#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vjj h GLN 113 N 0.00 -0.08 -0.48 0.00 4.15 -2.06 -2.77 115.11 113.87 2vjj h GLN 113 Ca 0.00 0.01 0.06 0.00 0.77 0.00 0.00 58.65 59.48 2vjj h GLN 113 Cb 0.00 0.02 -0.05 0.00 0.21 0.00 0.00 27.48 27.66 2vjj h GLN 113 CO 0.00 0.13 0.19 0.35 -1.93 0.00 0.00 178.83 177.57 2vjj h PHE 114 N -0.28 0.33 -0.59 3.99 3.57 -2.05 -1.53 116.94 120.39 2vjj h PHE 114 Ca -0.01 0.02 0.12 0.00 3.53 0.00 0.00 57.97 61.64 2vjj h PHE 114 Cb 0.25 -0.08 -0.11 0.00 2.79 0.00 0.00 35.95 38.80 2vjj h PHE 114 CO -0.01 0.13 -0.07 -0.09 -2.23 0.00 0.00 178.31 176.04 2vjj h ARG 115 N 0.37 0.06 -0.94 1.11 2.43 -1.98 0.26 114.38 115.68 2vjj h ARG 115 Ca 0.23 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 2vjj h ARG 115 Cb 0.21 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.70 2vjj h ARG 115 CO -0.21 0.04 0.59 0.00 -1.51 0.00 0.00 179.97 178.87 2vjj h ALA 116 N 1.56 1.26 -0.00 2.80 0.00 -1.02 -0.81 119.26 123.06 2vjj h ALA 116 Ca 0.30 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 2vjj h ALA 116 Cb 0.47 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 2vjj h ALA 116 CO -0.55 0.65 -0.00 0.82 0.00 0.00 0.00 179.25 180.17 2vjj h ILE 117 N 1.29 1.39 -0.62 0.00 2.04 -0.32 -2.72 117.51 118.58 2vjj h ILE 117 Ca 0.34 -1.16 -0.04 0.00 1.00 0.00 0.00 64.86 65.00 2vjj h ILE 117 Cb -0.09 2.18 -0.03 0.00 -0.74 0.00 0.00 36.82 38.14 2vjj h ILE 117 CO -0.07 0.30 0.21 0.40 0.00 0.00 0.00 178.15 178.99 2vjj h ILE 118 N -0.49 1.23 -0.00 -0.67 1.08 -0.37 -1.87 117.51 116.42 2vjj h ILE 118 Ca 0.00 -0.76 0.00 0.00 -0.39 0.00 0.00 64.86 63.71 2vjj h ILE 118 Cb 0.49 0.53 0.00 0.00 -3.07 0.00 0.00 36.82 34.77 2vjj h ILE 118 CO 0.00 0.30 -0.07 -0.62 -0.69 0.00 0.00 178.15 177.07 2vjj n GLU 119 N -4.29 0.04 -1.75 2.37 1.02 -0.32 -4.00 120.64 113.70 2vjj n GLU 119 Ca 0.05 -0.01 -0.29 0.00 -0.02 0.00 0.00 57.16 56.90 2vjj n GLU 119 Cb 0.19 -1.50 0.11 0.00 -0.02 0.00 0.00 31.44 30.22 2vjj n GLU 119 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2vjj s SER 120 N -2.96 4.13 0.28 1.62 1.04 -0.72 -4.91 113.70 112.18 2vjj s SER 120 Ca 0.15 0.86 0.20 0.00 0.48 0.00 0.00 55.95 57.64 2vjj s SER 120 Cb 0.19 -1.40 1.02 0.00 0.10 0.00 0.00 66.02 65.94 2vjj s SER 120 CO 0.55 -2.15 1.61 -2.65 0.98 0.00 0.00 173.24 171.58 2vjj n PRO 121 N -3.49 0.13 0.00 4.02 -0.02 -1.26 -1.39 135.00 132.99 2vjj n PRO 121 Ca 0.07 0.58 0.13 0.00 -2.02 0.00 0.00 63.50 62.26 2vjj n PRO 121 Cb 0.60 -1.89 0.43 0.00 -0.02 0.00 0.00 33.50 32.61 2vjj n PRO 121 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2vjj n GLU 122 N -2.17 0.33 -0.24 -0.52 4.71 -1.26 -4.58 120.64 116.91 2vjj n GLU 122 Ca -0.01 -0.15 0.03 0.00 -0.01 0.00 0.00 57.16 57.02 2vjj n GLU 122 Cb 0.07 -1.50 0.16 0.00 -1.01 0.00 0.00 31.44 29.16 2vjj n GLU 122 CO 0.00 0.00 0.00 0.78 0.09 0.00 0.00 177.13 178.00 2vjj h GLY 123 N 4.98 1.04 2.00 0.62 0.00 -1.01 -1.22 103.07 109.47 2vjj h GLY 123 Ca 0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 47.33 47.17 2vjj h GLY 123 CO 0.00 -0.05 -0.09 0.00 0.00 0.00 0.00 176.54 176.39 2vjj h ALA 124 N 1.49 1.13 0.00 3.60 0.00 -1.81 -0.37 119.26 123.31 2vjj h ALA 124 Ca 0.37 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2vjj h ALA 124 Cb 0.52 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2vjj h ALA 124 CO -0.36 0.12 0.00 0.41 0.00 0.00 0.00 179.25 179.42 2vjj n GLY 125 N -0.43 -0.97 0.44 0.00 0.00 -0.46 -1.86 105.19 101.91 2vjj n GLY 125 Ca -0.01 -0.10 0.04 0.00 0.00 0.00 0.00 46.02 45.95 2vjj n GLY 125 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2vjj n HIS 126 N -1.27 0.23 -3.79 1.61 8.25 -0.15 -4.92 115.22 115.19 2vjj n HIS 126 Ca 0.10 -0.33 -0.37 0.00 -0.26 0.00 0.00 57.72 56.86 2vjj n HIS 126 Cb 0.16 -0.02 -0.12 0.00 1.12 0.00 0.00 29.99 31.13 2vjj n HIS 126 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2vjj s VAL 127 N -0.90 3.47 0.75 1.59 1.01 -1.19 -5.05 120.40 120.07 2vjj s VAL 127 Ca 0.15 -1.44 -0.11 0.00 0.00 0.00 0.00 61.98 60.58 2vjj s VAL 127 Cb 0.08 -3.08 0.04 0.00 0.00 0.00 0.00 36.38 33.43 2vjj s VAL 127 CO 0.12 -0.30 1.09 -0.83 0.00 0.00 0.00 175.10 175.17 2vjj s GLY 128 N 1.53 1.71 -0.14 4.51 0.00 -1.26 -0.51 107.32 113.15 2vjj s GLY 128 Ca -0.00 0.25 -0.24 0.00 0.00 0.00 0.00 44.72 44.73 2vjj s GLY 128 CO -0.00 0.59 0.60 -0.47 0.00 0.00 0.00 173.10 173.82 2vjj s TYR 129 N -2.89 -0.61 -0.09 1.90 5.04 0.43 -4.69 117.35 116.45 2vjj s TYR 129 Ca 0.61 1.31 -0.04 0.00 -2.44 0.00 0.00 57.07 56.51 2vjj s TYR 129 Cb -0.17 0.28 0.05 0.00 0.35 0.00 0.00 41.96 42.47 2vjj s TYR 129 CO 0.55 -0.43 0.18 -1.14 -1.34 0.00 0.00 175.55 173.36 2vjj s GLN 130 N -0.40 0.07 -0.30 4.97 0.74 -1.26 -0.19 119.66 123.29 2vjj s GLN 130 Ca -0.05 0.56 -0.40 0.00 0.05 0.00 0.00 55.36 55.51 2vjj s GLN 130 Cb -0.03 -0.21 -0.15 0.00 1.10 0.00 0.00 33.01 33.72 2vjj s GLN 130 CO 0.04 -0.27 1.81 0.98 -0.55 0.00 0.00 175.29 177.30 2vjj n TYR 131 N 5.06 1.98 -2.62 1.67 9.36 -1.26 -1.40 117.16 129.94 2vjj n TYR 131 Ca -0.10 0.53 -0.12 0.00 3.32 0.00 0.00 57.90 61.53 2vjj n TYR 131 Cb 0.50 -2.46 -0.00 0.00 -0.63 0.00 0.00 39.34 36.75 2vjj n TYR 131 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 2vjj n ARG 132 N 5.75 -2.56 -2.31 2.98 1.74 -1.26 -0.32 116.66 120.68 2vjj n ARG 132 Ca 0.29 0.46 -0.16 0.00 -0.77 0.00 0.00 57.85 57.67 2vjj n ARG 132 Cb 0.13 -5.06 -0.01 0.00 -1.02 0.00 0.00 32.46 26.49 2vjj n ARG 132 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2vjj n ARG 133 N -2.91 -1.93 -2.41 5.56 1.74 -0.49 -4.93 116.66 111.29 2vjj n ARG 133 Ca -0.09 0.79 -0.43 0.00 -0.77 0.00 0.00 57.85 57.35 2vjj n ARG 133 Cb 0.58 -5.38 -0.02 0.00 -1.02 0.00 0.00 32.46 26.62 2vjj n ARG 133 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2vjj s ASN 134 N -2.07 6.77 0.62 0.55 2.47 0.56 -4.90 114.94 118.93 2vjj s ASN 134 Ca 0.00 1.41 0.36 0.00 0.42 0.00 0.00 52.86 55.05 2vjj s ASN 134 Cb 0.00 -2.54 2.04 0.00 -1.45 0.00 0.00 41.25 39.30 2vjj s ASN 134 CO 0.00 -0.96 2.28 0.71 -3.72 0.00 0.00 177.10 175.41 2vjj h THR 135 N 5.79 0.29 -0.00 -5.21 1.35 -1.92 -0.61 112.91 112.60 2vjj h THR 135 Ca -0.26 -0.07 0.00 0.00 -0.55 0.00 0.00 66.41 65.52 2vjj h THR 135 Cb 1.10 1.05 0.00 0.00 -1.73 0.00 0.00 68.15 68.58 2vjj h THR 135 CO 1.01 0.01 -0.04 0.61 -0.25 0.00 0.00 175.52 176.86 2vjj n GLY 136 N -1.11 -0.86 3.95 5.82 0.00 -1.26 -4.92 105.19 106.83 2vjj n GLY 136 Ca -0.03 -0.25 -0.23 0.00 0.00 0.00 0.00 46.02 45.51 2vjj n GLY 136 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2vjj s SER 137 N -2.23 5.98 0.24 1.61 0.01 -0.24 -5.05 113.70 114.02 2vjj s SER 137 Ca 0.37 0.28 -0.30 0.00 1.31 0.00 0.00 55.95 57.62 2vjj s SER 137 Cb 0.21 -1.64 -0.10 0.00 0.21 0.00 0.00 66.02 64.70 2vjj s SER 137 CO 0.41 -0.55 1.41 -0.89 0.41 0.00 0.00 173.24 174.03 2vjj s THR 138 N -2.44 2.75 -0.45 1.44 2.01 -1.26 -4.91 115.64 112.78 2vjj s THR 138 Ca 0.46 0.63 -0.29 0.00 0.31 0.00 0.00 61.69 62.80 2vjj s THR 138 Cb -0.10 -3.41 0.02 0.00 0.01 0.00 0.00 72.50 69.03 2vjj s THR 138 CO 0.37 0.10 1.27 -0.04 -0.69 0.00 0.00 174.62 175.62 2vjj s MET 139 N -0.37 3.65 0.47 4.92 -1.94 -1.26 -4.43 119.30 120.33 2vjj s MET 139 Ca 0.59 0.72 0.04 0.00 -1.71 0.00 0.00 55.69 55.33 2vjj s MET 139 Cb -0.41 -3.96 -0.04 0.00 2.01 0.00 0.00 34.83 32.43 2vjj s MET 139 CO 0.43 -1.48 0.04 1.03 -0.01 0.00 0.00 175.02 175.03 2vjj s ARG 140 N 4.70 2.11 0.07 2.03 0.52 0.73 -4.97 118.95 124.14 2vjj s ARG 140 Ca 0.54 -2.23 0.05 0.00 -0.52 0.00 0.00 55.73 53.57 2vjj s ARG 140 Cb -0.10 -1.64 -0.04 0.00 0.52 0.00 0.00 34.95 33.69 2vjj s ARG 140 CO 0.32 -0.24 -0.03 -1.64 0.02 0.00 0.00 175.30 173.73 2vjj s MET 141 N -3.84 2.47 0.31 3.54 -1.94 -1.26 -0.42 119.30 118.15 2vjj s MET 141 Ca 0.21 -0.84 0.07 0.00 -1.71 0.00 0.00 55.69 53.41 2vjj s MET 141 Cb 0.05 -2.49 0.82 0.00 2.01 0.00 0.00 34.83 35.22 2vjj s MET 141 CO 0.11 0.55 1.70 0.28 -0.01 0.00 0.00 175.02 177.65 2vjj h VAL 142 N 3.16 0.47 -0.88 -6.03 2.07 -0.62 -0.34 116.25 114.08 2vjj h VAL 142 Ca -0.48 -0.15 0.06 0.00 0.82 0.00 0.00 66.70 66.94 2vjj h VAL 142 Cb 1.17 -0.02 -0.06 0.00 -1.52 0.00 0.00 31.29 30.86 2vjj h VAL 142 CO 0.57 0.08 0.57 0.77 0.02 0.00 0.00 177.57 179.58 2vjj h SER 143 N 0.45 0.88 -0.76 0.57 4.64 -1.65 -1.20 113.55 116.49 2vjj h SER 143 Ca 0.61 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.89 2vjj h SER 143 Cb 1.18 -0.18 -0.04 0.00 -0.31 0.00 0.00 62.40 63.05 2vjj h SER 143 CO -0.52 0.57 0.34 0.44 -0.87 0.00 0.00 176.83 176.78 2vjj h ASP 144 N 1.00 1.03 -0.10 4.97 3.32 -1.35 -0.39 116.42 124.89 2vjj h ASP 144 Ca 0.37 -0.14 -0.16 0.00 0.02 0.00 0.00 57.03 57.12 2vjj h ASP 144 Cb 0.19 -0.26 0.01 0.00 0.22 0.00 0.00 39.33 39.48 2vjj h ASP 144 CO -0.14 0.89 -0.57 0.58 -1.72 0.00 0.00 179.24 178.28 2vjj h VAL 145 N 1.10 1.36 -0.14 -1.35 2.07 -1.31 -3.03 116.25 114.95 2vjj h VAL 145 Ca 0.26 -1.88 -0.01 0.00 0.82 0.00 0.00 66.70 65.89 2vjj h VAL 145 Cb 0.16 2.21 -0.01 0.00 -1.52 0.00 0.00 31.29 32.13 2vjj h VAL 145 CO -0.03 0.57 0.06 -0.07 0.02 0.00 0.00 177.57 178.12 2vjj h LEU 146 N 0.17 0.17 -0.18 2.57 3.38 -1.05 -1.15 115.31 119.23 2vjj h LEU 146 Ca -0.04 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2vjj h LEU 146 Cb 1.22 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.93 2vjj h LEU 146 CO 0.12 0.15 0.00 0.47 0.09 0.00 0.00 178.44 179.27 2vjj n ASP 147 N -4.48 0.14 0.20 -0.43 8.00 -0.17 -2.50 116.55 117.31 2vjj n ASP 147 Ca -0.01 0.54 0.15 0.00 0.71 0.00 0.00 54.79 56.18 2vjj n ASP 147 Cb 0.11 -0.57 0.61 0.00 -0.02 0.00 0.00 41.12 41.24 2vjj n ASP 147 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2vjj h GLU 148 N 0.00 0.00 -5.30 -1.24 5.08 -1.20 -3.44 114.58 108.48 2vjj h GLU 148 Ca 0.00 0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 57.86 2vjj h GLU 148 Cb 0.23 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 29.35 2vjj h GLU 148 CO 0.00 0.00 -0.60 -0.98 -1.00 0.00 0.00 179.01 176.43 2vjj s ARG 149 N -3.51 1.71 -0.17 2.33 1.04 -1.04 -5.04 118.95 114.27 2vjj s ARG 149 Ca 0.02 -1.96 -0.23 0.00 -1.04 0.00 0.00 55.73 52.52 2vjj s ARG 149 Cb 0.09 -1.00 0.06 0.00 -2.04 0.00 0.00 34.95 32.06 2vjj s ARG 149 CO 0.46 -0.17 0.61 0.54 -0.04 0.00 0.00 175.30 176.70 2vjj s VAL 150 N -3.19 0.00 0.20 4.99 0.11 -1.26 -4.98 120.40 116.27 2vjj s VAL 150 Ca 0.36 -0.04 -0.01 0.00 -2.93 0.00 0.00 61.98 59.36 2vjj s VAL 150 Cb 0.09 -0.88 -0.04 0.00 -1.53 0.00 0.00 36.38 34.02 2vjj s VAL 150 CO 0.16 -0.02 0.13 -0.94 -3.33 0.00 0.00 175.10 171.10 2vjj s SER 151 N -0.18 0.17 0.53 3.54 1.04 -1.26 -1.99 113.70 115.54 2vjj s SER 151 Ca -0.04 -1.39 0.23 0.00 0.48 0.00 0.00 55.95 55.23 2vjj s SER 151 Cb -0.03 0.38 1.36 0.00 0.10 0.00 0.00 66.02 67.83 2vjj s SER 151 CO 0.03 -0.85 2.02 0.25 0.98 0.00 0.00 173.24 175.68 2vjj h LEU 152 N 2.61 0.01 -2.32 2.42 5.85 -1.59 -0.97 115.31 121.33 2vjj h LEU 152 Ca -0.36 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.39 2vjj h LEU 152 Cb 1.25 -0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.27 2vjj h LEU 152 CO 0.53 0.01 0.10 -0.50 -0.34 0.00 0.00 178.44 178.23 2vjj h TRP 153 N 0.01 0.00 0.00 1.25 -0.00 -1.93 -0.85 115.95 114.43 2vjj h TRP 153 Ca 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 59.10 2vjj h TRP 153 Cb 0.82 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.98 2vjj h TRP 153 CO -0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 178.44 178.19 2vjj n ASP 154 N -3.88 0.00 0.00 -3.49 8.00 -0.37 -3.57 116.55 113.24 2vjj n ASP 154 Ca -0.01 0.30 0.00 0.00 0.71 0.00 0.00 54.79 55.80 2vjj n ASP 154 Cb 0.20 -0.42 0.00 0.00 -0.02 0.00 0.00 41.12 40.88 2vjj n ASP 154 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2vjj n PHE 155 N -1.42 0.00 -2.47 1.24 3.01 -0.50 -4.94 117.46 112.39 2vjj n PHE 155 Ca 0.07 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.11 2vjj n PHE 155 Cb 0.23 0.00 0.01 0.00 -0.01 0.00 0.00 39.48 39.71 2vjj n PHE 155 CO 0.00 0.00 0.00 1.58 1.01 0.00 0.00 176.76 179.35 2vjj n HIS 156 N -0.18 2.70 -3.97 1.38 -0.00 -0.45 -4.68 115.22 110.03 2vjj n HIS 156 Ca 0.00 -2.73 -0.08 0.00 0.46 0.00 0.00 57.72 55.37 2vjj n HIS 156 Cb 0.08 -1.74 -0.09 0.00 -0.12 0.00 0.00 29.99 28.12 2vjj n HIS 156 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2vjj s ASP 158 N -2.79 2.44 0.34 0.00 1.47 0.43 -4.85 116.67 113.70 2vjj s ASP 158 Ca 0.05 0.47 0.24 0.00 1.18 0.00 0.00 52.55 54.49 2vjj s ASP 158 Cb 0.05 -0.65 1.25 0.00 -0.34 0.00 0.00 42.92 43.23 2vjj s ASP 158 CO -0.10 -3.17 1.74 -0.65 0.68 0.00 0.00 175.17 173.67 2vjj h PRO 159 N -1.93 0.00 -0.01 2.11 0.11 -2.01 -0.98 132.00 129.29 2vjj h PRO 159 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2vjj h PRO 159 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2vjj h PRO 159 CO 0.40 0.00 -0.13 0.43 -0.21 0.00 0.00 178.00 178.49 2vjj n SER 160 N -2.35 1.50 0.00 -2.05 7.64 -1.26 -4.95 113.62 112.15 2vjj n SER 160 Ca -0.01 -1.32 0.00 0.00 1.01 0.00 0.00 58.87 58.55 2vjj n SER 160 Cb 0.08 0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.37 2vjj n SER 160 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2vjj n GLY 161 N 1.27 0.75 3.72 0.23 0.00 -0.37 -5.06 105.19 105.74 2vjj n GLY 161 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 2vjj n GLY 161 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2vjj s ASN 162 N -2.46 7.31 0.43 1.61 0.01 -1.26 -4.75 114.94 115.83 2vjj s ASN 162 Ca 0.00 1.58 -0.25 0.00 -0.71 0.00 0.00 52.86 53.48 2vjj s ASN 162 Cb 0.00 -2.53 -0.09 0.00 0.41 0.00 0.00 41.25 39.03 2vjj s ASN 162 CO 0.00 -0.16 1.28 0.55 -1.51 0.00 0.00 177.10 177.25 2vjj n VAL 163 N 3.53 2.65 -4.63 1.60 3.14 -1.26 -0.43 118.33 122.93 2vjj n VAL 163 Ca 0.03 -0.50 -0.33 0.00 -2.96 0.00 0.00 64.34 60.58 2vjj n VAL 163 Cb 0.51 -1.58 -0.14 0.00 -1.06 0.00 0.00 33.84 31.57 2vjj n VAL 163 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 2vjj s ILE 164 N -1.21 3.26 0.23 1.55 1.01 -0.43 -4.76 121.20 120.85 2vjj s ILE 164 Ca 0.62 -0.58 -0.30 0.00 0.00 0.00 0.00 60.65 60.39 2vjj s ILE 164 Cb -0.50 -2.39 -0.09 0.00 0.01 0.00 0.00 42.46 39.49 2vjj s ILE 164 CO 0.57 0.51 1.15 -1.10 0.00 0.00 0.00 174.94 176.08 2vjj s GLN 165 N 0.43 4.56 0.78 2.79 -1.52 -1.26 -4.79 119.66 120.65 2vjj s GLN 165 Ca -0.08 1.84 -0.11 0.00 -1.95 0.00 0.00 55.36 55.06 2vjj s GLN 165 Cb -0.15 -3.21 0.06 0.00 -0.22 0.00 0.00 33.01 29.48 2vjj s GLN 165 CO 0.04 0.05 1.09 -1.25 -0.25 0.00 0.00 175.29 174.97 2vjj s PRO 166 N -0.84 2.20 0.00 2.91 0.04 -1.26 -4.88 135.00 133.17 2vjj s PRO 166 Ca 0.49 0.82 0.00 0.00 0.04 0.00 0.00 61.00 62.35 2vjj s PRO 166 Cb -0.32 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.30 2vjj s PRO 166 CO 0.39 -1.59 0.00 0.41 0.04 0.00 0.00 177.00 176.25 2vjj n GLY 167 N -1.79 0.47 0.21 0.56 0.00 -1.25 -4.96 105.19 98.42 2vjj n GLY 167 Ca 0.07 -1.09 0.14 0.00 0.00 0.00 0.00 46.02 45.14 2vjj n GLY 167 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2vjj h PRO 168 N 0.00 0.00 -0.57 1.61 0.13 -1.96 -0.87 132.00 130.34 2vjj h PRO 168 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2vjj h PRO 168 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2vjj h PRO 168 CO 0.00 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 177.86 2vjj n ASN 169 N -2.49 4.34 -4.06 1.44 3.02 -1.26 -4.91 115.26 111.34 2vjj n ASN 169 Ca -0.01 -2.41 -0.24 0.00 -0.03 0.00 0.00 54.58 51.88 2vjj n ASN 169 Cb 0.08 -0.52 -0.16 0.00 -0.61 0.00 0.00 39.78 38.57 2vjj n ASN 169 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2vjj s VAL 170 N -1.77 1.18 -0.42 2.41 1.01 -0.33 -5.11 120.40 117.37 2vjj s VAL 170 Ca 0.46 -0.54 -0.20 0.00 0.00 0.00 0.00 61.98 61.70 2vjj s VAL 170 Cb 0.29 -1.05 0.02 0.00 0.00 0.00 0.00 36.38 35.65 2vjj s VAL 170 CO 0.22 0.36 0.58 -0.62 0.00 0.00 0.00 175.10 175.64 2vjj s ASP 171 N 0.39 6.29 0.00 3.32 -1.08 -1.26 -4.39 116.67 119.93 2vjj s ASP 171 Ca -0.09 -0.39 0.29 0.00 -0.52 0.00 0.00 52.55 51.84 2vjj s ASP 171 Cb -0.13 -2.29 1.22 0.00 -1.46 0.00 0.00 42.92 40.25 2vjj s ASP 171 CO 0.03 -0.70 1.85 -1.20 0.52 0.00 0.00 175.17 175.68 2vjj n SER 172 N 6.04 0.45 0.06 -0.34 7.64 0.47 -4.47 113.62 123.47 2vjj n SER 172 Ca -0.03 -0.53 -0.13 0.00 1.01 0.00 0.00 58.87 59.19 2vjj n SER 172 Cb 0.48 -0.08 -0.06 0.00 -1.01 0.00 0.00 64.21 63.53 2vjj n SER 172 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 2vjj h ARG 173 N 0.53 -0.53 -0.11 1.43 2.43 -1.93 -1.79 114.38 114.42 2vjj h ARG 173 Ca 0.00 0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.18 2vjj h ARG 173 Cb 0.36 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 2vjj h ARG 173 CO 0.00 -0.35 -0.04 -0.56 -1.51 0.00 0.00 179.97 177.51 2vjj h GLN 174 N -0.55 0.15 -0.16 0.20 3.07 -1.96 -0.80 115.11 115.07 2vjj h GLN 174 Ca 0.05 -0.02 -0.16 0.00 0.09 0.00 0.00 58.65 58.61 2vjj h GLN 174 Cb 0.63 -0.03 0.01 0.00 0.08 0.00 0.00 27.48 28.17 2vjj h GLN 174 CO -0.30 0.21 -0.52 1.88 0.09 0.00 0.00 178.83 180.18 2vjj h TYR 175 N 0.15 0.82 -0.64 0.06 0.05 -1.69 0.14 116.97 115.86 2vjj h TYR 175 Ca 0.04 -0.34 -0.08 0.00 0.05 0.00 0.00 58.73 58.40 2vjj h TYR 175 Cb 0.17 -0.14 -0.03 0.00 1.01 0.00 0.00 36.73 37.75 2vjj h TYR 175 CO 0.00 1.12 0.08 1.25 -1.05 0.00 0.00 178.16 179.56 2vjj h LEU 176 N 0.29 1.03 -0.57 3.88 5.85 -0.88 -1.85 115.31 123.05 2vjj h LEU 176 Ca -0.02 -0.26 -0.05 0.00 0.84 0.00 0.00 57.88 58.39 2vjj h LEU 176 Cb 1.15 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.88 2vjj h LEU 176 CO 0.11 1.04 0.15 -0.61 -0.34 0.00 0.00 178.44 178.79 2vjj h GLN 177 N 1.00 0.91 -0.96 1.25 5.75 -1.07 -1.60 115.11 120.39 2vjj h GLN 177 Ca 0.19 -0.21 0.04 0.00 -0.15 0.00 0.00 58.65 58.52 2vjj h GLN 177 Cb 0.47 -0.12 -0.06 0.00 1.07 0.00 0.00 27.48 28.83 2vjj h GLN 177 CO 0.02 0.84 0.62 0.00 -2.65 0.00 0.00 178.83 177.65 2vjj h ALA 178 N 1.03 1.28 0.01 3.38 0.00 -0.73 -0.47 119.26 123.76 2vjj h ALA 178 Ca 0.18 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2vjj h ALA 178 Cb 0.33 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2vjj h ALA 178 CO -0.00 0.48 -0.00 0.00 0.00 0.00 0.00 179.25 179.72 2vjj h ALA 179 N 1.40 -0.01 -0.61 0.00 0.00 -1.01 -1.33 119.26 117.70 2vjj h ALA 179 Ca 0.39 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.26 2vjj h ALA 179 Cb 0.04 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2vjj h ALA 179 CO -0.14 -0.45 0.39 0.82 0.00 0.00 0.00 179.25 179.88 2vjj h ILE 180 N -0.12 1.13 -0.26 0.00 2.04 -1.04 -0.77 117.51 118.49 2vjj h ILE 180 Ca -0.00 -0.27 -0.03 0.00 1.00 0.00 0.00 64.86 65.55 2vjj h ILE 180 Cb 0.11 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 36.45 2vjj h ILE 180 CO 0.00 0.14 0.04 0.44 0.00 0.00 0.00 178.15 178.78 2vjj h ASP 181 N 0.79 0.42 -0.05 1.72 3.32 -1.02 -0.50 116.42 121.11 2vjj h ASP 181 Ca 0.23 -0.26 -0.00 0.00 0.02 0.00 0.00 57.03 57.01 2vjj h ASP 181 Cb -0.05 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.38 2vjj h ASP 181 CO -0.07 0.58 0.02 0.22 -1.72 0.00 0.00 179.24 178.27 2vjj h TYR 182 N 0.24 0.07 -0.62 4.55 3.20 -1.06 -1.86 116.97 121.50 2vjj h TYR 182 Ca 0.08 -0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.88 2vjj h TYR 182 Cb 0.34 -0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.56 