#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k1d n GLY 126 N 0.00 1.81 0.00 -0.72 0.00 -1.26 -4.67 105.19 100.35 2k1d n GLY 126 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2k1d n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k1d n GLY 127 N 0.00 0.54 3.21 -0.02 0.00 -1.26 -4.87 105.19 102.79 2k1d n GLY 127 Ca 0.00 0.08 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 2k1d n GLY 127 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2k1d s TYR 128 N 0.00 3.23 0.54 1.61 1.51 -1.26 -4.55 117.35 118.42 2k1d s TYR 128 Ca 0.00 -1.67 -0.20 0.00 -1.01 0.00 0.00 57.07 54.19 2k1d s TYR 128 Cb 0.00 -2.15 -0.06 0.00 -0.11 0.00 0.00 41.96 39.65 2k1d s TYR 128 CO 0.00 -0.76 1.16 0.54 -1.11 0.00 0.00 175.55 175.38 2k1d s VAL 129 N 1.31 3.01 0.07 0.71 0.11 -1.26 -5.04 120.40 119.31 2k1d s VAL 129 Ca -0.03 0.66 0.05 0.00 -2.93 0.00 0.00 61.98 59.73 2k1d s VAL 129 Cb -0.19 -3.28 -0.04 0.00 -1.53 0.00 0.00 36.38 31.34 2k1d s VAL 129 CO -0.00 -0.11 -0.06 -0.76 -3.33 0.00 0.00 175.10 170.83 2k1d s LEU 130 N -3.70 3.19 0.00 2.54 2.01 -1.26 -4.95 118.68 116.51 2k1d s LEU 130 Ca 0.72 -0.26 0.00 0.00 0.01 0.00 0.00 54.13 54.60 2k1d s LEU 130 Cb -0.27 -1.92 0.00 0.00 0.01 0.00 0.00 46.19 44.01 2k1d s LEU 130 CO 0.30 0.21 0.00 0.61 1.01 0.00 0.00 176.35 178.48 2k1d n GLY 131 N 0.95 0.94 0.00 -3.19 0.00 -1.26 -5.08 105.19 97.54 2k1d n GLY 131 Ca -0.13 0.57 0.00 0.00 0.00 0.00 0.00 46.02 46.46 2k1d n GLY 131 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2k1d n SER 132 N 0.00 0.00 -2.39 1.61 3.41 -1.26 -4.91 113.62 110.08 2k1d n SER 132 Ca 0.00 0.79 -0.08 0.00 -0.26 0.00 0.00 58.87 59.33 2k1d n SER 132 Cb 0.00 -0.29 0.01 0.00 -0.26 0.00 0.00 64.21 63.67 2k1d n SER 132 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k1d n ALA 133 N -1.59 -1.16 -2.43 7.33 0.00 -1.26 -4.83 120.51 116.57 2k1d n ALA 133 Ca 0.00 -1.02 -0.28 0.00 0.00 0.00 0.00 53.44 52.15 2k1d n ALA 133 Cb 0.00 0.81 -0.12 0.00 0.00 0.00 0.00 19.45 20.14 2k1d n ALA 133 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2k1d s MET 134 N -2.16 1.54 0.21 0.00 -1.94 -1.26 -5.14 119.30 110.55 2k1d s MET 134 Ca 0.14 -1.41 -0.05 0.00 -1.71 0.00 0.00 55.69 52.66 2k1d s MET 134 Cb -0.03 -1.91 -0.06 0.00 2.01 0.00 0.00 34.83 34.84 2k1d s MET 134 CO 0.10 0.43 0.46 0.45 -0.01 0.00 0.00 175.02 176.46 2k1d s SER 135 N -2.41 6.49 -0.60 3.03 0.15 -1.26 -4.62 113.70 114.48 2k1d s SER 135 Ca 0.18 0.66 -0.05 0.00 0.70 0.00 0.00 55.95 57.44 2k1d s SER 135 Cb -0.09 -2.12 0.01 0.00 -1.71 0.00 0.00 66.02 62.11 2k1d s SER 135 CO 0.09 -0.06 0.64 0.54 1.20 0.00 0.00 173.24 175.65 2k1d n ARG 136 N -0.36 -1.61 0.20 5.44 1.74 -1.26 -4.90 116.66 115.91 2k1d n ARG 136 Ca -0.02 1.66 0.15 0.00 -0.77 0.00 0.00 57.85 58.87 2k1d n ARG 136 Cb 0.53 -5.55 0.60 0.00 -1.02 0.00 0.00 32.46 27.01 2k1d n ARG 136 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 2k1d h PRO 137 N 0.94 0.00 -5.91 5.56 0.13 -1.99 -3.44 132.00 127.30 2k1d h PRO 137 Ca 0.00 0.00 -0.64 0.00 -0.87 0.00 0.00 66.00 64.49 2k1d h PRO 137 Cb 0.98 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.10 2k1d h PRO 137 CO 0.25 0.00 1.46 -0.89 -0.23 0.00 0.00 178.00 178.59 2k1d n ILE 138 N -2.64 0.17 -4.15 -3.56 2.08 -1.26 -4.93 119.36 105.06 2k1d n ILE 138 Ca 0.01 -0.30 -0.29 0.00 0.56 0.00 0.00 62.75 62.73 2k1d n ILE 138 Cb 0.26 -1.74 -0.08 0.00 -0.75 0.00 0.00 39.64 37.32 2k1d n ILE 138 CO 0.00 0.00 0.00 -0.51 0.56 0.00 0.00 176.55 176.60 2k1d s ILE 139 N 7.86 3.89 -0.31 1.39 2.07 -1.26 -5.04 121.20 129.80 2k1d s ILE 139 Ca 1.09 -1.12 -0.35 0.00 -1.41 0.00 0.00 