.00 177.57 177.54 3ly2 h GLU 440 N -0.30 -0.06 -0.52 1.57 3.07 -1.92 -1.45 114.58 114.96 3ly2 h GLU 440 Ca 0.11 0.00 0.03 0.00 -0.50 0.00 0.00 59.36 59.01 3ly2 h GLU 440 Cb 0.56 0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 28.45 3ly2 h GLU 440 CO -0.67 -0.04 0.30 -0.22 -1.40 0.00 0.00 179.01 176.98 3ly2 h LYS 441 N -0.06 0.57 -0.73 2.33 3.64 -1.76 -2.53 116.57 118.02 3ly2 h LYS 441 Ca 0.12 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.47 3ly2 h LYS 441 Cb 0.24 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 31.90 3ly2 h LYS 441 CO -0.26 0.38 0.48 0.77 -2.27 0.00 0.00 179.45 178.54 3ly2 h SER 442 N 0.58 0.85 -0.44 4.20 0.02 -0.71 -1.81 113.55 116.25 3ly2 h SER 442 Ca 0.22 -0.03 0.02 0.00 -0.84 0.00 0.00 61.79 61.16 3ly2 h SER 442 Cb 0.06 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.36 3ly2 h SER 442 CO -0.12 0.62 0.26 1.56 -1.14 0.00 0.00 176.83 178.01 3ly2 h GLN 443 N 1.00 0.50 -0.87 3.45 1.08 -0.92 0.14 115.11 119.49 3ly2 h GLN 443 Ca 0.27 -0.03 0.03 0.00 -1.45 0.00 0.00 58.65 57.47 3ly2 h GLN 443 Cb -0.11 -0.11 -0.05 0.00 -0.05 0.00 0.00 27.48 27.16 3ly2 h GLN 443 CO -0.06 0.33 0.57 0.28 -0.95 0.00 0.00 178.83 179.00 3ly2 h VAL 444 N 0.52 1.16 -0.38 -0.54 2.07 -1.05 0.55 116.25 118.58 3ly2 h VAL 444 Ca 0.17 -0.38 -0.11 0.00 0.82 0.00 0.00 66.70 67.20 3ly2 h VAL 444 Cb 0.01 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 29.72 3ly2 h VAL 444 CO -0.08 0.20 -0.22 1.23 0.02 0.00 0.00 177.57 178.73 3ly2 h GLY 445 N 1.12 0.80 1.02 2.17 0.00 -0.74 -0.22 103.07 107.22 3ly2 h GLY 445 Ca 0.34 -0.67 -0.04 0.00 0.00 0.00 0.00 47.33 46.96 3ly2 h GLY 445 CO -0.11 0.62 0.29 -2.75 0.00 0.00 0.00 176.54 174.59 3ly2 h PHE 446 N 0.65 1.06 -0.14 5.60 3.57 0.14 -0.84 116.94 126.99 3ly2 h PHE 446 Ca 0.09 -0.08 -0.08 0.00 3.53 0.00 0.00 57.97 61.44 3ly2 h PHE 446 Cb 0.72 -0.32 -0.00 0.00 2.79 0.00 0.00 35.95 39.13 3ly2 h PHE 446 CO 0.04 0.82 -0.21 0.82 -2.23 0.00 0.00 178.31 177.54 3ly2 h ILE 447 N 1.00 1.36 -0.53 1.41 2.04 -0.62 -1.02 117.51 121.15 3ly2 h ILE 447 Ca 0.24 -1.44 -0.10 0.00 1.00 0.00 0.00 64.86 64.55 3ly2 h ILE 447 Cb 0.19 1.97 -0.02 0.00 -0.74 0.00 0.00 36.82 38.23 3ly2 h ILE 447 CO -0.02 0.42 -0.07 0.44 0.00 0.00 0.00 178.15 178.93 3ly2 h ASP 448 N -0.00 0.96 0.32 1.72 3.32 -0.91 0.40 116.42 122.23 3ly2 h ASP 448 Ca 0.01 -0.29 -0.32 0.00 0.02 0.00 0.00 57.03 56.45 3ly2 h ASP 448 Cb 0.78 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 40.03 3ly2 h ASP 448 CO 0.05 1.05 -1.89 -1.22 -1.72 0.00 0.00 179.24 175.50 3ly2 n TYR 449 N -4.16 