2vjj h TYR 182 CO 0.02 0.18 0.12 0.28 -1.64 0.00 0.00 178.16 177.13 2vjj h VAL 183 N -0.06 1.25 -0.62 1.81 2.07 -1.06 -1.75 116.25 117.89 2vjj h VAL 183 Ca 0.02 -0.94 0.10 0.00 0.82 0.00 0.00 66.70 66.70 2vjj h VAL 183 Cb 0.14 0.64 -0.08 0.00 -1.52 0.00 0.00 31.29 30.47 2vjj h VAL 183 CO -0.00 0.35 0.21 -1.28 0.02 0.00 0.00 177.57 176.87 2vjj h SER 184 N 0.93 0.18 -0.79 0.57 0.87 -0.98 -1.28 113.55 113.06 2vjj h SER 184 Ca 0.19 0.09 0.16 0.00 -1.23 0.00 0.00 61.79 61.00 2vjj h SER 184 Cb 0.37 0.08 -0.05 0.00 -0.44 0.00 0.00 62.40 62.36 2vjj h SER 184 CO 0.01 0.10 0.52 0.77 -0.53 0.00 0.00 176.83 177.71 2vjj h SER 185 N 0.38 0.42 -0.62 6.23 4.64 -0.46 -2.64 113.55 121.50 2vjj h SER 185 Ca 0.32 0.03 -0.08 0.00 -0.47 0.00 0.00 61.79 61.59 2vjj h SER 185 Cb 0.42 -0.06 -0.05 0.00 -0.31 0.00 0.00 62.40 62.41 2vjj h SER 185 CO -0.33 0.21 0.10 0.59 -0.87 0.00 0.00 176.83 176.52 2vjj n ASN 186 N -4.49 5.31 0.00 4.97 3.02 -0.66 -4.90 115.26 118.50 2vjj n ASN 186 Ca 0.15 -3.00 0.00 0.00 -0.03 0.00 0.00 54.58 51.70 2vjj n ASN 186 Cb 0.55 -0.70 0.00 0.00 -0.61 0.00 0.00 39.78 39.01 2vjj n ASN 186 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2vjj n GLY 187 N 0.35 0.71 0.08 7.41 0.00 -1.00 -4.95 105.19 107.78 2vjj n GLY 187 Ca 0.32 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.30 2vjj n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vjj n GLY 188 N -2.57 -3.76 0.00 -0.02 0.00 -0.57 -4.96 105.19 93.30 2vjj n GLY 188 Ca 0.00 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 43.94 2vjj n GLY 188 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vjj n GLY 189 N -0.04 -0.06 3.06 -0.02 0.00 -0.39 -4.90 105.19 102.84 2vjj n GLY 189 Ca 0.00 -1.55 -0.29 0.00 0.00 0.00 0.00 46.02 44.19 2vjj n GLY 189 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vjj s THR 190 N -2.66 1.53 -0.24 2.61 2.01 -1.26 -0.70 115.64 116.93 2vjj s THR 190 Ca 0.00 -0.66 -0.11 0.00 0.31 0.00 0.00 61.69 61.23 2vjj s THR 190 Cb 0.00 -1.40 -0.05 0.00 0.01 0.00 0.00 72.50 71.07 2vjj s THR 190 CO 0.00 0.45 0.18 -0.63 -0.69 0.00 0.00 174.62 173.93 2vjj s ILE 191 N 0.97 5.34 0.01 1.82 1.01 -0.39 -4.35 121.20 125.61 2vjj s ILE 191 Ca -0.07 0.23 -0.22 0.00 0.00 0.00 0.00 60.65 60.60 2vjj s ILE 191 Cb -0.15 -3.52 -0.05 0.00 0.01 0.00 0.00 42.46 38.74 2vjj s ILE 191 CO -0.01 0.34 0.64 -0.89 0.00 0.00 0.00 174.94 175.01 2vjj s THR 192 N 1.09 4.85 -0.50 2.92 2.01 -0.84 -0.62 115.64 124.55 2vjj s THR 192 Ca 0.09 1.34 -0.16 0.00 0.31 0.00 0.00 61.69 63.27 2vjj s THR 192 Cb -0.14 -3.97 0.10 0.00 0.01 0.00 0.00 72.50 68.49 2vjj s THR 192 CO 0.05 0.41 0.45 -0.63 -0.69 0.00 0.00 174.62 174.21 2vjj s ILE 193 N -0.21 5.21 0.43 1.82 -1.09 0.15 -1.37 121.20 126.15 2vjj s ILE 193 Ca 0.33 -1.22 -0.26 0.00 -2.23 0.00 0.00 60.65 57.27 2vjj s ILE 193 Cb -0.19 -4.22 -0.09 0.00 -1.58 0.00 0.00 42.46 36.38 2vjj s ILE 193 CO 0.19 -0.71 1.46 -2.84 -1.23 0.00 0.00 174.94 171.81 2vjj s PRO 194 N 1.67 3.78 0.72 2.79 0.02 -1.26 -1.36 135.00 141.36 2vjj s PRO 194 Ca 0.04 2.49 -0.15 0.00 0.02 0.00 0.00 61.00 63.41 2vjj s PRO 194 Cb -0.26 -2.74 0.03 0.00 0.02 0.00 0.00 34.50 31.55 2vjj s PRO 194 CO 0.05 -0.77 1.17 0.00 -0.33 0.00 0.00 177.00 177.13 2vjj s ALA 195 N -1.17 2.19 0.00 -1.55 0.00 -1.26 -3.10 121.76 116.87 2vjj s ALA 195 Ca 0.59 0.76 0.00 0.00 0.00 0.00 0.00 51.96 53.31 2vjj s ALA 195 Cb -0.45 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.25 2vjj s ALA 195 CO 0.59 -1.74 0.00 0.41 0.00 0.00 0.00 175.76 175.02 2vjj n GLY 196 N 0.10 0.74 3.06 0.00 0.00 -1.26 -4.85 105.19 102.97 2vjj n GLY 196 Ca 0.12 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.04 2vjj n GLY 196 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2vjj s TYR 197 N -2.75 0.57 -0.18 1.61 2.02 -1.25 -5.10 117.35 112.27 2vjj s TYR 197 Ca 0.00 -0.65 -0.04 0.00 -0.37 0.00 0.00 57.07 56.01 2vjj s TYR 197 Cb 0.00 -0.36 -0.02 0.00 -0.40 0.00 0.00 41.96 41.18 2vjj s TYR 197 CO 0.00 -0.16 -0.03 0.99 -1.57 0.00 0.00 175.55 174.78 2vjj s THR 198 N -2.10 3.80 -0.32 -0.71 2.01 -1.26 -2.34 115.64 114.71 2vjj s THR 198 Ca -0.06 -0.37 -0.07 0.00 0.31 0.00 0.00 61.69 61.50 2vjj s THR 198 Cb -0.05 -2.70 0.02 0.00 0.01 0.00 0.00 72.50 69.79 2vjj s THR 198 CO -0.02 0.45 0.11 0.26 -0.69 0.00 0.00 174.62 174.73 2vjj s TRP 199 N 0.82 3.21 0.09 4.92 0.52 0.41 -3.90 118.94 125.00 2vjj s TRP 199 Ca -0.01 -1.16 -0.11 0.00 0.02 0.00 0.00 56.10 54.84 2vjj s TRP 199 Cb -0.14 -2.29 -0.06 0.00 -1.15 0.00 0.00 33.47 29.83 2vjj s TRP 199 CO 0.02 -0.65 0.44 0.71 0.02 0.00 0.00 176.95 177.49 2vjj s TYR 200 N 1.47 3.61 -0.12 -1.98 1.51 -1.26 -1.77 117.35 118.80 2vjj s TYR 200 Ca 0.01 0.88 -0.00 0.00 -1.01 0.00 0.00 57.07 56.94 2vjj s TYR 200 Cb -0.18 -2.23 -0.02 0.00 -0.11 0.00 0.00 41.96 39.42 2vjj s TYR 200 CO 0.03 0.51 -0.12 -0.51 -1.11 0.00 0.00 175.55 174.36 2vjj s LEU 201 N -1.82 2.80 -0.00 -1.29 1.43 -0.46 -0.40 118.68 118.93 2vjj s LEU 201 Ca 0.33 -0.28 0.00 0.00 -1.03 0.00 0.00 54.13 53.15 2vjj s LEU 201 Cb -0.14 -1.63 0.00 0.00 0.03 0.00 0.00 46.19 44.45 2vjj s LEU 201 CO 0.18 0.19 0.95 0.61 0.23 0.00 0.00 176.35 178.50 2vjj n GLY 202 N 3.39 0.17 3.56 -3.19 0.00 -1.26 -1.08 105.19 106.78 2vjj n GLY 202 Ca -0.18 -0.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.73 2vjj n GLY 202 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2vjj s SER 203 N -0.91 -0.46 0.45 1.61 1.04 -1.26 -4.82 113.70 109.36 2vjj s SER 203 Ca 0.00 -0.19 -0.15 0.00 0.48 0.00 0.00 55.95 56.09 2vjj s SER 203 Cb 0.00 0.63 -0.08 0.00 0.10 0.00 0.00 66.02 66.67 2vjj s SER 203 CO 0.00 -1.07 0.89 -0.31 0.98 0.00 0.00 173.24 173.73 2vjj s TYR 204 N -3.77 3.44 0.81 5.02 2.02 -1.26 -4.77 117.35 118.84 2vjj s TYR 204 Ca 0.04 1.32 -0.14 0.00 -0.37 0.00 0.00 57.07 57.93 2vjj s TYR 204 Cb -0.03 -2.66 0.19 0.00 -0.40 0.00 0.00 41.96 39.06 2vjj s TYR 204 CO -0.07 -0.22 1.08 0.41 -1.57 0.00 0.00 175.55 175.19 2vjj n GLY 205 N -1.28 -1.51 3.51 0.71 0.00 0.11 -4.96 105.19 101.77 2vjj n GLY 205 Ca 0.05 -1.69 -0.24 0.00 0.00 0.00 0.00 46.02 44.14 2vjj n GLY 205 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2vjj s VAL 206 N -3.34 1.21 0.00 1.61 -7.23 -1.26 -4.60 120.40 106.79 2vjj s VAL 206 Ca 0.62 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.79 2vjj s VAL 206 Cb -0.02 -2.71 0.00 0.00 0.56 0.00 0.00 36.38 34.22 2vjj s VAL 206 CO 0.43 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.83 2vjj n GLY 207 N -0.81 1.29 0.28 2.32 0.00 -1.26 -3.83 105.19 103.19 2vjj n GLY 207 Ca -0.05 -0.61 0.12 0.00 0.00 0.00 0.00 46.02 45.48 2vjj n GLY 207 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2vjj h GLY 208 N 0.00 0.00 1.17 -0.02 0.00 -1.92 -1.98 103.07 100.31 2vjj h GLY 208 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2vjj h GLY 208 CO 0.00 0.00 -0.28 0.29 0.00 0.00 0.00 176.54 176.55 2vjj n ILE 209 N -4.18 0.00 -0.14 2.60 -5.35 -1.25 -1.79 119.36 109.24 2vjj n ILE 209 Ca -0.03 -0.02 0.01 0.00 -0.27 0.00 0.00 62.75 62.44 2vjj n ILE 209 Cb 0.10 0.02 0.28 0.00 -1.74 0.00 0.00 39.64 38.30 2vjj n ILE 209 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2vjj h ALA 210 N 3.17 1.48 0.00 -1.28 0.00 -1.56 0.25 119.26 121.32 2vjj h ALA 210 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2vjj h ALA 210 Cb 0.48 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2vjj h ALA 210 CO 0.00 0.45 0.00 0.41 0.00 0.00 0.00 179.25 180.11 2vjj n GLY 211 N -1.33 -0.54 0.41 0.00 0.00 -1.25 -2.45 105.19 100.02 2vjj n GLY 211 Ca 0.06 -0.07 0.06 0.00 0.00 0.00 0.00 46.02 46.07 2vjj n GLY 211 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2vjj n HIS 212 N -1.13 0.00 -4.16 1.61 8.25 -0.06 -4.94 115.22 114.79 2vjj n HIS 212 Ca 0.08 -0.82 -0.35 0.00 -0.26 0.00 0.00 57.72 56.37 2vjj n HIS 212 Cb 0.07 -0.15 -0.02 0.00 1.12 0.00 0.00 29.99 31.02 2vjj n HIS 212 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2vjj n SER 213 N -0.86 -3.61 -4.80 0.41 7.64 -1.03 -3.83 113.62 107.55 2vjj n SER 213 Ca 0.12 -0.96 -0.35 0.00 1.01 0.00 0.00 58.87 58.69 2vjj n SER 213 Cb 0.71 -2.94 -0.07 0.00 -1.01 0.00 0.00 64.21 60.91 2vjj n SER 213 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2vjj s GLY 214 N -3.26 2.61 -0.16 0.23 0.00 -0.41 -1.09 107.32 105.23 2vjj s GLY 214 Ca 0.73 0.44 -0.15 0.00 0.00 0.00 0.00 44.72 45.74 2vjj s GLY 214 CO 0.90 0.80 -0.30 1.39 0.00 0.00 0.00 173.10 175.90 2vjj n ILE 215 N 0.05 1.42 -4.79 0.90 5.41 -0.51 -0.71 119.36 121.13 2vjj n ILE 215 Ca 0.04 0.17 -0.33 0.00 1.00 0.00 0.00 62.75 63.63 2vjj n ILE 215 Cb 0.52 -2.32 -0.13 0.00 -0.71 0.00 0.00 39.64 37.00 2vjj n ILE 215 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 2vjj s ILE 216 N -2.69 3.25 -0.28 1.39 -1.09 0.41 -3.02 121.20 119.16 2vjj s ILE 216 Ca -0.25 -0.64 -0.14 0.00 -2.23 0.00 0.00 60.65 57.39 2vjj s ILE 216 Cb 0.03 -2.31 -0.04 0.00 -1.58 0.00 0.00 42.46 38.57 2vjj s ILE 216 CO 0.37 0.58 0.31 -1.58 -1.23 0.00 0.00 174.94 173.39 2vjj s GLN 217 N -0.59 3.92 0.48 2.79 0.74 -1.26 -0.98 119.66 124.76 2vjj s GLN 217 Ca 0.09 -0.16 -0.20 0.00 0.05 0.00 0.00 55.36 55.14 2vjj s GLN 217 Cb -0.11 -3.68 -0.09 0.00 1.10 0.00 0.00 33.01 30.23 2vjj s GLN 217 CO 0.01 -0.28 1.01 -0.51 -0.55 0.00 0.00 175.29 174.98 2vjj s LEU 218 N 1.95 3.83 0.10 3.68 1.43 0.18 -4.92 118.68 124.94 2vjj s LEU 218 Ca 0.12 1.84 0.05 0.00 -1.03 0.00 0.00 54.13 55.10 2vjj s LEU 218 Cb -0.16 -4.55 -0.03 0.00 0.03 0.00 0.00 46.19 41.48 2vjj s LEU 218 CO 0.11 -0.69 -0.12 -0.13 0.23 0.00 0.00 176.35 175.75 2vjj s ARG 219 N -3.33 0.88 0.50 1.70 0.52 -1.26 -4.67 118.95 113.29 2vjj s ARG 219 Ca 0.65 -1.12 -0.23 0.00 -0.52 0.00 0.00 55.73 54.51 2vjj s ARG 219 Cb -0.14 -0.71 -0.06 0.00 0.52 0.00 0.00 34.95 34.56 2vjj s ARG 219 CO 0.20 0.13 1.36 -1.12 0.02 0.00 0.00 175.30 175.90 2vjj s SER 220 N -2.25 5.61 0.00 0.23 0.01 -1.26 -2.48 113.70 113.55 2vjj s SER 220 Ca 0.04 2.78 0.00 0.00 1.31 0.00 0.00 55.95 60.08 2vjj s SER 220 Cb -0.05 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.54 2vjj s SER 220 CO 0.01 -1.34 0.00 0.59 0.41 0.00 0.00 173.24 172.92 2vjj n ASN 221 N -0.62 -4.11 -4.27 2.44 3.02 -0.18 -4.78 115.26 106.77 2vjj n ASN 221 Ca 0.08 0.00 -0.38 0.00 -0.03 0.00 0.00 54.58 54.25 2vjj n ASN 221 Cb 0.44 -2.53 -0.12 0.00 -0.61 0.00 0.00 39.78 36.96 2vjj n ASN 221 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2vjj s VAL 222 N -1.37 3.78 0.27 2.41 1.01 -1.04 -1.26 120.40 124.21 2vjj s VAL 222 Ca 0.00 -1.16 -0.05 0.00 0.00 0.00 0.00 61.98 60.77 2vjj s VAL 222 Cb 0.00 -3.16 -0.05 0.00 0.00 0.00 0.00 36.38 33.17 2vjj s VAL 222 CO 0.00 -0.20 0.53 0.20 0.00 0.00 0.00 175.10 175.63 2vjj s ASN 223 N 1.44 6.46 -0.21 3.32 0.01 0.12 -4.48 114.94 121.59 2vjj s ASN 223 Ca -0.01 0.70 0.01 0.00 -0.71 0.00 0.00 52.86 52.84 2vjj s ASN 223 Cb -0.20 -2.14 0.03 0.00 0.41 0.00 0.00 41.25 39.35 2vjj s ASN 223 CO 0.03 -0.16 -0.14 -0.76 -1.51 0.00 0.00 177.10 174.55 2vjj s LEU 224 N -3.44 2.67 -0.80 0.60 1.43 -0.35 -1.26 118.68 117.54 2vjj s LEU 224 Ca 0.44 -0.83 -0.17 0.00 -1.03 0.00 0.00 54.13 52.53 2vjj s LEU 224 Cb -0.11 -1.55 0.15 0.00 0.03 0.00 0.00 46.19 44.71 2vjj s LEU 224 CO 0.29 -0.07 0.88 0.21 0.23 0.00 0.00 176.35 177.90 2vjj s ASN 225 N 1.27 6.55 -0.62 2.29 3.04 0.21 -1.19 114.94 126.48 2vjj s ASN 225 Ca 0.01 -2.08 -0.22 0.00 0.04 0.00 0.00 52.86 50.60 2vjj s ASN 225 Cb -0.15 -2.31 0.07 0.00 -1.54 0.00 0.00 41.25 37.32 2vjj s ASN 225 CO -0.09 -0.92 0.91 -0.63 -3.04 0.00 0.00 177.10 173.34 2vjj s ILE 226 N 1.84 4.42 -0.17 -5.21 1.01 0.62 -0.67 121.20 123.04 2vjj s ILE 226 Ca 0.22 -0.29 0.17 0.00 0.00 0.00 0.00 60.65 60.75 2vjj s ILE 226 Cb -0.12 -4.61 -0.25 0.00 0.01 0.00 0.00 42.46 37.49 2vjj s ILE 226 CO -0.05 -1.31 0.12 -0.62 0.00 0.00 0.00 174.94 173.08 2vjj n GLU 227 N 7.43 0.84 0.00 2.79 -0.58 -0.46 -0.92 120.64 129.75 2vjj n GLU 227 Ca -0.03 -0.03 0.00 0.00 -0.42 0.00 0.00 57.16 56.67 2vjj n GLU 227 Cb 0.46 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.84 2vjj n GLU 227 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2vjj n GLY 228 N 1.75 0.97 3.53 0.62 0.00 -0.53 -3.84 105.19 107.70 2vjj n GLY 228 Ca -0.27 -1.85 -0.33 0.00 0.00 0.00 0.00 46.02 43.56 2vjj n GLY 228 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2vjj s ARG 229 N 1.92 2.75 -0.13 1.61 0.52 -0.99 -2.06 118.95 122.57 2vjj s ARG 229 Ca 0.00 -0.60 0.01 0.00 -0.52 0.00 0.00 55.73 54.62 2vjj s ARG 229 Cb 0.00 -2.54 -0.01 0.00 0.52 0.00 0.00 34.95 32.92 2vjj s ARG 229 CO 0.00 0.61 -0.16 0.42 0.02 0.00 0.00 175.30 176.19 2vjj s ILE 230 N -0.67 2.76 -0.03 1.52 1.01 0.10 -0.44 121.20 125.45 2vjj s ILE 230 Ca 0.10 -0.76 0.01 0.00 0.00 0.00 0.00 60.65 60.00 2vjj s ILE 230 Cb -0.11 -2.14 0.02 0.00 0.01 0.00 0.00 42.46 40.24 2vjj s ILE 230 CO 0.01 0.53 -0.03 -2.28 0.00 0.00 0.00 174.94 173.18 2vjj s HIS 231 N 0.45 0.51 -0.00 3.97 2.46 -0.73 -0.22 115.29 121.72 2vjj s HIS 231 Ca -0.11 -0.10 -0.29 0.00 0.47 0.00 0.00 55.06 55.03 2vjj s HIS 231 Cb -0.16 -0.48 -0.03 0.00 -0.13 0.00 0.00 32.58 31.77 2vjj s HIS 231 CO 0.05 -0.13 0.93 -0.51 -2.47 0.00 0.00 174.74 172.62 2vjj s LEU 232 N 0.73 4.37 0.69 8.88 1.43 -0.82 -1.36 118.68 132.60 2vjj s LEU 232 Ca -0.08 1.59 -0.11 0.00 -1.03 0.00 0.00 54.13 54.49 2vjj s LEU 232 Cb -0.12 -3.49 0.00 0.00 0.03 0.00 0.00 46.19 42.62 2vjj s LEU 232 CO -0.01 -0.22 1.08 -0.44 0.23 0.00 0.00 176.35 177.00 2vjj s SER 233 N 0.89 5.61 0.41 2.29 0.01 -0.24 -4.43 113.70 118.24 2vjj s SER 233 Ca 0.49 1.19 0.27 0.00 1.31 0.00 0.00 55.95 59.21 2vjj s SER 233 Cb -0.21 -2.04 1.48 0.00 0.21 0.00 0.00 66.02 65.47 2vjj s SER 233 CO 0.26 -1.24 1.83 -0.65 0.41 0.00 0.00 173.24 173.86 2vjj h PRO 234 N -0.58 0.00 -1.21 12.44 0.11 -1.95 -2.00 132.00 138.81 2vjj h PRO 234 Ca -0.45 0.00 0.38 0.00 0.11 0.00 0.00 66.00 66.04 2vjj h PRO 234 Cb 1.24 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 32.23 2vjj h PRO 234 CO 0.63 0.00 0.77 0.35 -0.21 0.00 0.00 178.00 179.54 2vjj h PHE 235 N 0.00 0.59 -0.01 0.65 3.57 -1.92 -0.85 116.94 118.98 2vjj h PHE 235 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 2vjj h PHE 235 Cb 0.02 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 38.60 2vjj h PHE 235 CO 0.00 -0.13 -0.05 1.19 -2.23 0.00 0.00 178.31 177.09 2vjj n PHE 236 N -4.71 0.00 -1.72 0.41 3.72 -0.75 -4.83 117.46 109.57 2vjj n PHE 236 Ca 0.33 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.31 2vjj n PHE 236 Cb 1.23 -0.03 -0.02 0.00 -0.94 0.00 0.00 39.48 39.72 2vjj n PHE 236 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 2vjj n ASP 237 N -0.16 3.66 -1.07 4.37 2.03 -0.33 -1.68 116.55 123.38 2vjj n ASP 237 Ca 0.18 1.12 -0.14 0.00 0.52 0.00 0.00 54.79 56.47 2vjj n ASP 237 Cb 0.32 -1.55 -0.06 0.00 -0.72 0.00 0.00 41.12 39.11 2vjj n ASP 237 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2vjj n LEU 238 N 2.72 -0.74 -4.48 -2.67 4.77 -1.17 -4.96 117.00 110.47 2vjj n LEU 238 Ca 0.12 0.34 -0.24 0.00 -0.03 0.00 0.00 56.01 56.20 2vjj n LEU 238 Cb 0.35 -2.63 -0.10 0.00 -2.33 0.00 0.00 43.42 38.71 2vjj n LEU 238 CO 0.64 -1.01 -0.47 -0.54 -1.33 0.00 0.00 177.39 174.68 2vjj s LYS 239 N -3.14 1.71 0.60 3.23 1.02 -0.67 -3.43 119.74 119.05 2vjj s LYS 239 Ca 0.00 -1.74 -0.15 0.00 0.02 0.00 0.00 55.97 54.10 2vjj s LYS 239 Cb 0.00 -1.80 -0.04 0.00 -0.52 0.00 0.00 37.83 35.48 2vjj s LYS 239 CO 0.00 0.34 1.04 -1.25 -0.92 0.00 0.00 175.35 174.56 2vjj s PRO 240 N -3.48 3.40 -0.13 -1.68 0.04 -1.26 -4.79 135.00 127.09 2vjj s PRO 240 Ca 0.30 1.08 -0.29 0.00 0.04 0.00 0.00 61.00 62.12 2vjj s PRO 240 Cb -0.05 -2.05 0.08 0.00 0.04 0.00 0.00 34.50 32.52 2vjj s PRO 240 CO 0.15 -0.74 0.77 -0.59 0.04 0.00 0.00 177.00 176.64 2vjj s PHE 241 N -2.64 -0.62 -0.18 0.56 -0.12 -1.05 -4.96 117.98 108.98 2vjj s PHE 241 Ca 0.61 1.20 -0.00 0.00 -0.05 0.00 0.00 56.93 58.69 2vjj s PHE 241 Cb -0.14 0.39 0.04 0.00 -0.63 0.00 0.00 43.02 42.68 2vjj s PHE 241 CO 0.40 -0.49 -0.06 -0.65 -0.05 0.00 0.00 175.22 174.37 2vjj s GLN 242 N -0.76 1.54 0.04 1.99 -0.21 -0.25 -1.21 119.66 120.80 2vjj s GLN 242 Ca -0.06 -0.60 -0.21 0.00 0.02 0.00 0.00 55.36 54.51 2vjj s GLN 242 Cb -0.01 -2.11 -0.14 0.00 1.00 0.00 0.00 33.01 31.74 2vjj s GLN 242 CO 0.05 -0.44 1.39 0.28 -2.12 0.00 0.00 175.29 174.45 2vjj h VAL 243 N 6.39 1.32 -3.21 1.09 2.07 -1.19 -1.35 116.25 121.37 2vjj h VAL 243 Ca -0.25 -1.10 -0.61 0.00 0.82 0.00 0.00 66.70 65.57 2vjj h VAL 243 Cb 1.11 1.77 -0.35 0.00 -1.52 0.00 0.00 31.29 32.30 2vjj h VAL 243 CO 0.42 0.32 -0.84 -0.36 0.02 0.00 0.00 177.57 177.12 2vjj s PHE 244 N -4.56 2.18 -0.08 1.57 0.08 -0.10 -0.44 117.98 116.62 2vjj s PHE 244 Ca -0.14 -1.10 0.02 0.00 0.12 0.00 0.00 56.93 55.82 2vjj s PHE 244 Cb 0.05 -1.56 0.01 0.00 -0.57 0.00 0.00 43.02 40.95 2vjj s PHE 244 CO 0.73 -0.56 -0.13 0.08 -0.10 0.00 0.00 175.22 175.23 2vjj s VAL 245 N 1.09 1.29 -1.19 -0.44 1.01 -0.15 -0.14 120.40 121.88 2vjj s VAL 245 Ca -0.03 -0.54 0.21 0.00 0.00 0.00 0.00 61.98 61.62 2vjj s VAL 245 Cb -0.14 -1.18 -0.18 0.00 0.00 0.00 0.00 36.38 34.87 2vjj s VAL 245 CO -0.04 0.39 0.95 0.61 0.00 0.00 0.00 175.10 177.01 2vjj n GLY 246 N 4.01 -0.82 3.75 4.51 0.00 0.62 -0.64 105.19 116.61 2vjj n GLY 246 Ca -0.21 -0.60 -0.37 0.00 0.00 0.00 0.00 46.02 44.84 2vjj n GLY 246 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2vjj s PHE 247 N -2.90 2.33 -0.21 1.61 0.08 -1.26 -4.42 117.98 113.21 2vjj s PHE 247 Ca 0.10 1.45 0.06 0.00 0.12 0.00 0.00 56.93 58.65 2vjj s PHE 247 Cb 0.16 -3.66 0.13 0.00 -0.57 0.00 0.00 43.02 39.08 2vjj s PHE 247 CO 0.81 -2.60 1.09 -0.40 -0.10 0.00 0.00 175.22 174.02 2vjj n ASP 248 N -1.28 2.32 -3.81 1.36 5.68 -1.26 -4.54 116.55 115.02 2vjj n ASP 248 Ca 0.12 -2.21 -0.12 0.00 -0.50 0.00 0.00 54.79 52.07 2vjj n ASP 248 Cb 0.47 -0.14 -0.11 0.00 -1.14 0.00 0.00 41.12 40.21 2vjj n ASP 248 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 2vjj s ASN 249 N -1.33 -0.16 0.52 -1.12 3.84 -1.24 -4.23 114.94 111.22 2vjj s ASN 249 Ca 0.11 0.21 0.18 0.00 0.21 0.00 0.00 52.86 53.58 2vjj s ASN 249 Cb 0.08 0.37 1.31 0.00 -0.55 0.00 0.00 41.25 42.46 2vjj s ASN 249 CO 0.04 -0.23 2.13 1.23 -2.79 0.00 0.00 177.10 177.48 2vjj h GLY 250 N 4.99 0.00 -7.41 1.21 0.00 -1.65 -3.36 103.07 96.84 2vjj h GLY 250 Ca -0.28 0.00 -0.68 0.00 0.00 0.00 0.00 47.33 46.37 2vjj h GLY 250 CO 0.38 0.00 -0.26 -0.35 0.00 0.00 0.00 176.54 176.31 2vjj s ASP 251 N -6.87 6.18 0.50 0.19 2.15 -1.26 -4.74 116.67 112.82 2vjj s ASP 251 Ca -0.05 -0.51 0.15 0.00 0.43 0.00 0.00 52.55 52.58 2vjj s ASP 251 Cb 0.16 -2.21 1.22 0.00 -0.30 0.00 0.00 42.92 41.79 2vjj s ASP 251 CO 0.65 -0.47 2.12 1.55 -0.17 0.00 0.00 175.17 178.85 2vjj h PRO 252 N 8.61 0.09 -0.04 4.34 0.13 -1.98 -0.25 132.00 142.91 2vjj h PRO 252 Ca -0.28 -0.01 0.01 0.00 -0.87 0.00 0.00 66.00 64.86 2vjj h PRO 252 Cb 1.12 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 32.23 2vjj h PRO 252 CO 0.75 0.06 0.03 0.00 -0.23 0.00 0.00 178.00 178.61 2vjj h ALA 253 N 1.93 1.75 -0.14 -0.56 0.00 -1.93 -2.19 119.26 118.12 2vjj h ALA 253 Ca 0.05 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2vjj h ALA 253 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2vjj h ALA 253 CO -0.01 -0.05 0.00 0.43 0.00 0.00 0.00 179.25 