60.65 58.86 2k1d s ILE 139 Cb -0.79 -2.88 -0.11 0.00 0.13 0.00 0.00 42.46 38.82 2k1d s ILE 139 CO 0.46 0.06 2.15 1.41 -1.91 0.00 0.00 174.94 177.11 2k1d n HIS 140 N 0.39 1.71 0.05 3.50 8.25 -1.26 -4.87 115.22 122.99 2k1d n HIS 140 Ca -0.11 0.23 -0.02 0.00 -0.26 0.00 0.00 57.72 57.57 2k1d n HIS 140 Cb 0.53 -2.55 -0.01 0.00 1.12 0.00 0.00 29.99 29.07 2k1d n HIS 140 CO 0.00 0.00 0.00 0.74 0.64 0.00 0.00 176.34 177.72 2k1d h PHE 141 N 12.14 -0.12 0.00 4.41 0.04 -2.02 -3.47 116.94 127.92 2k1d h PHE 141 Ca -0.31 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.46 2k1d h PHE 141 Cb 1.31 0.04 0.00 0.00 2.20 0.00 0.00 35.95 39.50 2k1d h PHE 141 CO 0.94 -0.08 0.00 0.41 -0.60 0.00 0.00 178.31 178.99 2k1d n GLY 142 N -0.63 3.32 3.09 -1.45 0.00 -1.26 -4.97 105.19 103.28 2k1d n GLY 142 Ca -0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.88 2k1d n GLY 142 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k1d s SER 143 N -1.06 -0.05 0.34 1.61 0.01 -1.26 -5.03 113.70 108.25 2k1d s SER 143 Ca 0.00 0.65 0.04 0.00 1.31 0.00 0.00 55.95 57.94 2k1d s SER 143 Cb 0.00 0.66 0.60 0.00 0.21 0.00 0.00 66.02 67.49 2k1d s SER 143 CO 0.00 -0.21 1.90 0.44 0.41 0.00 0.00 173.24 175.78 2k1d h ASP 144 N 7.72 0.55 -0.25 2.44 5.19 -1.99 0.97 116.42 131.05 2k1d h ASP 144 Ca -0.27 -0.09 -0.11 0.00 -0.62 0.00 0.00 57.03 55.94 2k1d h ASP 144 Cb 1.14 -0.14 -0.00 0.00 0.18 0.00 0.00 39.33 40.50 2k1d h ASP 144 CO 0.24 0.57 -0.29 1.88 -3.12 0.00 0.00 179.24 178.52 2k1d h TYR 145 N 0.58 0.77 -0.00 4.55 0.05 -2.02 -3.11 116.97 117.78 2k1d h TYR 145 Ca 0.13 -0.24 -0.13 0.00 0.05 0.00 0.00 58.73 58.55 2k1d h TYR 145 Cb 0.25 -0.16 -0.02 0.00 1.01 0.00 0.00 36.73 37.82 2k1d h TYR 145 CO 0.01 0.97 -0.60 0.93 -1.05 0.00 0.00 178.16 178.42 2k1d h GLU 146 N 0.35 0.00 -0.27 4.88 4.39 -1.91 -3.00 114.58 119.01 2k1d h GLU 146 Ca 0.03 -0.00 0.03 0.00 0.34 0.00 0.00 59.36 59.76 2k1d h GLU 146 Cb 0.86 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.49 2k1d h GLU 146 CO 0.07 0.60 0.18 0.22 -1.16 0.00 0.00 179.01 178.92 2k1d h ASP 147 N 0.00 0.23 0.09 1.42 3.58 -0.75 0.24 116.42 121.23 2k1d h ASP 147 Ca -0.01 -0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.44 2k1d h ASP 147 Cb 1.06 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 42.06 2k1d h ASP 147 CO 0.08 0.16 -0.04 0.03 -2.88 0.00 0.00 179.24 176.58 2k1d h ARG 148 N 0.26 -0.11 -0.00 0.28 3.08 -1.51 -2.66 114.38 113.72 2k1d h ARG 148 Ca 0.11 0.01 -0.16 0.00 0.07 0.00 0.00 59.98 60.01 2k1d h ARG 148 Cb 0.12 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 2k1d h ARG 148 CO -0.02 0.05 -0.75 -0.92 -1.07 0.00 0.00 179.97 177.25 2k1d h TYR 149 N -0.25 0.01 0.00 3.04 3.20 -1.57 -3.08 116.97 118.32 2k1d h TYR 149 Ca -0.01 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.85 2k1d h TYR 149 Cb 0.21 -0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.48 2k1d h TYR 149 CO -0.03 0.76 -0.02 -0.92 -1.64 0.00 0.00 178.16 176.31 2k1d h TYR 150 N 0.01 0.00 -0.62 -3.82 3.20 -0.40 -1.81 116.97 113.53 2k1d h TYR 150 Ca -0.01 0.00 0.18 0.00 3.14 0.00 0.00 58.73 62.04 2k1d h TYR 150 Cb 1.33 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.57 2k1d h TYR 150 CO 0.00 0.02 0.48 -0.09 -1.64 0.00 0.00 178.16 176.93 2k1d h ARG 151 N 0.00 0.00 0.00 1.82 9.65 -1.38 0.33 114.38 124.80 2k1d h ARG 151 Ca -0.00 0.00 -0.16 0.00 -1.10 0.00 0.00 59.98 58.72 2k1d h ARG 151 Cb 0.05 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 28.60 2k1d h ARG 151 CO 0.00 0.00 -1.40 0.39 2.80 0.00 0.00 179.97 181.77 2k1d n GLU 152 N -4.16 0.62 0.09 0.20 -0.58 -0.68 -4.11 