#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1auv s ALA 113 N 0.00 2.85 -0.07 0.00 0.00 -1.26 -4.72 121.76 118.56 1auv s ALA 113 Ca 0.00 0.23 -0.12 0.00 0.00 0.00 0.00 51.96 52.07 1auv s ALA 113 Cb 0.00 -3.18 -0.05 0.00 0.00 0.00 0.00 23.12 19.90 1auv s ALA 113 CO 0.00 -0.74 0.29 1.03 0.00 0.00 0.00 175.76 176.33 1auv s ARG 114 N -4.39 3.79 -0.33 0.00 1.81 -0.41 -4.90 118.95 114.52 1auv s ARG 114 Ca 0.60 0.15 -0.11 0.00 -1.72 0.00 0.00 55.73 54.66 1auv s ARG 114 Cb -0.14 -3.24 -0.01 0.00 -0.45 0.00 0.00 34.95 31.12 1auv s ARG 114 CO 0.41 0.65 0.19 0.08 -0.68 0.00 0.00 175.30 175.96 1auv s VAL 115 N -0.82 4.86 -0.27 3.52 1.01 -1.26 0.77 120.40 128.21 1auv s VAL 115 Ca 0.19 -0.39 -0.08 0.00 0.00 0.00 0.00 61.98 61.69 1auv s VAL 115 Cb -0.14 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.70 1auv s VAL 115 CO 0.08 0.00 0.11 -0.22 0.00 0.00 0.00 175.10 175.08 1auv s LEU 116 N 1.65 3.70 -0.16 3.92 2.96 -0.08 -0.26 118.68 130.42 1auv s LEU 116 Ca 0.05 -0.25 -0.16 0.00 -0.22 0.00 0.00 54.13 53.55 1auv s LEU 116 Cb -0.17 -1.98 -0.04 0.00 0.50 0.00 0.00 46.19 44.50 1auv s LEU 116 CO 0.08 -0.08 0.39 -0.22 -1.32 0.00 0.00 176.35 175.20 1auv s LEU 117 N 1.64 4.23 -0.22 -0.68 2.96 0.15 -0.73 118.68 126.03 1auv s LEU 117 Ca 0.06 0.62 -0.01 0.00 -0.22 0.00 0.00 54.13 54.58 1auv s LEU 117 Cb -0.16 -2.53 0.01 0.00 0.50 0.00 0.00 46.19 44.01 1auv s LEU 117 CO 0.06 0.01 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.30 1auv s VAL 118 N 0.80 2.76 -0.47 1.68 1.01 0.13 -0.90 120.40 125.41 1auv s VAL 118 Ca 0.21 -0.81 -0.20 0.00 0.00 0.00 0.00 61.98 61.17 1auv s VAL 118 Cb -0.14 -2.28 0.04 0.00 0.00 0.00 0.00 36.38 34.00 1auv s VAL 118 CO 0.07 0.39 0.65 -0.63 0.00 0.00 0.00 175.10 175.59 1auv s ILE 119 N 1.36 4.82 0.12 2.22 1.01 -0.27 -1.87 121.20 128.59 1auv s ILE 119 Ca 0.04 -0.14 -0.25 0.00 0.00 0.00 0.00 60.65 60.30 1auv s ILE 119 Cb -0.15 -4.26 0.07 0.00 0.01 0.00 0.00 42.46 38.13 1auv s ILE 119 CO -0.07 -0.72 0.77 -0.62 0.00 0.00 0.00 174.94 174.30 1auv s ASP 120 N 2.33 -0.40 0.81 3.58 -1.08 -0.22 -1.52 116.67 120.18 1auv s ASP 120 Ca 0.20 -0.14 -0.11 0.00 -0.52 0.00 0.00 52.55 51.98 1auv s ASP 120 Cb -0.16 0.53 0.08 0.00 -1.46 0.00 0.00 42.92 41.91 1auv s ASP 120 CO 0.16 -0.89 1.10 -1.61 0.52 0.00 0.00 175.17 174.44 1auv s GLU 121 N -3.49 1.91 0.63 4.34 2.02 -1.26 -3.73 118.70 119.12 1auv s GLU 121 Ca 0.05 1.14 0.40 0.00 0.02 0.00 0.00 54.97 56.58 1auv s GLU 121 Cb -0.02 -1.86 2.07 0.00 0.10 0.00 0.00 34.13 34.43 1auv s GLU 121 CO -0.07 -1.88 2.25 -1.00 0.02 0.00 0.00 175.26 174.59 1auv h PRO 122 N -1.30 0.00 -1.21 0.39 0.13 -1.98 -3.30 132.00 124.73 1auv h PRO 122 Ca -0.45 0.00 0.44 0.00 -0.87 0.00 0.00 66.00 65.12 1auv h PRO 122 Cb 1.25 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.22 1auv h PRO 122 CO 0.51 0.01 0.74 1.25 -0.23 0.00 0.00 178.00 180.28 1auv h HIS 123 N 0.00 0.65 -3.40 1.56 -0.00 -2.05 -3.38 115.15 108.53 1auv h HIS 123 Ca -0.00 0.03 -0.64 0.00 -0.00 0.00 0.00 60.37 59.76 1auv h HIS 123 Cb 0.15 -0.15 -0.22 0.00 -0.00 0.00 0.00 27.41 27.18 1auv h HIS 123 CO 0.00 -0.32 -0.66 0.99 -0.00 0.00 0.00 177.93 177.94 1auv s THR 124 N -5.39 3.98 -0.91 6.26 2.01 -1.25 -5.05 115.64 115.30 1auv s THR 124 Ca -0.08 -0.31 -0.20 0.00 0.31 0.00 0.00 61.69 61.41 1auv s THR 124 Cb 0.32 -2.79 0.11 0.00 0.01 0.00 0.00 72.50 70.15 1auv s THR 124 CO 0.81 0.44 1.15 -0.62 -0.69 0.00 0.00 174.62 175.71 1auv s ASP 125 N 0.84 6.56 0.30 3.53 2.15 -1.26 -4.84 116.67 123.95 1auv s ASP 125 Ca 0.00 -1.84 0.10 0.00 0.43 0.00 0.00 52.55 51.25 1auv s ASP 125 Cb -0.14 -2.42 0.48 0.00 -0.30 0.00 0.00 42.92 40.53 1auv s ASP 125 CO 0.02 -1.17 1.69 -0.50 -0.17 0.00 0.00 175.17 175.04 1auv h TRP 126 N 9.05 0.05 -0.57 -5.34 4.06 -1.96 -2.74 115.95 118.50 1auv h TRP 126 Ca 0.11 -0.01 0.07 0.00 2.06 0.00 0.00 58.89 61.11 1auv h TRP 126 Cb 1.03 -0.01 -0.03 0.00 -1.00 0.00 0.00 29.16 29.14 1auv h TRP 126 CO 1.16 0.55 0.38 0.00 -3.56 0.00 0.00 178.44 176.97 1auv h ALA 127 N 1.45 1.89 -0.27 1.49 0.00 -1.88 -1.91 119.26 120.02 1auv h ALA 127 Ca -0.00 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.73 1auv h ALA 127 Cb 0.93 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1auv h ALA 127 CO 0.07 0.01 -0.49 -0.22 0.00 0.00 0.00 179.25 178.62 1auv h LYS 128 N 0.50 0.75 0.00 0.00 3.64 -1.90 -1.42 116.57 118.13 1auv h LYS 128 Ca 0.25 -0.44 0.00 0.00 -1.27 0.00 0.00 60.65 59.19 1auv h LYS 128 Cb 0.35 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1auv h LYS 128 CO -0.07 1.06 -0.00 1.88 -2.27 0.00 0.00 179.45 180.05 1auv h TYR 129 N 0.59 0.00 0.00 1.91 0.05 -1.46 -3.23 116.97 114.83 1auv h TYR 129 Ca 0.03 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.81 1auv h TYR 129 Cb 1.06 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.80 1auv h TYR 129 CO 0.06 0.00 -1.04 1.19 -1.05 0.00 0.00 178.16 177.31 1auv n PHE 130 N -2.72 0.15 -1.66 4.88 3.72 -0.78 -4.91 117.46 116.13 1auv n PHE 130 Ca 0.05 0.04 -0.47 0.00 -0.05 0.00 0.00 57.45 57.02 1auv n PHE 130 Cb 0.49 -0.31 -0.04 0.00 -0.94 0.00 0.00 39.48 38.67 1auv n PHE 130 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1auv n LYS 131 N -1.82 2.00 0.00 -1.08 4.81 -0.54 -1.62 118.16 119.91 1auv n LYS 131 Ca 0.02 0.72 0.00 0.00 -0.87 0.00 0.00 58.31 58.18 1auv n LYS 131 Cb 0.41 -2.46 0.00 0.00 0.02 0.00 0.00 35.03 33.00 1auv n LYS 131 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1auv n GLY 132 N 3.12 2.86 3.71 3.14 0.00 -1.26 -4.99 105.19 111.77 1auv n GLY 132 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1auv n GLY 132 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1auv s LYS 133 N -0.14 4.32 0.04 1.61 -0.14 -0.64 -5.02 119.74 119.76 1auv s LYS 133 Ca 0.00 2.01 0.07 0.00 -1.36 0.00 0.00 55.97 56.69 1auv s LYS 133 Cb 0.00 -3.36 -0.02 0.00 -1.68 0.00 0.00 37.83 32.76 1auv s LYS 133 CO 0.00 -0.46 -0.19 0.15 -0.76 0.00 0.00 175.35 174.09 1auv s LYS 134 N 1.51 1.31 -0.24 1.68 1.02 -1.26 -3.74 119.74 120.03 1auv s LYS 134 Ca 0.64 -0.87 -0.25 0.00 0.02 0.00 0.00 55.97 55.51 1auv s LYS 134 Cb -0.34 -1.38 -0.00 0.00 -0.52 0.00 0.00 37.83 35.58 1auv s LYS 134 CO 0.29 0.36 0.85 0.42 -0.92 0.00 0.00 175.35 176.35 1auv s ILE 135 N -0.76 4.82 -1.12 2.17 1.01 0.15 -3.38 121.20 124.09 1auv s ILE 135 Ca 0.06 1.62 0.00 0.00 0.00 0.00 0.00 60.65 62.33 1auv s ILE 135 Cb -0.08 -4.14 0.00 0.00 0.01 0.00 0.00 42.46 38.25 1auv s ILE 135 CO 0.01 -0.08 0.00 1.41 0.00 0.00 0.00 174.94 176.29 1auv n HIS 136 N 5.99 0.00 -0.98 3.97 8.25 -1.26 -1.63 115.22 129.55 1auv n HIS 136 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 1auv n HIS 136 Cb 0.47 -2.18 0.00 0.00 1.12 0.00 0.00 29.99 29.40 1auv n HIS 136 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1auv n GLY 137 N -1.11 0.30 1.10 -1.41 0.00 -1.22 -4.81 105.19 98.04 1auv n GLY 137 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1auv n GLY 137 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1auv n GLU 138 N -1.27 0.00 -2.59 1.61 -0.58 -0.69 -4.99 120.64 112.14 1auv n GLU 138 Ca 0.00 0.00 -0.42 0.00 -0.42 0.00 0.00 57.16 56.32 1auv n GLU 138 Cb 0.21 -0.47 -0.03 0.00 -0.57 0.00 0.00 31.44 30.57 1auv n GLU 138 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1auv s ILE 139 N -2.00 4.54 0.91 -3.67 1.01 -0.65 -4.80 121.20 116.54 1auv s ILE 139 Ca 0.00 1.83 -0.14 0.00 0.00 0.00 0.00 60.65 62.33 1auv s ILE 139 Cb 0.00 -4.17 0.15 0.00 0.01 0.00 0.00 42.46 38.45 1auv s ILE 139 CO 0.00 0.08 1.23 -1.81 0.00 0.00 0.00 174.94 174.45 1auv s ASP 140 N 1.13 3.58 -0.12 3.58 1.01 -1.26 0.30 116.67 124.89 1auv s ASP 140 Ca 0.54 0.57 0.00 0.00 0.71 0.00 0.00 52.55 54.37 1auv s ASP 140 Cb -0.23 -0.86 0.02 0.00 1.01 0.00 0.00 42.92 42.86 1auv s ASP 140 CO 0.25 -2.47 -0.10 -0.63 0.21 0.00 0.00 175.17 172.43 1auv s ILE 141 N -3.65 1.21 -0.30 0.77 1.01 -1.25 -1.28 121.20 117.72 1auv s ILE 141 Ca 0.68 -0.42 -0.17 0.00 0.00 0.00 0.00 60.65 60.74 1auv s ILE 141 Cb -0.08 -1.17 -0.02 0.00 0.01 0.00 0.00 42.46 41.19 1auv s ILE 141 CO 0.52 0.39 0.45 -0.75 0.00 0.00 0.00 174.94 175.55 1auv s LYS 142 N 1.46 3.88 -0.28 2.79 2.47 0.23 -4.93 119.74 125.36 1auv s LYS 142 Ca 0.02 0.02 -0.16 0.00 -1.56 0.00 0.00 55.97 54.29 1auv s LYS 142 Cb -0.13 -3.71 -0.03 0.00 -1.46 0.00 0.00 37.83 32.50 1auv s LYS 142 CO -0.07 -0.42 0.42 0.08 0.16 0.00 0.00 175.35 175.52 1auv s VAL 143 N 2.22 5.13 -0.15 4.02 1.01 -1.26 -0.90 120.40 130.48 1auv s VAL 143 Ca 0.17 0.58 -0.04 0.00 0.00 0.00 0.00 61.98 62.69 1auv s VAL 143 Cb -0.16 -3.76 -0.03 0.00 0.00 0.00 0.00 36.38 32.43 1auv s VAL 143 CO 0.11 0.09 -0.02 -1.61 0.00 0.00 0.00 175.10 173.66 1auv s GLU 144 N 2.15 3.63 -0.05 2.72 0.41 0.09 -4.85 118.70 122.80 1auv s GLU 144 Ca 0.16 -0.49 0.02 0.00 -0.41 0.00 0.00 54.97 54.25 1auv s GLU 144 Cb -0.16 -2.93 0.02 0.00 -1.78 0.00 0.00 34.13 29.28 1auv s GLU 144 CO 0.10 0.30 -0.08 -1.14 -0.49 0.00 0.00 175.26 173.95 1auv s GLN 145 N 0.22 1.20 0.27 1.61 0.74 -1.26 0.18 119.66 122.62 1auv s GLN 145 Ca -0.01 -0.24 -0.15 0.00 0.05 0.00 0.00 55.36 55.01 1auv s GLN 145 Cb -0.14 -1.08 0.01 0.00 1.10 0.00 0.00 33.01 32.90 1auv s GLN 145 CO 0.02 -0.04 0.57 0.00 -0.55 0.00 0.00 175.29 175.30 1auv s ALA 146 N 0.81 -0.50 0.25 1.58 0.00 -0.78 -4.98 121.76 118.15 1auv s ALA 146 Ca -0.12 -0.75 0.01 0.00 0.00 0.00 0.00 51.96 51.10 1auv s ALA 146 Cb -0.15 0.99 -0.04 0.00 0.00 0.00 0.00 23.12 23.92 1auv s ALA 146 CO 0.02 -0.91 0.42 -1.21 0.00 0.00 0.00 175.76 174.07 1auv s GLU 147 N -3.82 3.49 0.23 0.00 2.02 -1.24 -1.06 118.70 118.32 1auv s GLU 147 Ca 0.19 -0.45 -0.06 0.00 0.02 0.00 0.00 54.97 54.67 1auv s GLU 147 Cb -0.02 -2.81 