0.90 0.00 4.55 4.02 -0.33 -4.50 117.16 117.64 3ly2 n TYR 449 Ca 0.02 0.28 -0.02 0.00 -0.01 0.00 0.00 57.90 58.17 3ly2 n TYR 449 Cb 0.37 -1.15 -0.01 0.00 -0.02 0.00 0.00 39.34 38.53 3ly2 n TYR 449 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 3ly2 n ILE 450 N -3.12 1.02 0.01 -0.72 5.41 -0.51 -4.70 119.36 116.74 3ly2 n ILE 450 Ca -0.24 0.28 -0.12 0.00 1.00 0.00 0.00 62.75 63.67 3ly2 n ILE 450 Cb 1.06 -1.69 -0.08 0.00 -0.71 0.00 0.00 39.64 38.22 3ly2 n ILE 450 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 3ly2 h VAL 451 N -0.26 1.21 -0.39 1.39 2.07 -1.21 -2.87 116.25 116.19 3ly2 h VAL 451 Ca 0.00 -0.62 -0.02 0.00 0.82 0.00 0.00 66.70 66.89 3ly2 h VAL 451 Cb 0.26 1.62 -0.02 0.00 -1.52 0.00 0.00 31.29 31.63 3ly2 h VAL 451 CO 0.00 0.16 0.18 -0.74 0.02 0.00 0.00 177.57 177.19 3ly2 h HIS 452 N -0.25 0.57 -0.99 1.57 -0.00 -0.43 -1.30 115.15 114.31 3ly2 h HIS 452 Ca 0.00 -0.03 0.04 0.00 -0.00 0.00 0.00 60.37 60.38 3ly2 h HIS 452 Cb 0.26 -0.17 -0.06 0.00 -0.00 0.00 0.00 27.41 27.44 3ly2 h HIS 452 CO 0.01 0.48 0.65 -1.35 -0.00 0.00 0.00 177.93 177.72 3ly2 h PRO 453 N 0.49 1.20 -0.20 5.26 0.11 -1.73 0.20 132.00 137.33 3ly2 h PRO 453 Ca 0.13 -0.07 -0.06 0.00 0.11 0.00 0.00 66.00 66.11 3ly2 h PRO 453 Cb 0.13 -0.27 -0.00 0.00 0.11 0.00 0.00 31.00 30.96 3ly2 h PRO 453 CO -0.02 0.79 -0.12 1.25 -0.21 0.00 0.00 178.00 179.69 3ly2 h LEU 454 N 1.23 0.45 -0.76 2.35 5.85 -1.26 -2.97 115.31 120.20 3ly2 h LEU 454 Ca 0.40 -0.43 -0.10 0.00 0.84 0.00 0.00 57.88 58.59 3ly2 h LEU 454 Cb 0.03 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 3ly2 h LEU 454 CO -0.13 0.79 -0.47 -0.50 -0.34 0.00 0.00 178.44 177.78 3ly2 h TRP 455 N 0.12 0.00 -0.62 1.25 4.06 -1.07 -2.04 115.95 117.65 3ly2 h TRP 455 Ca 0.04 0.00 -0.08 0.00 2.06 0.00 0.00 58.89 60.91 3ly2 h TRP 455 Cb 0.63 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.76 3ly2 h TRP 455 CO 0.07 0.47 0.09 1.49 -3.56 0.00 0.00 178.44 177.00 3ly2 h GLU 456 N 0.00 1.02 -0.22 0.49 4.81 -0.96 0.37 114.58 120.09 3ly2 h GLU 456 Ca -0.00 -0.27 -0.19 0.00 -0.13 0.00 0.00 59.36 58.76 3ly2 h GLU 456 Cb 1.03 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.29 3ly2 h GLU 456 CO 0.06 0.95 -0.63 1.15 -0.73 0.00 0.00 179.01 179.81 3ly2 h THR 457 N 0.96 1.29 -0.38 0.32 2.02 -1.35 -1.69 112.91 114.08 3ly2 h THR 457 Ca 0.19 -1.84 -0.06 0.00 0.77 0.00 0.00 66.41 65.47 3ly2 h THR 457 Cb 0.43 1.79 -0.01 0.00 -1.74 0.00 0.00 68.15 68.62 3ly2 h THR 457 CO 0.01 0.59 -0.01 -0.25 0.37 0.00 0.00 175.52 176.24 3ly2 h TRP 458 N 0.57 0.73 -0.37 3.16 2.91 -1.02 -1.12 115.95 120.82 3ly2 h TRP 458 Ca -0.01 -0.13 0.03 0.00 1.13 0.00 0.00 58.89 59.91 3ly2 h TRP 458 Cb 1.24 -0.19 -0.02 0.00 -0.51 0.00 0.00 29.16 29.68 3ly2 h TRP 458 CO 0.07 0.76 0.25 0.00 -1.03 0.00 0.00 178.44 178.49 3ly2 h ALA 459 N 0.87 1.86 -0.25 2.65 0.00 -0.23 -1.24 119.26 122.91 3ly2 h ALA 459 Ca 0.11 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 3ly2 h ALA 459 Cb 0.48 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3ly2 h ALA 459 CO 0.02 0.10 -0.08 0.22 0.00 0.00 0.00 179.25 179.51 3ly2 h ASP 460 N 0.39 0.50 -0.42 0.00 3.58 -0.64 -1.06 116.42 118.77 3ly2 h ASP 460 Ca 0.15 -0.38 -0.03 0.00 0.42 0.00 0.00 57.03 57.18 3ly2 h ASP 460 Cb 0.11 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 41.00 3ly2 h ASP 460 CO -0.03 0.77 0.14 0.25 -2.88 0.00 0.00 179.24 177.49 3ly2 h LEU 461 N 0.22 0.60 -3.58 2.28 5.85 -0.24 -3.16 115.31 117.30 3ly2 h LEU 461 Ca 0.06 -0.19 -0.16 0.00 0.84 0.00 0.00 57.88 58.43 3ly2 h LEU 461 Cb 0.56 -0.16 -0.09 0.00 0.37 0.00 0.00 40.66 41.34 3ly2 h LEU 461 CO 0.03 0.63 0.16 1.33 -0.34 0.00 0.00 178.44 180.25 3ly2 n VAL 462 N -4.59 2.75 -1.57 1.05 0.24 -0.57 -4.96 118.33 110.68 3ly2 n VAL 462 Ca 0.00 -1.84 -0.51 0.00 -2.04 0.00 0.00 64.34 59.96 3ly2 n VAL 462 Cb 0.17 -0.33 -0.05 0.00 -1.47 0.00 0.00 33.84 32.16 3ly2 n VAL 462 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 3ly2 n GLN 463 N -0.34 1.05 -0.84 7.34 7.27 -0.40 -0.72 117.38 130.73 3ly2 n GLN 463 Ca 0.35 0.38 0.07 0.00 0.07 0.00 0.00 57.00 57.87 3ly2 n GLN 463 Cb 1.23 -1.91 0.39 0.00 2.41 0.00 0.00 30.24 32.36 3ly2 n GLN 463 CO 0.00 0.00 0.00 -0.35 0.07 0.00 0.00 177.06 176.78 3ly2 n PRO 464 N 2.00 4.67 -0.06 3.69 -0.04 -1.26 -4.97 135.00 139.03 3ly2 n PRO 464 Ca 0.17 -3.13 0.22 0.00 -0.04 0.00 0.00 63.50 60.72 3ly2 n PRO 464 Cb 0.21 -2.21 0.69 0.00 -0.04 0.00 0.00 33.50 32.15 3ly2 n PRO 464 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3ly2 h ASP 465 N 3.78 0.03 -0.58 3.54 3.32 -1.22 -2.69 116.42 122.60 3ly2 h ASP 465 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3ly2 h ASP 465 Cb 1.91 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.46 3ly2 h ASP 465 CO 0.46 0.01 0.00 0.00 -1.72 0.00 0.00 179.24 177.99 3ly2 n ALA 466 N -2.65 3.12 -0.37 3.45 0.00 -1.26 -4.60 120.51 118.19 3ly2 n ALA 466 Ca 0.12 -1.69 -0.01 0.00 0.00 0.00 0.00 53.44 51.87 3ly2 n ALA 466 Cb 0.70 -0.95 0.13 0.00 0.00 0.00 0.00 19.45 19.32 3ly2 n ALA 466 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 3ly2 h GLN 467 N 3.71 1.27 -0.60 0.00 5.75 -1.82 -1.74 115.11 121.67 