120.64 112.02 2k1d n GLU 152 Ca 0.12 0.23 -0.18 0.00 -0.42 0.00 0.00 57.16 56.90 2k1d n GLU 152 Cb 0.73 -1.81 -0.10 0.00 -0.57 0.00 0.00 31.44 29.68 2k1d n GLU 152 CO 0.00 0.00 0.00 -0.91 -0.48 0.00 0.00 177.13 175.74 2k1d h ASN 153 N 0.00 0.67 -0.43 1.62 2.35 -0.57 -3.22 115.58 116.00 2k1d h ASN 153 Ca -0.16 -0.61 0.12 0.00 -0.55 0.00 0.00 56.30 55.10 2k1d h ASN 153 Cb 1.57 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 39.71 2k1d h ASN 153 CO 0.05 1.43 0.31 0.00 -1.65 0.00 0.00 177.43 177.57 2k1d h MET 154 N 0.22 0.00 0.00 0.81 -0.00 -0.70 0.31 114.93 115.57 2k1d h MET 154 Ca -0.14 -0.00 -0.06 0.00 -0.00 0.00 0.00 59.70 59.50 2k1d h MET 154 Cb 1.82 -0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 33.41 2k1d h MET 154 CO 0.21 0.00 -0.29 0.45 -0.00 0.00 0.00 176.91 177.28 2k1d h HIS 155 N 0.00 0.00 -0.31 -0.10 3.86 -1.72 -2.93 115.15 113.96 2k1d h HIS 155 Ca 0.20 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.41 2k1d h HIS 155 Cb 0.81 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.28 2k1d h HIS 155 CO -0.00 0.29 0.00 0.54 0.86 0.00 0.00 177.93 179.62 2k1d n ARG 156 N -3.44 2.89 -1.24 2.45 5.12 0.83 -5.04 116.66 118.23 2k1d n ARG 156 Ca 0.00 -2.30 -0.36 0.00 -1.93 0.00 0.00 57.85 53.26 2k1d n ARG 156 Cb 0.47 -1.45 0.07 0.00 -1.16 0.00 0.00 32.46 30.39 2k1d n ARG 156 CO 0.00 0.00 0.00 2.48 -1.93 0.00 0.00 177.63 178.18 2k1d n TYR 157 N 0.13 -0.75 -2.17 -1.55 4.11 0.26 -4.87 117.16 112.33 2k1d n TYR 157 Ca 0.15 0.35 -0.42 0.00 -0.00 0.00 0.00 57.90 57.97 2k1d n TYR 157 Cb 0.58 -1.92 -0.03 0.00 -0.00 0.00 0.00 39.34 37.97 2k1d n TYR 157 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.86 175.61 2k1d s PRO 158 N -2.85 4.24 -0.19 -3.48 0.04 -1.26 -4.91 135.00 126.60 2k1d s PRO 158 Ca 0.65 2.02 0.14 0.00 0.04 0.00 0.00 61.00 63.85 2k1d s PRO 158 Cb -0.34 -3.69 0.39 0.00 0.04 0.00 0.00 34.50 30.90 2k1d s PRO 158 CO 0.58 -0.67 1.23 0.27 0.04 0.00 0.00 177.00 178.45 2k1d n ASN 159 N 5.93 2.09 -3.70 6.66 6.94 -1.26 -4.90 115.26 127.02 2k1d n ASN 159 Ca 0.14 -3.58 -0.11 0.00 -0.02 0.00 0.00 54.58 51.02 2k1d n ASN 159 Cb 0.43 -0.51 -0.11 0.00 -2.36 0.00 0.00 39.78 37.24 2k1d n ASN 159 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 2k1d s GLN 160 N -3.10 0.37 -0.05 -3.83 -1.52 -1.26 -4.60 119.66 105.66 2k1d s GLN 160 Ca 0.37 0.76 0.03 0.00 -1.95 0.00 0.00 55.36 54.57 2k1d s GLN 160 Cb 0.34 -0.03 0.01 0.00 -0.22 0.00 0.00 33.01 33.10 2k1d s GLN 160 CO -0.02 -0.16 -0.14 0.14 -0.25 0.00 0.00 175.29 174.86 2k1d s VAL 161 N 1.38 1.22 0.19 1.09 -7.23 -1.26 -4.96 120.40 110.84 2k1d s VAL 161 Ca -0.09 -0.56 0.02 0.00 -1.81 0.00 0.00 61.98 59.54 2k1d s VAL 161 Cb -0.09 -1.09 -0.05 0.00 0.56 0.00 0.00 36.38 35.72 2k1d s VAL 161 CO -0.12 0.37 0.00 -0.31 -0.31 0.00 0.00 175.10 174.73 2k1d s TYR 162 N 0.39 1.32 0.01 2.82 2.02 -1.26 -4.72 117.35 117.93 2k1d s TYR 162 Ca -0.10 -0.99 -0.03 0.00 -0.37 0.00 0.00 57.07 55.58 2k1d s TYR 162 Cb -0.14 -0.75 -0.01 0.00 -0.40 0.00 0.00 41.96 40.66 2k1d s TYR 162 CO 0.03 -0.16 0.04 1.52 -1.57 0.00 0.00 175.55 175.41 2k1d s TYR 163 N -3.59 0.16 0.28 2.71 1.13 -1.26 -4.30 117.35 112.48 2k1d s TYR 163 Ca 0.25 -0.33 0.11 0.00 -1.41 0.00 0.00 57.07 55.69 2k1d s TYR 163 Cb 0.06 -0.12 -0.05 0.00 -1.10 0.00 0.00 41.96 40.75 2k1d s TYR 163 CO 0.06 -0.21 -0.13 1.03 -2.51 0.00 0.00 175.55 173.79 2k1d s ARG 164 N -1.32 1.89 1.24 -3.49 0.52 -1.26 -4.77 118.95 111.76 2k1d s ARG 164 Ca -0.14 -1.68 -0.21 0.00 -0.52 0.00 0.00 55.73 53.18 2k1d s ARG 164 Cb -0.08 -1.89 0.31 0.00 0.52 0.00 0.00 34.95 33.80 2k1d s ARG 164 CO 0.00 0.32 