0.40 0.00 0.10 0.00 0.00 34.13 31.80 1auv s GLU 147 CO 0.09 0.35 1.70 0.74 0.02 0.00 0.00 175.26 178.16 1auv h PHE 148 N 1.49 0.31 0.00 1.61 0.04 -1.92 -0.86 116.94 117.61 1auv h PHE 148 Ca -0.49 0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.32 1auv h PHE 148 Cb 1.21 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 39.33 1auv h PHE 148 CO 0.52 -0.03 0.01 0.66 -0.60 0.00 0.00 178.31 178.87 1auv h SER 149 N 0.31 0.00 -0.60 2.17 4.64 -1.94 -2.14 113.55 115.98 1auv h SER 149 Ca 0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 1auv h SER 149 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 1auv h SER 149 CO -0.45 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 175.98 1auv n ASP 150 N -3.05 4.78 -4.30 4.97 8.00 -0.33 -4.96 116.55 121.67 1auv n ASP 150 Ca -0.03 -2.53 -0.22 0.00 0.71 0.00 0.00 54.79 52.72 1auv n ASP 150 Cb 0.08 -0.58 -0.12 0.00 -0.02 0.00 0.00 41.12 40.49 1auv n ASP 150 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1auv s LEU 151 N -2.00 2.38 0.28 0.64 1.43 -0.81 0.93 118.68 121.54 1auv s LEU 151 Ca 0.50 -0.79 -0.15 0.00 -1.03 0.00 0.00 54.13 52.66 1auv s LEU 151 Cb 0.33 -0.79 0.01 0.00 0.03 0.00 0.00 46.19 45.77 1auv s LEU 151 CO 0.22 -0.02 0.60 0.21 0.23 0.00 0.00 176.35 177.59 1auv s ASN 152 N -2.35 -0.06 0.20 2.29 3.84 0.59 -4.97 114.94 114.47 1auv s ASN 152 Ca 0.11 -0.88 -0.23 0.00 0.21 0.00 0.00 52.86 52.07 1auv s ASN 152 Cb -0.07 0.68 0.06 0.00 -0.55 0.00 0.00 41.25 41.37 1auv s ASN 152 CO 0.05 -1.30 0.96 -1.48 -2.79 0.00 0.00 177.10 172.54 1auv s LEU 153 N -3.01 -0.10 -0.04 3.21 0.05 -1.26 0.75 118.68 118.29 1auv s LEU 153 Ca 0.18 -0.59 -0.02 0.00 0.05 0.00 0.00 54.13 53.75 1auv s LEU 153 Cb -0.03 2.24 0.03 0.00 -2.05 0.00 0.00 46.19 46.38 1auv s LEU 153 CO 0.09 -1.04 0.10 -0.69 -0.55 0.00 0.00 176.35 174.26 1auv s VAL 154 N -2.83 -0.04 -0.00 1.48 1.01 -1.05 -5.01 120.40 113.96 1auv s VAL 154 Ca 0.16 0.15 0.04 0.00 0.00 0.00 0.00 61.98 62.33 1auv s VAL 154 Cb -0.02 -0.16 -0.01 0.00 0.00 0.00 0.00 36.38 36.18 1auv s VAL 154 CO 0.05 0.06 -0.14 0.00 0.00 0.00 0.00 175.10 175.07 1auv s ALA 155 N 0.88 1.18 0.04 5.51 0.00 -1.26 -2.34 121.76 125.77 1auv s ALA 155 Ca -0.07 -0.64 0.08 0.00 0.00 0.00 0.00 51.96 51.33 1auv s ALA 155 Cb -0.09 -0.29 -0.03 0.00 0.00 0.00 0.00 23.12 22.71 1auv s ALA 155 CO -0.04 0.28 -0.22 -1.01 0.00 0.00 0.00 175.76 174.78 1auv s HIS 156 N -0.39 2.45 -0.31 0.00 3.76 -0.15 -5.00 115.29 115.65 1auv s HIS 156 Ca 0.05 -0.33 0.23 0.00 -0.15 0.00 0.00 55.06 54.86 1auv s HIS 156 Cb -0.06 -1.44 1.11 0.00 1.11 0.00 0.00 32.58 33.31 1auv s HIS 156 CO -0.00 0.19 1.70 0.00 -0.85 0.00 0.00 174.74 175.78 1auv n ALA 157 N 1.69 1.35 1.79 -1.40 0.00 -1.26 -1.25 120.51 121.43 1auv n ALA 157 Ca -0.17 0.15 0.15 0.00 0.00 0.00 0.00 53.44 53.58 1auv n ALA 157 Cb 0.52 -1.36 0.76 0.00 0.00 0.00 0.00 19.45 19.37 1auv n ALA 157 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1auv n ASN 158 N -2.28 0.64 0.00 0.00 0.23 -1.26 -4.90 115.26 107.68 1auv n ASN 158 Ca 0.00 -1.22 0.00 0.00 -0.53 0.00 0.00 54.58 52.83 1auv n ASN 158 Cb 0.13 -0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.83 1auv n ASN 158 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1auv n GLY 159 N 1.07 2.01 3.77 4.83 0.00 -0.38 -5.07 105.19 111.42 1auv n GLY 159 Ca 0.22 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.87 1auv n GLY 159 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1auv s GLY 160 N -2.47 2.75 0.19 -0.02 0.00 -1.25 -4.86 107.32 101.67 1auv s GLY 160 Ca 0.00 0.91 -0.23 0.00 0.00 0.00 0.00 44.72 45.41 1auv s GLY 160 CO 0.00 1.35 0.98 -0.11 0.00 0.00 0.00 173.10 175.33 1auv s PHE 161 N -1.58 -0.00 -0.29 1.90 -0.71 -1.26 -0.97 117.98 115.06 1auv s PHE 161 Ca 0.65 -0.38 -0.16 0.00 -1.04 0.00 0.00 56.93 56.00 1auv s PHE 161 Cb -0.28 0.69 0.12 0.00 -1.21 0.00 0.00 43.02 42.34 1auv s PHE 161 CO 0.33 -0.95 0.85 0.45 -1.34 0.00 0.00 175.22 174.57 1auv s SER 162 N -3.18 -0.71 -0.31 1.98 0.15 -0.99 -4.97 113.70 105.67 1auv s SER 162 Ca 0.17 1.11 -0.07 0.00 0.70 0.00 0.00 55.95 57.87 1auv s SER 162 Cb -0.02 1.35 0.02 0.00 -1.71 0.00 0.00 66.02 65.65 1auv s SER 162 CO 0.05 -0.17 0.10 -0.69 1.20 0.00 0.00 173.24 173.72 1auv s VAL 163 N 1.58 4.00 0.75 4.45 1.01 -0.35 -2.53 120.40 129.31 1auv s VAL 163 Ca -0.09 -0.78 -0.00 0.00 0.00 0.00 0.00 61.98 61.11 1auv s VAL 163 Cb -0.05 -3.11 0.15 0.00 0.00 0.00 0.00 36.38 33.36 1auv s VAL 163 CO -0.17 0.00 1.02 -1.81 0.00 0.00 0.00 175.10 174.15 1auv s ASP 164 N 1.49 4.19 0.00 3.32 1.01 0.23 -0.29 116.67 126.62 1auv s ASP 164 Ca 0.02 -0.49 0.00 0.00 0.71 0.00 0.00 52.55 52.78 1auv s ASP 164 Cb -0.18 0.22 0.00 0.00 1.01 0.00 0.00 42.92 43.97 1auv s ASP 164 CO 0.03 -1.99 0.00 -0.62 0.21 0.00 0.00 175.17 172.80 1auv n GLU 166 N -2.89 0.00 0.00 8.23 1.02 0.26 -0.30 120.64 126.96 1auv n GLU 166 Ca 0.17 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.31 1auv n GLU 166 Cb 0.61 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.03 1auv n GLU 166 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1auv n VAL 167 N 0.00 0.00 -3.89 2.62 0.31 0.36 -4.57 118.33 113.16 1auv n VAL 167 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 64.34 63.98 1auv n VAL 167 Cb 0.00 0.00 -0.13 0.00 -0.91 0.00 0.00 33.84 32.80 1auv n VAL 167 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 1auv s LEU 168 N 0.00 4.41 0.00 7.52 2.96 -1.26 -1.54 118.68 130.77 1auv s LEU 168 Ca 0.00 -1.63 0.00 0.00 -0.22 0.00 0.00 54.13 52.28 1auv s LEU 168 Cb 0.00 -1.73 0.00 0.00 0.50 0.00 0.00 46.19 44.96 1auv s LEU 168 CO 0.00 -0.36 0.00 -1.14 -1.32 0.00 0.00 176.35 173.53 1auv n ARG 169 N 4.56 0.00 -1.23 1.98 3.00 -1.26 -5.02 116.66 118.69 1auv n ARG 169 Ca -0.08 0.00 -0.35 0.00 -0.00 0.00 0.00 57.85 57.42 1auv n ARG 169 Cb 0.42 0.00 0.09 0.00 0.00 0.00 0.00 32.46 32.97 1auv n ARG 169 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1auv n ASN 170 N -0.14 -0.41 0.00 6.15 4.13 -1.26 -3.38 115.26 120.36 1auv n ASN 170 Ca 0.00 0.59 0.00 0.00 1.68 0.00 0.00 54.58 56.85 1auv n ASN 170 Cb 0.00 -1.32 0.00 0.00 -1.54 0.00 0.00 39.78 36.92 1auv n ASN 170 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1auv n GLY 171 N 1.29 0.57 3.11 7.41 0.00 -1.26 -4.47 105.19 111.84 1auv n GLY 171 Ca 0.11 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.99 1auv n GLY 171 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1auv n VAL 172 N -2.01 -7.68 -1.34 1.61 0.31 -1.22 -4.74 118.33 103.27 1auv n VAL 172 Ca 0.00 -1.04 0.00 0.00 -0.01 0.00 0.00 64.34 63.29 1auv n VAL 172 Cb 0.00 -5.85 0.00 0.00 -0.91 0.00 0.00 33.84 27.08 1auv n VAL 172 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1auv n LYS 173 N -3.25 -3.24 -3.64 5.55 0.00 -1.22 -5.04 118.16 107.32 1auv n LYS 173 Ca -0.11 2.46 -0.08 0.00 0.00 0.00 0.00 58.31 60.58 1auv n LYS 173 Cb 0.62 -2.50 -0.07 0.00 0.00 0.00 0.00 35.03 33.09 1auv n LYS 173 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1auv s VAL 174 N -0.65 0.00 -0.28 3.15 0.11 -0.59 -5.02 120.40 117.12 1auv s VAL 174 Ca 0.00 0.00 -0.09 0.00 -2.93 0.00 0.00 61.98 58.96 1auv s VAL 174 Cb 0.00 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.83 1auv s VAL 174 CO 0.00 0.00 0.13 0.54 -3.33 0.00 0.00 175.10 172.44 1auv s VAL 175 N 0.83 4.62 -0.02 2.04 0.11 -1.26 -0.49 120.40 126.23 1auv s VAL 175 Ca -0.03 -0.23 0.08 0.00 -2.93 0.00 0.00 61.98 58.87 1auv s VAL 175 Cb -0.05 -3.26 -0.02 0.00 -1.53 0.00 0.00 36.38 31.53 1auv s VAL 175 CO -0.10 0.20 -0.26 -0.13 -3.33 0.00 0.00 175.10 171.48 1auv s ARG 176 N 1.64 2.10 -0.16 1.54 0.52 -1.26 -5.01 118.95 118.32 1auv s ARG 176 Ca 0.06 -0.92 -0.04 0.00 -0.52 0.00 0.00 55.73 54.31 1auv s ARG 176 Cb -0.16 -2.03 -0.03 0.00 0.52 0.00 0.00 34.95 33.26 1auv s ARG 176 CO 0.06 0.55 -0.03 0.45 0.02 0.00 0.00 175.30 176.35 1auv s SER 177 N -0.59 4.75 0.17 0.23 0.15 -1.26 -4.11 113.70 113.04 1auv s SER 177 Ca 0.10 -0.16 0.08 0.00 0.70 0.00 0.00 55.95 56.67 1auv s SER 177 Cb -0.10 -1.78 -0.04 0.00 -1.71 0.00 0.00 66.02 62.39 1auv s SER 177 CO -0.01 0.14 -0.17 -0.76 1.20 0.00 0.00 173.24 173.64 1auv s LEU 178 N 0.52 2.46 -0.56 3.45 1.43 0.61 -4.96 118.68 121.62 1auv s LEU 178 Ca -0.03 -0.89 0.07 0.00 -1.03 0.00 0.00 54.13 52.24 1auv s LEU 178 Cb -0.14 -0.79 0.25 0.00 0.03 0.00 0.00 46.19 45.54 1auv s LEU 178 CO 0.03 -0.06 0.68 1.17 0.23 0.00 0.00 176.35 178.39 1auv n LYS 179 N 0.15 1.97 -1.62 1.70 4.81 -1.26 -1.22 118.16 122.70 1auv n LYS 179 Ca -0.12 -4.22 -0.48 0.00 -0.87 0.00 0.00 58.31 52.62 1auv n LYS 179 Cb 0.58 -1.93 -0.04 0.00 0.02 0.00 0.00 35.03 33.66 1auv n LYS 179 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1auv n PRO 180 N 1.01 1.52 0.07 1.64 -0.02 -1.26 -4.81 135.00 133.14 1auv n PRO 180 Ca 0.27 0.54 0.11 0.00 -2.02 0.00 0.00 63.50 62.41 1auv n PRO 180 Cb 0.45 -2.16 -0.00 0.00 -0.02 0.00 0.00 33.50 31.77 1auv n PRO 180 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1auv n ASP 181 N 2.38 0.65 -3.50 2.55 8.00 0.65 -4.96 116.55 122.33 1auv n ASP 181 Ca 0.15 0.14 -0.14 0.00 0.71 0.00 0.00 54.79 55.65 1auv n ASP 181 Cb 0.26 0.74 -0.04 0.00 -0.02 0.00 0.00 41.12 42.05 1auv n ASP 181 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1auv s PHE 182 N -3.33 -0.51 0.02 1.24 2.19 -1.03 -4.36 117.98 112.20 1auv s PHE 182 Ca -0.00 0.50 0.04 0.00 0.33 0.00 0.00 56.93 57.80 1auv s PHE 182 Cb 0.12 0.45 -0.02 0.00 -1.31 0.00 0.00 43.02 42.26 1auv s PHE 182 CO 0.80 -0.74 -0.12 0.08 1.83 0.00 0.00 175.22 177.08 1auv s VAL 183 N -2.88 0.91 -0.23 3.12 1.01 -0.69 -0.67 120.40 120.96 1auv s VAL 183 Ca -0.03 -0.79 0.02 0.00 0.00 0.00 0.00 61.98 61.17 1auv