179.62 2vjj n SER 254 N -4.11 3.05 -4.78 0.00 7.64 -0.13 -4.99 113.62 110.30 2vjj n SER 254 Ca -0.02 -1.95 -0.37 0.00 1.01 0.00 0.00 58.87 57.54 2vjj n SER 254 Cb 0.13 -0.08 -0.05 0.00 -1.01 0.00 0.00 64.21 63.19 2vjj n SER 254 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2vjj s SER 255 N -1.74 7.02 1.11 6.43 0.15 -0.83 -4.81 113.70 121.04 2vjj s SER 255 Ca 0.30 1.94 -0.19 0.00 0.70 0.00 0.00 55.95 58.70 2vjj s SER 255 Cb 0.20 -2.58 0.26 0.00 -1.71 0.00 0.00 66.02 62.19 2vjj s SER 255 CO 0.29 -0.30 1.23 -0.83 1.20 0.00 0.00 173.24 174.83 2vjj s GLY 256 N -1.61 1.70 0.27 9.45 0.00 -1.26 -4.96 107.32 110.92 2vjj s GLY 256 Ca 0.55 -1.18 -0.05 0.00 0.00 0.00 0.00 44.72 44.03 2vjj s GLY 256 CO 0.25 -0.31 0.54 -1.31 0.00 0.00 0.00 173.10 172.28 2vjj s ASN 257 N -4.48 6.46 -0.20 1.64 0.01 -1.26 -4.55 114.94 112.57 2vjj s ASN 257 Ca 0.74 0.71 -0.06 0.00 -0.71 0.00 0.00 52.86 53.54 2vjj s ASN 257 Cb -0.05 -2.14 -0.03 0.00 0.41 0.00 0.00 41.25 39.43 2vjj s ASN 257 CO 0.55 -0.17 0.03 -0.22 -1.51 0.00 0.00 177.10 175.78 2vjj s LEU 258 N -3.43 3.50 0.02 0.60 2.96 -0.43 -4.84 118.68 117.05 2vjj s LEU 258 Ca 0.44 -0.09 0.06 0.00 -0.22 0.00 0.00 54.13 54.32 2vjj s LEU 258 Cb -0.11 -1.89 -0.02 0.00 0.50 0.00 0.00 46.19 44.67 2vjj s LEU 258 CO 0.29 0.10 -0.17 -1.61 -1.32 0.00 0.00 176.35 173.64 2vjj s GLU 259 N 0.78 1.24 -1.21 1.98 2.02 -1.26 -0.83 118.70 121.42 2vjj s GLU 259 Ca 0.02 -0.77 -0.01 0.00 0.02 0.00 0.00 54.97 54.23 2vjj s GLU 259 Cb -0.14 -1.28 -0.01 0.00 0.10 0.00 0.00 34.13 32.81 2vjj s GLU 259 CO 0.02 0.33 0.90 0.09 0.02 0.00 0.00 175.26 176.63 2vjj n ASN 260 N 2.15 -2.38 -4.03 -0.19 3.02 -0.47 -1.01 115.26 112.34 2vjj n ASN 260 Ca -0.16 -0.69 -0.31 0.00 -0.03 0.00 0.00 54.58 53.38 2vjj n ASN 260 Cb 0.54 -4.81 -0.16 0.00 -0.61 0.00 0.00 39.78 34.75 2vjj n ASN 260 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2vjj s HIS 262 N 1.33 2.25 -0.19 0.00 3.76 -1.26 -1.96 115.29 119.22 2vjj s HIS 262 Ca -0.01 -0.89 -0.03 0.00 -0.15 0.00 0.00 55.06 53.97 2vjj s HIS 262 Cb -0.16 -1.53 -0.01 0.00 1.11 0.00 0.00 32.58 31.99 2vjj s HIS 262 CO -0.09 -0.37 -0.06 0.42 -0.85 0.00 0.00 174.74 173.79 2vjj s ILE 263 N 0.40 3.42 0.22 0.60 1.01 0.16 -1.21 121.20 125.81 2vjj s ILE 263 Ca -0.17 -0.50 -0.16 0.00 0.00 0.00 0.00 60.65 59.83 2vjj s ILE 263 Cb -0.17 -2.52 0.01 0.00 0.01 0.00 0.00 42.46 39.79 2vjj s ILE 263 CO 0.07 0.46 0.51 -0.72 0.00 0.00 0.00 174.94 175.26 2vjj s TYR 264 N 1.02 0.09 -4.06 3.97 1.13 -0.33 -1.17 117.35 118.00 2vjj s TYR 264 Ca 0.00 -0.46 0.00 0.00 -1.41 0.00 0.00 57.07 55.20 2vjj s TYR 264 Cb -0.15 0.32 0.00 0.00 -1.10 0.00 0.00 41.96 41.04 2vjj s TYR 264 CO 0.00 -0.97 0.00 0.41 -2.51 0.00 0.00 175.55 172.48 2vjj n GLY 265 N -0.36 0.86 1.25 5.49 0.00 -1.06 -0.28 105.19 111.09 2vjj n GLY 265 Ca -0.06 -1.99 0.12 0.00 0.00 0.00 0.00 46.02 44.09 2vjj n GLY 265 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2vjj n HIS 266 N 6.59 0.75 -1.02 1.61 8.25 -1.14 -3.73 115.22 126.53 2vjj n HIS 266 Ca 0.00 -0.39 0.00 0.00 -0.26 0.00 0.00 57.72 57.07 2vjj n HIS 266 Cb 0.00 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2vjj n HIS 266 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2vjj n GLY 267 N 1.55 -0.47 2.89 -1.41 0.00 -0.10 -4.84 105.19 102.81 2vjj n GLY 267 Ca 0.22 -1.74 -0.13 0.00 0.00 0.00 0.00 46.02 44.38 2vjj n GLY 267 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vjj s VAL 268 N -0.29 -0.01 -0.27 1.61 1.01 -0.88 -2.38 120.40 119.19 2vjj s VAL 268 Ca 0.00 0.04 -0.04 0.00 0.00 0.00 0.00 61.98 61.99 2vjj s VAL 268 Cb 0.00 -0.07 0.02 0.00 0.00 0.00 0.00 36.38 36.33 2vjj s VAL 268 CO 0.00 0.02 -0.00 -0.69 0.00 0.00 0.00 175.10 174.43 2vjj s VAL 269 N 0.25 3.31 -0.21 2.92 1.01 0.64 -0.72 120.40 127.60 2vjj s VAL 269 Ca -0.02 -0.92 -0.03 0.00 0.00 0.00 0.00 61.98 61.01 2vjj s VAL 269 Cb -0.03 -2.71 -0.00 0.00 0.00 0.00 0.00 36.38 33.64 2vjj s VAL 269 CO -0.01 0.13 -0.07 -0.62 0.00 0.00 0.00 175.10 174.53 2vjj s ASP 270 N 1.39 4.08 0.00 3.32 -1.08 0.69 -1.42 116.67 123.65 2vjj s ASP 270 Ca 0.01 -0.43 0.11 0.00 -0.52 0.00 0.00 52.55 51.71 2vjj s ASP 270 Cb -0.17 -1.69 0.45 0.00 -1.46 0.00 0.00 42.92 40.05 2vjj s ASP 270 CO -0.01 -0.01 1.32 0.49 0.52 0.00 0.00 175.17 177.48 2vjj n PHE 271 N 4.71 0.20 -0.97 -5.34 3.72 -0.63 -1.94 117.46 117.21 2vjj n PHE 271 Ca -0.19 -0.10 0.00 0.00 -0.05 0.00 0.00 57.45 57.11 2vjj n PHE 271 Cb 0.51 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.05 2vjj n PHE 271 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2vjj n GLY 272 N 0.86 0.85 3.17 1.37 0.00 -1.01 -3.82 105.19 106.61 2vjj n GLY 272 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2vjj n GLY 272 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vjj n GLY 273 N -2.14 1.17 3.74 -0.02 0.00 0.90 -4.99 105.19 103.86 2vjj n GLY 273 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2vjj n GLY 273 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2vjj s TYR 274 N -3.40 3.28 0.61 1.61 2.02 -1.25 -4.74 117.35 115.48 2vjj s TYR 274 Ca 0.00 1.33 -0.15 0.00 -0.37 0.00 0.00 57.07 57.88 2vjj s TYR 274 Cb 0.00 -3.56 -0.03 0.00 -0.40 0.00 0.00 41.96 37.98 2vjj s TYR 274 CO 0.00 -1.64 1.07 -1.21 -1.57 0.00 0.00 175.55 172.20 2vjj s GLU 275 N -0.53 3.22 0.44 -0.62 2.02 -1.26 -3.65 118.70 118.31 2vjj s GLU 275 Ca 0.54 1.22 -0.25 0.00 0.02 0.00 0.00 54.97 56.50 2vjj s GLU 275 Cb -0.36 -2.02 -0.09 0.00 0.10 0.00 0.00 34.13 31.76 2vjj s GLU 275 CO 0.41 -0.89 1.23 1.19 0.02 0.00 0.00 175.26 177.21 2vjj n PHE 276 N -2.14 1.96 0.04 1.61 3.72 -1.26 -3.05 117.46 118.34 2vjj n PHE 276 Ca 0.09 0.50 -0.06 0.00 -0.05 0.00 0.00 57.45 57.93 2vjj n PHE 276 Cb 0.53 -2.35 -0.11 0.00 -0.94 0.00 0.00 39.48 36.61 2vjj n PHE 276 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 2vjj h GLY 277 N 1.91 0.00 -4.41 1.37 0.00 -1.86 -3.45 103.07 96.62 2vjj h GLY 277 Ca -0.48 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 46.77 2vjj h GLY 277 CO 0.59 0.00 0.01 0.00 0.00 0.00 0.00 176.54 177.13 2vjj s ALA 278 N -2.72 -1.41 0.45 3.60 0.00 -1.26 -5.05 121.76 115.36 2vjj s ALA 278 Ca -0.01 1.12 0.21 0.00 0.00 0.00 0.00 51.96 53.28 2vjj s ALA 278 Cb 0.09 -0.21 1.27 0.00 0.00 0.00 0.00 23.12 24.28 2vjj s ALA 278 CO 0.81 -0.32 2.05 0.77 0.00 0.00 0.00 175.76 179.08 2vjj h SER 279 N 3.78 0.00 0.96 0.00 0.02 -1.93 -2.12 113.55 114.26 2vjj h SER 279 Ca -0.28 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 2vjj h SER 279 Cb 1.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.70 2vjj h SER 279 CO 0.33 0.14 0.00 -1.54 -1.14 0.00 0.00 176.83 174.62 2vjj n SER 280 N -3.99 0.33 -4.78 3.07 3.41 -1.26 -4.36 113.62 106.04 2vjj n SER 280 Ca -0.02 0.55 -0.32 0.00 -0.26 0.00 0.00 58.87 58.81 2vjj n SER 280 Cb 0.23 -0.63 0.05 0.00 -0.26 0.00 0.00 64.21 63.59 2vjj n SER 280 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2vjj s GLN 281 N -3.08 2.82 0.05 4.33 -0.21 -0.80 -5.07 119.66 117.70 2vjj s GLN 281 Ca 0.10 1.29 0.09 0.00 0.02 0.00 0.00 55.36 56.86 2vjj s GLN 281 Cb 0.13 -1.96 -0.03 0.00 1.00 0.00 0.00 33.01 32.16 2vjj s GLN 281 CO 0.46 -1.22 -0.26 -0.51 -2.12 0.00 0.00 175.29 171.65 2vjj s LEU 282 N -5.02 2.17 -0.00 2.90 1.43 -1.26 -4.96 118.68 113.95 2vjj s LEU 282 Ca 0.65 -0.59 0.00 0.00 -1.03 0.00 0.00 54.13 53.16 2vjj s LEU 282 Cb -0.19 -1.25 -0.00 0.00 0.03 0.00 0.00 46.19 44.79 2vjj s LEU 282 CO 0.44 0.24 -0.01 -0.13 0.23 0.00 0.00 176.35 177.13 2vjj s ARG 283 N -1.27 0.05 0.06 1.70 0.52 -1.26 -2.53 118.95 116.22 2vjj s ARG 283 Ca 0.11 -0.02 -0.10 0.00 -0.52 0.00 0.00 55.73 55.21 2vjj s ARG 283 Cb -0.10 -0.05 0.00 0.00 0.52 0.00 0.00 34.95 35.32 2vjj s ARG 283 CO 0.02 0.01 0.21 1.21 0.02 0.00 0.00 175.30 176.77 2vjj s ASN 284 N -0.00 0.04 -0.10 0.23 2.47 -0.35 -0.95 114.94 116.27 2vjj s ASN 284 Ca 0.00 -0.43 -0.06 0.00 0.42 0.00 0.00 52.86 52.79 2vjj s ASN 284 Cb -0.00 0.31 -0.02 0.00 -1.45 0.00 0.00 41.25 40.09 2vjj s ASN 284 CO -0.00 -0.62 -0.12 1.23 -3.72 0.00 0.00 177.10 173.87 2vjj h GLY 285 N 3.21 0.00 -7.03 1.21 0.00 -1.07 -1.95 103.07 97.43 2vjj h GLY 285 Ca -0.33 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.43 2vjj h GLY 285 CO 0.50 0.00 -0.80 0.14 0.00 0.00 0.00 176.54 176.38 2vjj s VAL 286 N -1.87 1.30 -0.48 4.60 1.01 -0.03 -0.93 120.40 124.00 2vjj s VAL 286 Ca -0.10 -0.76 -0.14 0.00 0.00 0.00 0.00 61.98 60.98 2vjj s VAL 286 Cb 0.01 -1.44 0.09 0.00 0.00 0.00 0.00 36.38 35.05 2vjj s VAL 286 CO 0.15 0.15 0.39 0.00 0.00 0.00 0.00 175.10 175.79 2vjj s ALA 287 N 1.55 3.51 0.15 5.51 0.00 0.81 -0.49 121.76 132.80 2vjj s ALA 287 Ca 0.00 -2.26 0.25 0.00 0.00 0.00 0.00 51.96 49.95 2vjj s ALA 287 Cb -0.16 -3.01 1.00 0.00 0.00 0.00 0.00 23.12 20.95 2vjj s ALA 287 CO -0.08 -1.80 1.86 0.74 0.00 0.00 0.00 175.76 176.48 2vjj h PHE 288 N 8.69 0.00 0.00 0.00 0.04 -1.66 0.18 116.94 124.19 2vjj h PHE 288 Ca -0.27 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.50 2vjj h PHE 288 Cb 1.10 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.25 2vjj h PHE 288 CO 0.65 0.19 0.00 0.41 -0.60 0.00 0.00 178.31 178.97 2vjj n GLY 289 N 0.09 0.47 3.52 -1.45 0.00 -1.26 -3.94 105.19 102.61 2vjj n GLY 289 Ca 0.00 -1.25 -0.43 0.00 0.00 0.00 0.00 46.02 44.34 2vjj n GLY 289 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2vjj s ARG 290 N 0.00 3.79 -0.17 1.61 0.52 -1.26 -2.43 118.95 121.01 2vjj s ARG 290 Ca 0.00 -1.80 -0.02 0.00 -0.52 0.00 0.00 55.73 53.39 2vjj s ARG 290 Cb 0.00 -5.22 -0.01 0.00 0.52 0.00 0.00 34.95 30.23 2vjj s ARG 290 CO 0.00 -2.01 -0.09 -1.54 0.02 0.00 0.00 175.30 171.68 2vjj s SER 291 N 4.00 4.19 -0.14 0.23 1.04 -1.25 -1.32 113.70 120.45 2vjj s SER 291 Ca 0.44 -0.34 -0.00 0.00 0.48 0.00 0.00 55.95 56.53 2vjj s SER 291 Cb -0.01 -1.68 0.03 0.00 0.10 0.00 0.00 66.02 64.46 2vjj s SER 291 CO -0.04 0.09 -0.10 -0.31 0.98 0.00 0.00 173.24 173.87 2vjj s TYR 292 N 0.81 1.84 -1.03 5.02 1.51 -0.01 -0.64 117.35 124.85 2vjj s TYR 292 Ca -0.03 -1.04 -0.05 0.00 -1.01 0.00 0.00 57.07 54.94 2vjj s TYR 292 Cb -0.15 -1.41 -0.05 0.00 -0.11 0.00 0.00 41.96 40.24 2vjj s TYR 292 CO 0.01 -0.61 0.90 -1.71 -1.11 0.00 0.00 175.55 173.03 2vjj n ASN 293 N 4.85 -5.54 -4.34 2.29 5.15 -0.06 -1.37 115.26 116.24 2vjj n ASN 293 Ca -0.14 -0.66 -0.25 0.00 -0.60 0.00 0.00 54.58 52.93 2vjj n ASN 293 Cb 0.49 -5.00 -0.12 0.00 -0.53 0.00 0.00 39.78 34.62 2vjj n ASN 293 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2vjj s SER 295 N -2.18 -0.48 -0.09 0.00 1.04 -0.83 -2.10 113.70 109.06 2vjj s SER 295 Ca 0.12 0.19 0.03 0.00 0.48 0.00 0.00 55.95 56.77 2vjj s SER 295 Cb -0.09 0.51 0.01 0.00 0.10 0.00 0.00 66.02 66.55 2vjj s SER 295 CO 0.06 -0.75 -0.18 -0.69 0.98 0.00 0.00 173.24 172.65 2vjj s VAL 296 N -2.56 1.65 -0.04 5.02 1.01 -0.60 -0.67 120.40 124.21 2vjj s VAL 296 Ca -0.05 -0.77 -0.01 0.00 0.00 0.00 0.00 61.98 61.16 2vjj s VAL 296 Cb -0.01 -1.46 0.03 0.00 0.00 0.00 0.00 36.38 34.94 2vjj s VAL 296 CO -0.03 0.47 0.02 -0.89 0.00 0.00 0.00 175.10 174.67 2vjj s THR 297 N 0.59 0.12 0.00 3.92 2.01 -0.31 -1.45 115.64 120.51 2vjj s THR 297 Ca -0.15 0.19 0.00 0.00 0.31 0.00 0.00 61.69 62.04 2vjj s THR 297 Cb -0.17 -0.27 0.00 0.00 0.01 0.00 0.00 72.50 72.08 2vjj s THR 297 CO 0.05 0.17 0.00 0.61 -0.69 0.00 0.00 174.62 174.76 2vjj n GLY 298 N 4.61 1.61 3.81 4.40 0.00 -0.77 -2.55 105.19 116.30 2vjj n GLY 298 Ca -0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.48 2vjj n GLY 298 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2vjj s ILE 299 N -2.92 4.56 -0.25 -0.61 -1.09 -1.24 -4.51 121.20 115.13 2vjj s ILE 299 Ca 0.00 1.34 -0.10 0.00 -2.23 0.00 0.00 60.65 59.66 2vjj s ILE 299 Cb 0.00 -3.91 -0.05 0.00 -1.58 0.00 0.00 42.46 36.92 2vjj s ILE 299 CO 0.00 0.30 0.15 -0.89 -1.23 0.00 0.00 174.94 173.27 2vjj s THR 300 N -1.41 5.10 -0.21 2.92 2.01 -1.00 -1.63 115.64 121.42 2vjj s THR 300 Ca 0.40 0.09 -0.06 0.00 0.31 0.00 0.00 61.69 62.43 2vjj s THR 300 Cb -0.18 -3.39 -0.03 0.00 0.01 0.00 0.00 72.50 68.91 2vjj s THR 300 CO 0.22 0.32 0.04 -0.36 -0.69 0.00 0.00 174.62 174.14 2vjj s PHE 301 N 1.38 3.09 0.11 4.92 0.40 0.33 -0.26 117.98 127.95 2vjj s PHE 301 Ca 0.07 -0.32 -0.12 0.00 -0.60 0.00 0.00 56.93 55.96 2vjj s PHE 301 Cb -0.15 -2.13 0.01 0.00 0.51 0.00 0.00 43.02 41.27 2vjj s PHE 301 CO 0.07 -0.19 0.28 1.14 0.70 0.00 0.00 175.22 177.22 2vjj s GLN 302 N 1.05 0.97 -0.68 0.44 -2.07 -0.51 -0.74 119.66 118.12 2vjj s GLN 302 Ca 0.03 -0.88 -0.03 0.00 -1.82 0.00 0.00 55.36 52.65 2vjj s GLN 302 Cb -0.14 0.40 -0.04 0.00 -1.09 0.00 0.00 33.01 32.14 2vjj s GLN 302 CO 0.02 -0.34 0.60 -1.71 -1.32 0.00 0.00 175.29 172.54 2vjj n ASN 303 N -0.14 -5.34 -3.30 12.60 5.15 -0.66 -1.60 115.26 121.97 2vjj n ASN 303 Ca -0.15 -0.40 -0.13 0.00 -0.60 0.00 0.00 54.58 53.31 2vjj n ASN 303 Cb 0.63 -3.77 -0.03 0.00 -0.53 0.00 0.00 39.78 36.08 2vjj n ASN 303 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 2vjj s GLY 304 N -3.16 1.12 -0.39 8.20 0.00 -0.43 -0.07 107.32 112.60 2vjj s GLY 304 Ca 0.25 -1.27 0.01 0.00 0.00 0.00 0.00 44.72 43.72 2vjj s GLY 304 CO 0.51 -0.80 0.19 -0.35 0.00 0.00 0.00 173.10 172.64 2vjj s ASP 305 N -3.17 3.70 0.19 1.64 2.15 -1.24 -2.48 116.67 117.47 2vjj s ASP 305 Ca 0.26 -2.25 0.03 0.00 0.43 0.00 0.00 52.55 51.02 2vjj s ASP 305 Cb -0.01 -0.91 -0.05 0.00 -0.30 0.00 0.00 42.92 41.65 2vjj s ASP 305 CO 0.17 -0.32 -0.02 0.68 -0.17 0.00 0.00 175.17 175.50 2vjj s VAL 306 N 0.85 0.94 -0.13 1.11 -7.23 -0.36 -4.47 120.40 111.12 2vjj s VAL 306 Ca 0.15 -2.02 -0.28 0.00 -1.81 0.00 0.00 61.98 58.02 2vjj s VAL 306 Cb -0.22 -2.16 -0.26 0.00 0.56 0.00 0.00 36.38 34.30 2vjj s VAL 306 CO -0.08 -0.47 0.76 0.74 -0.31 0.00 0.00 175.10 175.74 2vjj h THR 307 N 2.61 1.71 -3.97 5.32 2.02 -1.28 -3.44 112.91 115.89 2vjj h THR 307 Ca -0.37 -2.37 -0.20 0.00 0.77 0.00 0.00 66.41 64.24 2vjj h THR 307 Cb 1.21 3.31 -0.17 0.00 -1.74 0.00 0.00 68.15 70.76 2vjj h THR 307 CO 0.64 0.61 -0.70 0.26 0.37 0.00 0.00 175.52 176.69 2vjj s TRP 308 N -2.26 0.67 -0.13 3.16 0.51 -0.67 -1.33 118.94 118.90 2vjj s TRP 308 Ca -0.19 -0.80 -0.10 0.00 -2.12 0.00 0.00 56.10 52.89 2vjj s TRP 308 Cb -0.02 -0.42 -0.26 0.00 -0.81 0.00 0.00 33.47 31.97 2vjj s TRP 308 CO 0.70 -0.19 0.38 0.00 -0.51 0.00 0.00 176.95 177.33 2vjj h ALA 309 N 3.60 0.36 -3.44 0.98 0.00 -1.02 -3.15 119.26 116.58 2vjj h ALA 309 Ca -0.35 -1.32 -0.24 0.00 0.00 0.00 0.00 54.91 53.00 2vjj h ALA 309 Cb 1.17 0.68 -0.30 0.00 0.00 0.00 0.00 17.79 19.34 2vjj h ALA 309 CO 0.56 1.15 -0.64 0.42 0.00 0.00 0.00 179.25 180.75 2vjj s ILE 310 N -2.52 -0.03 -0.02 0.00 1.01 -0.55 -0.85 121.20 118.23 2vjj s ILE 310 Ca -0.23 0.10 0.08 0.00 0.00 0.00 0.00 60.65 60.60 2vjj s ILE 310 Cb 0.06 -0.15 -0.02 0.00 0.01 0.00 0.00 42.46 42.36 2vjj s ILE 310 CO 0.75 0.04 -0.25 0.42 0.00 0.00 0.00 174.94 175.90 2vjj s THR 311 N 0.62 1.99 -0.14 2.92 -4.23 0.36 -1.55 115.64 115.61 2vjj s THR 311 Ca -0.05 -1.07 0.01 0.00 -1.18 0.00 0.00 61.69 59.40 2vjj s THR 311 Cb -0.07 -1.65 -0.01 0.00 1.34 0.00 0.00 72.50 72.11 2vjj s THR 311 CO -0.03 0.56 -0.16 -0.76 -0.54 0.00 0.00 174.62 173.70 2vjj s LEU 312 N -0.55 2.52 0.05 4.79 1.43 -0.34 -2.00 118.68 124.58 2vjj s LEU 312 Ca 0.08 -0.43 0.00 0.00 -1.03 0.00 0.00 54.13 52.76 2vjj s LEU 312 Cb -0.10 -1.56 0.00 0.00 0.03 0.00 0.00 46.19 44.56 2vjj s LEU 312 CO -0.01 0.13 0.00 0.61 0.23 0.00 0.00 176.35 177.31 2vjj n GLY 313 N 3.78 -1.58 2.87 -3.19 0.00 -1.02 -0.09 105.19 105.97 2vjj n GLY 313 Ca -0.19 -1.48 -0.15 0.00 0.00 0.00 0.00 46.02 44.20 2vjj n GLY 313 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2vjj s TRP 314 N -1.49 -0.39 -1.58 1.61 -0.00 -0.76 -4.45 118.94 111.88 2vjj s TRP 314 Ca 0.00 0.60 -0.06 0.00 -0.00 0.00 0.00 56.10 56.64 2vjj s TRP 314 Cb 0.00 -0.19 0.05 0.00 -0.00 0.00 0.00 33.47 33.33 2vjj s TRP 314 CO 0.00 -0.51 0.28 0.09 -0.00 0.00 0.00 176.95 176.81 2vjj n ASN 315 N 5.34 -0.22 0.00 5.86 3.02 -1.23 -0.98 115.26 127.04 2vjj n ASN 315 Ca -0.05 -1.18 0.00 0.00 -0.03 0.00 0.00 54.58 53.32 2vjj n ASN 315 Cb 0.50 -2.09 0.00 0.00 -0.61 0.00 0.00 39.78 37.58 2vjj n ASN 315 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2vjj n GLY 316 N -2.08 1.34 3.64 7.41 0.00 -0.34 -0.61 105.19 114.55 2vjj n GLY 316 Ca -0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.39 2vjj n GLY 316 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2vjj s TYR 317 N -2.55 3.33 0.00 1.61 2.02 -0.15 -3.46 117.35 118.15 2vjj s TYR 317 Ca 0.00 1.05 0.00 0.00 -0.37 0.00 0.00 57.07 57.75 2vjj s TYR 317 Cb 0.00 -2.96 0.00 0.00 -0.40 0.00 0.00 41.96 38.60 2vjj s TYR 317 CO 0.00 -0.33 0.00 0.41 -1.57 0.00 0.00 175.55 174.06 2vjj n GLY 318 N 3.81 2.47 3.57 0.71 0.00 -1.26 -1.82 105.19 112.66 2vjj n GLY 318 Ca 0.03 -1.86 -0.09 0.00 0.00 0.00 0.00 46.02 44.10 2vjj n GLY 318 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2vjj s SER 319 N 0.00 -0.34 -1.23 1.61 0.15 0.19 -4.07 113.70 110.01 2vjj s SER 319 Ca 0.00 0.28 -0.09 0.00 0.70 0.00 0.00 55.95 56.84 2vjj s SER 319 Cb 0.00 0.30 -0.01 0.00 -1.71 0.00 0.00 66.02 64.60 2vjj s SER 319 CO 0.00 -0.38 0.71 0.59 1.20 0.00 0.00 173.24 175.36 2vjj n ASN 320 N 0.47 -3.32 -4.38 5.45 5.03 -0.24 -0.88 115.26 117.39 2vjj n ASN 320 Ca -0.09 -0.92 -0.33 0.00 0.87 0.00 0.00 54.58 54.11 2vjj n ASN 320 Cb 0.59 -3.72 -0.14 0.00 -1.02 0.00 0.00 39.78 35.48 2vjj n ASN 320 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2vjj s TYR 322 N 0.01 0.02 -0.17 0.00 2.02 -0.89 -1.22 117.35 117.12 2vjj s TYR 322 Ca -0.05 -0.04 0.01 0.00 -0.37 0.00 0.00 57.07 56.62 2vjj s TYR 322 Cb -0.14 -0.04 0.03 0.00 -0.40 0.00 0.00 41.96 41.40 2vjj s TYR 322 CO 0.04 -0.12 -0.15 0.08 -1.57 0.00 0.00 175.55 173.84 2vjj s VAL 323 N -0.57 1.76 -0.01 0.71 1.01 -0.60 -1.56 120.40 121.13 2vjj s VAL 323 Ca -0.06 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.08 2vjj s VAL 323 Cb -0.04 -1.68 0.01 0.00 0.00 0.00 0.00 36.38 34.67 2vjj s VAL 323 CO 0.00 0.40 -0.02 -0.13 0.00 0.00 0.00 175.10 175.36 2vjj s ARG 324 N 1.39 0.27 -1.53 2.72 0.52 -0.53 -1.25 118.95 120.54 2vjj s ARG 324 Ca 0.03 -0.02 -0.03 0.00 -0.52 0.00 0.00 55.73 55.19 2vjj s ARG 324 Cb -0.14 -0.35 0.01 0.00 0.52 0.00 0.00 34.95 35.00 2vjj s ARG 324 CO -0.11 -0.03 0.30 1.63 0.02 0.00 0.00 175.30 177.11 2vjj n LYS 325 N 3.53 -3.24 -3.84 3.54 5.02 -0.91 -1.84 118.16 120.42 2vjj n LYS 325 Ca -0.19 0.85 -0.26 0.00 -2.02 0.00 0.00 58.31 56.68 2vjj n LYS 325 Cb 0.55 -5.59 -0.03 0.00 -0.02 0.00 0.00 35.03 29.94 2vjj n LYS 325 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2vjj s ARG 327 N -3.33 2.36 -0.19 0.00 0.52 -0.64 -1.24 118.95 116.42 2vjj s ARG 327 Ca 0.36 -0.79 -0.01 0.00 -0.52 0.00 0.00 55.73 54.77 2vjj s ARG 327 Cb -0.11 -2.32 0.05 0.00 0.52 0.00 0.00 34.95 33.10 2vjj s ARG 327 CO 0.29 0.59 -0.02 -0.06 0.02 0.00 0.00 175.30 176.12 2vjj s PHE 328 N -0.81 1.64 -0.14 -0.53 0.08 0.01 -0.51 117.98 117.72 2vjj s PHE 328 Ca 0.13 -1.18 -0.01 0.00 0.12 0.00 0.00 56.93 55.99 2vjj s PHE 328 Cb -0.11 -1.28 0.04 0.00 -0.57 0.00 0.00 43.02 41.10 2vjj s PHE 328 CO 0.02 -0.65 -0.04 0.42 -0.10 0.00 0.00 175.22 174.87 2vjj s ILE 329 N 1.65 0.93 -1.00 0.64 1.01 0.08 -0.73 121.20 123.79 2vjj s ILE 329 Ca -0.02 -0.41 -0.05 0.00 0.00 0.00 