1.11 -1.25 0.02 0.00 0.00 175.30 175.50 2k1d s PRO 165 N -3.58 -1.57 -0.86 3.54 0.04 -1.26 -4.58 135.00 126.74 2k1d s PRO 165 Ca 0.31 -0.19 -0.02 0.00 0.04 0.00 0.00 61.00 61.14 2k1d s PRO 165 Cb -0.05 -1.57 -0.03 0.00 0.04 0.00 0.00 34.50 32.90 2k1d s PRO 165 CO 0.17 -3.92 0.78 -0.12 0.04 0.00 0.00 177.00 173.95 2k1d n MET 166 N -4.88 -1.67 -3.74 4.56 0.00 -1.26 -5.02 117.12 105.11 2k1d n MET 166 Ca 0.15 1.25 -0.28 0.00 0.00 0.00 0.00 57.70 58.82 2k1d n MET 166 Cb 0.60 -5.76 -0.16 0.00 0.00 0.00 0.00 33.22 27.90 2k1d n MET 166 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 2k1d s ASP 167 N -3.15 3.20 0.52 6.12 1.11 -1.26 -5.13 116.67 118.08 2k1d s ASP 167 Ca 0.18 -1.01 -0.22 0.00 0.18 0.00 0.00 52.55 51.67 2k1d s ASP 167 Cb -0.02 -0.66 -0.06 0.00 1.07 0.00 0.00 42.92 43.24 2k1d s ASP 167 CO 0.75 -0.33 1.32 -0.62 1.18 0.00 0.00 175.17 177.47 2k1d n GLU 168 N 5.00 1.72 0.00 8.23 1.02 -1.26 -4.96 120.64 130.40 2k1d n GLU 168 Ca -0.08 0.63 0.00 0.00 -0.02 0.00 0.00 57.16 57.69 2k1d n GLU 168 Cb 0.46 -2.51 0.00 0.00 -0.02 0.00 0.00 31.44 29.37 2k1d n GLU 168 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2k1d n TYR 169 N -0.86 0.00 -3.89 -0.32 4.01 -1.26 -4.75 117.16 110.09 2k1d n TYR 169 Ca 0.09 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.55 2k1d n TYR 169 Cb 0.44 -0.41 0.02 0.00 -0.31 0.00 0.00 39.34 39.07 2k1d n TYR 169 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2k1d n SER 170 N -1.90 -3.53 -1.30 7.72 7.64 -1.26 -3.67 113.62 117.33 2k1d n SER 170 Ca 0.00 -0.82 0.16 0.00 1.01 0.00 0.00 58.87 59.22 2k1d n SER 170 Cb 0.00 -3.80 -0.07 0.00 -1.01 0.00 0.00 64.21 59.33 2k1d n SER 170 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2k1d n ASN 171 N -2.89 -7.54 0.15 6.43 3.02 -1.26 -2.88 115.26 110.30 2k1d n ASN 171 Ca -0.06 1.06 0.04 0.00 -0.03 0.00 0.00 54.58 55.58 2k1d n ASN 171 Cb 0.57 -4.28 0.44 0.00 -0.61 0.00 0.00 39.78 35.90 2k1d n ASN 171 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 2k1d h GLN 172 N -1.25 0.16 0.03 3.52 4.20 -1.99 -1.67 115.11 118.11 2k1d h GLN 172 Ca -0.11 -0.03 0.03 0.00 0.06 0.00 0.00 58.65 58.59 2k1d h GLN 172 Cb 1.23 -0.02 -0.05 0.00 0.30 0.00 0.00 27.48 28.93 2k1d h GLN 172 CO 0.05 0.29 -0.31 -0.91 -0.67 0.00 0.00 178.83 177.28 2k1d h ASN 173 N 0.16 -0.92 0.91 1.46 2.35 -1.91 -0.68 115.58 116.95 2k1d h ASN 173 Ca 0.03 0.12 -0.11 0.00 -0.55 0.00 0.00 56.30 55.79 2k1d h ASN 173 Cb 0.31 0.36 -0.02 0.00 0.05 0.00 0.00 38.32 39.03 2k1d h ASN 173 CO 0.02 -0.38 -0.51 -1.13 -1.65 0.00 0.00 177.43 173.78 2k1d h ASN 174 N -0.48 0.00 -0.09 5.81 -0.73 -1.39 -2.88 115.58 115.82 2k1d h ASN 174 Ca 0.05 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.22 2k1d h ASN 174 Cb 0.55 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 39.14 2k1d h ASN 174 CO -0.24 0.51 0.06 0.15 -0.37 0.00 0.00 177.43 177.54 2k1d h PHE 175 N 0.00 0.12 -0.14 0.67 3.57 -0.55 -0.77 116.94 119.84 2k1d h PHE 175 Ca -0.01 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.45 2k1d h PHE 175 Cb 1.10 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.80 2k1d h PHE 175 CO 0.00 0.08 -0.09 0.28 -2.23 0.00 0.00 178.31 176.34 2k1d h VAL 176 N 0.13 1.33 -0.48 1.41 2.07 -1.18 -2.85 116.25 116.68 2k1d h VAL 176 Ca 0.03 -1.19 0.09 0.00 0.82 0.00 0.00 66.70 66.46 2k1d h VAL 176 Cb -0.01 1.82 -0.07 0.00 -1.52 0.00 0.00 31.29 31.50 2k1d h VAL 176 CO -0.01 0.35 0.03 0.45 0.02 0.00 0.00 177.57 178.41 2k1d h HIS 177 N -0.05 0.03 -0.78 1.57 3.86 -1.42 -1.17 115.15 117.18 2k1d h HIS 177 Ca 0.03 0.03 0.04 0.00 -1.16 0.00 0.00 60.37 59.31 2k1d h HIS 