s VAL 183 Cb -0.00 -0.82 0.05 0.00 0.00 0.00 0.00 36.38 35.61 1auv s VAL 183 CO -0.05 0.03 -0.10 -0.22 0.00 0.00 0.00 175.10 174.76 1auv s LEU 184 N -0.86 2.78 -0.47 3.92 2.96 -0.08 -2.06 118.68 124.87 1auv s LEU 184 Ca 0.01 -1.13 -0.16 0.00 -0.22 0.00 0.00 54.13 52.63 1auv s LEU 184 Cb -0.07 -1.37 0.07 0.00 0.50 0.00 0.00 46.19 45.32 1auv s LEU 184 CO 0.01 -0.17 0.40 -0.63 -1.32 0.00 0.00 176.35 174.64 1auv s ILE 185 N 1.27 5.22 -0.78 6.68 1.01 -0.23 -1.12 121.20 133.24 1auv s ILE 185 Ca -0.05 -0.98 0.11 0.00 0.00 0.00 0.00 60.65 59.74 1auv s ILE 185 Cb -0.18 -4.11 0.33 0.00 0.01 0.00 0.00 42.46 38.50 1auv s ILE 185 CO -0.07 -0.56 1.27 0.54 0.00 0.00 0.00 174.94 176.12 1auv n ARG 186 N 5.26 2.88 -4.29 2.79 5.12 -0.58 -3.89 116.66 123.96 1auv n ARG 186 Ca -0.12 -2.15 -0.23 0.00 -1.93 0.00 0.00 57.85 53.43 1auv n ARG 186 Cb 0.44 -1.34 -0.12 0.00 -1.16 0.00 0.00 32.46 30.28 1auv n ARG 186 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 1auv s GLN 187 N -1.27 1.13 0.07 5.56 0.74 -1.14 -4.51 119.66 120.24 1auv s GLN 187 Ca 0.25 -1.22 -0.31 0.00 0.05 0.00 0.00 55.36 54.14 1auv s GLN 187 Cb 0.15 -1.30 -0.07 0.00 1.10 0.00 0.00 33.01 32.88 1auv s GLN 187 CO 0.14 0.29 1.40 -1.01 -0.55 0.00 0.00 175.29 175.56 1auv s HIS 188 N -1.46 3.05 -0.33 1.67 3.76 -1.26 -4.78 115.29 115.94 1auv s HIS 188 Ca 0.08 0.88 0.27 0.00 -0.15 0.00 0.00 55.06 56.14 1auv s HIS 188 Cb -0.09 -3.68 0.75 0.00 1.11 0.00 0.00 32.58 30.67 1auv s HIS 188 CO 0.05 -2.45 1.75 0.00 -0.85 0.00 0.00 174.74 173.23 1auv h ALA 189 N 7.29 1.00 -2.74 -1.40 0.00 -1.93 -3.47 119.26 118.01 1auv h ALA 189 Ca -0.41 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.38 1auv h ALA 189 Cb 1.20 0.00 -0.24 0.00 0.00 0.00 0.00 17.79 18.75 1auv h ALA 189 CO 0.88 0.00 -0.24 0.12 0.00 0.00 0.00 179.25 180.01 1auv s PHE 190 N -3.33 -0.46 0.00 0.00 5.36 -1.26 -1.11 117.98 117.19 1auv s PHE 190 Ca 0.06 1.11 0.00 0.00 -0.96 0.00 0.00 56.93 57.13 1auv s PHE 190 Cb 0.08 0.16 0.00 0.00 -0.34 0.00 0.00 43.02 42.91 1auv s PHE 190 CO 0.60 -0.22 0.00 0.45 -1.46 0.00 0.00 175.22 174.59 1auv n SER 191 N 2.91 0.00 0.00 6.13 2.88 -0.49 -4.89 113.62 120.16 1auv n SER 191 Ca -0.14 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.40 1auv n SER 191 Cb 0.57 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.03 1auv n SER 191 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1auv n ALA 193 N -3.00 -0.42 -3.75 -1.46 0.00 -1.26 -3.18 120.51 107.44 1auv n ALA 193 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.20 1auv n ALA 193 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1auv n ALA 193 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1auv n ARG 194 N 0.00 -1.49 0.00 0.00 0.63 -1.26 -4.59 116.66 109.95 1auv n ARG 194 Ca 0.00 0.72 0.00 0.00 -0.92 0.00 0.00 57.85 57.65 1auv n ARG 194 Cb 0.00 -2.11 0.00 0.00 0.45 0.00 0.00 32.46 30.80 1auv n ARG 194 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1auv n ASN 195 N -2.48 0.00 0.00 6.15 5.15 -1.26 -5.09 115.26 117.73 1auv n ASN 195 Ca -0.31 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.67 1auv n ASN 195 Cb 0.67 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.92 1auv n ASN 195 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1auv n GLY 196 N 0.00 1.83 3.28 8.20 0.00 -1.19 -4.93 105.19 112.37 1auv n GLY 196 Ca 0.00 -2.16 -0.43 0.00 0.00 0.00 0.00 46.02 43.43 1auv n GLY 196 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1auv s ASP 197 N 0.00 5.92 -0.04 1.61 2.15 -1.26 -1.39 116.67 123.66 1auv s ASP 197 Ca 0.00 -1.73 0.14 0.00 0.43 0.00 0.00 52.55 51.39 1auv s ASP 197 Cb 0.00 -2.10 0.44 0.00 -0.30 0.00 0.00 42.92 40.97 1auv s ASP 197 CO 0.00 -0.72 1.37 -1.22 -0.17 0.00 0.00 175.17 174.43 1auv n TYR 198 N 5.07 0.74 -0.20 -5.34 4.01 -0.27 -4.57 117.16 116.60 1auv n TYR 198 Ca -0.11 -0.57 0.09 0.00 -0.16 0.00 0.00 57.90 57.15 1auv n TYR 198 Cb 0.41 -0.09 0.37 0.00 -0.31 0.00 0.00 39.34 39.73 1auv n TYR 198 CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 1auv h ARG 199 N 2.61 0.68 -0.22 -0.72 2.43 -1.90 -0.54 114.38 116.72 1auv h ARG 199 Ca 0.00 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.04 1auv h ARG 199 Cb 0.97 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.35 1auv h ARG 199 CO 0.06 0.45 -0.24 0.66 -1.51 0.00 0.00 179.97 179.39 1auv h SER 200 N 0.70 0.41 -0.35 -3.80 4.64 -1.93 -0.82 113.55 112.39 1auv h SER 200 Ca 0.35 -0.13 -0.08 0.00 -0.47 0.00 0.00 61.79 61.46 1auv h SER 200 Cb 0.43 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.40 1auv h SER 200 CO -0.13 0.65 -0.09 -0.07 -0.87 0.00 0.00 176.83 176.32 1auv h LEU 201 N 0.36 0.69 -0.48 5.97 3.38 -1.45 0.15 115.31 123.93 1auv h LEU 201 Ca 0.06 -0.37 0.04 0.00 0.09 0.00 0.00 57.88 57.70 1auv h LEU 201 Cb 0.62 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 1auv h LEU 201 CO 0.04 0.89 0.24 0.58 0.09 0.00 0.00 178.44 180.29 1auv h VAL 202 N 0.47 0.97 -0.94 1.22 2.07 -1.02 0.32 116.25 119.34 1auv h VAL 202 Ca 0.09 -0.16 0.01 0.00 0.82 0.00 0.00 66.70 67.45 1auv h VAL 202 Cb 0.59 0.45 -0.05 0.00 -1.52 0.00 0.00 31.29 30.76 1auv h VAL 202 CO 0.04 0.09 0.61 0.40 0.02 0.00 0.00 177.57 178.72 1auv h ILE 203 N 0.48 1.25 -0.54 4.57 2.04 -0.90 -0.66 117.51 123.74 1auv h ILE 203 Ca 0.21 -0.47 -0.07 0.00 1.00 0.00 0.00 64.86 65.53 1auv h ILE 203 Cb 0.11 -0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 36.04 1auv h ILE 203 CO -0.14 0.24 0.06 1.23 0.00 0.00 0.00 178.15 179.54 1auv h GLY 204 N 1.28 0.99 1.05 5.37 0.00 0.64 1.00 103.07 113.38 1auv h GLY 204 Ca 0.34 -0.68 -0.06 0.00 0.00 0.00 0.00 47.33 46.93 1auv h GLY 204 CO -0.07 0.63 0.18 1.41 0.00 0.00 0.00 176.54 178.69 1auv h LEU 205 N 0.80 1.02 -0.47 3.11 3.38 0.37 -0.88 115.31 122.64 1auv h LEU 205 Ca 0.16 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 1auv h LEU 205 Cb 0.45 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1auv h LEU 205 CO 0.02 0.98 0.06 -0.61 0.09 0.00 0.00 178.44 178.97 1auv h GLN 206 N 1.01 0.78 -0.49 1.13 5.75 -0.83 -2.21 115.11 120.25 1auv h GLN 206 Ca 0.22 -0.22 0.06 0.00 -0.15 0.00 0.00 58.65 58.55 1auv h GLN 206 Cb 0.34 -0.09 -0.03 0.00 1.07 0.00 0.00 27.48 28.78 1auv h GLN 206 CO -0.00 0.81 0.33 -0.92 -2.65 0.00 0.00 178.83 176.39 1auv h TYR 207 N 0.65 0.42 -0.00 3.99 5.03 -0.49 0.46 116.97 127.03 1auv h TYR 207 Ca 0.14 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.46 1auv h TYR 207 Cb 0.41 -0.14 0.00 0.00 1.55 0.00 0.00 36.73 38.55 1auv h TYR 207 CO 0.03 0.23 -0.06 0.00 -1.32 0.00 0.00 178.16 177.04 1auv n ALA 208 N -2.51 2.64 -1.61 1.82 0.00 -0.36 -4.80 120.51 115.70 1auv n ALA 208 Ca 0.06 -0.21 -0.11 0.00 0.00 0.00 0.00 53.44 53.18 1auv n ALA 208 Cb 0.24 -1.41 -0.04 0.00 0.00 0.00 0.00 19.45 18.25 1auv n ALA 208 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1auv n GLY 209 N 1.28 0.84 3.67 0.00 0.00 0.15 -4.97 105.19 106.15 1auv n GLY 209 Ca 0.14 -0.47 -0.43 0.00 0.00 0.00 0.00 46.02 45.26 1auv n GLY 209 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1auv s ILE 210 N -2.47 4.69 0.57 -0.61 1.01 -1.07 -5.01 121.20 118.30 1auv s ILE 210 Ca 0.00 2.03 -0.21 0.00 0.00 0.00 0.00 60.65 62.47 1auv s ILE 210 Cb 0.00 -4.31 -0.04 0.00 0.01 0.00 0.00 42.46 38.12 1auv s ILE 210 CO 0.00 -0.14 1.33 -2.65 0.00 0.00 0.00 174.94 173.48 1auv n PRO 211 N 6.07 1.56 -3.94 2.79 -0.02 -1.26 -4.79 135.00 135.40 1auv n PRO 211 Ca 0.11 0.58 -0.09 0.00 -2.02 0.00 0.00 63.50 62.08 1auv n PRO 211 Cb 0.46 -2.55 -0.07 0.00 -0.02 0.00 0.00 33.50 31.32 1auv n PRO 211 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1auv s SER 212 N -1.00 0.09 -0.14 2.55 0.15 -1.26 -1.71 113.70 112.38 1auv s SER 212 Ca 0.74 -0.83 -0.04 0.00 0.70 0.00 0.00 55.95 56.52 1auv s SER 212 Cb -0.41 0.39 0.05 0.00 -1.71 0.00 0.00 66.02 64.34 1auv s SER 212 CO 0.47 -0.82 0.07 -0.63 1.20 0.00 0.00 173.24 173.53 1auv s ILE 213 N -3.94 -0.00 1.01 6.45 1.01 -0.88 -3.54 121.20 121.31 1auv s ILE 213 Ca 0.14 -0.05 -0.15 0.00 0.00 0.00 0.00 60.65 60.59 1auv s ILE 213 Cb 0.04 -0.52 0.20 0.00 0.01 0.00 0.00 42.46 42.19 1auv s ILE 213 CO -0.03 -0.13 1.16 0.20 0.00 0.00 0.00 174.94 176.14 1auv s ASN 214 N 2.11 2.59 0.56 3.58 0.01 -1.26 -1.07 114.94 121.44 1auv s ASN 214 Ca 0.03 0.75 -0.21 0.00 -0.71 0.00 0.00 52.86 52.72 1auv s ASN 214 Cb -0.15 -1.13 -0.05 0.00 0.41 0.00 0.00 41.25 40.33 1auv s ASN 214 CO -0.07 -3.10 1.14 -1.54 -1.51 0.00 0.00 177.10 172.02 1auv n SER 215 N -4.10 1.67 0.13 -1.22 3.41 -1.23 -4.76 113.62 107.52 1auv n SER 215 Ca 0.10 0.91 0.05 0.00 -0.26 0.00 0.00 58.87 59.67 1auv n SER 215 Cb 0.59 -1.47 0.49 0.00 -0.26 0.00 0.00 64.21 63.57 1auv n SER 215 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1auv h LEU 216 N 1.01 0.23 -0.29 1.04 3.38 -1.90 -1.25 115.31 117.52 1auv h LEU 216 Ca -0.49 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.47 1auv h LEU 216 Cb 1.34 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 42.01 1auv h LEU 216 CO 0.54 0.23 0.19 -0.74 0.09 0.00 0.00 178.44 178.75 1auv h HIS 217 N 0.26 0.36 -0.39 1.13 2.76 -1.93 -0.79 115.15 116.56 1auv h HIS 217 Ca 0.07 0.01 -0.15 0.00 -2.20 0.00 0.00 60.37 58.10 1auv h HIS 217 Cb 0.08 -0.12 -0.01 0.00 1.55 0.00 0.00 27.41 28.91 1auv h HIS 217 CO 0.00 0.23 -0.34 0.66 -1.30 0.00 0.00 177.93 177.18 1auv h SER 218 N 0.39 0.95 -0.39 3.26 4.64 -1.55 -1.98 113.55 118.87 1auv h SER 218 Ca 0.11 -0.41 0.01 0.00 -0.47 0.00 0.00 61.79 61.03 1auv h SER 218 Cb -0.04 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 61.76 1auv h SER 218 CO -0.03 1.19 0.24 0.58 -0.87 0.00 0.00 176.83 177.94 1auv h VAL 219 N 0.75 1.07 -0.17 0.95 2.07 -1.09 