0.00 60.65 60.16 2vjj s ILE 329 Cb -0.17 -1.08 -0.06 0.00 0.01 0.00 0.00 42.46 41.16 2vjj s ILE 329 CO -0.07 0.19 0.88 0.59 0.00 0.00 0.00 174.94 176.53 2vjj n ASN 330 N 4.95 -6.82 -0.87 3.58 3.02 0.09 -1.66 115.26 117.56 2vjj n ASN 330 Ca -0.11 -0.61 0.08 0.00 -0.03 0.00 0.00 54.58 53.91 2vjj n ASN 330 Cb 0.49 -5.17 0.19 0.00 -0.61 0.00 0.00 39.78 34.68 2vjj n ASN 330 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2vjj n LEU 331 N -3.00 3.15 -3.93 3.41 4.77 -1.25 -1.31 117.00 118.83 2vjj n LEU 331 Ca -0.06 -1.81 -0.21 0.00 -0.03 0.00 0.00 56.01 53.90 2vjj n LEU 331 Cb 0.60 -0.27 -0.16 0.00 -2.33 0.00 0.00 43.42 41.25 2vjj n LEU 331 CO 0.58 0.75 -0.43 -0.69 -1.33 0.00 0.00 177.39 176.28 2vjj s VAL 332 N -1.07 0.73 0.00 4.08 1.01 -1.04 -1.22 120.40 122.89 2vjj s VAL 332 Ca 0.31 -0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.05 2vjj s VAL 332 Cb 0.17 -0.72 0.00 0.00 0.00 0.00 0.00 36.38 35.83 2vjj s VAL 332 CO 0.22 0.27 0.14 -0.46 0.00 0.00 0.00 175.10 175.27 2vjj n ASN 333 N 3.99 0.00 -4.14 3.32 0.23 -1.24 -4.48 115.26 112.94 2vjj n ASN 333 Ca -0.24 -1.00 -0.09 0.00 -0.53 0.00 0.00 54.58 52.72 2vjj n ASN 333 Cb 0.51 0.00 -0.10 0.00 -2.08 0.00 0.00 39.78 38.11 2vjj n ASN 333 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 2vjj s SER 334 N 0.00 0.90 0.29 0.53 1.04 -1.26 -5.00 113.70 110.20 2vjj s SER 334 Ca 0.00 -1.01 0.26 0.00 0.48 0.00 0.00 55.95 55.67 2vjj s SER 334 Cb 0.00 0.14 0.93 0.00 0.10 0.00 0.00 66.02 67.19 2vjj s SER 334 CO 0.00 -0.52 1.76 0.77 0.98 0.00 0.00 173.24 176.23 2vjj h SER 335 N 3.02 0.00 0.64 7.02 4.64 -1.99 -3.09 113.55 123.79 2vjj h SER 335 Ca -0.35 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.83 2vjj h SER 335 Cb 1.16 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.23 2vjj h SER 335 CO 0.65 0.00 -0.68 0.58 -0.87 0.00 0.00 176.83 176.51 2vjj h VAL 336 N 0.00 1.48 -2.21 0.95 2.07 -1.95 -3.44 116.25 113.15 2vjj h VAL 336 Ca 0.00 -2.31 -0.57 0.00 0.82 0.00 0.00 66.70 64.64 2vjj h VAL 336 Cb 0.55 2.24 0.02 0.00 -1.52 0.00 0.00 31.29 32.58 2vjj h VAL 336 CO 0.00 0.66 1.19 -3.20 0.02 0.00 0.00 177.57 176.24 2vjj n ASN 337 N -3.74 3.86 0.07 0.57 2.85 -1.17 -3.90 115.26 113.80 2vjj n ASN 337 Ca -0.01 0.92 -0.08 0.00 -0.11 0.00 0.00 54.58 55.29 2vjj n ASN 337 Cb 0.67 -1.46 0.04 0.00 1.24 0.00 0.00 39.78 40.27 2vjj n ASN 337 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2vjj h ALA 338 N 10.14 0.63 -1.05 5.20 0.00 -1.86 -3.48 119.26 128.84 2vjj h ALA 338 Ca -0.49 -0.63 0.24 0.00 0.00 0.00 0.00 54.91 54.03 2vjj h ALA 338 Cb 1.25 -0.07 -0.28 0.00 0.00 0.00 0.00 17.79 18.69 2vjj h ALA 338 CO 0.94 0.81 0.95 0.34 0.00 0.00 0.00 179.25 182.29 2vjj s ASP 339 N -6.94 -0.03 -0.14 0.00 2.15 -1.26 -5.01 116.67 105.43 2vjj s ASP 339 Ca -0.04 0.04 -0.08 0.00 0.43 0.00 0.00 52.55 52.89 2vjj s ASP 339 Cb 0.11 0.03 0.05 0.00 -0.30 0.00 0.00 42.92 42.81 2vjj s ASP 339 CO 0.82 -0.03 0.34 -2.28 -0.17 0.00 0.00 175.17 173.86 2vjj s HIS 340 N -0.89 -0.47 -0.05 -5.34 5.65 -1.14 -4.51 115.29 108.54 2vjj s HIS 340 Ca 0.09 1.05 0.01 0.00 0.25 0.00 0.00 55.06 56.46 2vjj s HIS 340 Cb -0.01 0.17 0.02 0.00 -1.18 0.00 0.00 32.58 31.58 2vjj s HIS 340 CO -0.09 -0.28 -0.05 -1.54 -0.65 0.00 0.00 174.74 172.14 2vjj s SER 341 N 1.13 1.14 0.08 9.88 1.04 -0.44 -0.90 113.70 125.62 2vjj s SER 341 Ca -0.08 -0.14 -0.20 0.00 0.48 0.00 0.00 55.95 56.01 2vjj s SER 341 Cb -0.08 -0.49 -0.10 0.00 0.10 0.00 0.00 66.02 65.44 2vjj s SER 341 CO -0.09 -0.07 1.56 0.74 0.98 0.00 0.00 173.24 176.36 2vjj h THR 342 N 6.15 1.21 -3.26 2.02 2.02 -0.85 -3.36 112.91 116.84 2vjj h THR 342 Ca -0.35 -0.67 -0.57 0.00 0.77 0.00 0.00 66.41 65.59 2vjj h THR 342 Cb 1.15 1.31 -0.35 0.00 -1.74 0.00 0.00 68.15 68.53 2vjj h THR 342 CO 0.44 0.20 -0.83 -0.69 0.37 0.00 0.00 175.52 175.02 2vjj s VAL 343 N -5.26 1.41 -0.27 3.16 1.01 -0.66 -0.63 120.40 119.16 2vjj s VAL 343 Ca -0.14 -0.58 -0.04 0.00 0.00 0.00 0.00 61.98 61.22 2vjj s VAL 343 Cb 0.07 -1.30 0.02 0.00 0.00 0.00 0.00 36.38 35.17 2vjj s VAL 343 CO 0.71 0.42 -0.00 -0.47 0.00 0.00 0.00 175.10 175.76 2vjj s TYR 344 N 1.06 3.11 -0.47 5.22 6.14 -0.59 -0.76 117.35 131.06 2vjj s TYR 344 Ca -0.05 -1.37 -0.16 0.00 0.64 0.00 0.00 57.07 56.13 2vjj s TYR 344 Cb -0.15 -2.14 0.07 0.00 0.42 0.00 0.00 41.96 40.17 2vjj s TYR 344 CO -0.02 -0.68 0.40 0.08 0.64 0.00 0.00 175.55 175.97 2vjj s VAL 345 N 1.38 5.23 -0.21 3.14 1.01 0.88 -1.19 120.40 130.65 2vjj s VAL 345 Ca 0.01 -1.07 0.12 0.00 0.00 0.00 0.00 61.98 61.03 2vjj s VAL 345 Cb -0.17 -4.13 0.42 0.00 0.00 0.00 0.00 36.38 32.50 2vjj s VAL 345 CO -0.02 -0.59 1.21 -3.20 0.00 0.00 0.00 175.10 172.51 2vjj n ASN 346 N 5.21 1.94 -3.94 3.32 5.15 0.88 -0.99 115.26 126.83 2vjj n ASN 346 Ca -0.12 -3.78 -0.09 0.00 -0.60 0.00 0.00 54.58 49.98 2vjj n ASN 346 Cb 0.44 -0.50 -0.10 0.00 -0.53 0.00 0.00 39.78 39.09 2vjj n ASN 346 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2vjj s PRO 348 N -2.14 0.93 -1.33 0.00 0.04 -1.26 -4.30 135.00 126.94 2vjj s PRO 348 Ca -0.09 0.42 -0.02 0.00 0.04 0.00 0.00 61.00 61.35 2vjj s PRO 348 Cb -0.04 -1.80 0.01 0.00 0.04 0.00 0.00 34.50 32.71 2vjj s PRO 348 CO -0.03 -2.37 0.80 0.66 0.04 0.00 0.00 177.00 176.11 2vjj n TYR 349 N -3.91 -2.05 -3.84 0.56 4.01 -0.29 -3.37 117.16 108.27 2vjj n TYR 349 Ca 0.06 0.87 -0.09 0.00 -0.16 0.00 0.00 57.90 58.58 2vjj n TYR 349 Cb 0.58 -4.46 -0.06 0.00 -0.31 0.00 0.00 39.34 35.09 2vjj n TYR 349 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 2vjj s SER 350 N -4.16 -0.01 0.00 7.72 0.01 -1.06 -1.08 113.70 115.11 2vjj s SER 350 Ca 0.13 -0.64 0.00 0.00 1.31 0.00 0.00 55.95 56.74 2vjj s SER 350 Cb -0.06 0.42 0.00 0.00 0.21 0.00 0.00 66.02 66.59 2vjj s SER 350 CO 0.80 -0.84 0.00 0.61 0.41 0.00 0.00 173.24 174.22 2vjj n GLY 351 N -0.17 -1.40 3.01 3.44 0.00 -0.36 -2.42 105.19 107.29 2vjj n GLY 351 Ca -0.12 -0.99 -0.25 0.00 0.00 0.00 0.00 46.02 44.66 2vjj n GLY 351 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vjj s VAL 352 N -2.60 1.11 -0.02 1.61 1.01 -0.44 -1.56 120.40 119.51 2vjj s VAL 352 Ca 0.00 -0.45 -0.01 0.00 0.00 0.00 0.00 61.98 61.51 2vjj s VAL 352 Cb 0.00 -1.03 0.02 0.00 0.00 0.00 0.00 36.38 35.37 2vjj s VAL 352 CO 0.00 0.35 0.06 -0.70 0.00 0.00 0.00 175.10 174.81 2vjj s GLU 353 N 0.78 0.04 -1.34 2.72 2.12 -0.38 -1.15 118.70 121.47 2vjj s GLU 353 Ca -0.12 0.14 -0.04 0.00 0.36 0.00 0.00 54.97 55.31 2vjj s GLU 353 Cb -0.15 -0.07 0.02 0.00 0.26 0.00 0.00 34.13 34.19 2vjj s GLU 353 CO 0.02 -0.07 0.84 0.43 -0.54 0.00 0.00 175.26 175.95 2vjj n SER 354 N 3.49 -2.47 -4.78 -1.70 7.64 -0.62 -2.80 113.62 112.37 2vjj n SER 354 Ca -0.18 -0.76 -0.23 0.00 1.01 0.00 0.00 58.87 58.71 2vjj n SER 354 Cb 0.56 -4.25 -0.06 0.00 -1.01 0.00 0.00 64.21 59.45 2vjj n SER 354 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2vjj s TYR 356 N -2.47 1.73 -0.10 0.00 5.04 -0.38 -1.61 117.35 119.57 2vjj s TYR 356 Ca 0.41 -0.64 0.00 0.00 -2.44 0.00 0.00 57.07 54.40 2vjj s TYR 356 Cb -0.01 -1.22 0.02 0.00 0.35 0.00 0.00 41.96 41.10 2vjj s TYR 356 CO 0.24 -0.29 -0.09 -0.06 -1.34 0.00 0.00 175.55 174.00 2vjj s PHE 357 N 0.51 1.52 -0.01 4.97 0.40 0.28 -0.81 117.98 124.84 2vjj s PHE 357 Ca -0.14 -0.71 0.01 0.00 -0.60 0.00 0.00 56.93 55.49 2vjj s PHE 357 Cb -0.16 -1.21 0.01 0.00 0.51 0.00 0.00 43.02 42.17 2vjj s PHE 357 CO 0.05 -0.45 -0.02 0.45 0.70 0.00 0.00 175.22 175.94 2vjj s SER 358 N 1.38 0.38 0.09 1.36 0.15 0.10 -0.78 113.70 116.38 2vjj s SER 358 Ca -0.01 -0.05 0.06 0.00 0.70 0.00 0.00 55.95 56.65 2vjj s SER 358 Cb -0.14 -0.10 -0.03 0.00 -1.71 0.00 0.00 66.02 64.05 2vjj s SER 358 CO -0.05 -0.00 -0.16 -0.04 1.20 0.00 0.00 173.24 174.19 2vjj s MET 359 N 0.24 0.92 -0.00 5.44 -1.94 -0.45 -0.73 119.30 122.78 2vjj s MET 359 Ca -0.02 -1.05 0.03 0.00 -1.71 0.00 0.00 55.69 52.93 2vjj s MET 359 Cb -0.05 -0.96 -0.04 0.00 2.01 0.00 0.00 34.83 35.80 2vjj s MET 359 CO -0.01 0.21 0.08 -1.13 -0.01 0.00 0.00 175.02 174.16 2vjj n SER 360 N 1.11 2.63 -4.79 3.03 3.41 -1.26 -4.28 113.62 113.47 2vjj n SER 360 Ca -0.20 -0.23 -0.36 0.00 -0.26 0.00 0.00 58.87 57.82 2vjj n SER 360 Cb 0.54 1.07 -0.04 0.00 -0.26 0.00 0.00 64.21 65.52 2vjj n SER 360 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2vjj s SER 361 N -1.86 6.74 0.34 4.04 0.15 -1.26 -4.94 113.70 116.91 2vjj s SER 361 Ca -0.00 1.96 0.03 0.00 0.70 0.00 0.00 55.95 58.63 2vjj s SER 361 Cb 0.02 -2.57 0.64 0.00 -1.71 0.00 0.00 66.02 62.39 2vjj s SER 361 CO 0.11 -0.50 1.98 0.77 1.20 0.00 0.00 173.24 176.80 2vjj h SER 362 N 2.29 0.75 -0.68 5.45 4.64 -1.95 -2.76 113.55 121.29 2vjj h SER 362 Ca -0.48 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 60.81 2vjj h SER 362 Cb 1.21 -0.18 -0.03 0.00 -0.31 0.00 0.00 62.40 63.09 2vjj h SER 362 CO 0.62 0.52 0.37 -0.26 -0.87 0.00 0.00 176.83 177.21 2vjj h PHE 363 N 0.87 0.96 -0.06 4.77 0.04 -1.92 -2.33 116.94 119.26 2vjj h PHE 363 Ca 0.28 -0.02 -0.02 0.00 2.80 0.00 0.00 57.97 61.00 2vjj h PHE 363 Cb 0.04 -0.31 -0.01 0.00 2.20 0.00 0.00 35.95 37.87 2vjj h PHE 363 CO -0.00 0.67 -0.07 0.00 -0.60 0.00 0.00 178.31 178.31 2vjj h ALA 364 N 1.43 1.77 0.00 2.45 0.00 -1.78 -1.16 119.26 121.98 2vjj h ALA 364 Ca 0.25 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2vjj h ALA 364 Cb 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2vjj h ALA 364 CO -0.04 0.17 0.00 0.54 0.00 0.00 0.00 179.25 179.93 2vjj n ARG 365 N -4.40 0.19 -0.02 0.00 1.74 -0.88 -1.46 116.66 111.82 2vjj n ARG 365 Ca -0.02 0.42 0.01 0.00 -0.77 0.00 0.00 57.85 57.49 2vjj n ARG 365 Cb 0.18 -1.86 -0.08 0.00 -1.02 0.00 0.00 32.46 29.68 2vjj n ARG 365 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2vjj n ASN 366 N -2.21 2.55 0.00 0.55 3.02 -0.64 -4.02 115.26 114.52 2vjj n ASN 366 Ca 0.02 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.57 2vjj n ASN 366 Cb 0.23 1.17 0.00 0.00 -0.61 0.00 0.00 39.78 40.56 2vjj n ASN 366 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 2vjj n ILE 367 N -2.09 0.00 -3.87 2.41 -5.35 -0.53 -4.87 119.36 105.06 2vjj n ILE 367 Ca -0.08 -0.28 -0.35 0.00 -0.27 0.00 0.00 62.75 61.77 2vjj n ILE 367 Cb 0.51 0.80 -0.08 0.00 -1.74 0.00 0.00 39.64 39.13 2vjj n ILE 367 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2vjj s ALA 368 N -1.15 3.62 0.07 -1.28 0.00 -0.53 -2.90 121.76 119.59 2vjj s ALA 368 Ca 0.00 -0.70 0.09 0.00 0.00 0.00 0.00 51.96 51.34 2vjj s ALA 368 Cb 0.00 -2.02 -0.03 0.00 0.00 0.00 0.00 23.12 21.06 2vjj s ALA 368 CO 0.00 0.27 -0.22 0.00 0.00 0.00 0.00 175.76 175.81 2vjj h SER 370 N 4.33 0.31 -4.99 0.00 4.64 -1.06 -1.11 113.55 115.68 2vjj h SER 370 Ca -0.48 -0.97 -0.16 0.00 -0.47 0.00 0.00 61.79 59.71 2vjj h SER 370 Cb 1.16 -0.10 -0.21 0.00 -0.31 0.00 0.00 62.40 62.94 2vjj h SER 370 CO 0.45 1.26 -0.63 -0.69 -0.87 0.00 0.00 176.83 176.35 2vjj s VAL 371 N -2.37 0.10 -0.04 0.95 1.01 -0.80 -1.65 120.40 117.62 2vjj s VAL 371 Ca -0.15 -0.86 0.03 0.00 0.00 0.00 0.00 61.98 60.99 2vjj s VAL 371 Cb -0.00 -0.36 0.01 0.00 0.00 0.00 0.00 36.38 36.03 2vjj s VAL 371 CO 0.78 -0.47 -0.11 -1.61 0.00 0.00 0.00 175.10 173.69 2vjj s GLU 372 N -1.51 1.26 -0.27 2.72 2.02 0.06 -2.16 118.70 120.82 2vjj s GLU 372 Ca -0.15 -0.37 -0.04 0.00 0.02 0.00 0.00 54.97 54.43 2vjj s GLU 372 Cb -0.09 -1.13 0.02 0.00 0.10 0.00 0.00 34.13 33.04 2vjj s GLU 372 CO -0.00 0.10 0.01 -0.51 0.02 0.00 0.00 175.26 174.88 2vjj s LEU 373 N 0.32 3.54 0.00 1.80 1.43 0.14 -0.08 118.68 125.83 2vjj s LEU 373 Ca -0.06 -0.82 0.00 0.00 -1.03 0.00 0.00 54.13 52.22 2vjj s LEU 373 Cb -0.11 -1.77 0.00 0.00 0.03 0.00 0.00 46.19 44.34 2vjj s LEU 373 CO 0.01 -0.16 0.65 1.41 0.23 0.00 0.00 176.35 178.49 2vjj n HIS 374 N 4.76 0.00 -4.02 0.29 8.25 -0.16 -1.68 115.22 122.66 2vjj n HIS 374 Ca -0.15 -0.16 -0.09 0.00 -0.26 0.00 0.00 57.72 57.06 2vjj n HIS 374 Cb 0.47 -0.02 -0.08 0.00 1.12 0.00 0.00 29.99 31.48 2vjj n HIS 374 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 2vjj s GLN 375 N -0.32 0.93 0.68 -0.41 -1.52 -1.25 -4.71 119.66 113.06 2vjj s GLN 375 Ca 0.00 -1.22 -0.16 0.00 -1.95 0.00 0.00 55.36 52.03 2vjj s GLN 375 Cb 0.00 0.30 0.01 0.00 -0.22 0.00 0.00 33.01 33.10 2vjj s GLN 375 CO 0.00 -0.29 1.19 -3.38 -0.25 0.00 0.00 175.29 172.56 2vjj s HIS 376 N -3.96 2.27 -1.17 0.91 -3.43 -1.26 -3.89 115.29 104.76 2vjj s HIS 376 Ca 0.15 1.57 -0.02 0.00 -0.80 0.00 0.00 55.06 55.95 2vjj s HIS 376 Cb 0.06 -3.41 -0.02 0.00 -1.43 0.00 0.00 32.58 27.78 2vjj s HIS 376 CO -0.03 -2.30 0.94 -0.25 -2.00 0.00 0.00 174.74 171.10 2vjj n ASP 377 N -2.33 -3.31 -4.33 7.38 8.00 0.56 -2.61 116.55 119.91 2vjj n ASP 377 Ca 0.13 -0.68 -0.19 0.00 0.71 0.00 0.00 54.79 54.76 2vjj n ASP 377 Cb 0.50 -5.00 -0.10 0.00 -0.02 0.00 0.00 41.12 36.50 2vjj n ASP 377 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2vjj s THR 378 N -3.40 1.69 0.04 -3.53 -4.23 -0.93 -1.14 115.64 104.14 2vjj s THR 378 Ca 0.14 -2.08 -0.10 0.00 -1.18 0.00 0.00 61.69 58.46 2vjj s THR 378 Cb -0.02 -1.93 0.01 0.00 1.34 0.00 0.00 72.50 71.89 2vjj s THR 378 CO 0.74 -0.52 0.21 0.72 -0.54 0.00 0.00 174.62 175.24 2vjj s PHE 379 N -2.68 0.02 -0.23 3.99 -0.12 -1.02 -1.62 117.98 116.33 2vjj s PHE 379 Ca 0.19 -0.22 -0.04 0.00 -0.05 0.00 0.00 56.93 56.81 2vjj s PHE 379 Cb -0.02 -0.01 0.08 0.00 -0.63 0.00 0.00 43.02 42.44 2vjj s PHE 379 CO 0.06 -0.44 0.11 -0.47 -0.05 0.00 0.00 175.22 174.43 2vjj s TYR 380 N -2.50 0.28 0.06 3.49 5.04 0.22 -1.33 117.35 122.61 2vjj s TYR 380 Ca -0.05 -0.59 0.03 0.00 -2.44 0.00 0.00 57.07 54.02 2vjj s TYR 380 Cb -0.01 -0.80 -0.03 0.00 0.35 0.00 0.00 41.96 41.47 2vjj s TYR 380 CO -0.03 -0.66 -0.10 1.03 -1.34 0.00 0.00 175.55 174.44 2vjj s ARG 381 N 2.11 0.67 -1.71 4.97 0.52 -0.30 -1.73 118.95 123.48 2vjj s ARG 381 Ca 0.05 -0.88 -0.00 0.00 -0.52 0.00 0.00 55.73 54.38 2vjj s ARG 381 Cb -0.16 -0.51 0.00 0.00 0.52 0.00 0.00 34.95 34.80 2vjj s ARG 381 CO -0.22 0.10 0.05 0.41 0.02 0.00 0.00 175.30 175.66 2vjj n GLY 382 N 1.27 -0.46 3.62 -3.53 0.00 -0.56 -1.59 105.19 103.93 2vjj n GLY 382 Ca -0.21 -0.03 -0.24 0.00 0.00 0.00 0.00 46.02 45.55 2vjj n GLY 382 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2vjj s SER 383 N -2.14 4.29 -0.07 1.61 0.01 -1.26 -3.32 113.70 112.82 2vjj s SER 383 Ca 0.02 -0.81 0.04 0.00 1.31 0.00 0.00 55.95 56.52 2vjj s SER 383 Cb -0.01 -0.66 0.00 0.00 0.21 0.00 0.00 66.02 65.56 2vjj s SER 383 CO 0.03 -0.07 -0.20 -0.89 0.41 0.00 0.00 173.24 172.52 2vjj s THR 384 N -2.41 1.74 -0.06 1.44 2.01 -0.64 -0.69 115.64 117.04 2vjj s THR 384 Ca 0.32 -0.86 0.03 0.00 0.31 0.00 0.00 61.69 61.49 2vjj s THR 384 Cb -0.04 -1.51 0.01 0.00 0.01 0.00 0.00 72.50 70.96 2vjj s THR 384 CO 0.19 0.49 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.79 2vjj s VAL 385 N 0.25 1.21 -0.01 3.82 1.01 0.06 -0.55 120.40 126.19 2vjj s VAL 385 Ca -0.12 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.32 2vjj s VAL 385 Cb -0.15 -1.08 0.01 0.00 0.00 0.00 0.00 36.38 35.15 2vjj s VAL 385 CO 0.06 0.37 -0.00 0.21 0.00 0.00 0.00 175.10 175.73 2vjj s ASN 386 N 0.50 0.18 0.00 3.32 3.04 0.04 -1.15 114.94 120.86 2vjj s ASN 386 Ca -0.12 -0.01 0.00 0.00 0.04 0.00 0.00 52.86 52.77 2vjj s ASN 386 Cb -0.15 -0.05 0.00 0.00 -1.54 0.00 0.00 41.25 39.51 2vjj s ASN 386 CO 0.03 -0.02 0.00 0.61 -3.04 0.00 0.00 177.10 174.68 2vjj n GLY 387 N 3.36 0.75 3.93 1.21 0.00 -1.00 -1.35 105.19 112.10 2vjj n GLY 387 Ca -0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.61 2vjj n GLY 387 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2vjj s TYR 388 N -2.60 3.50 0.01 1.61 1.51 -1.26 -3.81 117.35 116.32 2vjj s TYR 388 Ca 0.00 0.39 -0.23 0.00 -1.01 0.00 0.00 57.07 56.22 2vjj s TYR 388 Cb 0.00 -1.92 -0.17 0.00 -0.11 0.00 0.00 41.96 39.76 2vjj s TYR 388 CO 0.00 0.16 1.34 0.00 -1.11 0.00 0.00 175.55 175.93 2vjj s ARG 390 N -4.43 0.71 -0.06 0.00 0.52 -0.41 0.02 118.95 115.31 2vjj s ARG 390 Ca -0.15 -0.98 -0.02 0.00 -0.52 0.00 0.00 55.73 54.06 2vjj s ARG 390 Cb 0.04 -0.46 -0.01 0.00 0.52 0.00 0.00 34.95 35.04 2vjj s ARG 390 CO 0.71 0.08 -0.04 0.78 0.02 0.00 0.00 175.30 176.84 2vjj h GLY 391 N 4.01 0.00 -5.34 -3.53 0.00 -0.86 -2.37 103.07 94.98 2vjj h GLY 391 Ca -0.37 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 46.84 2vjj h GLY 391 CO 0.47 0.00 -0.24 0.00 0.00 0.00 0.00 176.54 176.77 2vjj s ALA 392 N -2.83 -1.06 0.04 3.60 0.00 0.86 -1.90 121.76 120.47 2vjj s ALA 392 Ca -0.03 1.31 -0.19 0.00 0.00 0.00 0.00 51.96 53.04 2vjj s ALA 392 Cb 0.00 -0.77 -0.06 0.00 0.00 0.00 0.00 23.12 22.29 2vjj s ALA 392 CO 0.05 -0.22 0.57 0.71 0.00 0.00 0.00 175.76 176.86 2vjj s TYR 393 N 0.57 3.76 -0.27 0.00 1.51 -0.92 -1.19 117.35 120.81 2vjj s TYR 393 Ca -0.03 1.23 0.00 0.00 -1.01 0.00 0.00 57.07 57.26 2vjj s TYR 393 Cb -0.04 -2.52 0.08 0.00 -0.11 0.00 0.00 41.96 39.36 2vjj s TYR 393 CO -0.03 0.51 0.04 0.08 -1.11 0.00 0.00 175.55 175.03 2vjj s VAL 394 N -0.77 1.23 0.03 0.71 1.01 0.28 -0.68 120.40 122.21 2vjj s VAL 394 Ca 0.29 -1.36 -0.08 0.00 0.00 0.00 0.00 61.98 60.83 2vjj s VAL 394 Cb -0.19 -1.76 -0.00 0.00 0.00 0.00 0.00 36.38 34.43 2vjj s VAL 394 CO 0.18 -0.42 0.15 0.68 0.00 0.00 0.00 175.10 175.69 2vjj s VAL 395 N 1.48 0.11 -0.35 2.92 -7.23 -0.67 -2.72 120.40 113.94 2vjj s VAL 395 Ca 0.04 -0.91 0.00 0.00 -1.81 0.00 0.00 61.98 59.30 2vjj s VAL 395 Cb -0.18 -0.81 0.09 0.00 0.56 0.00 0.00 36.38 36.05 2vjj s VAL 395 CO -0.14 -0.50 0.09 -0.32 -0.31 0.00 0.00 175.10 173.91 2vjj s MET 396 N -2.32 1.88 -0.26 4.82 1.75 -0.83 -4.20 119.30 120.15 2vjj s MET 396 Ca -0.07 -1.72 -0.27 0.00 -1.25 0.00 0.00 55.69 52.37 2vjj s MET 396 Cb -0.02 -3.32 0.01 0.00 2.84 0.00 0.00 34.83 34.33 2vjj s MET 396 CO -0.03 -0.91 0.98 -1.01 -0.65 0.00 0.00 175.02 173.40 2vjj s HIS 397 N 1.06 3.29 0.38 4.11 3.76 -1.26 -2.52 115.29 124.10 2vjj s HIS 397 Ca 0.06 1.28 0.17 0.00 -0.15 0.00 0.00 55.06 56.42 2vjj s HIS 397 Cb -0.21 -3.29 1.06 0.00 1.11 0.00 0.00 32.58 31.25 2vjj s HIS 397 CO -0.05 -0.52 1.76 0.00 -0.85 0.00 0.00 174.74 175.07 2vjj h ALA 398 N 7.68 2.14 0.00 -1.40 0.00 -1.87 0.02 119.26 125.82 2vjj h ALA 398 Ca -0.21 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2vjj h ALA 398 Cb 1.07 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2vjj h ALA 398 CO 0.96 -0.57 0.00 0.00 0.00 0.00 0.00 179.25 179.64 2vjj n ALA 399 N -2.43 1.40 -0.70 0.00 0.00 -1.26 -2.12 120.51 115.40 2vjj n ALA 399 Ca 0.26 0.11 0.08 0.00 0.00 0.00 0.00 53.44 53.89 2vjj n ALA 399 Cb 0.86 -1.33 0.25 0.00 0.00 0.00 0.00 19.45 19.23 2vjj n ALA 399 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2vjj n GLU 400 N -2.16 3.11 -0.07 0.00 1.02 -0.01 -4.74 120.64 117.79 2vjj n GLU 400 Ca 0.01 -2.62 0.08 0.00 -0.02 0.00 0.00 57.16 54.61 2vjj n GLU 400 Cb 0.14 -1.70 0.33 0.00 -0.02 0.00 0.00 31.44 30.20 2vjj n GLU 400 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2vjj n ALA 401 N 0.05 2.53 -0.15 0.62 0.00 -0.90 -3.67 120.51 118.97 2vjj n ALA 401 Ca 0.19 -0.38 -0.10 0.00 0.00 0.00 0.00 53.44 53.15 2vjj n ALA 401 Cb 0.76 -1.11 -0.01 0.00 0.00 0.00 0.00 19.45 19.10 2vjj n ALA 401 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2vjj h ALA 402 N 3.73 0.60 0.00 0.00 0.00 -1.83 -2.82 119.26 118.94 2vjj h ALA 402 Ca 0.00 -0.29 -0.20 0.00 0.00 0.00 0.00 54.91 54.42 2vjj h ALA 402 Cb 0.30 