177 Cb 0.59 0.06 -0.05 0.00 1.06 0.00 0.00 27.41 29.07 2k1d h HIS 177 CO 0.07 -0.07 0.49 -0.97 0.86 0.00 0.00 177.93 178.31 2k1d h ASN 178 N 0.15 0.80 -0.08 2.45 -0.73 -1.15 -0.67 115.58 116.35 2k1d h ASN 178 Ca 0.24 0.00 0.02 0.00 1.87 0.00 0.00 56.30 58.44 2k1d h ASN 178 Cb 0.35 -0.17 -0.00 0.00 0.27 0.00 0.00 38.32 38.77 2k1d h ASN 178 CO -0.37 0.54 0.08 0.00 -0.37 0.00 0.00 177.43 177.31 2k1d h VAL 180 N 0.00 1.36 -0.38 0.00 2.07 -0.62 -3.23 116.25 115.44 2k1d h VAL 180 Ca 0.04 -2.45 -0.03 0.00 0.82 0.00 0.00 66.70 65.08 2k1d h VAL 180 Cb 0.20 2.50 -0.02 0.00 -1.52 0.00 0.00 31.29 32.45 2k1d h VAL 180 CO -0.00 0.74 0.12 -1.13 0.02 0.00 0.00 177.57 177.31 2k1d h ASN 181 N 0.27 0.50 -0.24 0.57 -0.73 -0.91 -2.70 115.58 112.34 2k1d h ASN 181 Ca -0.12 -0.06 -0.01 0.00 1.87 0.00 0.00 56.30 57.98 2k1d h ASN 181 Cb 1.70 -0.13 -0.01 0.00 0.27 0.00 0.00 38.32 40.15 2k1d h ASN 181 CO 0.19 0.48 0.09 0.40 -0.37 0.00 0.00 177.43 178.23 2k1d h ILE 182 N 0.54 1.17 -0.42 2.57 1.08 -1.52 -1.17 117.51 119.76 2k1d h ILE 182 Ca 0.13 -0.52 0.04 0.00 -0.39 0.00 0.00 64.86 64.12 2k1d h ILE 182 Cb 0.17 1.07 -0.04 0.00 -3.07 0.00 0.00 36.82 34.95 2k1d h ILE 182 CO -0.01 0.17 0.20 0.74 -0.69 0.00 0.00 178.15 178.57 2k1d h THR 183 N 0.23 0.96 -0.69 -0.27 2.02 -1.51 -2.17 112.91 111.48 2k1d h THR 183 Ca 0.08 -0.14 -0.05 0.00 0.77 0.00 0.00 66.41 67.07 2k1d h THR 183 Cb 0.18 0.51 -0.03 0.00 -1.74 0.00 0.00 68.15 67.07 2k1d h THR 183 CO -0.01 0.08 0.23 0.40 0.37 0.00 0.00 175.52 176.59 2k1d h ILE 184 N 0.41 1.25 0.28 3.11 1.08 -1.37 -1.93 117.51 120.34 2k1d h ILE 184 Ca 0.18 -0.83 -0.01 0.00 -0.39 0.00 0.00 64.86 63.81 2k1d h ILE 184 Cb 0.10 0.47 -0.01 0.00 -3.07 0.00 0.00 36.82 34.31 2k1d h ILE 184 CO -0.14 0.33 -0.29 0.50 -0.69 0.00 0.00 178.15 177.85 2k1d h LYS 185 N 1.01 -0.56 -0.13 2.37 3.11 -0.59 -1.96 116.57 119.83 2k1d h LYS 185 Ca 0.23 0.04 0.04 0.00 -2.81 0.00 0.00 60.65 58.14 2k1d h LYS 185 Cb 0.26 0.13 -0.01 0.00 -1.00 0.00 0.00 32.23 31.61 2k1d h LYS 185 CO -0.01 -0.37 0.13 1.96 -2.81 0.00 0.00 179.45 178.35 2k1d h GLN 186 N -0.58 0.00 -0.55 1.90 7.50 -1.46 -1.11 115.11 120.81 2k1d h GLN 186 Ca -0.04 0.00 0.16 0.00 0.50 0.00 0.00 58.65 59.27 2k1d h GLN 186 Cb 0.50 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.01 2k1d h GLN 186 CO -0.04 0.00 0.45 1.25 -1.50 0.00 0.00 178.83 178.99 2k1d h HIS 187 N 0.00 0.00 -0.42 2.96 2.76 -0.54 0.89 115.15 120.80 2k1d h HIS 187 Ca 0.06 0.00 0.12 0.00 -2.20 0.00 0.00 60.37 58.35 2k1d h HIS 187 Cb 0.32 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.26 2k1d h HIS 187 CO 0.00 0.00 0.33 0.00 -1.30 0.00 0.00 177.93 176.96 2k1d h THR 188 N 0.00 0.68 0.54 6.26 1.03 -1.17 -1.55 112.91 118.69 2k1d h THR 188 Ca 0.26 0.00 -0.03 0.00 -0.01 0.00 0.00 66.41 66.64 2k1d h THR 188 Cb 1.16 0.76 0.01 0.00 -1.07 0.00 0.00 68.15 69.01 2k1d h THR 188 CO -0.00 0.00 -0.26 0.58 -0.01 0.00 0.00 175.52 175.83 2k1d h VAL 189 N 0.00 0.27 -0.00 0.00 2.07 -1.03 -3.08 116.25 114.48 2k1d h VAL 189 Ca 0.20 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.29 2k1d h VAL 189 Cb 0.86 0.38 -0.00 0.00 -1.52 0.00 0.00 31.29 31.01 2k1d h VAL 189 CO -0.00 0.04 0.00 0.74 0.02 0.00 0.00 177.57 178.38 2k1d h THR 190 N -1.05 0.63 -0.23 2.57 2.02 -1.56 -1.42 112.91 113.86 2k1d h THR 190 Ca -0.07 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.17 2k1d h THR 190 Cb 0.62 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.02 2k1d h THR 190 CO 0.12 0.00 0.25 0.74 0.37 0.00 0.00 175.52 177.00 2k1d h THR 191 N 0.00 0.46 0.00 3.16 2.02 -1.20 0.14 112.91 117.48 2k1d h THR 191 