0.12 116.25 119.94 1auv h VAL 219 Ca 0.07 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 1auv h VAL 219 Cb 0.91 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 1auv h VAL 219 CO 0.08 0.09 0.08 0.22 0.02 0.00 0.00 177.57 178.07 1auv h TYR 220 N 0.49 0.24 0.00 1.57 5.03 -1.06 -2.51 116.97 120.74 1auv h TYR 220 Ca 0.15 -0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.45 1auv h TYR 220 Cb -0.02 -0.08 0.00 0.00 1.55 0.00 0.00 36.73 38.18 1auv h TYR 220 CO -0.06 0.27 0.00 0.09 -1.32 0.00 0.00 178.16 177.14 1auv n ASN 221 N -4.89 0.54 -0.19 -2.11 3.02 -0.75 -2.05 115.26 108.83 1auv n ASN 221 Ca -0.04 0.64 0.14 0.00 -0.03 0.00 0.00 54.58 55.29 1auv n ASN 221 Cb 0.09 -0.76 0.60 0.00 -0.61 0.00 0.00 39.78 39.11 1auv n ASN 221 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1auv n PHE 222 N -2.11 0.00 0.30 3.10 3.01 0.38 -4.14 117.46 118.00 1auv n PHE 222 Ca 0.02 0.00 0.17 0.00 1.01 0.00 0.00 57.45 58.65 1auv n PHE 222 Cb 0.20 -0.11 0.79 0.00 -0.01 0.00 0.00 39.48 40.34 1auv n PHE 222 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1auv s ASP 224 N -4.98 4.48 0.22 0.00 1.01 -1.26 -4.90 116.67 111.23 1auv s ASP 224 Ca -0.01 -1.54 -0.10 0.00 0.71 0.00 0.00 52.55 51.61 1auv s ASP 224 Cb 0.10 -1.54 0.31 0.00 1.01 0.00 0.00 42.92 42.80 1auv s ASP 224 CO 0.42 -0.23 1.66 0.11 0.21 0.00 0.00 175.17 177.33 1auv h LYS 225 N 7.75 0.11 0.00 8.23 1.57 -1.87 0.11 116.57 132.47 1auv h LYS 225 Ca -0.16 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.59 1auv h LYS 225 Cb 1.04 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.32 1auv h LYS 225 CO 0.47 0.07 -0.12 -1.35 -0.57 0.00 0.00 179.45 177.95 1auv h PRO 226 N 0.11 0.00 -0.35 3.15 0.11 -1.95 0.12 132.00 133.19 1auv h PRO 226 Ca 0.33 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 66.30 1auv h PRO 226 Cb 0.54 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.65 1auv h PRO 226 CO -0.55 0.12 -0.33 2.35 -0.21 0.00 0.00 178.00 179.38 1auv h TRP 227 N 0.00 1.01 -0.58 0.65 2.91 -1.16 0.17 115.95 118.95 1auv h TRP 227 Ca -0.00 -0.30 -0.10 0.00 1.13 0.00 0.00 58.89 59.62 1auv h TRP 227 Cb 0.39 -0.21 -0.02 0.00 -0.51 0.00 0.00 29.16 28.81 1auv h TRP 227 CO 0.00 1.09 -0.03 0.28 -1.03 0.00 0.00 178.44 178.76 1auv h VAL 228 N 0.63 1.26 -0.35 2.65 2.07 -0.65 -2.77 116.25 119.09 1auv h VAL 228 Ca 0.06 -1.16 -0.09 0.00 0.82 0.00 0.00 66.70 66.33 1auv h VAL 228 Cb 0.92 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 31.52 1auv h VAL 228 CO 0.08 0.42 -0.14 0.15 0.02 0.00 0.00 177.57 178.10 1auv h PHE 229 N 0.93 0.68 -0.52 1.57 3.57 -0.62 -2.04 116.94 120.51 1auv h PHE 229 Ca 0.16 -0.12 0.10 0.00 3.53 0.00 0.00 57.97 61.64 1auv h PHE 229 Cb 0.57 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 39.11 1auv h PHE 229 CO 0.04 0.73 0.36 0.00 -2.23 0.00 0.00 178.31 177.21 1auv h ALA 230 N 1.28 2.13 0.00 2.41 0.00 -0.38 -1.39 119.26 123.31 1auv h ALA 230 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1auv h ALA 230 Cb 0.57 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1auv h ALA 230 CO 0.04 -0.25 0.00 1.04 0.00 0.00 0.00 179.25 180.08 1auv n GLN 231 N -4.46 0.34 0.00 0.00 1.13 -0.77 -2.49 117.38 111.13 1auv n GLN 231 Ca 0.08 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.14 1auv n GLN 231 Cb 0.40 -1.28 0.00 0.00 0.11 0.00 0.00 30.24 29.47 1auv n GLN 231 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 1auv n VAL 233 N 0.68 0.00 -0.23 5.09 0.31 -0.52 -2.46 118.33 121.19 1auv n VAL 233 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 64.34 64.26 1auv n VAL 233 Cb 0.14 0.00 0.04 0.00 -0.91 0.00 0.00 33.84 33.11 1auv n VAL 233 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1auv h ARG 234 N 0.00 0.98 -0.52 5.55 2.43 -1.77 0.23 114.38 121.28 1auv h ARG 234 Ca 0.00 -0.19 -0.07 0.00 -0.81 0.00 0.00 59.98 58.91 1auv h ARG 234 Cb 0.00 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.38 1auv h ARG 234 CO 0.00 0.83 0.03 -0.07 -1.51 0.00 0.00 179.97 179.26 1auv h LEU 235 N 0.92 0.87 -0.68 3.80 3.38 -1.79 -0.97 115.31 120.84 1auv h LEU 235 Ca 0.21 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1auv h LEU 235 Cb 0.23 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1auv h LEU 235 CO -0.01 0.94 0.37 -0.74 0.09 0.00 0.00 178.44 179.09 1auv h HIS 236 N 0.77 0.93 -0.57 1.13 2.76 -1.76 0.33 115.15 118.74 1auv h HIS 236 Ca 0.15 -0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.29 1auv h HIS 236 Cb 0.48 -0.30 -0.03 0.00 1.55 0.00 0.00 27.41 29.11 1auv h HIS 236 CO 0.04 0.66 0.30 -0.22 -1.30 0.00 0.00 177.93 177.41 1auv h LYS 237 N 0.93 0.80 0.08 5.26 3.11 -0.26 -0.22 116.57 126.27 1auv h LYS 237 Ca 0.24 -0.10 -0.00 0.00 -2.81 0.00 0.00 60.65 57.98 1auv h LYS 237 Cb 0.04 -0.15 0.00 0.00 -1.00 0.00 0.00 32.23 31.12 1auv h LYS 237 CO -0.04 0.62 -0.04 -0.22 -2.81 0.00 0.00 179.45 176.96 1auv h LYS 238 N 0.77 -0.11 -0.03 1.90 3.64 -0.80 -3.35 116.57 118.58 1auv h LYS 238 Ca 0.20 0.01 -0.18 0.00 -1.27 0.00 0.00 60.65 59.41 1auv h LYS 238 Cb 0.06 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 1auv h LYS 238 CO -0.03 0.39 -0.76 -0.07 -2.27 0.00 0.00 179.45 176.71 1auv h LEU 239 N -0.69 0.27 0.00 5.20 3.38 -0.37 -3.50 115.31 119.60 1auv h LEU 239 Ca -0.01 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1auv h LEU 239 Cb 0.55 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1auv h LEU 239 CO 0.02 0.93 0.00 0.61 0.09 0.00 0.00 178.44 180.09 1auv n GLY 240 N 0.61 -0.54 0.35 0.83 0.00 -0.10 -4.26 105.19 102.09 1auv n GLY 240 Ca -0.03 -1.60 0.03 0.00 0.00 0.00 0.00 46.02 44.42 1auv n GLY 240 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1auv h THR 241 N 0.00 1.11 0.00 2.61 2.02 -1.79 0.17 112.91 117.04 1auv h THR 241 Ca 0.00 -0.32 -0.02 0.00 0.77 0.00 0.00 66.41 66.84 1auv h THR 241 Cb 0.00 0.09 -0.00 0.00 -1.74 0.00 0.00 68.15 66.49 1auv h THR 241 CO 0.00 0.17 -0.09 -0.33 0.37 0.00 0.00 175.52 175.64 1auv h GLU 242 N 0.94 0.00 0.00 6.66 4.39 -1.98 -3.07 114.58 121.52 1auv h GLU 242 Ca 0.32 0.00 -0.39 0.00 0.34 0.00 0.00 59.36 59.63 1auv h GLU 242 Cb 0.08 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 28.66 1auv h GLU 242 CO -0.10 0.09 -2.46 0.39 -1.16 0.00 0.00 179.01 175.77 1auv n GLU 243 N -4.05 0.65 -3.44 2.33 -0.58 -0.76 -4.86 120.64 109.94 1auv n GLU 243 Ca -0.02 0.13 -0.27 0.00 -0.42 0.00 0.00 57.16 56.57 1auv n GLU 243 Cb 0.18 -1.52 -0.11 0.00 -0.57 0.00 0.00 31.44 29.42 1auv n GLU 243 CO 0.00 0.00 0.00 0.12 -0.48 0.00 0.00 177.13 176.77 1auv s PHE 244 N -2.51 0.63 -1.18 -0.32 5.36 0.54 -4.86 117.98 115.63 1auv s PHE 244 Ca -0.32 -1.62 -0.18 0.00 -0.96 0.00 0.00 56.93 53.85 1auv s PHE 244 Cb 0.09 -0.84 -0.03 0.00 -0.34 0.00 0.00 43.02 41.89 1auv s PHE 244 CO 0.63 -0.85 2.02 -0.35 -1.46 0.00 0.00 175.22 175.21 1auv n PRO 245 N 3.90 2.33 -2.42 10.12 -0.04 -1.16 -4.20 135.00 143.52 1auv n PRO 245 Ca 0.14 -2.44 -0.41 0.00 -0.04 0.00 0.00 63.50 60.75 1auv n PRO 245 Cb 0.39 -3.25 -0.03 0.00 -0.04 0.00 0.00 33.50 30.57 1auv n PRO 245 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1auv s LEU 246 N 3.10 4.44 0.43 1.53 2.96 -1.26 0.74 118.68 130.60 1auv s LEU 246 Ca 0.54 2.14 -0.26 0.00 -0.22 0.00 0.00 54.13 56.32 1auv s LEU 246 Cb 0.11 -3.60 -0.09 0.00 0.50 0.00 0.00 46.19 43.11 1auv s LEU 246 CO 0.03 -0.36 1.45 0.00 -1.32 0.00 0.00 176.35 176.15 1auv n ILE 247 N 2.86 2.51 -2.19 6.68 3.06 -0.10 -4.75 119.36 127.43 1auv n ILE 247 Ca 0.05 -0.50 -0.42 0.00 -2.50 0.00 0.00 62.75 59.38 1auv n ILE 247 Cb 0.45 -1.89 -0.00 0.00 0.54 0.00 0.00 39.64 38.74 1auv n ILE 247 CO 0.00 0.00 0.00 -3.20 -2.50 0.00 0.00 176.55 170.85 1auv n ASN 248 N 0.04 4.41 -4.86 9.51 5.15 -1.26 -4.97 115.26 123.29 1auv n ASN 248 Ca 0.04 -2.88 -0.31 0.00 -0.60 0.00 0.00 54.58 50.83 1auv n ASN 248 Cb 0.40 -1.70 -0.02 0.00 -0.53 0.00 0.00 39.78 37.93 1auv n ASN 248 CO 0.00 0.00 0.00 -1.58 1.40 0.00 0.00 177.26 177.08 1auv s GLN 249 N 3.87 3.80 -0.06 1.20 0.74 -1.26 -4.50 119.66 123.45 1auv s GLN 249 Ca 0.52 0.78 0.04 0.00 0.05 0.00 0.00 55.36 56.75 1auv s GLN 249 Cb 0.08 -2.17 0.00 0.00 1.10 0.00 0.00 33.01 32.02 1auv s GLN 249 CO 0.01 -0.32 -0.17 0.99 -0.55 0.00 0.00 175.29 175.25 1auv s THR 250 N -2.76 1.48 -0.14 -0.34 2.01 0.88 -4.97 115.64 111.82 1auv s THR 250 Ca 0.56 -0.71 -0.06 0.00 0.31 0.00 0.00 61.69 61.78 1auv s THR 250 Cb -0.10 -1.30 -0.04 0.00 0.01 0.00 0.00 72.50 71.07 1auv s THR 250 CO 0.39 0.43 0.09 0.12 -0.69 0.00 0.00 174.62 174.95 1auv s PHE 251 N 0.29 3.39 -0.20 4.92 5.36 -1.26 -0.92 117.98 129.56 1auv s PHE 251 Ca -0.10 0.32 0.01 0.00 -0.96 0.00 0.00 56.93 56.19 1auv s PHE 251 Cb -0.14 -1.97 0.04 0.00 -0.34 0.00 0.00 43.02 40.61 1auv s PHE 251 CO 0.04 0.48 -0.10 0.71 -1.46 0.00 0.00 175.22 174.89 1auv s TYR 252 N -0.47 2.42 0.13 10.12 2.02 0.18 -4.98 117.35 126.76 1auv s TYR 252 Ca 0.11 -1.60 -0.15 0.00 -0.37 0.00 0.00 57.07 55.06 1auv s TYR 252 Cb -0.12 -1.64 -0.01 0.00 -0.40 0.00 0.00 41.96 39.80 1auv s TYR 252 CO 0.02 -0.74 1.61 -1.35 -1.57 0.00 0.00 175.55 173.51 1auv h PRO 253 N 7.97 0.68 -2.95 -1.71 0.11 -1.95 -2.08 132.00 132.08 1auv h PRO 253 Ca -0.27 -0.18 -0.17 0.00 0.11 0.00 0.00 66.00 65.48 1auv h PRO 253 Cb 1.10 -0.08 -0.29 0.00 0.11 0.00 0.00 31.00 31.84 1auv h PRO 253 CO 0.47 0.73 -0.43 1.21 -0.21 0.00 0.00 178.00 179.76 1auv s ASN 254 N -6.09 -0.32 0.34 -2.05 3.84 -1.26 -3.49 114.94 105.90 1auv s ASN 254 Ca -0.13 0.61 0.24 0.00 0.21 0.00 0.00 52.86 53.79 1auv s ASN 254 Cb 0.10 0.50 1.17 0.00 -0.55 0.00 0.00 41.25 42.47 1auv s ASN 254 CO 0.78 -0.16 1.24 0.00 -2.79 0.00 0.00 177.10 176.17 1auv n HIS 255 N 4.09 0.62 -0.15 0.43 1.44 -1.26 -3.85 