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 2vjj h ALA 402 CO 0.00 0.42 -1.50 0.41 0.00 0.00 0.00 179.25 178.58 2vjj n GLY 403 N -0.32 -1.14 0.17 0.00 0.00 0.22 -4.51 105.19 99.61 2vjj n GLY 403 Ca -0.00 -0.10 0.02 0.00 0.00 0.00 0.00 46.02 45.94 2vjj n GLY 403 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vjj n ALA 404 N -2.44 1.71 0.00 4.61 0.00 -1.22 -4.59 120.51 118.58 2vjj n ALA 404 Ca -0.12 -1.11 0.00 0.00 0.00 0.00 0.00 53.44 52.21 2vjj n ALA 404 Cb 0.90 -0.23 0.00 0.00 0.00 0.00 0.00 19.45 20.12 2vjj n ALA 404 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2vjj n GLY 405 N -0.34 -0.55 1.22 0.00 0.00 -1.06 -4.70 105.19 99.77 2vjj n GLY 405 Ca 0.03 -1.76 0.08 0.00 0.00 0.00 0.00 46.02 44.37 2vjj n GLY 405 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2vjj n SER 406 N -0.91 3.57 -4.32 1.61 3.41 -1.26 -4.59 113.62 111.13 2vjj n SER 406 Ca 0.00 -2.23 -0.33 0.00 -0.26 0.00 0.00 58.87 56.05 2vjj n SER 406 Cb 0.00 -0.47 -0.15 0.00 -0.26 0.00 0.00 64.21 63.34 2vjj n SER 406 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 2vjj s TYR 407 N -1.59 2.84 -0.43 7.33 1.51 -1.26 -0.75 117.35 125.00 2vjj s TYR 407 Ca 0.40 -0.86 -0.15 0.00 -1.01 0.00 0.00 57.07 55.44 2vjj s TYR 407 Cb 0.24 -1.92 0.04 0.00 -0.11 0.00 0.00 41.96 40.21 2vjj s TYR 407 CO 0.22 -0.39 0.33 0.00 -1.11 0.00 0.00 175.55 174.60 2vjj s ALA 408 N 0.78 3.50 0.14 3.71 0.00 0.10 -4.28 121.76 125.71 2vjj s ALA 408 Ca -0.05 -1.87 0.04 0.00 0.00 0.00 0.00 51.96 50.08 2vjj s ALA 408 Cb -0.15 -2.94 -0.04 0.00 0.00 0.00 0.00 23.12 19.98 2vjj s ALA 408 CO 0.01 -1.56 -0.08 1.52 0.00 0.00 0.00 175.76 175.65 2vjj s TYR 409 N 1.66 1.18 -1.02 0.00 1.13 -1.25 -1.53 117.35 117.52 2vjj s TYR 409 Ca 0.05 -0.82 -0.06 0.00 -1.41 0.00 0.00 57.07 54.82 2vjj s TYR 409 Cb -0.21 -0.63 -0.06 0.00 -1.10 0.00 0.00 41.96 39.96 2vjj s TYR 409 CO 0.09 -0.00 0.90 0.09 -2.51 0.00 0.00 175.55 174.11 2vjj n ASN 410 N -0.17 -6.75 -4.41 -0.18 3.02 0.26 -0.32 115.26 106.70 2vjj n ASN 410 Ca -0.10 -0.65 -0.34 0.00 -0.03 0.00 0.00 54.58 53.45 2vjj n ASN 410 Cb 0.61 -5.20 -0.13 0.00 -0.61 0.00 0.00 39.78 34.45 2vjj n ASN 410 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2vjj s MET 411 N -4.28 3.53 -0.13 3.52 -1.94 -0.87 -2.00 119.30 117.13 2vjj s MET 411 Ca 0.42 -0.57 0.01 0.00 -1.71 0.00 0.00 55.69 53.83 2vjj s MET 411 Cb -0.06 -2.94 0.02 0.00 2.01 0.00 0.00 34.83 33.87 2vjj s MET 411 CO 0.74 0.06 -0.14 -1.14 -0.01 0.00 0.00 175.02 174.54 2vjj s GLN 412 N 0.82 2.19 -0.32 2.03 0.74 -0.64 -1.06 119.66 123.42 2vjj s GLN 412 Ca -0.01 -0.53 0.03 0.00 0.05 0.00 0.00 55.36 54.90 2vjj s GLN 412 Cb -0.15 -1.98 0.09 0.00 1.10 0.00 0.00 33.01 32.08 2vjj s GLN 412 CO 0.02 -0.18 0.04 0.08 -0.55 0.00 0.00 175.29 174.69 2vjj s VAL 413 N 1.34 1.90 0.00 1.34 1.01 0.10 -0.61 120.40 125.48 2vjj s VAL 413 Ca 0.01 -1.99 0.01 0.00 0.00 0.00 0.00 61.98 60.02 2vjj s VAL 413 Cb -0.13 -2.36 -0.01 0.00 0.00 0.00 0.00 36.38 33.88 2vjj s VAL 413 CO -0.07 -0.53 -0.05 -1.61 0.00 0.00 0.00 175.10 172.84 2vjj s GLU 414 N 1.11 0.39 -1.59 2.72 2.02 -0.71 -1.56 118.70 121.10 2vjj s GLU 414 Ca 0.08 -0.22 -0.03 0.00 0.02 0.00 0.00 54.97 54.81 2vjj s GLU 414 Cb -0.19 -0.35 0.00 0.00 0.10 0.00 0.00 34.13 33.69 2vjj s GLU 414 CO -0.11 0.09 0.46 0.09 0.02 0.00 0.00 175.26 175.81 2vjj n ASN 415 N 2.82 -6.02 -4.95 -0.19 3.02 -0.52 -1.49 115.26 107.93 2vjj n ASN 415 Ca -0.14 -0.22 -0.23 0.00 -0.03 0.00 0.00 54.58 53.97 2vjj n ASN 415 Cb 0.58 -4.88 -0.00 0.00 -0.61 0.00 0.00 39.78 34.87 2vjj n ASN 415 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2vjj s ASN 416 N -2.56 6.10 -0.09 6.41 0.01 -1.26 -2.93 114.94 120.62 2vjj s ASN 416 Ca 0.23 0.31 0.01 0.00 -0.71 0.00 0.00 52.86 52.70 2vjj s ASN 416 Cb -0.10 -1.77 0.02 0.00 0.41 0.00 0.00 41.25 39.81 2vjj s ASN 416 CO 0.28 -0.45 -0.10 -0.63 -1.51 0.00 0.00 177.10 174.69 2vjj s ILE 417 N -2.38 1.10 -0.11 0.60 1.01 0.14 -1.44 121.20 120.12 2vjj s ILE 417 Ca 0.43 -0.41 -0.10 0.00 0.00 0.00 0.00 60.65 60.58 2vjj s ILE 417 Cb -0.10 -1.05 0.03 0.00 0.01 0.00 0.00 42.46 41.36 2vjj s ILE 417 CO 0.36 0.36 0.30 0.00 0.00 0.00 0.00 174.94 175.96 2vjj s ALA 418 N 1.09 -0.73 -0.25 9.38 0.00 -0.39 -0.76 121.76 130.10 2vjj s ALA 418 Ca -0.06 0.86 -0.01 0.00 0.00 0.00 0.00 51.96 52.75 2vjj s ALA 418 Cb -0.14 -0.51 0.03 0.00 0.00 0.00 0.00 23.12 22.50 2vjj s ALA 418 CO -0.01 -0.15 -0.07 0.08 0.00 0.00 0.00 175.76 175.61 2vjj s VAL 419 N 0.25 2.77 0.37 0.00 1.01 -0.30 -1.31 120.40 123.20 2vjj s VAL 419 Ca -0.01 -1.07 0.03 0.00 0.00 0.00 0.00 61.98 60.94 2vjj s VAL 419 Cb -0.03 -2.41 -0.04 0.00 0.00 0.00 0.00 36.38 33.90 2vjj s VAL 419 CO -0.00 0.20 0.09 0.27 0.00 0.00 0.00 175.10 175.65 2vjj s ILE 420 N 1.30 0.87 -0.05 2.22 -4.36 -0.52 -2.37 121.20 118.29 2vjj s ILE 420 Ca -0.00 -2.00 0.04 0.00 -0.26 0.00 0.00 60.65 58.42 2vjj s ILE 420 Cb -0.17 -2.54 -0.05 0.00 1.25 0.00 0.00 42.46 40.96 2vjj s ILE 420 CO -0.05 0.00 0.10 -1.22 0.24 0.00 0.00 174.94 174.01 2vjj n TYR 421 N -0.82 0.00 0.00 1.37 4.02 -0.30 -0.90 117.16 120.53 2vjj n TYR 421 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.84 2vjj n TYR 421 Cb 0.66 -0.06 0.00 0.00 -0.02 0.00 0.00 39.34 39.92 2vjj n TYR 421 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2vjj n GLY 422 N 1.92 1.18 3.51 2.72 0.00 0.10 -4.50 105.19 110.13 2vjj n GLY 422 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2vjj n GLY 422 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2vjj s GLN 423 N 2.33 2.59 -0.06 1.61 1.11 -1.12 -1.86 119.66 124.26 2vjj s GLN 423 Ca 0.00 -0.64 -0.08 0.00 0.01 0.00 0.00 55.36 54.65 2vjj s GLN 423 Cb 0.00 -2.45 -0.04 0.00 -1.01 0.00 0.00 33.01 29.50 2vjj s GLN 423 CO 0.00 0.64 0.34 0.35 0.01 0.00 0.00 175.29 176.63 2vjj h PHE 424 N 5.31 -0.27 -3.20 0.91 3.57 -0.98 -2.44 116.94 119.85 2vjj h PHE 424 Ca -0.47 -0.01 -0.65 0.00 3.53 0.00 0.00 57.97 60.38 2vjj h PHE 424 Cb 1.16 0.09 -0.34 0.00 2.79 0.00 0.00 35.95 39.64 2vjj h PHE 424 CO 0.52 -0.17 -0.86 0.08 -2.23 0.00 0.00 178.31 175.66 2vjj s VAL 425 N -2.48 1.88 -0.19 1.41 1.01 -0.12 -0.10 120.40 121.81 2vjj s VAL 425 Ca -0.04 -0.86 -0.04 0.00 0.00 0.00 0.00 61.98 61.03 2vjj s VAL 425 Cb 0.00 -1.68 -0.02 0.00 0.00 0.00 0.00 36.38 34.68 2vjj s VAL 425 CO 0.13 0.51 -0.02 -0.63 0.00 0.00 0.00 175.10 175.09 2vjj s ILE 426 N 0.93 3.81 -0.06 2.22 1.09 -0.33 -0.83 121.20 128.03 2vjj s ILE 426 Ca -0.05 -0.37 -0.01 0.00 -1.10 0.00 0.00 60.65 59.12 2vjj s ILE 426 Cb -0.15 -2.71 -0.03 0.00 -1.06 0.00 0.00 42.46 38.50 2vjj s ILE 426 CO -0.03 0.44 0.01 -0.76 -0.10 0.00 0.00 174.94 174.50 2vjj s LEU 427 N 0.97 3.59 -0.02 2.97 1.43 0.26 -0.56 118.68 127.32 2vjj s LEU 427 Ca 0.01 0.11 -0.30 0.00 -1.03 0.00 0.00 54.13 52.93 2vjj s LEU 427 Cb -0.14 -1.89 0.10 0.00 0.03 0.00 0.00 46.19 44.29 2vjj s LEU 427 CO 0.01 0.35 1.00 -0.83 0.23 0.00 0.00 176.35 177.12 2vjj s GLY 428 N -1.09 -0.38 0.14 -3.19 0.00 -1.10 -1.74 107.32 99.96 2vjj s GLY 428 Ca 0.15 0.96 -0.20 0.00 0.00 0.00 0.00 44.72 45.63 2vjj s GLY 428 CO 0.05 0.30 0.50 -1.35 0.00 0.00 0.00 173.10 172.60 2vjj s SER 429 N -2.54 -0.41 0.31 1.64 1.04 -1.26 -1.97 113.70 110.51 2vjj s SER 429 Ca 0.08 -0.15 -0.08 0.00 0.48 0.00 0.00 55.95 56.28 2vjj s SER 429 Cb -0.01 0.54 0.03 0.00 0.10 0.00 0.00 66.02 66.68 2vjj s SER 429 CO -0.06 -0.91 0.55 -0.90 0.98 0.00 0.00 173.24 172.90 2vjj n ASP 430 N -0.29 -1.58 -4.28 7.02 5.68 -1.05 -3.91 116.55 118.15 2vjj n ASP 430 Ca -0.17 -2.39 -0.18 0.00 -0.50 0.00 0.00 54.79 51.56 2vjj n ASP 430 Cb 0.64 2.71 -0.11 0.00 -1.14 0.00 0.00 41.12 43.23 2vjj n ASP 430 CO 0.00 0.00 0.00 0.68 -1.33 0.00 0.00 177.20 176.55 2vjj s VAL 431 N -2.46 1.46 0.38 2.12 -7.23 -1.26 -0.69 120.40 112.72 2vjj s VAL 431 Ca 0.17 -1.95 0.00 0.00 -1.81 0.00 0.00 61.98 58.39 2vjj s VAL 431 Cb -0.03 -1.78 0.00 0.00 0.56 0.00 0.00 36.38 35.14 2vjj s VAL 431 CO 0.12 -0.53 0.03 0.35 -0.31 0.00 0.00 175.10 174.77 2vjj n THR 432 N 0.09 0.00 -0.14 5.32 -2.24 0.10 -4.84 114.28 112.57 2vjj n THR 432 Ca -0.12 -1.75 0.12 0.00 -2.27 0.00 0.00 64.05 60.03 2vjj n THR 432 Cb 0.59 0.30 0.46 0.00 -2.10 0.00 0.00 70.33 69.58 2vjj n THR 432 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2vjj h ALA 433 N 1.14 1.97 0.00 6.98 0.00 -2.01 -3.25 119.26 124.09 2vjj h ALA 433 Ca -0.31 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2vjj h ALA 433 Cb 0.94 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.63 2vjj h ALA 433 CO 0.50 -0.13 -0.57 0.25 0.00 0.00 0.00 179.25 179.30 2vjj n THR 434 N -4.48 0.00 -4.34 0.00 -2.24 -1.26 -5.03 114.28 96.92 2vjj n THR 434 Ca 0.12 -0.29 -0.18 0.00 -2.27 0.00 0.00 64.05 61.42 2vjj n THR 434 Cb 0.40 0.80 -0.14 0.00 -2.10 0.00 0.00 70.33 69.29 2vjj n THR 434 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2vjj s VAL 435 N -1.79 0.75 -0.18 2.28 1.01 -1.23 -5.13 120.40 116.11 2vjj s VAL 435 Ca 0.01 -0.52 -0.03 0.00 0.00 0.00 0.00 61.98 61.44 2vjj s VAL 435 Cb 0.04 -0.65 -0.02 0.00 0.00 0.00 0.00 36.38 35.75 2vjj s VAL 435 CO 0.23 0.13 -0.06 -0.44 0.00 0.00 0.00 175.10 174.96 2vjj s SER 436 N -0.44 4.43 0.18 3.32 0.01 -1.26 -0.73 113.70 119.22 2vjj s SER 436 Ca 0.02 -0.28 -0.23 0.00 1.31 0.00 0.00 55.95 56.77 2vjj s SER 436 Cb -0.05 -1.73 -0.08 0.00 0.21 0.00 0.00 66.02 64.37 2vjj s SER 436 CO -0.00 0.08 0.76 -0.83 0.41 0.00 0.00 173.24 173.66 2vjj s GLY 437 N 0.86 2.81 -0.01 3.44 0.00 0.13 -4.83 107.32 109.72 2vjj s GLY 437 Ca -0.01 0.29 0.05 0.00 0.00 0.00 0.00 44.72 45.05 2vjj s GLY 437 CO 0.01 0.75 -0.16 0.30 0.00 0.00 0.00 173.10 174.00 2vjj s HIS 438 N -1.28 1.46 -0.14 1.90 3.76 0.07 -4.29 115.29 116.78 2vjj s HIS 438 Ca 0.38 -0.28 0.01 0.00 -0.15 0.00 0.00 55.06 55.03 2vjj s HIS 438 Cb -0.21 -0.94 0.02 0.00 1.11 0.00 0.00 32.58 32.56 2vjj s HIS 438 CO 0.24 -0.02 -0.16 -1.17 -0.85 0.00 0.00 174.74 172.77 2vjj s LEU 439 N -0.39 1.81 0.16 0.89 2.96 -0.27 -0.72 118.68 123.11 2vjj s LEU 439 Ca 0.06 -0.50 -0.22 0.00 -0.22 0.00 0.00 54.13 53.25 2vjj s LEU 439 Cb -0.06 -1.22 0.06 0.00 0.50 0.00 0.00 46.19 45.47 2vjj s LEU 439 CO -0.01 -0.01 0.57 0.54 -1.32 0.00 0.00 176.35 176.13 2vjj s ASN 440 N 1.19 -0.52 -0.78 3.68 4.22 -0.58 -1.48 114.94 120.67 2vjj s ASN 440 Ca -0.01 -0.05 -0.03 0.00 -2.14 0.00 0.00 52.86 50.64 2vjj s ASN 440 Cb -0.14 0.58 -0.03 0.00 1.28 0.00 0.00 41.25 42.94 2vjj s ASN 440 CO -0.06 -0.95 0.70 0.47 -2.04 0.00 0.00 177.10 175.21 2vjj n ASP 441 N -0.36 -6.55 -4.46 3.54 8.00 -0.21 -3.41 116.55 113.10 2vjj n ASP 441 Ca -0.17 -0.34 -0.32 0.00 0.71 0.00 0.00 54.79 54.67 2vjj n ASP 441 Cb 0.65 -4.68 -0.13 0.00 -0.02 0.00 0.00 41.12 36.94 2vjj n ASP 441 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2vjj s VAL 442 N -3.17 2.91 -0.06 2.53 1.01 -0.81 -0.58 120.40 122.23 2vjj s VAL 442 Ca 0.20 -0.89 0.02 0.00 0.00 0.00 0.00 61.98 61.31 2vjj s VAL 442 Cb -0.03 -2.16 0.01 0.00 0.00 0.00 0.00 36.38 34.21 2vjj s VAL 442 CO 0.65 0.51 -0.11 -0.51 0.00 0.00 0.00 175.10 175.64 2vjj s ILE 443 N -0.79 1.05 -0.28 2.22 2.07 -0.22 -1.03 121.20 124.22 2vjj s ILE 443 Ca 0.13 -0.42 0.02 0.00 -1.41 0.00 0.00 60.65 58.96 2vjj s ILE 443 Cb -0.11 -0.98 0.08 0.00 0.13 0.00 0.00 42.46 41.59 2vjj s ILE 443 CO 0.02 0.34 -0.00 -0.69 -1.91 0.00 0.00 174.94 172.69 2vjj s VAL 444 N 0.74 1.73 0.02 4.00 1.01 0.04 -0.72 120.40 127.23 2vjj s VAL 444 Ca -0.13 -1.65 -0.15 0.00 0.00 0.00 0.00 61.98 60.05 2vjj s VAL 444 Cb -0.15 -2.11 0.02 0.00 0.00 0.00 0.00 36.38 34.14 2vjj s VAL 444 CO 0.03 -0.34 0.32 -0.94 0.00 0.00 0.00 175.10 174.17 2vjj s SER 445 N 1.24 -0.16 0.00 3.32 1.04 -0.60 -1.55 113.70 116.99 2vjj s SER 445 Ca 0.01 -0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.37 2vjj s SER 445 Cb -0.19 0.35 0.00 0.00 0.10 0.00 0.00 66.02 66.28 2vjj s SER 445 CO -0.10 -0.56 0.00 0.61 0.98 0.00 0.00 173.24 174.17 2vjj n GLY 446 N 0.80 0.39 3.83 7.32 0.00 -0.79 -1.43 105.19 115.31 2vjj n GLY 446 Ca -0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 2vjj n GLY 446 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2vjj s ASN 447 N -2.04 6.90 -0.18 1.61 0.01 -1.26 -3.61 114.94 116.37 2vjj s ASN 447 Ca 0.00 1.12 0.01 0.00 -0.71 0.00 0.00 52.86 53.28 2vjj s ASN 447 Cb 0.00 -2.30 0.02 0.00 0.41 0.00 0.00 41.25 39.37 2vjj s ASN 447 CO 0.00 0.20 -0.19 -0.51 -1.51 0.00 0.00 177.10 175.09 2vjj s ILE 448 N -1.28 2.12 -0.01 0.60 2.07 -0.52 -1.21 121.20 122.97 2vjj s ILE 448 Ca 0.32 -0.92 -0.00 0.00 -1.41 0.00 0.00 60.65 58.64 2vjj s ILE 448 Cb -0.17 -1.89 0.01 0.00 0.13 0.00 0.00 42.46 40.54 2vjj s ILE 448 CO 0.18 0.53 0.02 -0.69 -1.91 0.00 0.00 174.94 173.07 2vjj s VAL 449 N 1.30 -0.02 0.08 4.00 1.01 -0.52 -1.27 120.40 124.98 2vjj s VAL 449 Ca 0.05 0.06 0.02 0.00 0.00 0.00 0.00 61.98 62.11 2vjj s VAL 449 Cb -0.13 -0.04 -0.03 0.00 0.00 0.00 0.00 36.38 36.17 2vjj s VAL 449 CO -0.13 0.02 -0.07 -0.94 0.00 0.00 0.00 175.10 173.99 2vjj s SER 450 N 0.30 1.05 -0.19 3.32 1.04 -0.43 -1.79 113.70 116.99 2vjj s SER 450 Ca -0.02 -0.81 -0.28 0.00 0.48 0.00 0.00 55.95 55.31 2vjj s SER 450 Cb -0.04 0.07 -0.00 0.00 0.10 0.00 0.00 66.02 66.15 2vjj s SER 450 CO -0.01 -0.35 0.97 -0.63 0.98 0.00 0.00 173.24 174.20 2vjj s ILE 451 N -2.66 4.76 0.82 -1.02 -1.09 -0.32 -1.44 121.20 120.25 2vjj s ILE 451 Ca 0.03 1.91 -0.11 0.00 -2.23 0.00 0.00 60.65 60.25 2vjj s ILE 451 Cb -0.01 -4.26 0.09 0.00 -1.58 0.00 0.00 42.46 36.70 2vjj s ILE 451 CO -0.02 -0.09 1.12 -0.83 -1.23 0.00 0.00 174.94 173.88 2vjj s GLY 452 N 1.19 1.73 -0.01 6.18 0.00 -0.08 -4.38 107.32 111.95 2vjj s GLY 452 Ca 0.43 0.43 -0.37 0.00 0.00 0.00 0.00 44.72 45.21 2vjj s GLY 452 CO 0.10 0.80 1.56 -2.21 0.00 0.00 0.00 173.10 173.36 2vjj n GLU 453 N -3.72 1.49 -3.55 2.90 2.13 -1.26 -4.93 120.64 113.69 2vjj n GLU 453 Ca 0.10 0.54 -0.07 0.00 0.66 0.00 0.00 57.16 58.40 2vjj n GLU 453 Cb 0.52 -2.25 -0.02 0.00 0.27 0.00 0.00 31.44 29.97 2vjj n GLU 453 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 2vjj s ARG 454 N 1.81 0.76 0.53 5.31 1.70 -1.26 -5.14 118.95 122.66 2vjj s ARG 454 Ca 0.88 -0.31 -0.19 0.00 -0.47 0.00 0.00 55.73 55.64 2vjj s ARG 454 Cb -0.89 0.33 -0.06 0.00 -0.57 0.00 0.00 34.95 33.76 2vjj s ARG 454 CO 0.50 -0.34 1.08 0.00 -1.08 0.00 0.00 175.30 175.46 2vjj s ALA 455 N -2.99 2.76 0.27 7.88 0.00 -1.26 -4.72 121.76 123.69 2vjj s ALA 455 Ca 0.07 0.64 -0.30 0.00 0.00 0.00 0.00 51.96 52.37 2vjj s ALA 455 Cb -0.01 -3.29 -0.13 0.00 0.00 0.00 0.00 23.12 19.69 2vjj s ALA 455 CO -0.07 -0.61 1.39 0.00 0.00 0.00 0.00 175.76 176.47 2vjj n ALA 456 N -1.35 1.25 -1.46 0.00 0.00 -1.26 -2.44 120.51 115.25 2vjj n ALA 456 Ca 0.10 0.40 -0.16 0.00 0.00 0.00 0.00 53.44 53.78 2vjj n ALA 456 Cb 0.52 -2.28 -0.07 0.00 0.00 0.00 0.00 19.45 17.62 2vjj n ALA 456 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2vjj n PHE 457 N 1.58 0.00 1.24 0.00 3.72 -1.26 -4.86 117.46 117.88 2vjj n PHE 457 Ca 0.10 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.63 2vjj n PHE 457 Cb 0.33 -2.82 0.32 0.00 -0.94 0.00 0.00 39.48 36.37 2vjj n PHE 457 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2vjj n SER 458 N -0.70 1.57 -3.84 4.37 3.41 -1.02 -4.90 113.62 112.51 2vjj n SER 458 Ca -0.16 -1.30 -0.11 0.00 -0.26 0.00 0.00 58.87 57.04 2vjj n SER 458 Cb 0.54 0.14 -0.06 0.00 -0.26 0.00 0.00 64.21 64.58 2vjj n SER 458 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2vjj s ALA 459 N -2.30 0.26 0.57 7.33 0.00 -1.26 -5.01 121.76 121.36 2vjj s ALA 459 Ca 0.28 -1.19 -0.19 0.00 0.00 0.00 0.00 51.96 50.86 2vjj s ALA 459 Cb 0.20 1.15 -0.06 0.00 0.00 0.00 0.00 23.12 24.40 2vjj s ALA 459 CO 0.45 -0.79 0.85 -2.30 0.00 0.00 0.00 175.76 173.97 2vjj n PRO 460 N -0.41 0.83 -1.66 0.00 -0.02 -1.26 -4.78 135.00 127.71 2vjj n PRO 460 Ca -0.00 0.32 -0.49 0.00 -2.02 0.00 0.00 63.50 61.31 2vjj n PRO 460 Cb 0.63 -2.03 -0.05 0.00 -0.02 0.00 0.00 33.50 32.03 2vjj n PRO 460 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2vjj n PHE 461 N -1.60 2.13 -2.28 6.00 -0.00 -1.26 -4.16 117.46 116.29 2vjj n PHE 461 Ca 0.13 0.28 -0.41 0.00 -0.00 0.00 0.00 57.45 57.45 2vjj n PHE 461 Cb 0.46 -2.53 -0.03 0.00 -0.00 0.00 0.00 39.48 37.38 2vjj n PHE 461 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.76 176.96 2vjj s GLY 462 N 1.99 2.63 -0.11 7.13 0.00 0.48 -4.27 107.32 115.16 2vjj s GLY 462 Ca 0.86 1.06 -0.29 0.00 0.00 0.00 0.00 44.72 46.35 2vjj s GLY 462 CO 0.46 1.94 0.68 0.00 0.00 0.00 0.00 173.10 176.18 2vjj s ALA 463 N -0.17 -1.74 -0.14 3.20 0.00 -0.78 -1.21 121.76 120.92 2vjj s ALA 463 Ca 0.54 1.50 -0.24 0.00 0.00 0.00 0.00 51.96 53.76 2vjj s ALA 463 Cb -0.35 -0.35 -0.21 0.00 0.00 0.00 0.00 23.12 22.20 2vjj s ALA 463 CO 0.39 -0.36 0.59 0.35 0.00 0.00 0.00 175.76 176.74 2vjj h PHE 464 N 3.64 0.00 -3.54 0.00 3.57 -1.16 -0.01 116.94 119.44 2vjj h PHE 464 Ca -0.28 0.00 -0.67 0.00 3.53 0.00 0.00 57.97 60.56 2vjj h PHE 464 Cb 1.15 0.00 -0.25 0.00 2.79 0.00 0.00 35.95 39.63 2vjj h PHE 464 CO 0.39 0.89 -0.76 0.42 -2.23 0.00 0.00 178.31 177.02 2vjj s ILE 465 N -2.14 3.10 -0.08 1.41 -1.09 -0.10 -0.94 121.20 121.35 2vjj s ILE 465 Ca -0.17 -0.67 0.05 0.00 -2.23 0.00 0.00 60.65 57.63 2vjj s ILE 465 Cb -0.02 -2.27 -0.00 0.00 -1.58 0.00 0.00 42.46 38.59 2vjj s ILE 465 CO 0.57 0.55 -0.23 -0.62 -1.23 0.00 0.00 174.94 173.98 2vjj s ASP 466 N -0.01 2.88 -0.57 3.58 2.15 -0.01 -1.07 116.67 123.62 2vjj s ASP 466 Ca -0.03 -0.50 -0.16 0.00 0.43 0.00 0.00 52.55 52.28 2vjj s ASP 466 Cb -0.14 -1.11 0.13 0.00 -0.30 0.00 0.00 42.92 41.51 2vjj s ASP 466 CO 0.04 0.17 0.55 -0.63 -0.17 0.00 0.00 175.17 175.13 2vjj s ILE 467 N 0.19 5.18 -0.12 4.11 -1.09 -0.19 -0.57 121.20 128.71 2vjj s ILE 467 Ca -0.12 -1.50 -0.15 0.00 -2.23 0.00 0.00 60.65 56.65 2vjj s ILE 467 Cb -0.16 -4.37 -0.05 0.00 -1.58 0.00 0.00 42.46 36.30 2vjj s ILE 467 CO 0.06 -0.92 0.35 -0.83 -1.23 0.00 0.00 174.94 172.37 2vjj s GLY 468 N 3.51 2.30 0.96 6.18 0.00 -0.71 -2.09 107.32 117.47 2vjj s GLY 468 Ca 0.05 -0.36 -0.11 0.00 0.00 0.00 0.00 44.72 44.31 2vjj s GLY 468 CO 0.03 0.41 1.11 -4.14 0.00 0.00 0.00 173.10 170.51 2vjj s PRO 469 N 0.12 0.70 1.17 2.90 0.02 -1.26 -4.69 135.00 133.96 2vjj s PRO 469 Ca 0.20 1.28 -0.20 0.00 0.02 0.00 0.00 61.00 62.30 2vjj s PRO 469 Cb -0.14 -1.71 0.29 0.00 0.02 0.00 0.00 34.50 32.96 2vjj s PRO 469 CO 0.07 -2.76 1.09 -0.40 -0.33 0.00 0.00 177.00 174.67 2vjj n ASP 470 N -4.30 -1.80 0.15 2.53 5.68 -0.54 -4.75 116.55 113.52 2vjj n ASP 470 Ca 0.09 -1.19 0.12 0.00 -0.50 0.00 0.00 54.79 53.31 2vjj n ASP 470 Cb 0.53 -0.98 0.55 0.00 -1.14 0.00 0.00 41.12 40.08 2vjj n ASP 470 CO 0.00 0.00 0.00 0.78 -1.33 0.00 0.00 177.20 176.65 2vjj h ASN 471 N -2.56 0.00 -0.33 -1.12 2.35 -1.95 0.86 115.58 112.82 2vjj h ASN 471 Ca -0.40 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.35 2vjj h ASN 471 Cb 1.