Ca 0.00 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.09 2k1d h THR 191 Cb 0.01 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.21 2k1d h THR 191 CO -0.00 0.00 -0.43 0.74 0.37 0.00 0.00 175.52 176.20 2k1d h THR 192 N 0.00 1.17 -0.72 3.16 2.02 -1.34 -2.52 112.91 114.68 2k1d h THR 192 Ca 0.11 -1.53 -0.00 0.00 0.77 0.00 0.00 66.41 65.76 2k1d h THR 192 Cb 0.60 1.86 -0.04 0.00 -1.74 0.00 0.00 68.15 68.83 2k1d h THR 192 CO -0.00 0.42 0.44 0.74 0.37 0.00 0.00 175.52 177.48 2k1d h THR 193 N 0.00 1.20 0.00 3.16 2.02 -0.89 -1.68 112.91 116.72 2k1d h THR 193 Ca -0.00 -0.43 0.00 0.00 0.77 0.00 0.00 66.41 66.74 2k1d h THR 193 Cb 0.82 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 67.41 2k1d h THR 193 CO 0.06 0.21 -0.58 0.29 0.37 0.00 0.00 175.52 175.87 2k1d n LYS 194 N -4.40 0.19 -2.75 6.66 5.02 -1.13 -4.95 118.16 116.81 2k1d n LYS 194 Ca 0.07 0.05 -0.20 0.00 -2.02 0.00 0.00 58.31 56.21 2k1d n LYS 194 Cb 0.06 -1.62 0.01 0.00 -0.02 0.00 0.00 35.03 33.47 2k1d n LYS 194 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2k1d n GLY 195 N 1.40 -0.51 3.43 0.72 0.00 -0.63 -4.97 105.19 104.63 2k1d n GLY 195 Ca 0.04 0.06 -0.23 0.00 0.00 0.00 0.00 46.02 45.89 2k1d n GLY 195 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k1d s GLU 196 N -5.40 1.81 0.52 1.61 0.41 -1.23 -5.07 118.70 111.35 2k1d s GLU 196 Ca 0.16 -2.08 0.06 0.00 -0.41 0.00 0.00 54.97 52.70 2k1d s GLU 196 Cb -0.07 -0.34 0.03 0.00 -1.78 0.00 0.00 34.13 31.97 2k1d s GLU 196 CO 0.20 -0.49 0.42 -0.80 -0.49 0.00 0.00 175.26 174.10 2k1d s ASN 197 N -3.51 4.73 -0.08 -0.19 0.01 -1.26 -4.79 114.94 109.84 2k1d s ASN 197 Ca 0.30 -1.12 0.03 0.00 -0.71 0.00 0.00 52.86 51.36 2k1d s ASN 197 Cb 0.03 0.21 -0.01 0.00 0.41 0.00 0.00 41.25 41.88 2k1d s ASN 197 CO 0.17 -1.03 -0.19 0.72 -1.51 0.00 0.00 177.10 175.27 2k1d s PHE 198 N -2.71 2.63 0.33 2.20 -0.71 -1.26 -5.10 117.98 113.36 2k1d s PHE 198 Ca 0.39 -0.61 0.01 0.00 -1.04 0.00 0.00 56.93 55.68 2k1d s PHE 198 Cb -0.02 -1.70 -0.03 0.00 -1.21 0.00 0.00 43.02 40.05 2k1d s PHE 198 CO 0.24 -0.15 0.52 0.95 -1.34 0.00 0.00 175.22 175.44 2k1d s THR 199 N -0.06 5.13 0.53 -4.49 -4.23 -1.26 -4.90 115.64 106.35 2k1d s THR 199 Ca -0.05 -0.53 0.18 0.00 -1.18 0.00 0.00 61.69 60.11 2k1d s THR 199 Cb -0.14 -3.86 0.28 0.00 1.34 0.00 0.00 72.50 70.12 2k1d s THR 199 CO 0.04 -0.52 2.17 -0.33 -0.54 0.00 0.00 174.62 175.44 2k1d h GLU 200 N 0.82 0.00 0.17 3.99 5.08 -2.00 0.17 114.58 122.82 2k1d h GLU 200 Ca -0.50 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 57.60 2k1d h GLU 200 Cb 1.22 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.50 2k1d h GLU 200 CO 0.61 0.00 -1.12 1.15 -1.00 0.00 0.00 179.01 178.65 2k1d h THR 201 N 0.00 1.38 0.03 1.13 2.02 -2.00 -3.06 112.91 112.41 2k1d h THR 201 Ca 0.00 -2.55 -0.00 0.00 0.77 0.00 0.00 66.41 64.63 2k1d h THR 201 Cb 0.00 3.02 0.00 0.00 -1.74 0.00 0.00 68.15 69.43 2k1d h THR 201 CO -0.00 0.75 -0.01 0.44 0.37 0.00 0.00 175.52 177.07 2k1d h ASP 202 N -0.05 -0.03 -0.69 4.18 3.32 -1.82 -3.09 116.42 118.24 2k1d h ASP 202 Ca -0.19 -0.43 0.13 0.00 0.02 0.00 0.00 57.03 56.57 2k1d h ASP 202 Cb 1.86 0.01 -0.04 0.00 0.22 0.00 0.00 39.33 41.38 2k1d h ASP 202 CO 0.21 0.42 0.47 1.62 -1.72 0.00 0.00 179.24 180.23 2k1d h VAL 203 N -0.48 0.83 -0.03 -1.35 3.04 -0.83 -1.77 116.25 115.65 2k1d h VAL 203 Ca -0.00 -0.14 0.00 0.00 -1.01 0.00 0.00 66.70 65.55 2k1d h VAL 203 Cb 0.45 0.39 -0.00 0.00 -2.01 0.00 0.00 31.29 30.12 2k1d h VAL 203 CO 0.01 0.07 0.02 0.50 -1.01 0.00 0.00 177.57 177.16 2k1d h LYS 204 N 0.41 0.04 -0.77 4.17 1.63 -1.45 0.19 116.57 120.79 