115.22 116.55 1auv n HIS 255 Ca -0.24 0.63 -0.03 0.00 -2.01 0.00 0.00 57.72 56.07 1auv n HIS 255 Cb 0.54 -1.04 -0.03 0.00 0.12 0.00 0.00 29.99 29.58 1auv n HIS 255 CO 0.00 0.00 0.00 1.17 -2.81 0.00 0.00 176.34 174.70 1auv n LYS 256 N -4.37 -0.15 -3.03 -1.40 4.81 -1.26 -4.78 118.16 107.99 1auv n LYS 256 Ca 0.32 0.56 -0.42 0.00 -0.87 0.00 0.00 58.31 57.90 1auv n LYS 256 Cb 1.21 -0.82 -0.06 0.00 0.02 0.00 0.00 35.03 35.38 1auv n LYS 256 CO 0.00 0.00 0.00 -1.83 1.17 0.00 0.00 177.40 176.74 1auv s GLU 257 N -5.21 3.79 0.00 1.64 1.03 -1.25 -5.15 118.70 113.55 1auv s GLU 257 Ca -0.05 0.28 0.00 0.00 0.03 0.00 0.00 54.97 55.24 1auv s GLU 257 Cb 0.05 -3.78 0.00 0.00 -0.80 0.00 0.00 34.13 29.60 1auv s GLU 257 CO 0.23 -0.74 0.00 1.28 -1.33 0.00 0.00 175.26 174.70 1auv n LEU 259 N 6.18 0.00 -4.29 1.83 4.77 -1.26 -5.13 117.00 119.10 1auv n LEU 259 Ca 0.01 0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 55.83 1auv n LEU 259 Cb 0.48 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.48 1auv n LEU 259 CO 0.50 0.00 -0.20 -0.94 -1.33 0.00 0.00 177.39 175.42 1auv s SER 260 N 0.00 1.13 -0.11 -1.43 1.04 -1.26 -4.83 113.70 108.24 1auv s SER 260 Ca 0.00 -1.52 0.03 0.00 0.48 0.00 0.00 55.95 54.94 1auv s SER 260 Cb 0.00 0.38 -0.00 0.00 0.10 0.00 0.00 66.02 66.50 1auv s SER 260 CO 0.00 -0.88 -0.22 -0.44 0.98 0.00 0.00 173.24 172.68 1auv s SER 261 N -3.31 3.25 0.44 7.02 0.01 -1.26 -4.99 113.70 114.86 1auv s SER 261 Ca 0.38 -0.52 0.10 0.00 1.31 0.00 0.00 55.95 57.22 1auv s SER 261 Cb 0.05 -1.44 0.56 0.00 0.21 0.00 0.00 66.02 65.40 1auv s SER 261 CO 0.17 0.16 1.20 0.71 0.41 0.00 0.00 173.24 175.89 1auv h THR 262 N 5.66 0.00 -2.93 1.44 1.35 -2.01 -3.42 112.91 113.00 1auv h THR 262 Ca -0.20 0.00 0.03 0.00 -0.55 0.00 0.00 66.41 65.69 1auv h THR 262 Cb 1.23 0.23 -0.02 0.00 -1.73 0.00 0.00 68.15 67.86 1auv h THR 262 CO 0.49 0.00 0.30 0.42 -0.25 0.00 0.00 175.52 176.47 1auv s THR 263 N -3.48 0.00 0.02 6.82 -4.23 -1.26 -5.19 115.64 108.32 1auv s THR 263 Ca -0.01 -0.95 -0.10 0.00 -1.18 0.00 0.00 61.69 59.45 1auv s THR 263 Cb 0.03 -2.58 0.01 0.00 1.34 0.00 0.00 72.50 71.30 1auv s THR 263 CO 0.09 0.00 0.20 -0.31 -0.54 0.00 0.00 174.62 174.06 1auv s TYR 264 N -2.82 0.01 0.96 3.99 2.02 -1.26 -4.48 117.35 115.77 1auv s TYR 264 Ca 0.14 -0.13 -0.12 0.00 -0.37 0.00 0.00 57.07 56.59 1auv s TYR 264 Cb -0.05 -0.01 0.17 0.00 -0.40 0.00 0.00 41.96 41.67 1auv s TYR 264 CO 0.09 -0.38 1.12 -1.25 -1.57 0.00 0.00 175.55 173.56 1auv s PRO 265 N -1.97 0.73 -0.01 -1.71 0.04 -1.26 -4.94 135.00 125.88 1auv s PRO 265 Ca -0.10 0.37 0.01 0.00 0.04 0.00 0.00 61.00 61.32 1auv s PRO 265 Cb -0.04 -1.79 0.01 0.00 0.04 0.00 0.00 34.50 32.72 1auv s PRO 265 CO -0.01 -2.49 -0.03 0.54 0.04 0.00 0.00 177.00 175.05 1auv s VAL 266 N -3.14 0.33 -0.25 -0.36 0.11 -0.77 -2.15 120.40 114.16 1auv s VAL 266 Ca 0.65 -0.12 -0.14 0.00 -2.93 0.00 0.00 61.98 59.44 1auv s VAL 266 Cb -0.16 -0.32 -0.04 0.00 -1.53 0.00 0.00 36.38 34.33 1auv s VAL 266 CO 0.55 0.12 0.33 -0.69 -3.33 0.00 0.00 175.10 172.08 1auv s VAL 267 N 0.24 5.22 -0.27 2.04 1.01 0.13 -1.05 120.40 127.73 1auv s VAL 267 Ca -0.02 0.49 -0.10 0.00 0.00 0.00 0.00 61.98 62.35 1auv s VAL 267 Cb -0.06 -3.66 -0.05 0.00 0.00 0.00 0.00 36.38 32.62 1auv s VAL 267 CO -0.00 0.21 0.16 -0.69 0.00 0.00 0.00 175.10 174.78 1auv s VAL 268 N 1.76 5.13 0.34 2.92 1.01 0.12 -1.67 120.40 130.01 1auv s VAL 268 Ca 0.14 0.11 0.04 0.00 0.00 0.00 0.00 61.98 62.26 1auv s VAL 268 Cb -0.15 -3.43 0.04 0.00 0.00 0.00 0.00 36.38 32.84 1auv s VAL 268 CO 0.09 0.29 0.33 0.29 0.00 0.00 0.00 175.10 176.10 1auv n LYS 269 N 4.87 0.91 0.00 2.72 5.02 0.11 -0.85 118.16 130.94 1auv n LYS 269 Ca -0.15 -2.05 0.00 0.00 -2.02 0.00 0.00 58.31 54.09 1auv n LYS 269 Cb 0.52 0.10 0.00 0.00 -0.02 0.00 0.00 35.03 35.63 1auv n LYS 269 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1auv n GLY 271 N 0.83 0.00 2.96 0.72 0.00 -0.19 -0.90 105.19 108.61 1auv n GLY 271 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1auv n GLY 271 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1auv s HIS 272 N 0.00 3.16 0.13 1.61 2.46 -1.26 -4.79 115.29 116.60 1auv s HIS 272 Ca 0.00 -2.55 0.03 0.00 0.47 0.00 0.00 55.06 53.02 1auv s HIS 272 Cb 0.00 -2.43 -0.04 0.00 -0.13 0.00 0.00 32.58 29.98 1auv s HIS 272 CO 0.00 -0.91 -0.09 0.00 -2.47 0.00 0.00 174.74 171.27 1auv s ALA 273 N 1.12 1.27 0.24 1.58 0.00 -1.26 -4.62 121.76 120.08 1auv s ALA 273 Ca 0.07 -1.43 0.04 0.00 0.00 0.00 0.00 51.96 50.64 1auv s ALA 273 Cb -0.19 0.09 -0.05 0.00 0.00 0.00 0.00 23.12 22.97 1auv s ALA 273 CO -0.11 -0.14 -0.00 -1.01 0.00 0.00 0.00 175.76 174.50 1auv s HIS 274 N -3.39 1.61 -2.02 0.00 0.09 -1.26 -4.82 115.29 105.50 1auv s HIS 274 Ca 0.14 -0.91 0.00 0.00 -0.00 0.00 0.00 55.06 54.29 1auv s HIS 274 Cb 0.03 -0.94 0.00 0.00 -0.00 0.00 0.00 32.58 31.67 1auv s HIS 274 CO -0.01 -0.02 0.00 0.43 -0.00 0.00 0.00 174.74 175.14 1auv n SER 275 N -0.44 -5.09 0.00 1.40 7.64 -1.26 -4.92 113.62 110.95 1auv n SER 275 Ca -0.05 0.45 0.00 0.00 1.01 0.00 0.00 58.87 60.28 1auv n SER 275 Cb 0.64 -4.52 0.00 0.00 -1.01 0.00 0.00 64.21 59.32 1auv n SER 275 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1auv n GLY 276 N -0.39 0.53 1.86 0.23 0.00 -1.26 -5.14 105.19 101.03 1auv n GLY 276 Ca -0.19 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.03 1auv n GLY 276 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1auv n GLY 278 N 0.00 0.00 3.90 -0.02 0.00 -1.26 -4.90 105.19 102.91 1auv n GLY 278 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1auv n GLY 278 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1auv s LYS 279 N 0.00 3.49 -0.17 1.61 1.02 -1.26 -4.28 119.74 120.15 1auv s LYS 279 Ca 0.00 -0.27 -0.06 0.00 0.02 0.00 0.00 55.97 55.67 1auv s LYS 279 Cb 0.00 -3.05 0.08 0.00 -0.52 0.00 0.00 37.83 34.34 1auv s LYS 279 CO 0.00 0.63 0.34 0.08 -0.92 0.00 0.00 175.35 175.48 1auv s VAL 280 N -1.41 -0.54 -0.11 3.17 1.01 -0.03 -4.98 120.40 117.51 1auv s VAL 280 Ca 0.31 0.20 -0.24 0.00 0.00 0.00 0.00 61.98 62.24 1auv s VAL 280 Cb -0.13 -0.58 -0.03 0.00 0.00 0.00 0.00 36.38 35.65 1auv s VAL 280 CO 0.21 0.07 0.77 -0.75 0.00 0.00 0.00 175.10 175.40 1auv s LYS 281 N 2.52 4.38 -0.24 2.72 2.20 -1.26 -0.70 119.74 129.35 1auv s LYS 281 Ca 0.01 0.96 0.02 0.00 -0.36 0.00 0.00 55.97 56.59 1auv s LYS 281 Cb -0.12 -3.51 0.06 0.00 -1.51 0.00 0.00 37.83 32.75 1auv s LYS 281 CO -0.11 -0.12 -0.09 0.08 -0.36 0.00 0.00 175.35 174.75 1auv s VAL 282 N 1.42 1.88 -1.01 4.02 1.01 -0.21 -4.98 120.40 122.53 1auv s VAL 282 Ca 0.38 -1.41 0.28 0.00 0.00 0.00 0.00 61.98 61.23 1auv s VAL 282 Cb -0.17 -2.04 0.23 0.00 0.00 0.00 0.00 36.38 34.40 1auv s VAL 282 CO 0.16 -0.02 1.89 0.47 0.00 0.00 0.00 175.10 177.60 1auv n ASP 283 N 4.55 0.00 -3.57 3.32 8.00 -1.26 -1.84 116.55 125.75 1auv n ASP 283 Ca -0.14 0.49 -0.10 0.00 0.71 0.00 0.00 54.79 55.75 1auv n ASP 283 Cb 0.43 -0.50 -0.02 0.00 -0.02 0.00 0.00 41.12 41.01 1auv n ASP 283 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1auv s ASN 284 N -2.99 -0.44 0.23 -2.24 2.20 -1.26 -4.50 114.94 105.93 1auv s ASN 284 Ca 0.13 -0.21 -0.12 0.00 -0.94 0.00 0.00 52.86 51.72 1auv s ASN 284 Cb 0.18 0.62 0.32 0.00 -2.00 0.00 0.00 41.25 40.37 1auv s ASN 284 CO 0.50 -1.06 1.60 -0.61 -2.94 0.00 0.00 177.10 174.60 1auv h GLN 285 N 2.05 0.00 -0.02 3.55 5.75 -1.97 -0.71 115.11 123.77 1auv h GLN 285 Ca -0.30 -0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.20 1auv h GLN 285 Cb 1.29 -0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.84 1auv h GLN 285 CO 0.35 0.00 0.00 0.45 -2.65 0.00 0.00 178.83 176.99 1auv h HIS 286 N 0.00 0.03 -0.21 3.99 3.86 -1.98 -2.19 115.15 118.65 1auv h HIS 286 Ca 0.37 -0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.55 1auv h HIS 286 Cb 0.56 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 29.01 1auv h HIS 286 CO -0.60 0.24 0.04 -0.44 0.86 0.00 0.00 177.93 178.03 1auv h ASP 287 N -0.20 0.26 -0.37 2.45 5.19 -1.87 -2.07 116.42 119.82 1auv h ASP 287 Ca 0.01 -0.03 -0.01 0.00 -0.62 0.00 0.00 57.03 56.38 1auv h ASP 287 Cb 0.23 -0.07 -0.02 0.00 0.18 0.00 0.00 39.33 39.66 1auv h ASP 287 CO 0.00 0.28 0.19 0.15 -3.12 0.00 0.00 179.24 176.74 1auv h PHE 288 N 0.29 0.51 0.00 4.55 3.57 -0.88 -2.28 116.94 122.71 1auv h PHE 288 Ca 0.07 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.53 1auv h PHE 288 Cb 0.13 -0.16 -0.00 0.00 2.79 0.00 0.00 35.95 38.71 1auv h PHE 288 CO 0.00 0.42 -0.09 1.96 -2.23 0.00 0.00 178.31 178.37 1auv h GLN 289 N 0.46 0.00 -0.06 1.11 4.20 -0.74 0.55 115.11 120.62 1auv h GLN 289 Ca 0.13 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.82 1auv h GLN 289 Cb 0.09 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.86 1auv h GLN 289 CO -0.02 0.09 -0.04 -0.44 -0.67 0.00 0.00 178.83 177.76 1auv h ASP 290 N 0.00 0.14 -0.10 1.46 3.32 -1.15 -2.78 116.42 117.31 1auv h ASP 290 Ca -0.00 -0.43 -0.04 0.00 0.02 0.00 0.00 57.03 56.58 1auv h ASP 290 Cb 0.17 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 1auv h ASP 290 CO 0.01 0.54 -0.04 0.40 -1.72 0.00 0.00 179.24 178.44 1auv h ILE 291 N -0.26 1.16 -0.91 0.35 1.08 -0.82 -2.22 117.51 115.90 1auv h ILE 291 Ca 0.01 -0.65 0.02 0.00 -0.39 0.00 0.00 64.86 63.85 1auv h ILE 291 Cb 0.49 1.04 -0.05 0.00 -3.07 0.00 0.00 36.82 35.22 1auv h ILE 291 CO 0.01 0.22 0.60 0.00 -0.69 0.00 0.00 178.15 178.29 1auv h ALA 292 N 1.64 1.39 -0.37 1.87 0.00 -0.69 0.12 119.26 123.22 1auv h ALA 292 Ca 0.07 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 1auv h ALA 292 Cb 0.28 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1auv h ALA 292 CO 0.01 0.54 -0.31 0.77 0.00 0.00 0.00 179.25 180.26 