3ly2 h GLN 467 Ca 0.00 -0.08 -0.03 0.00 -0.15 0.00 0.00 58.65 58.39 3ly2 h GLN 467 Cb 1.47 -0.29 -0.03 0.00 1.07 0.00 0.00 27.48 29.71 3ly2 h GLN 467 CO 0.25 0.84 0.24 -0.44 -2.65 0.00 0.00 178.83 177.07 3ly2 h ASP 468 N 1.30 0.82 -0.95 -0.69 3.45 -1.85 -0.94 116.42 117.57 3ly2 h ASP 468 Ca 0.39 -0.17 -0.01 0.00 0.43 0.00 0.00 57.03 57.67 3ly2 h ASP 468 Cb -0.06 -0.21 -0.05 0.00 -0.56 0.00 0.00 39.33 38.45 3ly2 h ASP 468 CO -0.11 0.77 0.57 0.40 -1.57 0.00 0.00 179.24 179.30 3ly2 h ILE 469 N 0.83 1.26 -0.73 0.35 2.04 -1.79 -0.92 117.51 118.55 3ly2 h ILE 469 Ca 0.20 -0.56 -0.02 0.00 1.00 0.00 0.00 64.86 65.48 3ly2 h ILE 469 Cb 0.20 -0.08 -0.03 0.00 -0.74 0.00 0.00 36.82 36.17 3ly2 h ILE 469 CO -0.02 0.27 0.38 0.25 0.00 0.00 0.00 178.15 179.04 3ly2 h LEU 470 N 1.30 0.93 -0.40 1.44 5.85 -0.72 -0.62 115.31 123.10 3ly2 h LEU 470 Ca 0.34 -0.11 -0.16 0.00 0.84 0.00 0.00 57.88 58.79 3ly2 h LEU 470 Cb -0.06 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.73 3ly2 h LEU 470 CO -0.06 0.78 -0.38 0.44 -0.34 0.00 0.00 178.44 178.88 3ly2 h ASP 471 N 1.02 1.01 -0.60 1.25 3.32 -0.64 -2.08 116.42 119.70 3ly2 h ASP 471 Ca 0.26 -0.46 -0.09 0.00 0.02 0.00 0.00 57.03 56.75 3ly2 h ASP 471 Cb 0.07 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.31 3ly2 h ASP 471 CO -0.04 1.27 0.01 0.74 -1.72 0.00 0.00 179.24 179.50 3ly2 h THR 472 N 0.78 1.27 -0.81 0.35 2.02 -1.01 0.47 112.91 115.98 3ly2 h THR 472 Ca 0.06 -1.13 -0.01 0.00 0.77 0.00 0.00 66.41 66.10 3ly2 h THR 472 Cb 0.97 0.80 -0.04 0.00 -1.74 0.00 0.00 68.15 68.14 3ly2 h THR 472 CO 0.09 0.41 0.48 0.25 0.37 0.00 0.00 175.52 177.12 3ly2 h LEU 473 N 0.96 0.98 -0.35 2.58 5.85 -1.04 0.10 115.31 124.40 3ly2 h LEU 473 Ca 0.17 -0.07 -0.08 0.00 0.84 0.00 0.00 57.88 58.73 3ly2 h LEU 473 Cb 0.54 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 3ly2 h LEU 473 CO 0.03 0.77 -0.11 -0.08 -0.34 0.00 0.00 178.44 178.71 3ly2 h GLU 474 N 1.11 0.69 -0.49 1.25 4.57 -0.95 -1.37 114.58 119.40 3ly2 h GLU 474 Ca 0.29 -0.28 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 3ly2 h GLU 474 Cb -0.02 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.51 3ly2 h GLU 474 CO -0.05 0.87 0.32 -0.44 -1.18 0.00 0.00 179.01 178.52 3ly2 h ASP 475 N 0.48 0.58 -0.28 1.04 3.32 -0.48 -2.36 116.42 118.71 3ly2 h ASP 475 Ca 0.08 -0.03 -0.06 0.00 0.02 0.00 0.00 57.03 57.04 3ly2 h ASP 475 Cb 0.63 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 40.02 3ly2 h ASP 475 CO 0.04 0.43 -0.02 0.78 -1.72 0.00 0.00 179.24 178.75 3ly2 h ASN 476 N 0.66 0.59 -0.15 6.45 2.35 -0.69 -2.41 