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.58 2vjj h ASN 471 CO 0.27 0.00 0.00 -1.20 -1.65 0.00 0.00 177.43 174.85 2vjj n SER 472 N -2.30 3.38 0.00 5.81 7.64 -1.26 -4.97 113.62 121.92 2vjj n SER 472 Ca 0.01 -1.99 0.00 0.00 1.01 0.00 0.00 58.87 57.89 2vjj n SER 472 Cb 0.15 -0.21 0.00 0.00 -1.01 0.00 0.00 64.21 63.14 2vjj n SER 472 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2vjj n GLY 473 N 1.49 0.72 3.73 0.23 0.00 0.30 -5.04 105.19 106.61 2vjj n GLY 473 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2vjj n GLY 473 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vjj s ALA 474 N -2.52 3.51 -1.09 4.61 0.00 -1.26 -4.67 121.76 120.34 2vjj s ALA 474 Ca 0.00 1.05 0.12 0.00 0.00 0.00 0.00 51.96 53.12 2vjj s ALA 474 Cb 0.00 -3.48 0.28 0.00 0.00 0.00 0.00 23.12 19.92 2vjj s ALA 474 CO 0.00 -0.52 1.19 -1.13 0.00 0.00 0.00 175.76 175.31 2vjj n SER 475 N 3.21 2.79 -0.60 0.00 3.41 -1.26 -1.47 113.62 119.71 2vjj n SER 475 Ca 0.08 -1.90 0.06 0.00 -0.26 0.00 0.00 58.87 56.85 2vjj n SER 475 Cb 0.43 -0.20 0.12 0.00 -0.26 0.00 0.00 64.21 64.31 2vjj n SER 475 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2vjj n ASN 476 N 0.61 1.51 -0.11 4.04 6.94 -1.26 -1.08 115.26 125.92 2vjj n ASN 476 Ca 0.11 -3.03 0.01 0.00 -0.02 0.00 0.00 54.58 51.65 2vjj n ASN 476 Cb 0.41 -0.41 0.01 0.00 -2.36 0.00 0.00 39.78 37.43 2vjj n ASN 476 CO 0.00 0.00 0.00 1.33 -1.03 0.00 0.00 177.26 177.56 2vjj n VAL 477 N -0.75 0.08 -3.20 3.53 0.24 -1.26 -5.05 118.33 111.92 2vjj n VAL 477 Ca 0.13 -0.54 -0.38 0.00 -2.04 0.00 0.00 64.34 61.51 2vjj n VAL 477 Cb 0.76 1.01 -0.06 0.00 -1.47 0.00 0.00 33.84 34.08 2vjj n VAL 477 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 2vjj s GLN 478 N -0.28 4.25 -0.50 7.34 1.11 -1.25 -4.20 119.66 126.14 2vjj s GLN 478 Ca 0.03 0.81 0.04 0.00 0.01 0.00 0.00 55.36 56.24 2vjj s GLN 478 Cb 0.02 -3.15 0.16 0.00 -1.01 0.00 0.00 33.01 29.03 2vjj s GLN 478 CO 0.03 0.57 0.36 0.34 0.01 0.00 0.00 175.29 176.60 2vjj s ASP 479 N -1.27 2.88 -0.16 5.90 2.15 -1.26 -4.84 116.67 120.08 2vjj s ASP 479 Ca 0.33 -3.15 -0.01 0.00 0.43 0.00 0.00 52.55 50.15 2vjj s ASP 479 Cb -0.19 -0.88 -0.01 0.00 -0.30 0.00 0.00 42.92 41.54 2vjj s ASP 479 CO 0.21 -0.17 -0.13 -0.63 -0.17 0.00 0.00 175.17 174.28 2vjj s ILE 480 N -0.25 2.91 0.29 4.11 1.01 -1.26 -1.11 121.20 126.90 2vjj s ILE 480 Ca 0.27 -0.69 -0.20 0.00 0.00 0.00 0.00 60.65 60.03 2vjj s ILE 480 Cb -0.05 -2.24 0.03 0.00 0.01 0.00 0.00 42.46 40.20 2vjj s ILE 480 CO -0.14 0.50 0.74 0.00 0.00 0.00 0.00 174.94 176.04 2vjj s GLN 481 N 0.76 1.84 -1.21 2.79 -2.07 -0.55 -0.68 119.66 120.55 2vjj s GLN 481 Ca -0.05 -1.05 -0.15 0.00 -1.82 0.00 0.00 55.36 52.29 2vjj s GLN 481 Cb -0.15 0.61 -0.01 0.00 -1.09 0.00 0.00 33.01 32.37 2vjj s GLN 481 CO 0.01 -0.85 0.71 0.54 -1.32 0.00 0.00 175.29 174.38 2vjj n ARG 482 N -0.47 -1.95 -4.51 9.60 1.74 -1.25 -3.20 116.66 116.62 2vjj n ARG 482 Ca -0.05 0.45 -0.33 0.00 -0.77 0.00 0.00 57.85 57.15 2vjj n ARG 482 Cb 0.59 -4.28 -0.14 0.00 -1.02 0.00 0.00 32.46 27.61 2vjj n ARG 482 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2vjj s VAL 483 N -3.59 3.32 -0.20 1.55 1.01 -1.26 -1.05 120.40 120.18 2vjj s VAL 483 Ca 0.34 -0.55 -0.02 0.00 0.00 0.00 0.00 61.98 61.74 2vjj s VAL 483 Cb -0.12 -2.43 0.00 0.00 0.00 0.00 0.00 36.38 33.83 2vjj s VAL 483 CO 0.86 0.50 -0.10 -0.22 0.00 0.00 0.00 175.10 176.14 2vjj s LEU 484 N 0.58 2.63 -0.30 3.92 2.96 -0.19 -0.35 118.68 127.92 2vjj s LEU 484 Ca -0.06 -0.47 -0.00 0.00 -0.22 0.00 0.00 54.13 53.38 2vjj s LEU 484 Cb -0.15 -1.64 0.06 0.00 0.50 0.00 0.00 46.19 44.95 2vjj s LEU 484 CO 0.03 -0.00 -0.01 -0.69 -1.32 0.00 0.00 176.35 174.36 2vjj s VAL 485 N 1.34 2.76 -0.04 1.68 1.01 0.46 -0.78 120.40 126.83 2vjj s VAL 485 Ca 0.04 -1.57 -0.08 0.00 0.00 0.00 0.00 61.98 60.37 2vjj s VAL 485 Cb -0.14 -2.65 0.01 0.00 0.00 0.00 0.00 36.38 33.60 2vjj s VAL 485 CO -0.06 -0.17 0.20 0.28 0.00 0.00 0.00 175.10 175.35 2vjj s THR 486 N 1.18 0.04 -1.46 3.92 -1.32 -0.60 -1.66 115.64 115.74 2vjj s THR 486 Ca -0.04 -0.30 -0.07 0.00 -1.21 0.00 0.00 61.69 60.06 2vjj s THR 486 Cb -0.20 -0.39 0.02 0.00 -1.51 0.00 0.00 72.50 70.42 2vjj s THR 486 CO -0.03 -0.17 0.89 0.61 -2.21 0.00 0.00 174.62 173.72 2vjj n GLY 487 N 2.22 -0.53 3.73 6.08 0.00 -0.72 -3.29 105.19 112.68 2vjj n GLY 487 Ca -0.17 0.19 -0.24 0.00 0.00 0.00 0.00 46.02 45.80 2vjj n GLY 487 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2vjj s ASN 488 N -3.02 5.06 -0.09 1.61 0.01 -1.26 -1.89 114.94 115.35 2vjj s ASN 488 Ca 0.46 -0.37 0.04 0.00 -0.71 0.00 0.00 52.86 52.28 2vjj s ASN 488 Cb -0.21 -1.16 0.00 0.00 0.41 0.00 0.00 41.25 40.30 2vjj s ASN 488 CO 0.57 0.02 -0.22 -0.55 -1.51 0.00 0.00 177.10 175.41 2vjj s SER 489 N -3.43 2.88 -0.04 -1.22 0.15 -0.35 -0.96 113.70 110.73 2vjj s SER 489 Ca 0.31 -0.52 0.03 0.00 0.70 0.00 0.00 55.95 56.47 2vjj s SER 489 Cb -0.08 -1.27 0.00 0.00 -1.71 0.00 0.00 66.02 62.96 2vjj s SER 489 CO 0.22 0.15 -0.13 0.12 1.20 0.00 0.00 173.24 174.79 2vjj s PHE 490 N 0.35 1.37 -0.02 3.44 5.36 -0.29 -1.44 117.98 126.75 2vjj s PHE 490 Ca -0.17 -0.41 0.02 0.00 -0.96 0.00 0.00 56.93 55.41 2vjj s PHE 490 Cb -0.17 -0.97 0.00 0.00 -0.34 0.00 0.00 43.02 41.54 2vjj s PHE 490 CO 0.08 -0.17 -0.07 -0.47 -1.46 0.00 0.00 175.22 173.12 2vjj s TYR 491 N 0.28 0.76 -0.04 10.12 5.04 -0.74 -0.80 117.35 131.97 2vjj s TYR 491 Ca -0.07 -0.17 0.02 0.00 -2.44 0.00 0.00 57.07 54.42 2vjj s TYR 491 Cb -0.12 -0.54 0.01 0.00 0.35 0.00 0.00 41.96 41.66 2vjj s TYR 491 CO 0.02 -0.07 -0.10 0.00 -1.34 0.00 0.00 175.55 174.06 2vjj s ALA 492 N 0.11 1.01 0.45 3.97 0.00 -0.41 -1.17 121.76 125.70 2vjj s ALA 492 Ca -0.01 -0.35 -0.22 0.00 0.00 0.00 0.00 51.96 51.38 2vjj s ALA 492 Cb -0.06 -0.42 -0.12 0.00 0.00 0.00 0.00 23.12 22.52 2vjj s ALA 492 CO 0.00 0.13 0.52 -2.30 0.00 0.00 0.00 175.76 174.11 2vjj n PRO 493 N 3.51 0.55 -0.17 0.00 -0.02 -1.26 -4.63 135.00 132.98 2vjj n PRO 493 Ca -0.20 0.20 0.28 0.00 -2.02 0.00 0.00 63.50 61.75 2vjj n PRO 493 Cb 0.53 -1.52 0.71 0.00 -0.02 0.00 0.00 33.50 33.20 2vjj n PRO 493 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2vjj h ALA 494 N 0.69 2.80 0.00 3.55 0.00 -1.96 -0.75 119.26 123.59 2vjj h ALA 494 Ca -0.41 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2vjj h ALA 494 Cb 1.40 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.25 2vjj h ALA 494 CO 0.50 -1.05 0.00 -2.95 0.00 0.00 0.00 179.25 175.75 2vjj h ASN 495 N 0.02 0.00 -1.56 0.00 -1.07 -1.92 -3.43 115.58 107.62 2vjj h ASN 495 Ca 0.42 0.00 -0.65 0.00 0.07 0.00 0.00 56.30 56.14 2vjj h ASN 495 Cb 1.64 0.00 -0.13 0.00 -2.07 0.00 0.00 38.32 37.76 2vjj h ASN 495 CO -0.01 0.00 1.36 -0.63 0.07 0.00 0.00 177.43 178.21 2vjj s ILE 496 N -3.19 4.27 0.23 6.14 1.01 -0.29 -4.27 121.20 125.10 2vjj s ILE 496 Ca 0.08 -1.26 -0.06 0.00 0.00 0.00 0.00 60.65 59.41 2vjj s ILE 496 Cb 0.10 -4.98 0.19 0.00 0.01 0.00 0.00 42.46 37.78 2vjj s ILE 496 CO 0.58 -1.79 1.76 0.74 0.00 0.00 0.00 174.94 176.22 2vjj h THR 497 N 6.23 0.77 -0.92 2.92 2.02 -1.86 -3.23 112.91 118.84 2vjj h THR 497 Ca 0.22 -0.18 -0.73 0.00 0.77 0.00 0.00 66.41 66.49 2vjj h THR 497 Cb 0.99 0.20 -0.11 0.00 -1.74 0.00 0.00 68.15 67.49 2vjj h THR 497 CO 1.32 0.10 2.37 -0.90 0.37 0.00 0.00 175.52 178.77 2vjj n ASP 498 N -4.93 4.65 -3.76 4.18 5.75 -1.26 -4.73 116.55 116.46 2vjj n ASP 498 Ca 0.12 -2.98 -0.13 0.00 -0.01 0.00 0.00 54.79 51.79 2vjj n ASP 498 Cb 0.33 -1.58 -0.14 0.00 -1.03 0.00 0.00 41.12 38.69 2vjj n ASP 498 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2vjj s SER 499 N 2.31 -0.11 -0.00 -1.12 1.04 -1.22 -0.39 113.70 114.20 2vjj s SER 499 Ca 0.44 0.30 -0.06 0.00 0.48 0.00 0.00 55.95 57.11 2vjj s SER 499 Cb 0.09 0.20 0.00 0.00 0.10 0.00 0.00 66.02 66.41 2vjj s SER 499 CO -0.02 -0.13 0.12 0.00 0.98 0.00 0.00 173.24 174.18 2vjj s ALA 500 N 1.00 -0.27 0.15 5.32 0.00 -0.35 -0.87 121.76 126.74 2vjj s ALA 500 Ca -0.08 -0.12 -0.14 0.00 0.00 0.00 0.00 51.96 51.62 2vjj s ALA 500 Cb -0.10 0.07 0.02 0.00 0.00 0.00 0.00 23.12 23.11 2vjj s ALA 500 CO -0.05 -0.18 1.70 0.00 0.00 0.00 0.00 175.76 177.23 2vjj h ALA 501 N 4.56 0.61 -3.33 0.00 0.00 -0.67 -1.80 119.26 118.63 2vjj h ALA 501 Ca -0.30 -0.14 -0.31 0.00 0.00 0.00 0.00 54.91 54.16 2vjj h ALA 501 Cb 1.20 -0.18 -0.35 0.00 0.00 0.00 0.00 17.79 18.45 2vjj h ALA 501 CO 0.41 0.21 -0.69 -1.50 0.00 0.00 0.00 179.25 177.68 2vjj s ILE 502 N -5.58 -0.11 -0.40 0.00 2.07 -0.27 -0.93 121.20 115.98 2vjj s ILE 502 Ca -0.13 0.29 -0.17 0.00 -1.41 0.00 0.00 60.65 59.23 2vjj s ILE 502 Cb 0.11 -0.17 0.01 0.00 0.13 0.00 0.00 42.46 42.55 2vjj s ILE 502 CO 0.77 0.12 0.45 0.42 -1.91 0.00 0.00 174.94 174.79 2vjj s THR 503 N 1.61 5.07 -0.82 4.00 -4.23 -0.24 -1.73 115.64 119.31 2vjj s THR 503 Ca -0.03 -0.19 -0.09 0.00 -1.18 0.00 0.00 61.69 60.19 2vjj s THR 503 Cb -0.12 -4.02 0.21 0.00 1.34 0.00 0.00 72.50 69.91 2vjj s THR 503 CO -0.04 -0.37 0.73 -0.22 -0.54 0.00 0.00 174.62 174.17 2vjj s LEU 504 N 2.20 6.22 0.00 4.79 0.20 -0.13 -1.02 118.68 130.94 2vjj s LEU 504 Ca 0.14 -2.94 0.16 0.00 0.69 0.00 0.00 54.13 52.17 2vjj s LEU 504 Cb -0.17 -2.09 -0.07 0.00 -0.43 0.00 0.00 46.19 43.44 2vjj s LEU 504 CO 0.14 -0.45 0.77 0.54 -0.29 0.00 0.00 176.35 177.06 2vjj n ARG 505 N 3.54 1.81 -4.09 1.98 1.74 -0.89 -4.60 116.66 116.16 2vjj n ARG 505 Ca 0.14 -0.50 -0.10 0.00 -0.77 0.00 0.00 57.85 56.62 2vjj n ARG 505 Cb 0.43 -1.25 -0.08 0.00 -1.02 0.00 0.00 32.46 30.54 2vjj n ARG 505 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2vjj s ALA 506 N -2.09 0.53 0.22 7.54 0.00 -1.14 -4.67 121.76 122.16 2vjj s ALA 506 Ca 0.10 -1.28 -0.31 0.00 0.00 0.00 0.00 51.96 50.48 2vjj s ALA 506 Cb 0.12 1.05 -0.15 0.00 0.00 0.00 0.00 23.12 24.15 2vjj s ALA 506 CO 0.48 -0.62 1.17 0.09 0.00 0.00 0.00 175.76 176.89 2vjj n ASN 507 N -0.23 1.65 -3.91 0.00 4.13 -0.24 -4.75 115.26 111.91 2vjj n ASN 507 Ca -0.03 1.15 -0.24 0.00 1.68 0.00 0.00 54.58 57.14 2vjj n ASN 507 Cb 0.64 -1.28 -0.17 0.00 -1.54 0.00 0.00 39.78 37.43 2vjj n ASN 507 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2vjj s LEU 508 N 0.46 1.23 0.00 3.41 2.96 -0.54 -4.70 118.68 121.49 2vjj s LEU 508 Ca 0.68 -0.23 0.24 0.00 -0.22 0.00 0.00 54.13 54.59 2vjj s LEU 508 Cb -0.76 -0.70 0.21 0.00 0.50 0.00 0.00 46.19 45.43 2vjj s LEU 508 CO 0.54 -0.08 1.23 0.59 -1.32 0.00 0.00 176.35 177.31 2vjj n ASN 509 N 4.53 2.01 0.00 3.68 3.02 0.14 -0.48 115.26 128.16 2vjj n ASN 509 Ca -0.16 -1.50 0.00 0.00 -0.03 0.00 0.00 54.58 52.89 2vjj n ASN 509 Cb 0.51 0.32 0.00 0.00 -0.61 0.00 0.00 39.78 39.99 2vjj n ASN 509 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2vjj n GLY 510 N 1.38 2.60 3.55 7.41 0.00 -0.65 -4.35 105.19 115.13 2vjj n GLY 510 Ca 0.11 -0.07 -0.12 0.00 0.00 0.00 0.00 46.02 45.94 2vjj n GLY 510 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vjj s THR 512 N 0.62 1.81 -0.22 0.00 2.01 0.53 -0.84 115.64 119.55 2vjj s THR 512 Ca -0.02 -0.82 -0.04 0.00 0.31 0.00 0.00 61.69 61.12 2vjj s THR 512 Cb -0.05 -1.63 -0.01 0.00 0.01 0.00 0.00 72.50 70.82 2vjj s THR 512 CO -0.03 0.50 -0.03 -0.36 -0.69 0.00 0.00 174.62 174.00 2vjj s PHE 513 N 1.03 2.97 -0.02 4.92 0.40 0.11 -0.41 117.98 126.98 2vjj s PHE 513 Ca -0.04 -0.84 0.01 0.00 -0.60 0.00 0.00 56.93 55.47 2vjj s PHE 513 Cb -0.15 -2.10 0.01 0.00 0.51 0.00 0.00 43.02 41.29 2vjj s PHE 513 CO -0.05 -0.49 -0.04 0.42 0.70 0.00 0.00 175.22 175.76 2vjj s ILE 514 N 1.39 0.43 -1.42 0.64 1.01 -0.66 -1.80 121.20 120.79 2vjj s ILE 514 Ca 0.05 -0.15 -0.08 0.00 0.00 0.00 0.00 60.65 60.47 2vjj s ILE 514 Cb -0.14 -0.42 0.04 0.00 0.01 0.00 0.00 42.46 41.95 2vjj s ILE 514 CO -0.02 0.16 0.94 0.00 0.00 0.00 0.00 174.94 176.03 2vjj n ALA 515 N 3.51 -1.54 -2.74 9.38 0.00 -1.25 -2.94 120.51 124.93 2vjj n ALA 515 Ca -0.20 0.11 -0.21 0.00 0.00 0.00 0.00 53.44 53.15 2vjj n ALA 515 Cb 0.54 -3.82 -0.02 0.00 0.00 0.00 0.00 19.45 16.14 2vjj n ALA 515 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2vjj s ASN 516 N -3.68 5.89 -0.29 0.00 0.01 -1.26 -1.75 114.94 113.86 2vjj s ASN 516 Ca 0.42 -0.16 -0.01 0.00 -0.71 0.00 0.00 52.86 52.40 2vjj s ASN 516 Cb -0.21 -1.46 0.05 0.00 0.41 0.00 0.00 41.25 40.04 2vjj s ASN 516 CO 0.80 -0.19 -0.02 0.21 -1.51 0.00 0.00 177.10 176.39 2vjj s ASN 517 N -4.00 4.78 -0.23 -1.22 3.04 -0.13 -0.82 114.94 116.36 2vjj s ASN 517 Ca 0.37 -1.23 -0.03 0.00 0.04 0.00 0.00 52.86 52.01 2vjj s ASN 517 Cb -0.08 -1.69 -0.00 0.00 -1.54 0.00 0.00 41.25 37.93 2vjj s ASN 517 CO 0.28 -0.24 -0.05 -0.36 -3.04 0.00 0.00 177.10 173.70 2vjj s PHE 518 N 1.25 2.97 -0.49 0.43 0.08 -0.38 -1.14 117.98 120.70 2vjj s PHE 518 Ca -0.05 -1.07 0.03 0.00 0.12 0.00 0.00 56.93 55.96 2vjj s PHE 518 Cb -0.19 -2.10 0.15 0.00 -0.57 0.00 0.00 43.02 40.30 2vjj s PHE 518 CO -0.02 -0.59 0.30 0.34 -0.10 0.00 0.00 175.22 175.15 2vjj s ASP 519 N 1.45 3.64 0.34 1.36 2.15 0.02 -1.36 116.67 124.27 2vjj s ASP 519 Ca 0.05 -2.94 -0.11 0.00 0.43 0.00 0.00 52.55 49.98 2vjj s ASP 519 Cb -0.15 -1.12 0.04 0.00 -0.30 0.00 0.00 42.92 41.39 2vjj s ASP 519 CO -0.04 -0.22 0.64 0.00 -0.17 0.00 0.00 175.17 175.39 2vjj h ARG 521 N 0.00 -0.18 -6.58 0.00 9.65 -1.74 -3.43 114.38 112.09 2vjj h ARG 521 Ca -0.28 0.01 -0.67 0.00 -1.10 0.00 0.00 59.98 57.94 2vjj h ARG 521 Cb 1.07 0.04 -0.17 0.00 -1.39 0.00 0.00 29.97 29.52 2vjj h ARG 521 CO 0.36 0.12 -0.76 0.71 2.80 0.00 0.00 179.97 183.20 2vjj s TYR 522 N -4.91 2.67 -0.05 2.20 2.02 -0.05 -4.85 117.35 114.40 2vjj s TYR 522 Ca -0.15 -0.19 -0.03 0.00 -0.37 0.00 0.00 57.07 56.34 2vjj s TYR 522 Cb 0.03 -1.43 -0.01 0.00 -0.40 0.00 0.00 41.96 40.15 2vjj s TYR 522 CO 0.62 0.39 -0.05 0.52 -1.57 0.00 0.00 175.55 175.46 2vjj h MET 523 N 3.83 0.00 -5.37 -0.62 2.86 -1.29 -1.03 114.93 113.32 2vjj h MET 523 Ca -0.49 0.00 -0.65 0.00 -2.06 0.00 0.00 59.70 56.50 2vjj h MET 523 Cb 1.17 0.00 -0.25 0.00 0.06 0.00 0.00 31.60 32.58 2vjj h MET 523 CO 0.50 0.00 -0.73 0.08 1.06 0.00 0.00 176.91 177.82 2vjj s VAL 524 N -1.40 3.37 -0.05 -2.22 1.01 -1.23 -1.11 120.40 118.77 2vjj s VAL 524 Ca -0.04 -0.55 -0.09 0.00 0.00 0.00 0.00 61.98 61.30 2vjj s VAL 524 Cb 0.01 -2.44 0.02 0.00 0.00 0.00 0.00 36.38 33.97 2vjj s VAL 524 CO 0.06 0.52 0.22 -0.47 0.00 0.00 0.00 175.10 175.44 2vjj s TYR 525 N 0.27 -0.17 -0.06 5.22 5.04 -0.70 -0.74 117.35 126.21 2vjj s TYR 525 Ca -0.07 0.37 -0.08 0.00 -2.44 0.00 0.00 57.07 54.86 2vjj s TYR 525 Cb -0.15 0.06 0.02 0.00 0.35 0.00 0.00 41.96 42.23 2vjj s TYR 525 CO 0.04 -0.21 0.20 1.21 -1.34 0.00 0.00 175.55 175.45 2vjj s ASN 526 N -0.52 -0.18 0.17 4.32 2.47 -1.24 -0.96 114.94 119.01 2vjj s ASN 526 Ca -0.06 0.31 -0.30 0.00 0.42 0.00 0.00 52.86 53.23 2vjj s ASN 526 Cb -0.04 0.39 -0.08 0.00 -1.45 0.00 0.00 41.25 40.07 2vjj s ASN 526 CO 0.01 -0.13 1.30 0.00 -3.72 0.00 0.00 177.10 174.56 2vjj s ALA 527 N -0.17 3.51 0.61 1.71 0.00 -1.26 -4.53 121.76 121.63 2vjj s ALA 527 Ca -0.03 1.06 -0.18 0.00 0.00 0.00 0.00 51.96 52.82 2vjj s ALA 527 Cb -0.03 -3.48 -0.02 0.00 0.00 0.00 0.00 23.12 19.59 2vjj s ALA 527 CO 0.01 -0.52 1.18 -1.25 0.00 0.00 0.00 175.76 175.18 2vjj s PRO 528 N 0.18 2.90 -1.08 0.00 0.04 -1.26 -3.33 135.00 132.45 2vjj s PRO 528 Ca 0.58 1.73 -0.00 0.00 0.04 0.00 0.00 61.00 63.34 2vjj s PRO 528 Cb -0.35 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.26 2vjj s PRO 528 CO 0.36 -1.24 0.03 0.41 0.04 0.00 0.00 177.00 176.60 2vjj n GLY 529 N 0.31 -0.15 0.00 0.56 0.00 -1.26 -4.95 105.19 99.70 2vjj n GLY 529 Ca 0.13 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.81 2vjj n GLY 529 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2vjj n THR 530 N -4.01 0.00 -2.46 2.61 -2.24 -1.21 -5.13 114.28 101.84 2vjj n THR 530 Ca -0.15 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.36 2vjj n THR 530 Cb 0.61 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.85 2vjj n THR 530 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2vjj s THR 531 N 2.44 4.39 -0.59 4.28 -4.23 -1.26 -5.05 115.64 115.63 2vjj s THR 531 Ca 0.00 0.19 0.05 0.00 -1.18 0.00 0.00 61.69 60.75 2vjj s THR 531 Cb 0.00 -3.70 0.20 0.00 1.34 0.00 0.00 72.50 70.33 2vjj s THR 531 CO 0.00 -0.73 0.52 -1.20 -0.54 0.00 0.00 174.62 172.67 2vjj n SER 532 N -2.44 2.08 -4.73 3.99 7.64 -1.26 -4.82 113.62 114.08 2vjj n SER 532 Ca 0.03 -3.02 -0.40 0.00 1.01 0.00 0.00 58.87 56.49 2vjj n SER 532 Cb 0.56 -0.68 0.03 0.00 -1.01 0.00 0.00 64.21 63.11 2vjj n SER 532 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 2vjj n PRO 533 N 1.84 1.89 -3.14 1.43 -0.02 -1.26 -3.83 135.00 131.91 2vjj n PRO 533 Ca 0.25 0.68 -0.41 0.00 -2.02 0.00 0.00 63.50 62.00 2vjj n PRO 533 Cb 0.41 -2.51 -0.07 0.00 -0.02 0.00 0.00 33.50 31.31 2vjj n PRO 533 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2vjj s VAL 534 N -1.24 4.98 -0.15 -1.45 1.01 -1.26 -0.64 120.40 121.64 2vjj s VAL 534 Ca 0.65 0.91 -0.01 0.00 0.00 0.00 0.00 61.98 63.54 2vjj s VAL 534 Cb -0.45 -3.94 -0.01 0.00 0.00 0.00 0.00 36.38 31.97 2vjj s VAL 534 CO 0.54 -0.05 -0.12 -0.69 0.00 0.00 0.00 175.10 174.79 2vjj s VAL 535 N 2.51 3.05 0.02 2.92 1.01 0.04 -1.47 120.40 128.48 2vjj s VAL 535 Ca 0.24 -0.64 0.04 0.00 0.00 0.00 0.00 61.98 61.62 2vjj s VAL 535 Cb -0.15 -2.31 -0.02 0.00 0.00 0.00 0.00 36.38 33.90 2vjj s VAL 535 CO 0.10 0.50 -0.12 -1.10 0.00 0.00 0.00 175.10 174.48 2vjj s GLN 536 N 0.68 0.87 -1.42 2.72 -0.21 0.36 -1.57 119.66 121.08 2vjj s GLN 536 Ca -0.06 -0.64 -0.05 0.00 0.02 0.00 0.00 55.36 54.63 2vjj s GLN 536 Cb -0.15 -0.84 0.01 0.00 1.00 0.00 0.00 33.01 33.02 2vjj s GLN 536 CO 0.02 0.21 0.67 0.09 -2.12 0.00 0.00 175.29 174.16 2vjj n ASN 537 N 2.15 -5.90 -4.64 5.90 3.02 -0.91 -2.36 115.26 112.51 2vjj n ASN 537 Ca -0.17 -0.31 -0.42 0.00 -0.03 0.00 0.00 54.58 53.65 2vjj n ASN 537 Cb 0.55 -4.69 -0.05 0.00 -0.61 0.00 0.00 39.78 34.99 2vjj n ASN 537 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2vjj s LEU 538 N -6.38 4.08 -0.20 3.41 2.96 -1.26 -1.99 118.68 119.30 2vjj s LEU 538 Ca 0.33 1.00 0.01 0.00 -0.22 0.00 0.00 54.13 55.25 2vjj s LEU 538 Cb -0.15 -3.14 0.03 0.00 0.50 0.00 0.00 46.19 43.44 2vjj s LEU 538 CO 0.41 -0.49 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.11 2vjj s VAL 539 N 2.74 1.97 -0.43 1.68 1.01 -0.02 -0.49 120.40 126.87 2vjj s VAL 539 Ca 0.34 -1.11 -0.02 0.00 0.00 0.00 0.00 61.98 61.18 2vjj s VAL 539 Cb -0.15 -1.92 0.12 0.00 0.00 0.00 0.00 36.38 34.43 2vjj s VAL 539 CO 0.08 0.31 0.21 0.86 0.00 0.00 0.00 175.10 176.57 2vjj s TRP 540 N 1.27 3.58 0.59 5.22 -0.11 0.57 0.06 118.94 130.12 2vjj s TRP 540 Ca 0.00 -2.53 -0.17 0.00 1.22 0.00 0.00 56.10 54.62 2vjj s TRP 540 Cb -0.15 -3.18 -0.03 0.00 -1.50 0.00 0.00 33.47 28.60 2vjj s TRP 540 CO -0.10 -0.95 1.11 0.34 -4.62 0.00 0.00 176.95 172.73 2vjj s ASP 541 N 1.56 5.50 0.62 5.86 2.15 -0.74 -1.49 116.67 130.12 2vjj s ASP 541 Ca 0.10 2.06 0.38 0.00 0.43 0.00 0.00 52.55 55.52 2vjj s ASP 541 Cb -0.22 -2.56 2.01 0.00 -0.30 0.00 0.00 42.92 41.85 2vjj s ASP 541 CO -0.04 -1.36 2.24 0.50 -0.17 0.00 0.00 175.17 176.33 2vjj h LYS 542 N 0.67 0.00 0.00 4.34 3.64 -1.90 -2.61 116.57 120.71 2vjj h LYS 542 Ca -0.48 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 2vjj h LYS 542 Cb 1.25 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 2vjj h LYS 542 CO 0.56 0.02 0.00 -1.13 -2.27 0.00 0.00 179.45 176.63 2vjj n SER 543 N -3.24 0.00 -4.67 4.20 3.41 -1.26 -4.69 113.62 107.36 2vjj n SER 543 Ca -0.02 0.34 -0.43 0.00 -0.26 0.00 0.00 58.87 58.50 2vjj n SER 543 Cb 0.14 -0.42 -0.02 0.00 -0.26 0.00 0.00 64.21 63.65 2vjj n SER 543 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2vjj s ASN 544 N -2.84 6.98 -0.20 4.04 0.01 -0.98 -3.85 114.94 118.10 2vjj s ASN 544 Ca 0.10 1.78 -0.17 0.00 -0.71 0.00 0.00 52.86 53.86 2vjj s ASN 544 