1auv h SER 293 N 1.18 0.85 -0.37 0.00 0.02 -1.15 -2.05 113.55 112.03 1auv h SER 293 Ca 0.35 -0.35 -0.06 0.00 -0.84 0.00 0.00 61.79 60.89 1auv h SER 293 Cb -0.05 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.23 1auv h SER 293 CO -0.09 1.09 0.02 0.58 -1.14 0.00 0.00 176.83 177.28 1auv h VAL 294 N 0.69 1.23 -0.39 2.27 2.07 -0.84 -1.81 116.25 119.48 1auv h VAL 294 Ca 0.08 -0.93 -0.09 0.00 0.82 0.00 0.00 66.70 66.58 1auv h VAL 294 Cb 0.85 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 1auv h VAL 294 CO 0.07 0.33 -0.12 0.58 0.02 0.00 0.00 177.57 178.46 1auv h VAL 295 N 0.69 1.25 -0.74 2.57 2.07 -0.50 -1.99 116.25 119.61 1auv h VAL 295 Ca 0.14 -1.13 -0.04 0.00 0.82 0.00 0.00 66.70 66.50 1auv h VAL 295 Cb 0.40 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 1auv h VAL 295 CO 0.01 0.38 0.31 0.00 0.02 0.00 0.00 177.57 178.29 1auv h ALA 296 N 1.25 1.15 0.00 1.67 0.00 -0.66 -1.88 119.26 120.79 1auv h ALA 296 Ca 0.11 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1auv h ALA 296 Cb 0.56 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1auv h ALA 296 CO 0.03 0.62 0.00 1.28 0.00 0.00 0.00 179.25 181.18 1auv n LEU 297 N -4.30 0.00 0.07 0.00 4.77 -0.75 -2.82 117.00 113.97 1auv n LEU 297 Ca 0.07 0.22 0.11 0.00 -0.03 0.00 0.00 56.01 56.38 1auv n LEU 297 Cb 0.17 -0.22 -0.03 0.00 -2.33 0.00 0.00 43.42 41.02 1auv n LEU 297 CO 0.40 -0.06 -0.15 0.35 -1.33 0.00 0.00 177.39 176.61 1auv n THR 298 N -1.22 0.40 -3.09 -5.08 -2.24 -0.71 -4.97 114.28 97.38 1auv n THR 298 Ca 0.12 -0.48 -0.23 0.00 -2.27 0.00 0.00 64.05 61.19 1auv n THR 298 Cb 0.16 -0.17 0.04 0.00 -2.10 0.00 0.00 70.33 68.25 1auv n THR 298 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1auv n LYS 299 N -2.45 -5.05 -3.69 -0.78 5.02 -1.13 -4.97 118.16 105.11 1auv n LYS 299 Ca -0.01 0.88 -0.10 0.00 -2.02 0.00 0.00 58.31 57.06 1auv n LYS 299 Cb 0.53 -5.75 -0.04 0.00 -0.02 0.00 0.00 35.03 29.75 1auv n LYS 299 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1auv s THR 300 N -3.18 0.04 1.11 -0.18 -1.32 -1.26 -5.16 115.64 105.69 1auv s THR 300 Ca 0.33 -0.68 -0.14 0.00 -1.21 0.00 0.00 61.69 59.99 1auv s THR 300 Cb -0.15 -1.41 0.24 0.00 -1.51 0.00 0.00 72.50 69.68 1auv s THR 300 CO 0.41 -0.18 1.07 -0.72 -2.21 0.00 0.00 174.62 172.99 1auv s TYR 301 N -3.85 1.47 0.21 9.09 -0.85 -1.23 -4.73 117.35 117.47 1auv s TYR 301 Ca 0.07 0.90 -0.22 0.00 -0.52 0.00 0.00 57.07 57.29 1auv s TYR 301 Cb 0.00 -3.24 0.05 0.00 0.38 0.00 0.00 41.96 39.15 1auv s TYR 301 CO -0.07 -3.47 0.65 0.00 -1.52 0.00 0.00 175.55 171.15 1auv s ALA 302 N -2.82 -1.44 0.17 9.51 0.00 -0.78 -1.02 121.76 125.39 1auv s ALA 302 Ca 0.67 0.15 0.08 0.00 0.00 0.00 0.00 51.96 52.86 1auv s ALA 302 Cb -0.18 0.87 -0.04 0.00 0.00 0.00 0.00 23.12 23.77 1auv s ALA 302 CO 0.59 -0.88 -0.16 0.95 0.00 0.00 0.00 175.76 176.26 1auv s THR 303 N -3.82 1.68 0.01 0.00 -4.23 -0.08 -0.65 115.64 108.54 1auv s THR 303 Ca 0.05 -1.98 0.03 0.00 -1.18 0.00 0.00 61.69 58.61 1auv s THR 303 Cb -0.03 -1.85 -0.01 0.00 1.34 0.00 0.00 72.50 71.95 1auv s THR 303 CO -0.05 -0.44 -0.10 0.42 -0.54 0.00 0.00 174.62 173.91 1auv s THR 304 N -2.42 0.78 -0.01 3.99 -4.23 -0.10 -0.71 115.64 112.95 1auv s THR 304 Ca 0.17 -0.63 -0.06 0.00 -1.18 0.00 0.00 61.69 59.99 1auv s THR 304 Cb -0.04 -0.70 0.00 0.00 1.34 0.00 0.00 72.50 73.11 1auv s THR 304 CO 0.06 0.07 0.13 -1.83 -0.54 0.00 0.00 174.62 172.51 1auv s GLU 305 N -0.62 0.41 0.48 3.99 -1.05 -0.67 -0.08 118.70 121.15 1auv s GLU 305 Ca 0.01 -0.30 -0.24 0.00 -0.15 0.00 0.00 54.97 54.29 1auv s GLU 305 Cb -0.05 0.17 -0.08 0.00 -0.44 0.00 0.00 34.13 33.73 1auv s GLU 305 CO 0.00 -0.09 1.37 -2.30 0.95 0.00 0.00 175.26 175.19 1auv n PRO 306 N 1.76 2.01 -2.65 -4.83 -0.02 -1.26 -0.70 135.00 129.31 1auv n PRO 306 Ca -0.21 0.72 -0.41 0.00 -2.02 0.00 0.00 63.50 61.58 1auv n PRO 306 Cb 0.56 -2.56 -0.04 0.00 -0.02 0.00 0.00 33.50 31.44 1auv n PRO 306 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1auv s PHE 307 N -1.23 3.74 -0.28 6.00 5.36 -0.92 -4.69 117.98 125.97 1auv s PHE 307 Ca 0.64 1.73 -0.08 0.00 -0.96 0.00 0.00 56.93 58.26 1auv s PHE 307 Cb -0.45 -3.13 -0.02 0.00 -0.34 0.00 0.00 43.02 39.08 1auv s PHE 307 CO 0.55 -0.08 0.10 0.42 -1.46 0.00 0.00 175.22 174.75 1auv s ILE 308 N -0.12 4.38 -0.85 3.12 -1.09 -1.26 -4.89 121.20 120.48 1auv s ILE 308 Ca 0.48 -0.31 -0.25 0.00 -2.23 0.00 0.00 60.65 58.33 1auv s ILE 308 Cb -0.26 -3.14 0.04 0.00 -1.58 0.00 0.00 42.46 37.52 1auv s ILE 308 CO 0.32 0.21 1.36 -0.62 -1.23 0.00 0.00 174.94 174.98 1auv s ASP 309 N 1.60 6.27 0.16 3.58 2.15 -1.26 -4.99 116.67 124.19 1auv s ASP 309 Ca 0.05 -0.84 -0.09 0.00 0.43 0.00 0.00 52.55 52.10 1auv s ASP 309 Cb -0.16 -2.56 -0.06 0.00 -0.30 0.00 0.00 42.92 39.83 1auv s ASP 309 CO 0.04 -1.73 0.48 0.00 -0.17 0.00 0.00 175.17 173.79 1auv s ALA 310 N 5.54 3.66 0.07 3.66 0.00 -1.26 -2.45 121.76 130.97 1auv s ALA 310 Ca 0.40 -0.34 -0.09 0.00 0.00 0.00 0.00 51.96 51.93 1auv s ALA 310 Cb -0.05 -2.34 -0.28 0.00 0.00 0.00 0.00 23.12 20.45 1auv s ALA 310 CO 0.05 0.55 1.12 0.87 0.00 0.00 0.00 175.76 178.35 1auv h LYS 311 N 3.03 0.41 -2.29 0.00 1.57 -0.55 -3.45 116.57 115.30 1auv h LYS 311 Ca -0.47 -0.63 0.17 0.00 -1.87 0.00 0.00 60.65 57.84 1auv h LYS 311 Cb 1.18 0.23 -0.10 0.00 0.08 0.00 0.00 32.23 33.62 1auv h LYS 311 CO 0.69 1.29 0.50 1.52 -0.57 0.00 0.00 179.45 182.87 1auv s TYR 312 N -2.77 -0.17 0.13 -1.35 -0.85 -1.18 -4.89 117.35 106.26 1auv s TYR 312 Ca -0.06 -0.09 0.06 0.00 -0.52 0.00 0.00 57.07 56.45 1auv s TYR 312 Cb 0.06 0.61 -0.04 0.00 0.38 0.00 0.00 41.96 42.98 1auv s TYR 312 CO 0.91 -0.74 0.03 -0.51 -1.52 0.00 0.00 175.55 173.71 1auv s ASP 313 N -2.84 5.07 -0.01 -0.18 1.11 -0.03 -0.28 116.67 119.52 1auv s ASP 313 Ca 0.11 -0.22 0.02 0.00 0.18 0.00 0.00 52.55 52.63 1auv s ASP 313 Cb -0.01 -1.21 -0.00 0.00 1.07 0.00 0.00 42.92 42.77 1auv s ASP 313 CO -0.00 0.13 -0.06 -0.69 1.18 0.00 0.00 175.17 175.72 1auv s VAL 314 N -1.53 0.49 -0.11 -1.27 1.01 0.22 -0.33 120.40 118.88 1auv s VAL 314 Ca 0.27 -0.26 -0.01 0.00 0.00 0.00 0.00 61.98 61.99 1auv s VAL 314 Cb -0.11 -0.41 0.03 0.00 0.00 0.00 0.00 36.38 35.89 1auv s VAL 314 CO 0.20 0.14 -0.04 -0.60 0.00 0.00 0.00 175.10 174.79 1auv s ARG 315 N -0.11 1.21 -0.30 2.72 3.52 -0.54 -1.19 118.95 124.26 1auv s ARG 315 Ca 0.02 -0.20 -0.10 0.00 -0.13 0.00 0.00 55.73 55.32 1auv s ARG 315 Cb -0.03 -1.50 -0.01 0.00 -1.56 0.00 0.00 34.95 31.84 1auv s ARG 315 CO -0.00 -0.32 0.15 0.42 -0.81 0.00 0.00 175.30 174.73 1auv s ILE 316 N 1.78 4.65 0.21 4.11 1.01 -0.40 -1.52 121.20 131.05 1auv s ILE 316 Ca 0.04 -0.34 0.07 0.00 0.00 0.00 0.00 60.65 60.42 1auv s ILE 316 Cb -0.13 -3.34 -0.04 0.00 0.01 0.00 0.00 42.46 38.96 1auv s ILE 316 CO -0.07 0.11 0.10 0.00 0.00 0.00 0.00 174.94 175.08 1auv s GLN 317 N 1.63 2.69 -0.13 2.79 -2.07 0.19 -0.61 119.66 124.14 1auv s GLN 317 Ca 0.05 -1.08 -0.04 0.00 -1.82 0.00 0.00 55.36 52.47 1auv s GLN 317 Cb -0.17 -2.47 0.06 0.00 -1.09 0.00 0.00 33.01 29.35 1auv s GLN 317 CO 0.06 0.43 0.19 0.21 -1.32 0.00 0.00 175.29 174.86 1auv s LYS 318 N -3.41 0.10 -0.29 9.60 2.20 0.40 -2.51 119.74 125.84 1auv s LYS 318 Ca 0.31 0.44 0.03 0.00 -0.36 0.00 0.00 55.97 56.39 1auv s LYS 318 Cb -0.09 -0.62 0.08 0.00 -1.51 0.00 0.00 37.83 35.69 1auv s LYS 318 CO 0.22 -0.43 -0.03 0.42 -0.36 0.00 0.00 175.35 175.17 1auv s ILE 319 N 2.31 2.02 0.00 5.43 1.01 -0.59 -1.61 121.20 129.77 1auv s ILE 319 Ca 0.04 -1.80 0.00 0.00 0.00 0.00 0.00 60.65 58.89 1auv s ILE 319 Cb -0.13 -2.30 0.00 0.00 0.01 0.00 0.00 42.46 40.03 1auv s ILE 319 CO -0.08 -0.28 0.00 0.61 0.00 0.00 0.00 174.94 175.19 1auv n GLY 320 N 4.43 2.97 0.79 6.18 0.00 -0.18 -0.71 105.19 118.68 1auv n GLY 320 Ca -0.07 0.11 0.07 0.00 0.00 0.00 0.00 46.02 46.13 1auv n GLY 320 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1auv n GLN 321 N 8.43 2.93 -3.83 1.61 1.13 -1.26 -4.97 117.38 121.42 1auv n GLN 321 Ca 0.00 -2.50 -0.35 0.00 -1.94 0.00 0.00 57.00 52.21 1auv n GLN 321 Cb 0.00 -1.60 -0.10 0.00 0.11 0.00 0.00 30.24 28.66 1auv n GLN 321 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 1auv s ASN 322 N -1.51 5.79 0.07 1.08 3.84 0.11 -5.09 114.94 119.23 1auv s ASN 322 Ca 0.34 0.07 0.06 0.00 0.21 0.00 0.00 52.86 53.54 1auv s ASN 322 Cb 0.24 -2.02 -0.04 0.00 -0.55 0.00 0.00 41.25 38.89 1auv s ASN 322 CO 0.12 0.11 -0.12 -0.31 -2.79 0.00 0.00 177.10 174.11 1auv s TYR 323 N 0.76 2.72 -0.10 0.43 1.51 -1.26 -1.54 117.35 119.87 1auv s TYR 323 Ca 0.05 -0.16 -0.13 0.00 -1.01 0.00 0.00 57.07 55.82 1auv s TYR 323 Cb -0.13 -1.48 0.03 0.00 -0.11 0.00 0.00 41.96 40.28 1auv s TYR 323 CO 0.02 0.37 0.34 0.15 -1.11 0.00 0.00 175.55 175.32 1auv s LYS 324 N -1.83 0.48 -0.08 -0.62 1.02 -1.04 -5.02 119.74 112.65 1auv s LYS 324 Ca 0.18 0.31 0.03 0.00 0.02 0.00 0.00 55.97 56.51 1auv s LYS 324 Cb -0.11 0.22 0.01 0.00 -0.52 0.00 0.00 37.83 37.44 1auv s LYS 324 CO 0.10 -0.08 -0.15 0.00 -0.92 0.00 0.00 175.35 174.29 1auv s ALA 325 N -0.21 1.54 0.00 5.17 0.00 -1.26 -0.64 121.76 126.37 1auv s ALA 325 Ca -0.04 -0.60 0.00 0.00 0.00 0.00 0.00 51.96 51.33 1auv s ALA 325 Cb -0.03 -0.67 0.00 0.00 0.00 0.00 0.00 23.12 22.42 1auv s ALA 325 CO 0.01 0.13 0.00 0.66 0.00 0.00 0.00 175.76 176.56 1auv n TYR 326 N 3.81 0.00 -3.58 0.00 4.01 -0.58 -0.77 117.16 120.05 1auv n TYR 326 Ca -0.21 0.00 -0.05 0.00 -0.16 0.00 0.00 57.90 57.47 1auv n TYR 326 Cb 0.52 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.53 1auv n TYR 326 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 1auv s ARG 328 N 1.37 0.39 0.00 -0.72 3.52 0.56 -1.46 118.95 122.60 1auv s ARG 328 Ca 0.00 -0.11 0.00 0.00 -0.13 0.00 0.00 55.73 55.49 1auv s ARG 328 Cb 0.00 