115.58 122.38 3ly2 h ASN 476 Ca 0.18 -0.13 -0.00 0.00 -0.55 0.00 0.00 56.30 55.80 3ly2 h ASN 476 Cb -0.05 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.15 3ly2 h ASN 476 CO -0.04 0.67 0.09 -0.09 -1.65 0.00 0.00 177.43 176.41 3ly2 h ARG 477 N 0.58 0.21 -0.42 0.81 2.43 -0.81 -2.43 114.38 114.75 3ly2 h ARG 477 Ca 0.12 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.24 3ly2 h ARG 477 Cb 0.40 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 3ly2 h ARG 477 CO 0.02 0.21 0.14 -0.91 -1.51 0.00 0.00 179.97 177.92 3ly2 h ASN 478 N 0.16 0.55 0.17 -3.80 2.35 -1.25 0.11 115.58 113.86 3ly2 h ASN 478 Ca 0.05 -0.06 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 3ly2 h ASN 478 Cb 0.05 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.29 3ly2 h ASN 478 CO -0.01 0.52 -0.08 -0.25 -1.65 0.00 0.00 177.43 175.96 3ly2 h TRP 479 N 0.60 -0.21 0.00 1.19 7.01 -1.18 0.20 115.95 123.55 3ly2 h TRP 479 Ca 0.14 -0.00 -0.04 0.00 2.11 0.00 0.00 58.89 61.10 3ly2 h TRP 479 Cb 0.16 0.07 -0.01 0.00 -2.10 0.00 0.00 29.16 27.28 3ly2 h TRP 479 CO 0.01 0.01 -0.21 1.88 -2.79 0.00 0.00 178.44 177.34 3ly2 h TYR 480 N -0.40 0.00 -0.13 2.65 0.05 -1.19 -1.34 116.97 116.61 3ly2 h TYR 480 Ca -0.02 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.75 3ly2 h TYR 480 Cb 0.31 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.05 3ly2 h TYR 480 CO -0.01 0.21 0.06 0.37 -1.05 0.00 0.00 178.16 177.73 3ly2 h GLN 481 N 0.00 0.18 0.00 4.88 5.75 -0.20 -2.69 115.11 123.04 3ly2 h GLN 481 Ca -0.00 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 3ly2 h GLN 481 Cb 0.40 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 28.92 3ly2 h GLN 481 CO 0.03 0.25 0.00 -1.13 -2.65 0.00 0.00 178.83 175.33 3ly2 n SER 482 N -4.92 0.60 -0.38 -0.69 3.41 0.65 -2.85 113.62 109.43 3ly2 n SER 482 Ca -0.05 0.62 0.12 0.00 -0.26 0.00 0.00 58.87 59.30 3ly2 n SER 482 Cb 0.10 -0.76 0.25 0.00 -0.26 0.00 0.00 64.21 63.54 3ly2 n SER 482 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3ly2 n MET 483 N -2.13 1.10 -1.84 4.33 2.81 -0.60 -4.90 117.12 115.89 3ly2 n MET 483 Ca 0.03 -0.76 -0.42 0.00 -1.81 0.00 0.00 57.70 54.74 3ly2 n MET 483 Cb 0.27 -1.48 -0.03 0.00 -0.71 0.00 0.00 33.22 31.27 3ly2 n MET 483 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 3ly2 s ILE 484 N -2.43 2.95 -2.00 2.02 1.01 -1.13 -4.95 121.20 116.67 3ly2 s ILE 484 Ca 0.24 0.31 0.06 0.00 0.00 0.00 0.00 60.65 61.26 3ly2 s ILE 484 Cb 0.19 -3.20 0.16 0.00 0.01 0.00 0.00 42.46 39.62 3ly2 s ILE 484 CO 0.51 -0.01 0.81 -2.65 0.00 0.00 0.00 174.94 173.60