2k1d h LYS 204 Ca 0.33 -0.00 0.12 0.00 -0.85 0.00 0.00 60.65 60.25 2k1d h LYS 204 Cb 0.74 -0.01 -0.08 0.00 -0.60 0.00 0.00 32.23 32.28 2k1d h LYS 204 CO -0.10 0.05 0.37 0.52 -3.45 0.00 0.00 179.45 176.85 2k1d h MET 205 N 0.02 0.57 -0.23 1.90 2.86 -1.26 -1.34 114.93 117.44 2k1d h MET 205 Ca 0.01 -0.03 -0.19 0.00 -2.06 0.00 0.00 59.70 57.43 2k1d h MET 205 Cb 0.02 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 31.55 2k1d h MET 205 CO -0.00 0.37 -0.61 0.52 1.06 0.00 0.00 176.91 178.25 2k1d h MET 206 N 0.58 0.79 -0.91 1.72 2.86 -1.32 -3.10 114.93 115.56 2k1d h MET 206 Ca 0.40 -0.54 0.20 0.00 -2.06 0.00 0.00 59.70 57.70 2k1d h MET 206 Cb 0.52 0.08 -0.07 0.00 0.06 0.00 0.00 31.60 32.19 2k1d h MET 206 CO -0.33 1.16 0.60 0.93 1.06 0.00 0.00 176.91 180.33 2k1d h GLU 207 N 0.59 0.43 -0.08 1.72 5.08 0.51 0.23 114.58 123.07 2k1d h GLU 207 Ca -0.00 -0.03 -0.17 0.00 -1.00 0.00 0.00 59.36 58.16 2k1d h GLU 207 Cb 1.21 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.36 2k1d h GLU 207 CO 0.13 0.29 -0.68 -0.09 -1.00 0.00 0.00 179.01 177.65 2k1d h ARG 208 N 0.45 0.36 -0.06 2.33 9.65 -1.36 -2.67 114.38 123.08 2k1d h ARG 208 Ca 0.48 -0.28 -0.18 0.00 -1.10 0.00 0.00 59.98 58.90 2k1d h ARG 208 Cb 1.13 0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 29.75 2k1d h ARG 208 CO -0.19 0.91 -0.72 0.28 2.80 0.00 0.00 179.97 183.05 2k1d h VAL 209 N 0.25 1.40 -0.20 0.20 2.07 -0.64 -2.83 116.25 116.50 2k1d h VAL 209 Ca -0.02 -2.17 -0.14 0.00 0.82 0.00 0.00 66.70 65.19 2k1d h VAL 209 Cb 1.24 2.14 -0.01 0.00 -1.52 0.00 0.00 31.29 33.14 2k1d h VAL 209 CO 0.11 0.65 -0.46 0.58 0.02 0.00 0.00 177.57 178.47 2k1d h VAL 210 N 0.22 1.31 0.25 2.57 2.07 -0.84 -2.81 116.25 119.02 2k1d h VAL 210 Ca -0.03 -1.66 -0.01 0.00 0.82 0.00 0.00 66.70 65.82 2k1d h VAL 210 Cb 1.28 1.66 0.00 0.00 -1.52 0.00 0.00 31.29 32.71 2k1d h VAL 210 CO 0.12 0.52 -0.12 -0.08 0.02 0.00 0.00 177.57 178.02 2k1d h GLU 211 N 0.42 -0.33 -0.91 1.57 4.81 -1.45 -3.10 114.58 115.59 2k1d h GLU 211 Ca 0.03 0.02 0.17 0.00 -0.13 0.00 0.00 59.36 59.44 2k1d h GLU 211 Cb 0.97 0.07 -0.07 0.00 0.63 0.00 0.00 28.75 30.35 2k1d h GLU 211 CO 0.09 0.00 0.59 0.37 -0.73 0.00 0.00 179.01 179.33 2k1d h GLN 212 N -0.70 0.61 -0.78 1.92 -0.00 -1.55 0.72 115.11 115.33 2k1d h GLN 212 Ca -0.03 -0.04 0.10 0.00 -0.00 0.00 0.00 58.65 58.67 2k1d h GLN 212 Cb 0.48 -0.14 -0.05 0.00 0.00 0.00 0.00 27.48 27.77 2k1d h GLN 212 CO 0.06 0.40 0.51 1.98 0.00 0.00 0.00 178.83 181.78 2k1d h MET 213 N 0.63 0.69 -0.59 1.69 4.05 -1.42 -0.43 114.93 119.55 2k1d h MET 213 Ca 0.47 -0.04 0.06 0.00 -0.28 0.00 0.00 59.70 59.91 2k1d h MET 213 Cb 0.87 -0.16 -0.03 0.00 -0.80 0.00 0.00 31.60 31.48 2k1d h MET 213 CO -0.22 0.46 0.39 0.00 0.23 0.00 0.00 176.91 177.76 2k1d h ILE 215 N 0.59 1.40 -0.13 0.00 1.08 -1.13 -3.14 117.51 116.19 2k1d h ILE 215 Ca 0.25 -2.00 -0.10 0.00 -0.39 0.00 0.00 64.86 62.63 2k1d h ILE 215 Cb 0.25 2.03 0.00 0.00 -3.07 0.00 0.00 36.82 36.03 2k1d h ILE 215 CO -0.07 0.59 -0.31 0.74 -0.69 0.00 0.00 178.15 178.41 2k1d h THR 216 N 0.13 1.37 -0.75 -0.27 2.02 -0.98 -3.15 112.91 111.28 2k1d h THR 216 Ca -0.01 -1.60 0.13 0.00 0.77 0.00 0.00 66.41 65.71 2k1d h THR 216 Cb 1.10 2.07 -0.05 0.00 -1.74 0.00 0.00 68.15 69.53 2k1d h THR 216 CO 0.09 0.47 0.50 -0.61 0.37 0.00 0.00 175.52 176.34 2k1d h GLN 217 N 0.02 0.47 -3.52 6.66 -0.00 -1.27 -3.37 115.11 114.11 2k1d h GLN 217 Ca -0.00 -0.03 -0.49 0.00 -0.00 0.00 0.00 58.65 58.13 2k1d h GLN 217 Cb 0.91 -0.11 -0.40 0.00 0.00 0.00 0.00 27.48 27.89 2k1d h GLN 217 CO 0.07 0.31 -0.76 0.71 0.00 0.00 0.00 178.83 179.16 2k1d s TYR 218 N -5.47 0.83 0.16 3.99 2.02 -1.19 -5.01 117.35 112.68 2k1d s TYR 218 Ca -0.08 -0.62 -0.05 0.00 -0.37 0.00 0.00 57.07 55.95 2k1d s TYR 218 Cb 0.21 -0.93 0.00 0.00 -0.40 0.00 0.00 41.96 40.84 2k1d s TYR 218 CO 0.77 -0.53 1.40 0.93 -1.57 0.00 0.00 175.55 176.55 2k1d h GLU 219 N 8.29 0.52 -0.54 -0.62 5.08 -1.74 -3.23 114.58 122.34 2k1d h GLU 219 Ca -0.17 -0.42 0.04 0.00 -1.00 0.00 0.00 59.36 57.81 2k1d h GLU 219 Cb 1.13 0.09 -0.04 0.00 0.50 0.00 0.00 28.75 30.42 2k1d h GLU 219 CO 0.31 1.05 0.30 0.00 -1.00 0.00 0.00 179.01 179.67 2k1d h ARG 220 N 0.36 0.57 -0.41 2.33 -0.00 -1.95 -1.08 114.38 114.19 2k1d h ARG 220 Ca -0.04 -0.03 0.12 0.00 -0.50 0.00 0.00 59.98 59.53 2k1d h ARG 220 Cb 1.32 -0.13 -0.02 0.00 0.00 0.00 0.00 29.97 31.15 2k1d h ARG 220 CO 0.13 0.37 0.30 1.49 0.00 0.00 0.00 179.97 182.27 2k1d h GLU 221 N 0.58 0.00 -0.25 0.04 4.81 -1.91 0.34 114.58 118.20 2k1d h GLU 221 Ca 0.23 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.53 2k1d h GLU 221 Cb 0.09 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 2k1d h GLU 221 CO -0.13 0.00 0.22 0.66 -0.73 0.00 0.00 179.01 179.03 2k1d h SER 222 N 0.00 0.00 -0.28 1.04 4.64 -1.27 -2.08 113.55 115.61 2k1d h SER 222 Ca 0.19 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 61.57 2k1d h SER 222 Cb 0.80 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.83 2k1d h SER 222 CO -0.00 0.00 -0.09 -0.61 -0.87 0.00 0.00 176.83 175.26 2k1d h GLN 223 N 0.00 -0.03 -0.56 4.77 4.15 -1.02 0.21 115.11 122.63 2k1d h GLN 223 Ca 0.12 0.00 0.05 0.00 0.77 0.00 0.00 58.65 59.59 2k1d h GLN 223 Cb 0.56 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.23 2k1d h GLN 223 CO -0.00 -0.02 0.38 0.00 -1.93 0.00 0.00 178.83 177.26 2k1d h ALA 224 N 1.24 1.81 0.00 3.38 0.00 -1.55 0.94 119.26 125.07 2k1d h ALA 224 Ca 0.14 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.87 2k1d h ALA 224 Cb 0.24 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2k1d h ALA 224 CO -0.30 0.11 -0.75 -0.92 0.00 0.00 0.00 179.25 177.38 2k1d h TYR 225 N 0.57 0.00 0.08 0.00 3.20 -1.21 -3.26 116.97 116.34 2k1d h TYR 225 Ca 0.24 0.00 -0.27 0.00 3.14 0.00 0.00 58.73 61.83 2k1d h TYR 225 Cb 0.23 0.00 0.02 0.00 1.54 0.00 0.00 36.73 38.52 2k1d h TYR 225 CO -0.00 0.75 -1.15 -0.92 -1.64 0.00 0.00 178.16 175.21 2k1d h TYR 226 N 0.00 0.86 -3.93 -3.82 3.20 0.76 -3.45 116.97 110.58 2k1d h TYR 226 Ca -0.01 -0.52 -0.49 0.00 3.14 0.00 0.00 58.73 60.85 2k1d h TYR 226 Cb 1.42 -0.08 0.03 0.00 1.54 0.00 0.00 36.73 39.64 2k1d h TYR 226 CO 0.00 1.37 0.44 -1.14 -1.64 0.00 0.00 178.16 177.19 2k1d s GLN 227 N -3.06 4.20 0.33 1.82 0.74 0.19 -5.05 119.66 118.83 2k1d s GLN 227 Ca -0.08 1.63 0.07 0.00 0.05 0.00 0.00 55.36 57.03 2k1d s GLN 227 Cb 0.07 -2.67 -0.02 0.00 1.10 0.00 0.00 33.01 31.48 2k1d s GLN 227 CO 0.91 -0.13 0.24 2.89 -0.55 0.00 0.00 175.29 178.64 2k1d n ARG 228 N 0.15 0.44 -1.62 1.67 0.00 -1.26 -4.91 116.66 111.13 2k1d n ARG 228 Ca 0.04 -3.20 -0.40 0.00 -0.00 0.00 0.00 57.85 54.29 2k1d n ARG 228 Cb 0.48 2.41 -0.03 0.00 -0.00 0.00 0.00 32.46 35.32 2k1d n ARG 228 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 2k1d s GLY 229 N -3.26 0.10 0.22 2.89 0.00 -1.26 -4.95 107.32 101.06 2k1d s GLY 229 Ca 0.34 0.39 0.11 0.00 0.00 0.00 0.00 44.72 45.56 2k1d s GLY 229 CO 0.24 3.92 -0.21 -0.56 0.00 0.00 0.00 173.10 176.48 2k1d s SER 230 N 9.88 3.56 0.00 1.64 0.01 -1.26 -5.34 113.70 122.20 2k1d s SER 230 Ca 0.97 -0.89 0.20 0.00 1.31 0.00 0.00 55.95 57.55 2k1d s SER 230 Cb -0.25 -0.32 1.20 0.00 0.21 0.00 0.00 66.02 66.86 2k1d s SER 230 CO 0.31 0.09 1.59 -1.20 0.41 0.00 0.00 173.24 174.44