0.18 0.00 0.00 -1.56 0.00 0.00 34.95 33.57 1auv s ARG 328 CO 0.00 -0.16 0.00 -2.37 -0.81 0.00 0.00 175.30 171.96 1auv n THR 329 N -0.01 0.00 -4.71 4.11 5.66 -1.26 -0.85 114.28 117.22 1auv n THR 329 Ca -0.02 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.66 1auv n THR 329 Cb 0.59 0.00 -0.17 0.00 -1.55 0.00 0.00 70.33 69.20 1auv n THR 329 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1auv s LEU 344 N -1.87 2.07 -0.04 1.09 1.43 -1.26 -4.98 118.68 115.11 1auv s LEU 344 Ca 0.00 -0.58 0.00 0.00 -1.03 0.00 0.00 54.13 52.52 1auv s LEU 344 Cb 0.00 -1.40 0.02 0.00 0.03 0.00 0.00 46.19 44.84 1auv s LEU 344 CO 0.00 0.08 -0.02 -0.70 0.23 0.00 0.00 176.35 175.94 1auv s GLU 345 N 0.78 0.61 -0.13 1.70 2.56 -1.26 -4.94 118.70 118.01 1auv s GLU 345 Ca -0.08 -0.00 -0.29 0.00 0.00 0.00 0.00 54.97 54.59 1auv s GLU 345 Cb -0.16 -0.74 -0.02 0.00 2.00 0.00 0.00 34.13 35.21 1auv s GLU 345 CO -0.01 -0.14 1.34 -1.14 -0.56 0.00 0.00 175.26 174.75 1auv s GLN 346 N 1.15 4.23 0.21 4.30 0.74 -1.26 -4.38 119.66 124.65 1auv s GLN 346 Ca -0.08 1.77 0.08 0.00 0.05 0.00 0.00 55.36 57.19 1auv s GLN 346 Cb -0.14 -3.79 -0.04 0.00 1.10 0.00 0.00 33.01 30.14 1auv s GLN 346 CO -0.01 -0.72 0.03 0.96 -0.55 0.00 0.00 175.29 175.00 1auv s ILE 347 N 3.51 3.78 0.00 -2.34 -4.36 0.05 -4.98 121.20 116.86 1auv s ILE 347 Ca 0.59 -1.55 0.00 0.00 -0.26 0.00 0.00 60.65 59.42 1auv s ILE 347 Cb -0.24 -2.96 0.00 0.00 1.25 0.00 0.00 42.46 40.51 1auv s ILE 347 CO 0.18 -0.23 0.00 0.00 0.24 0.00 0.00 174.94 175.14 1auv n ALA 348 N -0.52 0.00 -3.62 2.27 0.00 -1.26 -4.04 120.51 113.34 1auv n ALA 348 Ca -0.08 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.33 1auv n ALA 348 Cb 0.57 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.00 1auv n ALA 348 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1auv s SER 350 N -1.75 -0.14 0.47 0.00 1.04 -1.26 -4.88 113.70 107.18 1auv s SER 350 Ca 0.00 -0.11 0.18 0.00 0.48 0.00 0.00 55.95 56.50 1auv s SER 350 Cb 0.00 0.23 1.14 0.00 0.10 0.00 0.00 66.02 67.48 1auv s SER 350 CO 0.00 -0.39 2.02 0.44 0.98 0.00 0.00 173.24 176.29 1auv h ASP 351 N 2.00 0.00 0.06 7.02 3.32 -2.05 -0.72 116.42 126.05 1auv h ASP 351 Ca -0.21 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.84 1auv h ASP 351 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 1auv h ASP 351 CO 0.26 0.16 -0.03 -0.09 -1.72 0.00 0.00 179.24 177.82 1auv h ARG 352 N 0.00 -0.08 -0.43 3.56 2.43 -1.99 -1.03 114.38 116.84 1auv h ARG 352 Ca -0.00 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.20 1auv h ARG 352 Cb 0.30 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.84 1auv h ARG 352 CO 0.02 0.27 0.24 1.88 -1.51 0.00 0.00 179.97 180.86 1auv h TYR 353 N -0.43 0.44 -0.50 2.20 0.05 -1.86 -2.21 116.97 114.66 1auv h TYR 353 Ca -0.01 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.79 1auv h TYR 353 Cb 0.38 -0.13 -0.02 0.00 1.01 0.00 0.00 36.73 37.96 1auv h TYR 353 CO 0.04 0.24 0.33 -0.22 -1.05 0.00 0.00 178.16 177.50 1auv h LYS 354 N 0.47 0.67 -0.85 4.88 3.64 -1.11 -2.35 116.57 121.92 1auv h LYS 354 Ca 0.18 -0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.56 1auv h LYS 354 Cb 0.05 -0.15 -0.06 0.00 -0.41 0.00 0.00 32.23 31.67 1auv h LYS 354 CO -0.11 0.45 0.54 1.25 -2.27 0.00 0.00 179.45 179.31 1auv h LEU 355 N 0.68 0.86 0.03 5.20 5.85 -0.74 0.25 115.31 127.45 1auv h LEU 355 Ca 0.18 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 1auv h LEU 355 Cb -0.07 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 40.79 1auv h LEU 355 CO -0.04 0.57 -0.02 -0.50 -0.34 0.00 0.00 178.44 178.12 1auv h TRP 356 N 1.01 -0.04 -0.05 1.25 6.55 -0.95 -1.46 115.95 122.25 1auv h TRP 356 Ca 0.36 -0.00 -0.19 0.00 0.95 0.00 0.00 58.89 60.00 1auv h TRP 356 Cb 0.09 0.01 -0.00 0.00 -0.86 0.00 0.00 29.16 28.40 1auv h TRP 356 CO -0.03 0.01 -0.79 -0.24 -1.05 0.00 0.00 178.44 176.35 1auv h VAL 357 N -0.09 1.39 -0.19 1.49 3.04 -1.11 -2.11 116.25 118.67 1auv h VAL 357 Ca -0.00 -2.25 -0.01 0.00 -1.01 0.00 0.00 66.70 63.43 1auv h VAL 357 Cb 0.07 2.21 -0.01 0.00 -2.01 0.00 0.00 31.29 31.55 1auv h VAL 357 CO 0.01 0.67 0.07 0.44 -1.01 0.00 0.00 177.57 177.75 1auv h ASP 358 N 0.25 0.27 -0.52 3.17 3.32 -0.48 0.16 116.42 122.60 1auv h ASP 358 Ca -0.04 -0.17 -0.03 0.00 0.02 0.00 0.00 57.03 56.81 1auv h ASP 358 Cb 1.38 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.83 1auv h ASP 358 CO 0.13 0.37 0.22 0.71 -1.72 0.00 0.00 179.24 178.96 1auv h THR 359 N 0.16 1.21 -0.37 0.35 1.35 -1.26 -2.35 112.91 112.00 1auv h THR 359 Ca 0.06 -0.63 -0.04 0.00 -0.55 0.00 0.00 66.41 65.26 1auv h THR 359 Cb 0.19 0.66 -0.02 0.00 -1.73 0.00 0.00 68.15 67.25 1auv h THR 359 CO -0.00 0.24 0.04 0.00 -0.25 0.00 0.00 175.52 175.55 1auv n SER 361 N -4.30 0.00 0.01 0.00 3.41 0.54 -2.39 113.62 110.89 1auv n SER 361 Ca 0.02 0.30 0.12 0.00 -0.26 0.00 0.00 58.87 59.05 1auv n SER 361 Cb 0.22 -0.40 0.16 0.00 -0.26 0.00 0.00 64.21 63.93 1auv n SER 361 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1auv n GLU 362 N -1.40 0.08 -1.60 4.33 1.02 -0.76 0.38 120.64 122.70 1auv n GLU 362 Ca 0.05 0.01 -0.33 0.00 -0.02 0.00 0.00 57.16 56.86 1auv n GLU 362 Cb 0.14 -1.54 0.07 0.00 -0.02 0.00 0.00 31.44 30.09 1auv n GLU 362 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 1auv s ILE 363 N -3.05 2.86 -1.60 -3.67 -4.36 -1.01 -2.93 121.20 107.44 1auv s ILE 363 Ca 0.09 0.40 -0.14 0.00 -0.26 0.00 0.00 60.65 60.74 1auv s ILE 363 Cb 0.16 -2.92 0.11 0.00 1.25 0.00 0.00 42.46 41.06 1auv s ILE 363 CO 0.74 -0.24 0.79 0.49 0.24 0.00 0.00 174.94 176.96 1auv n PHE 364 N -2.59 -1.91 -0.42 1.37 3.72 -1.26 -0.57 117.46 115.80 1auv n PHE 364 Ca 0.12 0.83 0.00 0.00 -0.05 0.00 0.00 57.45 58.34 1auv n PHE 364 Cb 0.51 -3.43 0.00 0.00 -0.94 0.00 0.00 39.48 35.63 1auv n PHE 364 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1auv n GLY 365 N -1.58 1.75 0.00 1.37 0.00 -1.23 -4.39 105.19 101.11 1auv n GLY 365 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1auv n GLY 365 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1auv n GLY 366 N -2.00 3.66 3.39 -0.02 0.00 0.27 -5.02 105.19 105.47 1auv n GLY 366 Ca 0.00 -1.09 -0.36 0.00 0.00 0.00 0.00 46.02 44.56 1auv n GLY 366 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1auv s LEU 367 N 0.00 3.42 0.21 0.99 1.43 0.16 -4.68 118.68 120.21 1auv s LEU 367 Ca 0.00 -0.38 0.04 0.00 -1.03 0.00 0.00 54.13 52.76 1auv s LEU 367 Cb 0.00 -1.87 0.17 0.00 0.03 0.00 0.00 46.19 44.52 1auv s LEU 367 CO 0.00 -0.07 1.50 0.44 0.23 0.00 0.00 176.35 178.45 1auv h ASP 368 N 8.21 0.26 -3.24 2.29 3.32 -1.91 -3.42 116.42 121.93 1auv h ASP 368 Ca -0.37 -0.17 -0.52 0.00 0.02 0.00 0.00 57.03 55.99 1auv h ASP 368 Cb 1.16 -0.08 -0.36 0.00 0.22 0.00 0.00 39.33 40.27 1auv h ASP 368 CO 0.59 0.87 -0.80 -0.63 -1.72 0.00 0.00 179.24 177.54 1auv s ILE 369 N -3.58 1.03 0.24 0.35 1.01 -1.26 -1.01 121.20 117.98 1auv s ILE 369 Ca -0.04 -0.32 -0.21 0.00 0.00 0.00 0.00 60.65 60.08 1auv s ILE 369 Cb 0.11 -1.03 0.05 0.00 0.01 0.00 0.00 42.46 41.61 1auv s ILE 369 CO 0.81 0.36 0.88 0.00 0.00 0.00 0.00 174.94 176.98 1auv s ALA 371 N -3.02 -1.78 -0.19 0.00 0.00 -0.96 -0.45 121.76 115.35 1auv s ALA 371 Ca 0.14 1.65 -0.06 0.00 0.00 0.00 0.00 51.96 53.69 1auv s ALA 371 Cb -0.04 -0.56 -0.03 0.00 0.00 0.00 0.00 23.12 22.49 1auv s ALA 371 CO 0.06 -0.35 0.03 0.08 0.00 0.00 0.00 175.76 175.58 1auv s VAL 372 N -0.48 4.41 -0.18 0.00 1.01 0.22 -1.08 120.40 124.30 1auv s VAL 372 Ca -0.06 -0.16 -0.13 0.00 0.00 0.00 0.00 61.98 61.63 1auv s VAL 372 Cb -0.02 -2.99 -0.05 0.00 0.00 0.00 0.00 36.38 33.32 1auv s VAL 372 CO 0.06 0.44 0.25 -1.61 0.00 0.00 0.00 175.10 174.24 1auv s GLU 373 N 0.66 4.23 0.03 2.72 0.41 0.20 -1.27 118.70 125.67 1auv s GLU 373 Ca 0.02 -0.00 -0.01 0.00 -0.41 0.00 0.00 54.97 54.57 1auv s GLU 373 Cb -0.14 -3.44 -0.02 0.00 -1.78 0.00 0.00 34.13 28.75 1auv s GLU 373 CO 0.02 0.23 -0.01 0.00 -0.49 0.00 0.00 175.26 175.00 1auv s ALA 374 N 0.52 0.18 0.07 5.21 0.00 -0.33 -0.39 121.76 127.02 1auv s ALA 374 Ca 0.14 -0.71 0.05 0.00 0.00 0.00 0.00 51.96 51.43 1auv s ALA 374 Cb -0.13 0.18 -0.04 0.00 0.00 0.00 0.00 23.12 23.14 1auv s ALA 374 CO 0.03 -0.22 -0.02 -0.51 0.00 0.00 0.00 175.76 175.03 1auv s LEU 375 N -1.86 3.39 -0.30 0.00 1.43 0.55 -0.61 118.68 121.29 1auv s LEU 375 Ca -0.10 -0.18 -0.04 0.00 -1.03 0.00 0.00 54.13 52.79 1auv s LEU 375 Cb -0.05 -2.10 0.04 0.00 0.03 0.00 0.00 46.19 44.11 1auv s LEU 375 CO -0.03 0.20 0.02 -2.28 0.23 0.00 0.00 176.35 174.49 1auv s HIS 376 N -1.25 3.21 0.51 0.29 5.65 0.62 -1.42 115.29 122.89 1auv s HIS 376 Ca 0.24 -1.58 -0.19 0.00 0.25 0.00 0.00 55.06 53.78 1auv s HIS 376 Cb -0.12 -2.16 -0.08 0.00 -1.18 0.00 0.00 32.58 29.05 1auv s HIS 376 CO 0.16 -0.74 1.03 0.20 -0.65 0.00 0.00 174.74 174.74 1auv s GLY 377 N 1.34 2.38 0.53 1.59 0.00 -0.70 0.15 107.32 112.60 1auv s GLY 377 Ca -0.02 0.51 0.19 0.00 0.00 0.00 0.00 44.72 45.39 1auv s GLY 377 CO -0.00 0.82 2.16 0.50 0.00 0.00 0.00 173.10 176.58 1auv h LYS 378 N 1.28 0.00 0.00 2.90 1.57 -1.78 0.21 116.57 120.75 1auv h LYS 378 Ca -0.49 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 1auv h LYS 378 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 1auv h LYS 378 CO 0.59 0.00 0.00 -3.47 -0.57 0.00 0.00 179.45 176.00 1auv n ASP 379 N -4.41 0.00 0.00 0.86 2.03 -1.26 -4.86 116.55 108.91 1auv n ASP 379 Ca -0.03 0.48 0.00 0.00 0.52 0.00 0.00 54.79 55.77 1auv n ASP 379 Cb 0.11 -0.49 0.00 0.00 -0.72 0.00 0.00 41.12 40.02 1auv n ASP 379 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1auv n GLY 380 N -0.99 2.67 3.76 0.27 0.00 0.73 -5.03 105.19 106.61 1auv n GLY 380 Ca 0.01 -0.39 -0.37 0.00 0.00 0.00 0.00 46.02 45.27 1auv n GLY 380 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1auv s ARG 381 N 0.00 3.41 0.31 1.61 0.52 -1.26 -4.73 118.95 118.82 1auv s ARG 381 Ca 0.00 1.91 0.03 0.00 -0.52 0.00 0.00 55.73 57.15 1auv s ARG 381 Cb 0.00 -2.26 -0.03 0.00 0.52 0.00 0.00 34.95 33.19 1auv s ARG 381 CO 0.00 -0.87 0.47 -0.51 0.02 0.00 0.00 175.30 174.41 1auv s ASP 382 N -1.30 6.23 -0.13 0.23 1.01 -1.26 -1.73 116.67 119.73 1auv s ASP 382 Ca 0.69 0.22 -0.05 0.00 0.71 0.00 0.00 52.55 54.12 1auv s ASP 382 Cb -0.32 -1.84 0.06 0.00 1.01 0.00 0.00 42.92 41.83 1auv s ASP 382 CO 0.38 -0.25 0.26 -1.00 0.21 0.00 0.00 175.17 174.77 1auv s HIS 383 N -2.19 -0.42 -0.08 4.23 3.76 -0.51 -4.83 115.29 115.27 1auv s HIS 383 Ca 0.39 0.96 -0.27 0.00 -0.15 0.00 0.00 55.06 55.99 1auv s HIS 383 Cb -0.09 -0.03 -0.03 0.00 1.11 0.00 0.00 32.58 33.54 1auv s HIS 383 CO 0.33 -0.35 0.85 0.42 -0.85 0.00 0.00 174.74 175.14 1auv s ILE 384 N 2.36 4.92 -0.27 0.60 1.01 0.23 -0.33 121.20 129.72 1auv s ILE 384 Ca 0.01 1.74 -0.13 0.00 0.00 0.00 0.00 60.65 62.27 1auv s ILE 384 Cb -0.12 -4.18 -0.13 0.00 0.01 0.00 0.00 42.46 38.04 1auv s ILE 384 CO -0.08 0.14 -0.29 -0.38 0.00 0.00 0.00 174.94 174.32 1auv n ILE 385 N 4.14 1.53 -3.76 2.92 2.08 0.47 -0.92 119.36 125.83 1auv n ILE 385 Ca 0.03 -0.38 -0.03 0.00 0.56 0.00 0.00 62.75 62.94 1auv n ILE 385 Cb 0.50 -1.85 -0.01 0.00 -0.75 0.00 0.00 39.64 37.53 1auv n ILE 385 CO 0.00 0.00 0.00 -1.83 0.56 0.00 0.00 176.55 175.28 1auv s GLU 386 N -2.50 1.15 -0.03 0.38 -1.05 -1.13 -4.91 118.70 110.61 1auv s GLU 386 Ca -0.38 -0.65 0.05 0.00 -0.15 0.00 0.00 54.97 53.85 1auv s GLU 386 Cb 0.14 0.39 -0.01 0.00 -0.44 0.00 0.00 34.13 34.20 1auv s GLU 386 CO 0.51 -0.53 -0.20 0.54 0.95 0.00 0.00 175.26 176.53 1auv s VAL 387 N -3.12 1.60 0.13 1.83 0.11 -1.26 -0.63 120.40 119.06 1auv s VAL 387 Ca 0.13 -0.84 0.08 0.00 -2.93 0.00 0.00 61.98 58.43 1auv s VAL 387 Cb -0.01 -1.35 -0.04 0.00 -1.53 0.00 0.00 36.38 33.45 1auv s VAL 387 CO 0.02 0.45 -0.11 0.68 -3.33 0.00 0.00 175.10 172.82 1auv s VAL 388 N -0.23 3.25 0.00 2.04 -7.23 -0.24 -4.98 120.40 113.02 1auv s VAL 388 Ca 0.02 -1.42 0.00 0.00 -1.81 0.00 0.00 61.98 58.76 1auv s VAL 388 Cb -0.10 -2.55 0.00 0.00 0.56 0.00 0.00 36.38 34.29 1auv s VAL 388 CO 0.01 0.04 0.00 0.61 -0.31 0.00 0.00 175.10 175.45 1auv n GLY 389 N 0.49 1.56 0.00 2.32 0.00 -1.26 -2.25 105.19 106.04 1auv n GLY 389 Ca -0.13 -1.76 0.03 0.00 0.00 0.00 0.00 46.02 44.16 1auv n GLY 389 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1auv n SER 390 N 0.00 0.00 -4.53 1.61 3.41 -1.16 -4.43 113.62 108.52 1auv n SER 390 Ca 0.00 0.39 -0.41 0.00 -0.26 0.00 0.00 58.87 58.59 1auv n SER 390 Cb 0.00 -0.43 -0.09 0.00 -0.26 0.00 0.00 64.21 63.43 1auv n SER 390 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1auv s SER 391 N -2.85 6.20 0.03 4.04 1.04 -1.25 -4.23 113.70 116.67 1auv s SER 391 Ca 0.04 -0.29 0.06 0.00 0.48 0.00 0.00 55.95 56.24 1auv s SER 391 Cb 0.04 -2.21 -0.03 0.00 0.10 0.00 0.00 66.02 63.92 1auv s SER 391 CO 0.11 -0.41 -0.15 -2.16 0.98 0.00 0.00 173.24 171.61 1auv s PRO 393 N 2.10 2.20 -0.15 4.02 0.04 -1.26 -4.79 135.00 137.16 1auv s PRO 393 Ca 0.13 -0.91 -0.25 0.00 0.04 0.00 0.00 61.00 60.01 1auv s PRO 393 Cb -0.16 -2.27 -0.02 0.00 0.04 0.00 0.00 34.50 32.09 1auv s PRO 393 CO 0.12 0.56 0.81 -0.51 0.04 0.00 0.00 177.00 178.01 1auv s LEU 394 N -1.43 4.20 0.51 -3.56 1.43 -1.26 -5.05 118.68 113.52 1auv s LEU 394 Ca 0.15 1.17 0.01 0.00 -1.03 0.00 0.00 54.13 54.43 1auv s LEU 394 Cb -0.11 -3.20 -0.01 0.00 0.03 0.00 0.00 46.19 42.90 1auv s LEU 394 CO 0.06 -0.35 0.02 0.27 0.23 0.00 0.00 176.35 176.58 1auv s ILE 395 N 1.91 1.04 0.00 -0.59 -4.36 -1.26 -5.00 121.20 112.93 1auv s ILE 395 Ca 0.38 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.77 1auv s ILE 395 Cb -0.17 -2.12 0.00 0.00 1.25 0.00 0.00 42.46 41.42 1auv s ILE 395 CO 0.14 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.93 1auv n GLY 396 N -1.25 -1.65 0.95 6.27 0.00 -1.26 -4.31 105.19 103.94 1auv n GLY 396 Ca -0.19 -1.30 0.12 0.00 0.00 0.00 0.00 46.02 44.65 1auv n GLY 396 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1auv n ASP 397 N -0.08 2.94 -2.03 1.61 5.68 -1.26 -4.28 116.55 119.14 1auv n ASP 397 Ca 0.00 -1.95 -0.25 0.00 -0.50 0.00 0.00 54.79 52.09 1auv n ASP 397 Cb 0.00 -0.06 0.10 0.00 -1.14 0.00 0.00 41.12 40.02 1auv n ASP 397 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 1auv n HIS 398 N 1.26 2.70 0.22 2.11 8.25 -1.26 -4.71 115.22 123.79 1auv n HIS 398 Ca 0.16 -2.42 0.06 0.00 -0.26 0.00 0.00 57.72 55.26 1auv n HIS 398 Cb 0.57 -0.92 0.51 0.00 1.12 0.00 0.00 29.99 31.28 1auv n HIS 398 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 1auv h GLN 399 N 1.76 0.00 0.00 -0.41 4.20 -1.75 -1.68 115.11 117.22 1auv h GLN 399 Ca 0.48 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 59.08 1auv h GLN 399 Cb 1.40 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.17 1auv h GLN 399 CO 1.09 0.22 -0.49 -0.44 -0.67 0.00 0.00 178.83 178.54 1auv h ASP 400 N 0.00 0.00 -0.01 1.46 5.19 -1.95 -1.66 116.42 119.45 1auv h ASP 400 Ca -0.00 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.40 1auv h ASP 400 Cb 0.41 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.92 1auv h ASP 400 CO 0.03 0.49 -0.01 -0.33 -3.12 0.00 0.00 179.24 176.29 1auv h GLU 401 N 0.00 0.02 -0.29 3.56 3.07 -1.70 -1.57 114.58 117.67 1auv h GLU 401 Ca -0.00 -0.01 0.05 0.00 -0.50 0.00 0.00 59.36 58.89 1auv h GLU 401 Cb 1.21 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 29.08 1auv h GLU 401 CO 0.06 0.60 -0.02 -0.44 -1.40 0.00 0.00 179.01 177.81 1auv h ASP 402 N -0.55 -0.15 -0.81 1.42 3.32 -1.39 -0.22 116.42 118.03 1auv h ASP 402 Ca 0.00 0.07 0.05 0.00 0.02 0.00 0.00 57.03 57.17 1auv h ASP 402 Cb 0.60 0.13 -0.06 0.00 0.22 0.00 0.00 39.33 40.22 1auv h ASP 402 CO 0.00 -0.04 0.51 0.11 -1.72 0.00 0.00 179.24 178.10 1auv h LYS 403 N 0.07 0.92 -0.03 3.56 1.57 -1.33 -0.26 116.57 121.07 1auv h LYS 403 Ca 0.14 -0.06 -0.10 0.00 -1.87 0.00 0.00 60.65 58.76 1auv h LYS 403 Cb 0.19 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 1auv h LYS 403 CO -0.25 0.61 -0.47 1.96 -0.57 0.00 0.00 179.45 180.73 1auv h GLN 404 N 0.95 0.07 -0.26 3.15 1.08 -0.61 -2.55 115.11 116.94 1auv h GLN 404 Ca 0.34 -0.03 -0.18 0.00 -1.45 0.00 0.00 58.65 57.33 1auv h GLN 404 Cb 0.11 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.54 1auv h GLN 404 CO -0.15 0.52 -0.56 -0.07 -0.95 0.00 0.00 178.83 177.62 1auv h LEU 405 N 0.05 0.90 -0.90 1.46 3.38 0.01 -2.05 115.31 118.16 1auv h LEU 405 Ca 0.00 -0.49 -0.06 0.00 0.09 0.00 0.00 57.88 57.42 1auv h LEU 405 Cb 0.85 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 1auv h LEU 405 CO 0.06 1.27 0.09 0.40 0.09 0.00 0.00 178.44 180.35 1auv h ILE 406 N 0.61 1.24 -0.29 1.22 2.04 -0.99 -1.06 117.51 120.28 1auv h ILE 406 Ca 0.01 -0.93 -0.02 0.00 1.00 0.00 0.00 64.86 64.91 1auv h ILE 406 Cb 1.16 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 37.94 1auv h ILE 406 CO 0.12 0.34 0.09 0.58 0.00 0.00 0.00 178.15 179.29 1auv h VAL 407 N 0.85 1.20 -0.53 1.67 2.07 -1.24 -0.24 116.25 120.03 1auv h VAL 407 Ca 0.18 -0.64 -0.08 0.00 0.82 0.00 0.00 66.70 66.98 1auv h VAL 407 Cb 0.38 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 1auv h VAL 407 CO 0.01 0.21 0.00 -0.33 0.02 0.00 0.00 177.57 177.48 1auv h GLU 408 N 0.32 0.90 0.54 1.57 5.08 -1.14 -0.48 114.58 121.37 1auv h GLU 408 Ca 0.10 -0.26 -0.03 0.00 -1.00 0.00 0.00 59.36 58.17 1auv h GLU 408 Cb 0.24 -0.10 0.01 0.00 0.50 0.00 0.00 28.75 29.40 1auv h GLU 408 CO -0.00 0.89 -0.26 1.25 -1.00 0.00 0.00 179.01 179.89 1auv h LEU 409 N 0.83 -0.62 -0.10 1.33 5.85 -0.91 -2.10 115.31 119.59 1auv h LEU 409 Ca 0.16 -0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.90 1auv h LEU 409 Cb 0.49 0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.65 1auv h LEU 409 CO 0.02 -0.40 -0.06 0.58 -0.34 0.00 0.00 178.44 178.24 1auv h VAL 410 N -0.79 0.81 -0.76 1.05 2.07 -0.93 -1.82 116.25 115.88 1auv h VAL 410 Ca -0.07 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.55 1auv h VAL 410 Cb 0.59 0.81 -0.07 0.00 -1.52 0.00 0.00 31.29 31.09 1auv h VAL 410 CO 0.12 0.00 0.40 0.58 0.02 0.00 0.00 177.57 178.69 1auv h VAL 411 N -0.06 0.85 -0.74 2.57 2.07 -1.08 -1.10 116.25 118.76 1auv h VAL 411 Ca 0.06 -0.23 -0.03 0.00 0.82 0.00 0.00 66.70 67.33 1auv h VAL 411 Cb 0.15 0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 30.02 1auv h VAL 411 CO -0.14 0.12 0.36 -1.13 0.02 0.00 0.00 177.57 176.80 1auv h ASN 412 N 0.66 0.97 0.00 0.57 -0.73 -1.00 -1.71 115.58 114.34 1auv h ASN 412 Ca 0.38 -0.13 0.00 0.00 1.87 0.00 0.00 56.30 58.41 1auv h ASN 412 Cb 0.40 -0.25 0.00 0.00 0.27 0.00 0.00 38.32 38.74 1auv h ASN 412 CO -0.27 0.83 0.00 0.29 -0.37 0.00 0.00 177.43 177.91 1auv n LYS 413 N -4.40 0.44 0.00 6.67 4.76 -0.42 -2.07 118.16 123.14 1auv n LYS 413 Ca 0.06 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.50 1auv n LYS 413 Cb 0.13 -1.28 0.00 0.00 -1.84 0.00 0.00 35.03 32.04 1auv n LYS 413 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1auv n ALA 415 N 0.83 0.00 1.64 7.82 0.00 -0.65 -1.12 120.51 129.04 1auv n ALA 415 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.59 1auv n ALA 415 Cb 0.22 0.00 0.77 0.00 0.00 0.00 0.00 19.45 20.44 1auv n ALA 415 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1auv n GLN 416 N 0.00 0.81 0.00 0.00 10.64 -0.88 -5.03 117.38 122.93 1auv n GLN 416 Ca 0.00 -0.14 0.16 0.00 -1.83 0.00 0.00 57.00 55.18 1auv n GLN 416 Cb 0.00 -1.50 0.91 0.00 -0.86 0.00 0.00 30.24 28.79 1auv n GLN 416 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23