Cb 0.10 -2.55 -0.04 0.00 0.41 0.00 0.00 41.25 39.18 2vjj s ASN 544 CO 0.26 -0.68 0.44 -0.69 -1.51 0.00 0.00 177.10 174.92 2vjj s VAL 545 N 2.87 5.17 -0.32 1.60 1.01 -0.00 -4.72 120.40 126.00 2vjj s VAL 545 Ca 0.56 0.80 -0.13 0.00 0.00 0.00 0.00 61.98 63.20 2vjj s VAL 545 Cb -0.24 -3.77 -0.02 0.00 0.00 0.00 0.00 36.38 32.35 2vjj s VAL 545 CO 0.19 0.23 0.28 -0.63 0.00 0.00 0.00 175.10 175.17 2vjj s ILE 546 N 1.41 5.24 1.00 2.22 1.01 -1.26 -1.24 121.20 129.59 2vjj s ILE 546 Ca 0.21 0.01 -0.16 0.00 0.00 0.00 0.00 60.65 60.71 2vjj s ILE 546 Cb -0.15 -3.72 0.20 0.00 0.01 0.00 0.00 42.46 38.80 2vjj s ILE 546 CO 0.09 0.02 1.21 -0.83 0.00 0.00 0.00 174.94 175.43 2vjj s GLY 547 N 1.73 1.66 -0.00 6.18 0.00 -0.46 -3.94 107.32 112.48 2vjj s GLY 547 Ca 0.09 -0.91 0.03 0.00 0.00 0.00 0.00 44.72 43.92 2vjj s GLY 547 CO 0.11 -0.19 1.06 0.61 0.00 0.00 0.00 173.10 174.69 2vjj n GLY 548 N -2.56 2.95 0.36 0.20 0.00 -1.26 -4.69 105.19 100.19 2vjj n GLY 548 Ca 0.12 -0.10 0.10 0.00 0.00 0.00 0.00 46.02 46.14 2vjj n GLY 548 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2vjj h THR 549 N 0.49 0.92 -0.40 2.61 2.02 -1.93 -2.05 112.91 114.57 2vjj h THR 549 Ca 0.00 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 66.98 2vjj h THR 549 Cb 0.56 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 67.25 2vjj h THR 549 CO 0.00 0.11 0.00 1.41 0.37 0.00 0.00 175.52 177.41 2vjj n HIS 550 N -4.49 0.52 -1.69 3.16 -0.00 -1.26 -4.55 115.22 106.91 2vjj n HIS 550 Ca 0.12 -0.26 -0.43 0.00 -0.00 0.00 0.00 57.72 57.16 2vjj n HIS 550 Cb 0.36 0.00 -0.01 0.00 -0.00 0.00 0.00 29.99 30.34 2vjj n HIS 550 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2vjj n ALA 551 N 1.19 1.13 -0.89 -1.41 0.00 -0.77 -1.58 120.51 118.17 2vjj n ALA 551 Ca 0.19 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.99 2vjj n ALA 551 Cb 0.52 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.74 2vjj n ALA 551 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2vjj n ASN 552 N 0.80 -1.15 -0.61 0.00 3.02 -1.26 -4.84 115.26 111.21 2vjj n ASN 552 Ca 0.05 0.00 0.08 0.00 -0.03 0.00 0.00 54.58 54.68 2vjj n ASN 552 Cb 0.36 -0.95 0.06 0.00 -0.61 0.00 0.00 39.78 38.64 2vjj n ASN 552 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2vjj n GLN 553 N -1.94 1.24 -0.94 3.52 1.13 -0.61 -4.72 117.38 115.05 2vjj n GLN 553 Ca 0.00 -1.39 -0.02 0.00 -1.94 0.00 0.00 57.00 53.64 2vjj n GLN 553 Cb 0.04 -1.30 0.31 0.00 0.11 0.00 0.00 30.24 29.41 2vjj n GLN 553 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2vjj n ARG 554 N 0.81 3.75 -1.64 -1.09 1.74 -1.26 -4.99 116.66 113.99 2vjj n ARG 554 Ca 0.09 -3.09 -0.51 0.00 -0.77 0.00 0.00 57.85 53.57 2vjj n ARG 554 Cb 0.39 -2.17 -0.05 0.00 -1.02 0.00 0.00 32.46 29.60 2vjj n ARG 554 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2vjj n ALA 555 N -0.12 0.05 -0.96 7.54 0.00 -1.18 -0.88 120.51 124.97 2vjj n ALA 555 Ca 0.37 0.45 0.00 0.00 0.00 0.00 0.00 53.44 54.26 2vjj n ALA 555 Cb 1.30 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 18.52 2vjj n ALA 555 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2vjj n GLY 556 N 3.23 0.63 3.50 0.00 0.00 -1.26 -4.94 105.19 106.36 2vjj n GLY 556 Ca 0.20 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.93 2vjj n GLY 556 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2vjj s GLN 557 N -0.24 1.82 -0.20 1.61 -0.21 -0.06 -4.81 119.66 117.57 2vjj s GLN 557 Ca 0.00 -1.24 -0.05 0.00 0.02 0.00 0.00 55.36 54.09 2vjj s GLN 557 Cb 0.00 -2.09 -0.02 0.00 1.00 0.00 0.00 33.01 31.89 2vjj s GLN 557 CO 0.00 0.46 -0.02 -0.80 -2.12 0.00 0.00 175.29 172.81 2vjj s ASN 558 N -2.38 4.68 0.15 5.90 0.02 -1.26 -0.48 114.94 121.58 2vjj s ASN 558 Ca 0.20 -0.24 -0.16 0.00 -1.02 0.00 0.00 52.86 51.63 2vjj s ASN 558 Cb -0.10 -1.80 0.05 0.00 0.02 0.00 0.00 41.25 39.42 2vjj s ASN 558 CO 0.11 0.05 1.76 0.25 0.02 0.00 0.00 177.10 179.30 2vjj h LEU 559 N 7.57 0.21 -8.20 0.60 5.85 -1.38 -3.29 115.31 116.67 2vjj h LEU 559 Ca -0.36 0.03 -0.69 0.00 0.84 0.00 0.00 57.88 57.69 2vjj h LEU 559 Cb 1.18 -0.01 -0.29 0.00 0.37 0.00 0.00 40.66 41.91 2vjj h LEU 559 CO 0.60 0.16 -0.61 -0.36 -0.34 0.00 0.00 178.44 177.89 2vjj s PHE 560 N -6.16 3.25 -0.49 1.25 0.40 -0.02 -0.82 117.98 115.39 2vjj s PHE 560 Ca -0.13 -1.43 -0.04 0.00 -0.60 0.00 0.00 56.93 54.73 2vjj s PHE 560 Cb 0.12 -2.27 0.13 0.00 0.51 0.00 0.00 43.02 41.51 2vjj s PHE 560 CO 0.71 -0.73 0.31 0.34 0.70 0.00 0.00 175.22 176.56 2vjj s ASP 561 N 1.40 5.38 -1.31 1.36 -1.08 0.08 -1.46 116.67 121.04 2vjj s ASP 561 Ca -0.02 -2.25 -0.08 0.00 -0.52 0.00 0.00 52.55 49.68 2vjj s ASP 561 Cb -0.19 -1.88 0.14 0.00 -1.46 0.00 0.00 42.92 39.52 2vjj s ASP 561 CO 0.03 -0.53 2.12 0.23 0.52 0.00 0.00 175.17 177.54 2vjj n MET 562 N 4.34 3.98 -2.26 4.34 2.81 -0.59 -3.62 117.12 126.12 2vjj n MET 562 Ca -0.00 -3.43 -0.43 0.00 -1.81 0.00 0.00 57.70 52.03 2vjj n MET 562 Cb 0.40 -2.82 0.00 0.00 -0.71 0.00 0.00 33.22 30.10 2vjj n MET 562 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 2vjj n GLN 563 N 3.08 3.41 -4.34 0.03 1.13 -1.26 -4.36 117.38 115.07 2vjj n GLN 563 Ca 0.50 -3.33 -0.18 0.00 -1.94 0.00 0.00 57.00 52.05 2vjj n GLN 563 Cb 0.31 -3.04 -0.10 0.00 0.11 0.00 0.00 30.24 27.52 2vjj n GLN 563 CO 0.00 0.00 0.00 -0.06 -1.44 0.00 0.00 177.06 175.56 2vjj s PHE 564 N 1.29 1.62 0.11 1.08 0.08 -1.26 -4.55 117.98 116.35 2vjj s PHE 564 Ca 0.42 -0.76 -0.13 0.00 0.12 0.00 0.00 56.93 56.59 2vjj s PHE 564 Cb 0.09 -0.88 -0.12 0.00 -0.57 0.00 0.00 43.02 41.54 2vjj s PHE 564 CO -0.01 0.15 1.35 0.00 -0.10 0.00 0.00 175.22 176.61 2vjj h ALA 565 N 2.51 0.38 -2.01 5.36 0.00 -0.98 -3.30 119.26 121.22 2vjj h ALA 565 Ca -0.38 -0.55 -0.01 0.00 0.00 0.00 0.00 54.91 53.98 2vjj h ALA 565 Cb 1.22 -0.05 -0.19 0.00 0.00 0.00 0.00 17.79 18.77 2vjj h ALA 565 CO 0.64 0.66 0.31 -1.54 0.00 0.00 0.00 179.25 179.32 2vjj s SER 566 N -6.99 -0.55 -0.07 0.00 1.04 -1.18 -1.66 113.70 104.29 2vjj s SER 566 Ca -0.11 0.50 -0.01 0.00 0.48 0.00 0.00 55.95 56.82 2vjj s SER 566 Cb 0.09 0.47 0.03 0.00 0.10 0.00 0.00 66.02 66.71 2vjj s SER 566 CO 0.89 -0.58 -0.02 -0.69 0.98 0.00 0.00 173.24 173.83 2vjj s VAL 567 N -1.58 0.48 0.03 5.02 1.01 -0.02 -0.78 120.40 124.56 2vjj s VAL 567 Ca -0.06 0.01 0.01 0.00 0.00 0.00 0.00 61.98 61.95 2vjj s VAL 567 Cb -0.00 -0.58 -0.02 0.00 0.00 0.00 0.00 36.38 35.77 2vjj s VAL 567 CO 0.04 0.26 -0.06 0.54 0.00 0.00 0.00 175.10 175.88 2vjj s VAL 568 N 1.62 0.39 -1.56 2.92 0.11 -0.61 -1.87 120.40 121.41 2vjj s VAL 568 Ca -0.00 -0.95 -0.13 0.00 -2.93 0.00 0.00 61.98 57.96 2vjj s VAL 568 Cb -0.13 -0.48 0.09 0.00 -1.53 0.00 0.00 36.38 34.34 2vjj s VAL 568 CO -0.04 -0.38 0.86 0.59 -3.33 0.00 0.00 175.10 172.80 2vjj n ASN 569 N 1.63 -3.73 -4.47 3.54 3.02 0.43 -2.14 115.26 113.54 2vjj n ASN 569 Ca -0.22 -0.87 -0.27 0.00 -0.03 0.00 0.00 54.58 53.19 2vjj n ASN 569 Cb 0.55 -3.50 -0.11 0.00 -0.61 0.00 0.00 39.78 36.12 2vjj n ASN 569 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2vjj s SER 570 N -3.47 3.70 -0.10 6.41 0.01 -1.24 -2.72 113.70 116.28 2vjj s SER 570 Ca 0.58 -0.79 0.01 0.00 1.31 0.00 0.00 55.95 57.06 2vjj s SER 570 Cb -0.30 -0.40 0.02 0.00 0.21 0.00 0.00 66.02 65.55 2vjj s SER 570 CO 0.86 0.11 -0.10 -0.89 0.41 0.00 0.00 173.24 173.63 2vjj s THR 571 N -1.73 1.15 -0.24 1.44 2.01 0.36 -0.78 115.64 117.84 2vjj s THR 571 Ca 0.23 -0.40 0.01 0.00 0.31 0.00 0.00 61.69 61.83 2vjj s THR 571 Cb -0.08 -1.11 0.06 0.00 0.01 0.00 0.00 72.50 71.38 2vjj s THR 571 CO 0.12 0.38 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.76 2vjj s ILE 572 N 1.33 1.49 -0.50 1.82 -1.09 0.19 -0.32 121.20 124.13 2vjj s ILE 572 Ca -0.01 -1.24 -0.07 0.00 -2.23 0.00 0.00 60.65 57.09 2vjj s ILE 572 Cb -0.14 -1.79 0.13 0.00 -1.58 0.00 0.00 42.46 39.08 2vjj s ILE 572 CO -0.05 -0.14 0.35 -1.61 -1.23 0.00 0.00 174.94 172.26 2vjj s GLU 573 N 1.40 2.46 -0.14 2.79 2.02 -0.56 -1.17 118.70 125.50 2vjj s GLU 573 Ca -0.05 -1.91 -0.27 0.00 0.02 0.00 0.00 54.97 52.76 2vjj s GLU 573 Cb -0.19 -3.87 -0.01 0.00 0.10 0.00 0.00 34.13 30.16 2vjj s GLU 573 CO -0.07 -1.18 0.91 0.08 0.02 0.00 0.00 175.26 175.02 2vjj s VAL 574 N 1.08 4.84 -0.18 2.63 1.01 0.20 -4.05 120.40 125.93 2vjj s VAL 574 Ca 0.08 1.81 -0.00 0.00 0.00 0.00 0.00 61.98 63.87 2vjj s VAL 574 Cb -0.24 -4.21 0.04 0.00 0.00 0.00 0.00 36.38 31.97 2vjj s VAL 574 CO -0.02 0.01 -0.05 -1.58 0.00 0.00 0.00 175.10 173.46 2vjj s GLN 575 N 2.11 1.47 0.63 2.72 2.00 -1.26 -1.52 119.66 125.80 2vjj s GLN 575 Ca 0.43 -0.58 -0.11 0.00 -2.00 0.00 0.00 55.36 53.09 2vjj s GLN 575 Cb -0.17 -2.10 -0.04 0.00 0.80 0.00 0.00 33.01 31.51 2vjj s GLN 575 CO 0.14 -0.45 1.03 -0.51 -0.50 0.00 0.00 175.29 175.00 2vjj s LEU 576 N 1.60 3.23 0.00 3.68 1.43 -1.26 -4.16 118.68 123.21 2vjj s LEU 576 Ca -0.00 1.45 0.00 0.00 -1.03 0.00 0.00 54.13 54.55 2vjj s LEU 576 Cb -0.16 -4.48 0.00 0.00 0.03 0.00 0.00 46.19 41.59 2vjj s LEU 576 CO -0.08 -0.94 0.45 -1.20 0.23 0.00 0.00 176.35 174.81 2vjj n SER 577 N -2.75 0.89 -3.66 2.29 7.64 -1.25 -4.93 113.62 111.84 2vjj n SER 577 Ca 0.06 -1.04 -0.05 0.00 1.01 0.00 0.00 58.87 58.85 2vjj n SER 577 Cb 0.54 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.72 2vjj n SER 577 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2vjj s GLU 579 N -3.16 3.90 -0.36 0.00 2.02 -1.26 -4.90 118.70 114.94 2vjj s GLU 579 Ca 0.10 1.89 0.01 0.00 0.02 0.00 0.00 54.97 56.99 2vjj s GLU 579 Cb -0.01 -2.58 0.14 0.00 0.10 0.00 0.00 34.13 31.78 2vjj s GLU 579 CO -0.02 -0.47 0.23 0.34 0.02 0.00 0.00 175.26 175.36 2vjj s ASP 580 N -1.13 2.76 0.00 -0.19 2.15 -1.26 -4.77 116.67 114.24 2vjj s ASP 580 Ca 0.60 -2.30 0.26 0.00 0.43 0.00 0.00 52.55 51.54 2vjj s ASP 580 Cb -0.32 -0.40 1.50 0.00 -0.30 0.00 0.00 42.92 43.40 2vjj s ASP 580 CO 0.40 -0.29 1.92 0.18 -0.17 0.00 0.00 175.17 177.21 2vjj n LEU 581 N 3.88 0.00 0.10 -1.34 4.77 -1.26 -3.14 117.00 120.01 2vjj n LEU 581 Ca 0.14 0.10 -0.04 0.00 -0.03 0.00 0.00 56.01 56.18 2vjj n LEU 581 Cb 0.38 -0.10 -0.01 0.00 -2.33 0.00 0.00 43.42 41.37 2vjj n LEU 581 CO 0.13 -0.02 0.30 0.77 -1.33 0.00 0.00 177.39 177.24 2vjj h SER 582 N 0.00 0.00 -3.99 -1.43 4.64 -1.90 -3.47 113.55 107.40 2vjj h SER 582 Ca 0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.80 2vjj h SER 582 Cb 0.08 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 62.25 2vjj h SER 582 CO 0.00 0.81 0.53 0.00 -0.87 0.00 0.00 176.83 177.30 2vjj s MET 583 N -3.01 3.75 0.13 4.77 0.23 -1.19 -3.12 119.30 120.87 2vjj s MET 583 Ca 0.01 1.91 -0.14 0.00 -1.03 0.00 0.00 55.69 56.44 2vjj s MET 583 Cb 0.10 -2.49 -0.02 0.00 -1.53 0.00 0.00 34.83 30.89 2vjj s MET 583 CO 0.79 -0.60 1.56 0.35 -2.03 0.00 0.00 175.02 175.09 2vjj h PHE 584 N 2.16 0.80 -3.23 3.16 3.57 -0.90 -3.47 116.94 119.04 2vjj h PHE 584 Ca -0.49 -0.15 -0.04 0.00 3.53 0.00 0.00 57.97 60.82 2vjj h PHE 584 Cb 1.25 -0.21 -0.13 0.00 2.79 0.00 0.00 35.95 39.66 2vjj h PHE 584 CO 0.52 0.82 0.04 -1.54 -2.23 0.00 0.00 178.31 175.93 2vjj s SER 585 N -6.26 -0.37 0.12 0.41 1.04 -1.23 -4.42 113.70 102.99 2vjj s SER 585 Ca -0.13 -0.19 -0.13 0.00 0.48 0.00 0.00 55.95 55.99 2vjj s SER 585 Cb 0.10 0.53 -0.08 0.00 0.10 0.00 0.00 66.02 66.67 2vjj s SER 585 CO 0.80 -0.90 1.42 0.00 0.98 0.00 0.00 173.24 175.54 2vjj s ILE 587 N -4.26 -0.01 -0.03 0.00 2.07 -1.05 -0.84 121.20 117.08 2vjj s ILE 587 Ca -0.11 0.03 0.01 0.00 -1.41 0.00 0.00 60.65 59.17 2vjj s ILE 587 Cb 0.10 -0.47 0.02 0.00 0.13 0.00 0.00 42.46 42.24 2vjj s ILE 587 CO 0.87 0.01 -0.03 -0.22 -1.91 0.00 0.00 174.94 173.66 2vjj s LEU 588 N 0.47 1.42 -0.22 8.50 0.20 -0.54 -0.79 118.68 127.73 2vjj s LEU 588 Ca -0.02 -0.08 -0.03 0.00 0.69 0.00 0.00 54.13 54.69 2vjj s LEU 588 Cb -0.04 -0.31 -0.00 0.00 -0.43 0.00 0.00 46.19 45.41 2vjj s LEU 588 CO -0.02 -0.05 -0.07 -0.36 -0.29 0.00 0.00 176.35 175.56 2vjj s PHE 589 N 0.72 2.93 0.74 5.38 0.40 -0.11 -1.54 117.98 126.50 2vjj s PHE 589 Ca -0.08 -1.07 -0.12 0.00 -0.60 0.00 0.00 56.93 55.06 2vjj s PHE 589 Cb -0.11 -2.08 0.04 0.00 0.51 0.00 0.00 43.02 41.38 2vjj s PHE 589 CO -0.01 -0.59 1.10 -1.25 0.70 0.00 0.00 175.22 175.17 2vjj s PRO 590 N 1.45 2.39 0.55 0.24 0.04 -1.26 -0.95 135.00 137.45 2vjj s PRO 590 Ca 0.06 1.26 0.22 0.00 0.04 0.00 0.00 61.00 62.58 2vjj s PRO 590 Cb -0.14 -1.91 1.49 0.00 0.04 0.00 0.00 34.50 33.98 2vjj s PRO 590 CO -0.05 -1.55 2.16 0.00 0.04 0.00 0.00 177.00 177.60 2vjj h ALA 591 N -0.76 1.88 0.00 8.56 0.00 -1.95 -0.68 119.26 126.31 2vjj h ALA 591 Ca -0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2vjj h ALA 591 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2vjj h ALA 591 CO 0.52 -0.09 0.00 -1.13 0.00 0.00 0.00 179.25 178.55 2vjj n SER 592 N -4.24 0.00 -4.52 0.00 3.41 -1.26 -4.61 113.62 102.40 2vjj n SER 592 Ca -0.01 0.28 -0.41 0.00 -0.26 0.00 0.00 58.87 58.46 2vjj n SER 592 Cb 0.16 -0.40 -0.09 0.00 -0.26 0.00 0.00 64.21 63.62 2vjj n SER 592 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2vjj s GLN 594 N 2.04 4.00 -0.04 0.00 -0.21 -0.66 -4.84 119.66 119.94 2vjj s GLN 594 Ca 0.12 1.64 -0.01 0.00 0.02 0.00 0.00 55.36 57.12 2vjj s GLN 594 Cb -0.17 -2.50 0.03 0.00 1.00 0.00 0.00 33.01 31.38 2vjj s GLN 594 CO 0.12 -0.31 0.04 -1.17 -2.12 0.00 0.00 175.29 171.85 2vjj s LEU 595 N -2.78 0.54 0.07 2.90 2.96 -1.26 -0.84 118.68 120.27 2vjj s LEU 595 Ca 0.60 0.04 -0.11 0.00 -0.22 0.00 0.00 54.13 54.44 2vjj s LEU 595 Cb -0.25 -0.16 0.01 0.00 0.50 0.00 0.00 46.19 46.29 2vjj s LEU 595 CO 0.31 -0.20 0.26 -0.94 -1.32 0.00 0.00 176.35 174.46 2vjj s SER 596 N 1.73 -0.02 -1.28 3.68 1.04 -0.78 -4.88 113.70 113.19 2vjj s SER 596 Ca -0.00 -0.41 -0.23 0.00 0.48 0.00 0.00 55.95 55.79 2vjj s SER 596 Cb -0.12 0.36 0.02 0.00 0.10 0.00 0.00 66.02 66.37 2vjj s SER 596 CO -0.03 -0.68 0.55 -1.22 0.98 0.00 0.00 173.24 172.84 2vjj n TYR 597 N 0.24 -1.49 -3.98 5.02 4.02 -0.82 -3.15 117.16 117.01 2vjj n TYR 597 Ca -0.17 0.30 -0.08 0.00 -0.01 0.00 0.00 57.90 57.94 2vjj n TYR 597 Cb 0.61 -3.01 -0.09 0.00 -0.02 0.00 0.00 39.34 36.84 2vjj n TYR 597 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 2vjj s SER 598 N -3.76 0.30 -0.17 7.72 0.01 -1.05 -0.43 113.70 116.32 2vjj s SER 598 Ca 0.35 -0.79 0.01 0.00 1.31 0.00 0.00 55.95 56.84 2vjj s SER 598 Cb -0.18 0.25 0.02 0.00 0.21 0.00 0.00 66.02 66.33 2vjj s SER 598 CO 0.95 -0.63 -0.20 -0.75 0.41 0.00 0.00 173.24 173.02 2vjj s LYS 599 N -3.65 2.94 -0.17 12.44 2.20 0.04 -0.91 119.74 132.63 2vjj s LYS 599 Ca 0.04 -0.81 -0.01 0.00 -0.36 0.00 0.00 55.97 54.83 2vjj s LYS 599 Cb 0.05 -2.53 0.05 0.00 -1.51 0.00 0.00 37.83 33.89 2vjj s LYS 599 CO -0.09 -0.20 -0.04 0.42 -0.36 0.00 0.00 175.35 175.08 2vjj s ILE 600 N 1.27 1.08 0.02 5.43 -1.09 0.07 -0.63 121.20 127.33 2vjj s ILE 600 Ca 0.04 -0.67 0.05 0.00 -2.23 0.00 0.00 60.65 57.84 2vjj s ILE 600 Cb -0.13 -1.30 -0.02 0.00 -1.58 0.00 0.00 42.46 39.43 2vjj s ILE 600 CO -0.12 0.07 -0.14 0.42 -1.23 0.00 0.00 174.94 173.94 2vjj s THR 601 N 1.64 1.14 -0.23 2.92 -4.23 -0.32 -2.06 115.64 114.50 2vjj s THR 601 Ca -0.00 -0.83 0.02 0.00 -1.18 0.00 0.00 61.69 59.70 2vjj s THR 601 Cb -0.16 -0.99 0.05 0.00 1.34 0.00 0.00 72.50 72.74 2vjj s THR 601 CO -0.07 0.16 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.36 2vjj s VAL 602 N -0.61 1.87 0.47 2.29 1.01 0.17 -0.63 120.40 124.96 2vjj s VAL 602 Ca 0.04 -1.29 -0.25 0.00 0.00 0.00 0.00 61.98 60.48 2vjj s VAL 602 Cb -0.07 -1.96 -0.08 0.00 0.00 0.00 0.00 36.38 34.27 2vjj s VAL 602 CO 0.00 0.08 1.41 -0.62 0.00 0.00 0.00 175.10 175.97 2vjj s ASP 603 N 1.27 5.78 0.46 3.32 2.15 -0.58 -4.43 116.67 124.64 2vjj s ASP 603 Ca -0.05 2.88 0.28 0.00 0.43 0.00 0.00 52.55 56.09 2vjj s ASP 603 Cb -0.18 -2.65 0.83 0.00 -0.30 0.00 0.00 42.92 40.62 2vjj s ASP 603 CO -0.07 -1.24 1.78 0.77 -0.17 0.00 0.00 175.17 176.24 2vjj h SER 604 N 2.18 0.00 -2.74 -0.34 4.64 -1.98 -3.45 113.55 111.86 2vjj h SER 604 Ca -0.51 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.27 2vjj h SER 604 Cb 1.27 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 63.43 2vjj h SER 604 CO 0.60 0.00 0.91 0.00 -0.87 0.00 0.00 176.83 177.47 2vjj n ALA 605 N -2.05 2.35 -0.99 5.18 0.00 -1.26 -0.96 120.51 122.77 2vjj n ALA 605 Ca 0.03 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.87 2vjj n ALA 605 Cb 0.41 -2.46 0.00 0.00 0.00 0.00 0.00 19.45 17.41 2vjj n ALA 605 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 2vjj n TRP 606 N 3.24 0.00 0.71 0.00 8.01 -1.26 -4.54 117.44 123.60 2vjj n TRP 606 Ca 0.14 0.00 0.08 0.00 -1.31 0.00 0.00 57.50 56.41 2vjj n TRP 606 Cb 0.34 -1.23 0.05 0.00 -2.01 0.00 0.00 31.31 28.46 2vjj n TRP 606 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.69 176.93 2vjj n THR 607 N -2.38 0.00 -0.19 -0.99 -2.24 -0.14 -4.53 114.28 103.81 2vjj n THR 607 Ca 0.00 -0.46 0.18 0.00 -2.27 0.00 0.00 64.05 61.49 2vjj n THR 607 Cb 0.30 1.32 0.52 0.00 -2.10 0.00 0.00 70.33 70.37 2vjj n THR 607 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 2vjj h LYS 608 N 2.98 0.37 -0.64 -0.78 2.10 -1.90 -1.63 116.57 117.06 2vjj h LYS 608 Ca 0.00 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 2vjj h LYS 608 Cb 0.67 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 31.92 2vjj h LYS 608 CO 0.00 0.24 0.00 0.43 -2.00 0.00 0.00 179.45 178.12 2vjj n SER 609 N -4.48 3.50 -4.69 7.07 7.64 -1.26 -4.91 113.62 116.49 2vjj n SER 609 Ca 0.17 -2.00 -0.39 0.00 1.01 0.00 0.00 58.87 57.66 2vjj n SER 609 Cb 0.63 -0.43 -0.06 0.00 -1.01 0.00 0.00 64.21 63.34 2vjj n SER 609 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 2vjj s MET 610 N -1.14 4.30 0.21 1.43 -1.94 -0.62 -4.96 119.30 116.58 2vjj s MET 610 Ca 0.44 0.60 -0.00 0.00 -1.71 0.00 0.00 55.69 55.02 2vjj s MET 610 Cb 0.23 -3.50 0.16 0.00 2.01 0.00 0.00 34.83 33.72 2vjj s MET 610 CO 0.30 -0.04 1.52 0.66 -0.01 0.00 0.00 175.02 177.44 2vjj h SER 611 N 7.09 0.47 -3.14 3.03 4.64 -1.91 -3.42 113.55 120.32 2vjj h SER 611 Ca -0.37 -0.27 -0.58 0.00 -0.47 0.00 0.00 61.79 60.10 2vjj h SER 611 Cb 1.17 -0.14 -0.36 0.00 -0.31 0.00 0.00 62.40 62.76 2vjj h SER 611 CO 0.76 0.96 -0.83 0.20 -0.87 0.00 0.00 176.83 177.05 2vjj s ASN 612 N -6.92 2.57 -0.17 4.97 0.01 -1.26 -4.84 114.94 109.30 2vjj s ASN 612 Ca -0.06 -0.45 -0.17 0.00 -0.71 0.00 0.00 52.86 51.47 2vjj s ASN 612 Cb 0.11 -1.09 -0.06 0.00 0.41 0.00 0.00 41.25 40.62 2vjj s ASN 612 CO 0.82 -0.07 -0.33 0.35 -1.51 0.00 0.00 177.10 176.36 2vjj n THR 613 N 4.81 1.47 -5.14 1.60 -2.24 -1.26 -4.27 114.28 109.25 2vjj n THR 613 Ca -0.16 0.15 -0.32 0.00 -2.27 0.00 0.00 64.05 61.46 2vjj n THR 613 Cb 0.50 -2.31 -0.16 0.00 -2.10 0.00 0.00 70.33 66.26 2vjj n THR 613 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2vjj s ALA 614 N -2.88 2.30 -0.12 6.98 0.00 -1.26 -0.23 121.76 126.55 2vjj s ALA 614 Ca -0.28 -1.01 0.02 0.00 0.00 0.00 0.00 51.96 50.69 2vjj s ALA 614 Cb 0.04 -0.80 0.01 0.00 0.00 0.00 0.00 23.12 22.37 2vjj s ALA 614 CO 0.41 0.41 -0.17 0.08 0.00 0.00 0.00 175.76 176.48 2vjj s VAL 615 N -0.15 1.67 -0.48 0.00 1.01 0.03 -5.00 120.40 117.49 2vjj s VAL 615 Ca -0.03 -0.75 0.04 0.00 0.00 0.00 0.00 61.98 61.24 2vjj s VAL 615 Cb -0.14 -1.50 0.12 0.00 0.00 0.00 0.00 36.38 34.86 2vjj s VAL 615 CO 0.04 0.47 0.21 -0.36 0.00 0.00 0.00 175.10 175.46 2vjj s PHE 616 N 0.92 3.31 -0.26 5.22 0.40 -1.26 -0.94 117.98 125.37 2vjj s PHE 616 Ca -0.07 -3.14 0.27 0.00 -0.60 0.00 0.00 56.93 53.39 2vjj s PHE 616 Cb -0.15 -2.84 1.17 0.00 0.51 0.00 0.00 43.02 41.70 2vjj s PHE 616 CO -0.01 -0.79 1.80 0.93 0.70 0.00 0.00 175.22 177.85 2vjj h GLU 617 N 6.74 0.00 -0.23 0.44 5.08 -1.32 -1.04 114.58 124.24 2vjj h GLU 617 Ca -0.07 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.25 2vjj h GLU 617 Cb 0.92 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.15 2vjj h GLU 617 CO 0.65 0.00 -0.02 0.41 -1.00 0.00 0.00 179.01 179.05 2vjj n GLY 618 N -0.20 4.35 3.27 -3.84 0.00 -1.26 -4.52 105.19 102.99 2vjj n GLY 618 Ca 0.01 -1.10 -0.23 0.00 0.00 0.00 0.00 46.02 44.70 2vjj n GLY 618 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2vjj n ASN 619 N -0.78 -4.87 0.21 1.61 3.02 -0.40 -4.86 115.26 109.19 2vjj n ASN 619 Ca 0.23 -0.38 0.15 0.00 -0.03 0.00 0.00 54.58 54.55 2vjj n ASN 619 Cb 0.88 -3.96 0.66 0.00 -0.61 0.00 0.00 39.78 36.74 2vjj n ASN 619 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 2vjj h GLN 620 N -1.28 0.00 0.00 3.52 7.50 -1.94 -2.42 115.11 120.49 2vjj h GLN 620 Ca -0.49 0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.66 2vjj h GLN 620 Cb 1.33 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.86 2vjj h GLN 620 CO 0.56 0.00 0.00 0.00 -1.50 0.00 0.00 178.83 177.89 2vjj n GLN 621 N -2.65 0.03 0.00 1.46 0.00 -1.26 -2.45 117.38 112.51 2vjj n GLN 621 Ca 0.01 0.23 0.14 0.00 0.00 0.00 0.00 57.00 57.38 2vjj n GLN 621 Cb 0.22 -1.56 0.70 0.00 0.00 0.00 0.00 30.24 29.60 2vjj n GLN 621 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2vjj n ALA 622 N -1.55 2.38 -1.73 2.61 0.00 -0.91 -4.79 120.51 116.53 2vjj n ALA 622 Ca 0.04 -0.13 -0.39 0.00 0.00 0.00 0.00 53.44 52.96 2vjj n ALA 622 Cb 0.21 -1.46 0.04 0.00 0.00 0.00 0.00 19.45 18.25 2vjj n ALA 622 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2vjj n GLY 623 N 1.15 0.71 0.25 0.00 0.00 -1.02 -4.88 105.19 101.40 2vjj n GLY 623 Ca 0.12 0.04 0.08 0.00 0.00 0.00 0.00 46.02 46.27 2vjj n GLY 623 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vjj h ALA 624 N 1.48 1.79 -0.11 4.61 0.00 -1.92 -2.42 119.26 122.69 2vjj h ALA 624 Ca -0.50 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.29 2vjj h ALA 624 Cb 1.30 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 2vjj h ALA 624 CO 0.57 0.09 -0.30 0.09 0.00 0.00 0.00 179.25 179.70 2vjj n ASN 625 N -4.31 2.09 -4.60 0.00 3.02 -1.26 -4.95 115.26 105.25 2vjj n ASN 625 Ca -0.03 -3.73 -0.35 0.00 -0.03 0.00 0.00 54.58 50.44 2vjj n ASN 625 Cb 0.15 -0.55 -0.10 0.00 -0.61 0.00 0.00 39.78 38.67 2vjj n ASN 625 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2vjj s VAL 626 N -3.18 4.72 -0.27 2.41 1.01 -0.91 -1.94 120.40 122.24 2vjj s VAL 626 Ca 0.39 -0.05 -0.03 0.00 0.00 0.00 0.00 61.98 62.29 2vjj s VAL 626 Cb 0.37 -3.14 0.03 0.00 0.00 0.00 0.00 36.38 33.63 2vjj s VAL 626 CO -0.03 0.43 -0.02 -0.31 0.00 0.00 0.00 175.10 175.17 2vjj s TYR 627 N 0.60 3.11 -0.01 5.22 1.51 -0.09 -4.79 117.35 122.91 2vjj s TYR 627 Ca 0.03 -1.49 -0.07 0.00 -1.01 0.00 0.00 57.07 54.54 2vjj s TYR 627 Cb -0.13 -2.10 0.00 0.00 -0.11 0.00 0.00 41.96 39.62 2vjj s TYR 627 CO 0.01 -0.71 0.14 0.14 -1.11 0.00 0.00 175.55 174.03 2vjj s VAL 628 N 1.35 0.07 -0.11 0.71 -7.23 -0.78 -0.75 120.40 113.65 2vjj s VAL 628 Ca -0.00 -0.55 -0.08 0.00 -1.81 0.00 0.00 61.98 59.54 2vjj s VAL 628 Cb -0.17 -0.39 0.04 0.00 0.56 0.00 0.00 36.38 36.42 2vjj s VAL 628 CO -0.03 -0.30 0.29 -0.94 -0.31 0.00 0.00 175.10 173.81 2vjj s SER 629 N -1.08 -0.31 -0.04 4.85 1.04 -0.88 0.26 113.70 117.54 2vjj s SER 629 Ca -0.12 0.60 -0.29 0.00 0.48 0.00 0.00 55.95 56.62 2vjj s SER 629 Cb -0.06 0.54 0.09 0.00 0.10 0.00 0.00 66.02 66.68 2vjj s SER 629 CO 0.01 -0.14 0.77 -0.72 0.98 0.00 0.00 173.24 174.15 2vjj s TYR 630 N 0.77 -0.53 0.52 5.02 1.13 -0.37 -0.65 117.35 123.23 2vjj s TYR 630 Ca -0.05 0.76 -0.19 0.00 -1.41 0.00 0.00 57.07 56.18 2vjj s TYR 630 Cb -0.06 0.46 -0.07 0.00 -1.10 0.00 0.00 41.96 41.19 2vjj s TYR 630 CO -0.05 -0.57 1.04 -2.14 -2.51 0.00 0.00 175.55 171.32 2vjj s PRO 631 N -1.82 3.68 0.02 -3.49 0.02 -1.26 -1.23 135.00 130.92 2vjj s PRO 631 Ca -0.05 1.30 -0.23 0.00 0.02 0.00 0.00 61.00 62.04 2vjj s PRO 631 Cb -0.00 -2.08 0.05 0.00 0.02 0.00 0.00 34.50 32.49 2vjj s PRO 631 CO 0.02 -0.52 0.52 0.00 -0.33 0.00 0.00 177.00 176.69 2vjj s ALA 632 N -2.14 -1.34 -0.05 -1.55 0.00 -0.05 -4.49 121.76 112.14 2vjj s ALA 632 Ca 0.66 0.69 -0.21 0.00 0.00 0.00 0.00 51.96 53.10 2vjj s ALA 632 Cb -0.16 0.28 -0.05 0.00 0.00 0.00 0.00 23.12 23.19 2vjj s ALA 632 CO 0.25 -0.45 0.61 0.99 0.00 0.00 0.00 175.76 177.16 2vjj s THR 633 N -2.08 5.02 -0.03 0.00 2.01 -1.26 -0.52 115.64 118.77 2vjj s THR 633 Ca -0.07 1.26 0.03 0.00 0.31 0.00 0.00 61.69 63.22 2vjj s THR 633 Cb -0.01 -3.95 -0.00 0.00 0.01 0.00 0.00 72.50 68.55 2vjj s THR 633 CO 0.01 0.34 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.47 2vjj s VAL 634 N 0.33 1.01 -0.14 3.82 1.01 0.27 -4.97 120.40 121.74 2vjj s VAL 634 Ca 0.32 -0.50 -0.15 0.00 0.00 0.00 0.00 61.98 61.66 2vjj s VAL 634 Cb -0.17 -0.88 -0.05 0.00 0.00 0.00 0.00 36.38 35.29 2vjj s VAL 634 CO 0.16 0.30 0.34 0.20 0.00 0.00 0.00 175.10 176.10 2vjj s ASN 635 N 0.05 6.52 0.07 3.32 0.01 -1.26 -0.94 114.94 122.71 2vjj s ASN 635 Ca -0.02 0.61 0.06 0.00 -0.71 0.00 0.00 52.86 52.81 2vjj s ASN 635 Cb -0.09 -2.21 -0.03 0.00 0.41 0.00 0.00 41.25 39.34 2vjj s ASN 635 CO 0.01 0.11 -0.17 -0.76 -1.51 0.00 0.00 177.10 174.78 2vjj s LEU 636 N 0.32 2.24 0.02 0.60 1.43 0.28 -0.89 118.68 122.69 2vjj s LEU 636 Ca 0.19 -0.58 0.02 0.00 -1.03 0.00 0.00 54.13 52.74 2vjj s LEU 636 Cb -0.14 -0.68 -0.01 0.00 0.03 0.00 0.00 46.19 45.39 2vjj s LEU 636 CO 0.06 0.01 -0.08 -0.89 0.23 0.00 0.00 176.35 175.68 2vjj s THR 637 N -1.08 0.61 0.37 5.49 2.01 0.10 -1.17 115.64 121.97 2vjj s THR 637 Ca 0.02 -0.65 0.07 0.00 0.31 0.00 0.00 61.69 61.44 2vjj s THR 637 Cb -0.09 -0.58 -0.02 0.00 0.01 0.00 0.00 72.50 71.82 2vjj s THR 637 CO 0.02 -0.05 0.40 -0.94 -0.69 0.00 0.00 174.62 173.36 2vjj s SER 638 N -0.78 5.46 1.00 3.53 1.04 -0.15 -0.52 113.70 123.28 2vjj s SER 638 Ca -0.02 -0.46 -0.15 0.00 0.48 0.00 0.00 55.95 55.80 2vjj s SER 638 Cb -0.06 -0.90 0.19 0.00 0.10 0.00 0.00 66.02 65.35 2vjj s SER 638 CO 0.00 -0.50 1.19 -0.31 0.98 0.00 0.00 173.24 174.60 2vjj s TYR 639 N -2.32 1.74 -0.96 5.02 2.02 -0.89 -4.21 117.35 117.75 2vjj s TYR 639 Ca 0.46 0.60 0.26 0.00 -0.37 0.00 0.00 57.07 58.01 2vjj s TYR 639 Cb -0.07 -3.63 0.60 0.00 -0.40 0.00 0.00 41.96 38.46 2vjj s TYR 639 CO 0.29 -2.81 1.48 0.27 -1.57 0.00 0.00 175.55 173.21 2vjj n ASN 640 N -4.00 0.45 -4.61 2.29 6.94 -1.26 -4.15 115.26 110.92 2vjj n ASN 640 Ca 0.11 -0.10 -0.52 0.00 -0.02 0.00 0.00 54.58 54.06 2vjj n ASN 640 Cb 0.59 0.13 -0.06 0.00 -2.36 0.00 0.00 39.78 38.08 2vjj n ASN 640 CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 2vjj n THR 641 N -1.56 0.02 -2.41 5.53 -1.04 -1.26 -1.18 114.28 112.39 2vjj n THR 641 Ca 0.05 -0.00 -0.40 0.00 -2.04 0.00 0.00 64.05 61.66 2vjj n THR 641 Cb 0.35 -0.93 -0.04 0.00 -1.82 0.00 0.00 70.33 67.89 2vjj n THR 641 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 2vjj s GLN 642 N 0.75 4.46 0.60 -2.82 -0.44 -1.26 -4.61 119.66 116.34 2vjj s GLN 642 Ca 0.85 1.83 0.00 0.00 -2.50 0.00 0.00 55.36 55.54 2vjj s GLN 642 Cb -0.93 -3.02 0.00 0.00 -1.64 0.00 0.00 33.01 27.42 2vjj s GLN 642 CO 0.47 0.04 0.00 0.41 0.50 0.00 0.00 175.29 176.71 2vjj n GLY 643 N 0.95 -0.43 3.72 2.59 0.00 0.54 -4.89 105.19 107.66 2vjj n GLY 643 Ca 0.01 -1.71 -0.42 0.00 0.00 0.00 0.00 46.02 43.90 2vjj n GLY 643 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vjj s ALA 644 N -1.79 3.88 -0.05 4.61 0.00 -1.26 -0.57 121.76 126.59 2vjj s ALA 644 Ca 0.00 1.51 -0.05 0.00 0.00 0.00 0.00 51.96 53.42 2vjj s ALA 644 Cb 0.00 -3.68 0.01 0.00 0.00 0.00 0.00 23.12 19.45 2vjj s ALA 644 CO 0.00 -0.90 0.14 0.54 0.00 0.00 0.00 175.76 175.54 2vjj s VAL 645 N 1.29 0.01 0.32 0.00 0.11 -0.67 -4.90 120.40 116.55 2vjj s VAL 645 Ca 0.74 -0.08 -0.25 0.00 -2.93 0.00 0.00 61.98 59.46 2vjj s VAL 645 Cb -0.48 -0.23 -0.10 0.00 -1.53 0.00 0.00 36.38 34.04 2vjj s VAL 645 CO 0.32 -0.04 0.91 -2.16 -3.33 0.00 0.00 175.10 170.80 2vjj s PRO 646 N -0.09 4.50 -0.07 1.54 0.04 -1.26 -0.55 135.00 139.11 2vjj s PRO 646 Ca -0.02 1.23 0.03 0.00 0.04 0.00 0.00 61.00 62.29 2vjj s PRO 646 Cb -0.02 -2.75 -0.02 0.00 0.04 0.00 0.00 34.50 31.75 2vjj s PRO 646 CO 0.00 0.27 -0.15 -0.06 0.04 0.00 0.00 177.00 177.10 2vjj s PHE 647 N -1.66 2.71 0.04 0.56 0.40 0.36 -2.10 117.98 118.29 2vjj s PHE 647 Ca 0.50 -0.31 0.08 0.00 -0.60 0.00 0.00 56.93 56.60 2vjj s PHE 647 Cb -0.17 -1.68 -0.03 0.00 0.51 0.00 0.00 43.02 41.65 2vjj s PHE 647 CO 0.22 0.07 -0.21 -0.06 0.70 0.00 0.00 175.22 175.93 2vjj s PHE 648 N -0.44 1.88 0.41 0.36 0.40 0.32 -1.72 117.98 119.20 2vjj s PHE 648 Ca 0.05 -0.38 -0.25 0.00 -0.60 0.00 0.00 56.93 55.75 2vjj s PHE 648 Cb -0.12 -1.13 -0.08 0.00 0.51 0.00 0.00 43.02 42.20 2vjj s PHE 648 CO 0.02 0.09 1.19 -1.54 0.70 0.00 0.00 175.22 175.68 2vjj s SER 649 N -1.16 6.44 0.23 1.36 1.04 -0.51 -0.72 113.70 120.38 2vjj s SER 649 Ca 0.08 2.40 0.05 0.00 0.48 0.00 0.00 55.95 58.95 2vjj s SER 649 Cb -0.09 -2.62 0.22 0.00 0.10 0.00 0.00 66.02 63.64 2vjj s SER 649 CO 0.02 -0.73 1.54 0.71 0.98 0.00 0.00 173.24 175.75 2vjj h THR 650 N 2.30 1.41 -2.67 2.02 1.35 -1.37 -3.44 112.91 112.50 2vjj h THR 650 Ca -0.49 -2.08 -0.47 0.00 -0.55 0.00 0.00 66.41 62.82 2vjj h THR 650 Cb 1.24 2.08 0.01 0.00 -1.73 0.00 0.00 68.15 69.75 2vjj h THR 650 CO 0.62 0.61 -0.20 -1.81 -0.25 0.00 0.00 175.52 174.50 2vjj s ASP 651 N -6.89 6.18 -0.31 5.36 1.01 -1.26 -5.03 116.67 115.71 2vjj s ASP 651 Ca -0.04 0.34 0.07 0.00 0.71 0.00 0.00 52.55 53.64 2vjj s ASP 651 Cb 0.12 -1.86 0.46 0.00 1.01 0.00 0.00 42.92 42.65 2vjj s ASP 651 CO 0.80 -0.37 1.36 0.35 0.21 0.00 0.00 175.17 177.51 2vjj n THR 652 N -1.81 2.59 -0.61 -1.27 -2.24 -1.26 -4.35 114.28 105.32 2vjj n THR 652 Ca -0.03 -3.50 0.03 0.00 -2.27 0.00 0.00 64.05 58.27 2vjj n THR 652 Cb 0.57 -0.73 0.32 0.00 -2.10 0.00 0.00 70.33 68.38 2vjj n THR 652 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2vjj n ASN 653 N -0.93 4.79 -0.82 3.42 5.03 -1.20 -4.43 115.26 121.13 2vjj n ASN 653 Ca 0.38 -2.84 0.06 0.00 0.87 0.00 0.00 54.58 53.04 2vjj n ASN 653 Cb 0.90 -0.67 0.15 0.00 -1.02 0.00 0.00 39.78 39.13 2vjj n ASN 653 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2vjj n TYR 654 N 0.35 0.00 0.33 3.10 4.01 0.42 -4.77 117.16 120.60 2vjj n TYR 654 Ca 0.26 -1.14 0.21 0.00 -0.16 0.00 0.00 57.90 57.08 2vjj n TYR 654 Cb 1.09 -0.21 1.11 0.00 -0.31 0.00 0.00 39.34 41.02 2vjj n TYR 654 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2vjj h ALA 655 N 0.90 1.04 -0.00 -0.72 0.00 -1.78 -2.30 119.26 116.40 2vjj h ALA 655 Ca -0.07 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2vjj h ALA 655 Cb 1.27 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2vjj h ALA 655 CO 0.03 0.01 -0.47 -2.67 0.00 0.00 0.00 179.25 176.14 2vjj n TRP 656 N -3.14 0.00 -2.94 0.00 4.27 -1.26 -4.93 117.44 109.44 2vjj n TRP 656 Ca -0.02 0.00 -0.41 0.00 -3.89 0.00 0.00 57.50 53.18 2vjj n TRP 656 Cb 0.11 -0.18 -0.04 0.00 -1.36 0.00 0.00 31.31 29.84 2vjj n TRP 656 CO 0.00 0.00 0.00 0.08 -2.29 0.00 0.00 177.69 175.48 2vjj s VAL 657 N -2.83 4.98 -0.13 -1.67 1.01 -0.87 -4.68 120.40 116.21 2vjj s VAL 657 Ca 0.15 1.63 0.09 0.00 0.00 0.00 0.00 61.98 63.85 2vjj s VAL 657 Cb 0.18 -4.13 -0.23 0.00 0.00 0.00 0.00 36.38 32.20 2vjj s VAL 657 CO 0.66 0.20 0.31 0.35 0.00 0.00 0.00 175.10 176.62 2vjj n THR 658 N 3.91 1.56 -3.53 3.92 -2.24 0.45 -4.22 114.28 114.14 2vjj n THR 658 Ca 0.01 -0.76 -0.14 0.00 -2.27 0.00 0.00 64.05 60.90 2vjj n THR 658 Cb 0.51 -1.04 -0.04 0.00 -2.10 0.00 0.00 70.33 67.66 2vjj n THR 658 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2vjj s SER 659 N -6.13 -0.48 0.01 3.42 1.04 -0.96 -4.62 113.70 105.97 2vjj s SER 659 Ca -0.13 0.15 -0.05 0.00 0.48 0.00 0.00 55.95 56.40 2vjj s SER 659 Cb 0.07 0.53 -0.01 0.00 0.10 0.00 0.00 66.02 66.71 2vjj s SER 659 CO 0.79 -0.79 0.08 0.00 0.98 0.00 0.00 173.24 174.30 2vjj s ALA 660 N -2.78 -0.18 0.05 5.32 0.00 -0.65 -0.23 121.76 123.30 2vjj s ALA 660 Ca -0.03 -0.27 0.00 0.00 0.00 0.00 0.00 51.96 51.66 2vjj s ALA 660 Cb -0.00 0.11 -0.03 0.00 0.00 0.00 0.00 23.12 23.20 2vjj s ALA 660 CO -0.04 -0.19 -0.04 1.52 0.00 0.00 0.00 175.76 177.01 2vjj s TYR 661 N -1.35 0.52 0.22 0.00 1.13 -0.78 -0.68 117.35 116.41 2vjj s TYR 661 Ca -0.14 -0.83 -0.30 0.00 -1.41 0.00 0.00 57.07 54.38 2vjj s TYR 661 Cb -0.08 -0.35 -0.10 0.00 -1.10 0.00 0.00 41.96 40.33 2vjj s TYR 661 CO 0.01 -0.26 1.48 0.45 -2.51 0.00 0.00 175.55 174.72 2vjj s SER 662 N -2.37 6.63 -0.04 -0.18 0.15 -0.32 -1.01 113.70 116.57 2vjj s SER 662 Ca -0.01 2.65 0.09 0.00 0.70 0.00 0.00 55.95 59.38 2vjj s SER 662 Cb 0.00 -2.61 0.25 0.00 -1.71 0.00 0.00 66.02 61.95 2vjj s SER 662 CO -0.05 -0.74 1.20 0.18 1.20 0.00 0.00 173.24 175.02 2vjj n LEU 663 N 2.86 2.76 -4.35 3.45 4.77 0.77 -4.85 117.00 122.41 2vjj n LEU 663 Ca 0.09 -2.26 -0.27 0.00 -0.03 0.00 0.00 56.01 53.53 2vjj n LEU 663 Cb 0.40 -0.23 -0.13 0.00 -2.33 0.00 0.00 43.42 41.12 2vjj n LEU 663 CO 0.61 0.65 -0.55 -0.44 -1.33 0.00 0.00 177.39 176.33 2vjj s SER 664 N -1.32 3.05 0.79 -1.43 0.01 -1.23 -4.84 113.70 108.74 2vjj s SER 664 Ca 0.20 -0.72 -0.12 0.00 1.31 0.00 0.00 55.95 56.63 2vjj s SER 664 Cb 0.14 -0.20 0.07 0.00 0.21 0.00 0.00 66.02 66.24 2vjj s SER 664 CO 0.09 0.15 1.12 0.27 0.41 0.00 0.00 173.24 175.28 2vjj s ILE 665 N -1.07 2.80 -0.34 1.44 -4.36 -1.26 -5.00 121.20 113.41 2vjj s ILE 665 Ca 0.11 0.26 -0.07 0.00 -0.26 0.00 0.00 60.65 60.70 2vjj s ILE 665 Cb -0.10 -3.12 0.04 0.00 1.25 0.00 0.00 42.46 40.53 2vjj s ILE 665 CO 0.05 -0.34 0.12 0.21 0.24 0.00 0.00 174.94 175.22 2vjj s ASN 666 N -4.18 5.36 0.00 4.36 2.47 -1.26 -4.98 114.94 116.70 2vjj s ASN 666 Ca 0.61 -1.14 0.30 0.00 0.42 0.00 0.00 52.86 53.04 2vjj s ASN 666 Cb -0.13 -1.88 1.58 0.00 -1.45 0.00 0.00 41.25 39.37 2vjj s ASN 666 CO 0.52 -0.34 2.06 -1.84 -3.72 0.00 0.00 177.10 173.78 2vjj n GLU 667 N 4.83 0.57 -3.71 0.43 0.28 -1.26 -4.91 120.64 116.87 2vjj n GLU 667 Ca -0.12 0.01 -0.27 0.00 -0.16 0.00 0.00 57.16 56.62 2vjj n GLU 667 Cb 0.45 -1.50 -0.03 0.00 1.43 0.00 0.00 31.44 31.79 2vjj n GLU 667 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 2vjj s ASN 668 N -2.40 6.38 -0.19 -1.84 0.01 -1.26 -5.05 114.94 110.59 2vjj s ASN 668 Ca 0.33 0.37 0.15 0.00 -0.71 0.00 0.00 52.86 53.01 2vjj s ASN 668 Cb 0.20 -2.00 -0.22 0.00 0.41 0.00 0.00 41.25 39.64 2vjj s ASN 668 CO 0.42 -0.05 0.05 0.18 -1.51 0.00 0.00 177.10 176.19 2vjj n LEU 669 N -0.73 0.21 -0.68 0.60 4.77 -1.26 -4.64 117.00 115.27 2vjj n LEU 669 Ca -0.05 -0.01 0.13 0.00 -0.03 0.00 0.00 56.01 56.05 2vjj n LEU 669 Cb 0.54 0.37 0.26 0.00 -2.33 0.00 0.00 43.42 42.26 2vjj n LEU 669 CO 0.48 0.49 0.68 -0.90 -1.33 0.00 0.00 177.39 176.81 2vjj n ASP 670 N -2.72 2.20 -3.71 -1.43 5.75 -1.26 -4.92 116.55 110.46 2vjj n ASP 670 Ca -0.31 -1.68 -0.09 0.00 -0.01 0.00 0.00 54.79 52.70 2vjj n ASP 670 Cb 1.09 0.07 -0.03 0.00 -1.03 0.00 0.00 41.12 41.22 2vjj n ASP 670 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 2vjj s PHE 671 N -2.10 -0.22 -0.01 2.11 -0.71 -1.26 -0.63 117.98 115.17 2vjj s PHE 671 Ca 0.30 -0.13 0.02 0.00 -1.04 0.00 0.00 56.93 56.07 2vjj s PHE 671 Cb 0.20 0.51 -0.00 0.00 -1.21 0.00 0.00 43.02 42.52 2vjj s PHE 671 CO 0.36 -1.00 -0.05 -1.54 -1.34 0.00 0.00 175.22 171.66 2vjj s SER 672 N -2.86 0.62 0.91 1.98 1.04 0.03 -4.71 113.70 110.70 2vjj s SER 672 Ca 0.08 -0.09 -0.12 0.00 0.48 0.00 0.00 55.95 56.30 2vjj s SER 672 Cb -0.02 -0.09 0.14 0.00 0.10 0.00 0.00 66.02 66.14 2vjj s SER 672 CO -0.02 0.05 1.12 -2.16 0.98 0.00 0.00 173.24 173.21 2vjj s PRO 673 N -0.02 1.13 0.50 4.02 0.04 -1.26 -1.09 135.00 138.32 2vjj s PRO 673 Ca 0.01 0.39 -0.23 0.00 0.04 0.00 0.00 61.00 61.21 2vjj s PRO 673 Cb -0.03 -1.83 -0.06 0.00 0.04 0.00 0.00 34.50 32.62 2vjj s PRO 673 CO -0.00 -2.22 1.31 -2.14 0.04 0.00 0.00 177.00 173.98 2vjj s PRO 674 N -5.19 3.45 0.17 0.56 0.02 -1.26 -4.70 135.00 128.04 2vjj s PRO 674 Ca 0.64 2.12 0.01 0.00 0.02 0.00 0.00 61.00 63.79 2vjj s PRO 674 Cb -0.16 -2.39 0.01 0.00 0.02 0.00 0.00 34.50 31.99 2vjj s PRO 674 CO 0.54 -0.91 1.39 0.00 -0.33 0.00 0.00 177.00 177.70 2vjj h ALA 675 N 1.83 0.54 -2.56 -1.55 0.00 -1.94 -3.43 119.26 112.15 2vjj h ALA 675 Ca -0.50 -0.69 -0.28 0.00 0.00 0.00 0.00 54.91 53.44 2vjj h ALA 675 Cb 1.28 -0.07 -0.17 0.00 0.00 0.00 0.00 17.79 18.83 2vjj h ALA 675 CO 0.59 0.87 -0.72 0.95 0.00 0.00 0.00 179.25 180.94 2vjj s THR 676 N -3.30 0.81 0.05 0.00 -4.23 -1.26 -1.18 115.64 106.53 2vjj s THR 676 Ca -0.04 -1.71 0.01 0.00 -1.18 0.00 0.00 61.69 58.77 2vjj s THR 676 Cb 0.10 -1.42 -0.03 0.00 1.34 0.00 0.00 72.50 72.49 2vjj s THR 676 CO 0.83 -0.67 -0.06 -0.31 -0.54 0.00 0.00 174.62 173.87 2vjj s TYR 677 N -2.82 0.60 0.00 3.99 1.51 0.15 -4.34 117.35 116.43 2vjj s TYR 677 Ca 0.07 -0.66 0.00 0.00 -1.01 0.00 0.00 57.07 55.46 2vjj s TYR 677 Cb -0.00 -0.37 0.00 0.00 -0.11 0.00 0.00 41.96 41.47 2vjj s TYR 677 CO -0.02 -0.16 0.00 -2.37 -1.11 0.00 0.00 175.55 171.89 2vjj n THR 678 N 1.02 0.00 -4.14 -0.71 5.66 -0.27 -1.64 114.28 114.20 2vjj n THR 678 Ca -0.20 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.67 2vjj n THR 678 Cb 0.57 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.33 2vjj n THR 678 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 2vjj n ASN 679 N -0.43 2.35 -4.19 1.09 6.94 -1.26 -0.81 115.26 118.96 2vjj n ASN 679 Ca 0.00 -1.90 -0.12 0.00 -0.02 0.00 0.00 54.58 52.55 2vjj n ASN 679 Cb 0.00 0.10 -0.10 0.00 -2.36 0.00 0.00 39.78 37.42 2vjj n ASN 679 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2vjj s LYS 680 N -2.82 0.92 0.48 -3.83 1.02 -0.15 -4.71 119.74 110.66 2vjj s LYS 680 Ca 0.04 -1.39 0.22 0.00 0.02 0.00 0.00 55.97 54.86 2vjj s LYS 680 Cb -0.00 -0.25 1.26 0.00 -0.52 0.00 0.00 37.83 38.32 2vjj s LYS 680 CO 0.02 -0.04 1.93 0.00 -0.92 0.00 0.00 175.35 176.35 2vjj h ALA 681 N 2.89 2.40 -0.06 5.17 0.00 -1.97 -0.19 119.26 127.49 2vjj h ALA 681 Ca -0.36 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2vjj h ALA 681 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2vjj h ALA 681 CO 0.64 -0.61 0.00 0.27 0.00 0.00 0.00 179.25 179.56 2vjj n ASN 682 N -4.41 0.80 0.00 0.00 6.94 -1.26 -4.89 115.26 112.44 2vjj n ASN 682 Ca 0.14 -1.48 0.00 0.00 -0.02 0.00 0.00 54.58 53.22 2vjj n ASN 682 Cb 0.66 -0.04 0.00 0.00 -2.36 0.00 0.00 39.78 38.04 2vjj n ASN 682 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2vjj n GLY 683 N 0.99 0.71 3.78 4.83 0.00 -0.08 -4.77 105.19 110.65 2vjj n GLY 683 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 2vjj n GLY 683 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2vjj s GLN 684 N -0.63 3.67 0.37 1.61 -0.21 -1.26 -0.44 119.66 122.77 2vjj s GLN 684 Ca 0.00 1.57 -0.17 0.00 0.02 0.00 0.00 55.36 56.79 2vjj s GLN 684 Cb 0.00 -2.19 -0.09 0.00 1.00 0.00 0.00 33.01 31.72 2vjj s GLN 684 CO 0.00 -0.58 0.81 -0.51 -2.12 0.00 0.00 175.29 172.89 2vjj s LEU 685 N -3.38 4.00 -0.04 2.90 1.43 -1.26 -0.97 118.68 121.35 2vjj s LEU 685 Ca 0.67 1.40 -0.04 0.00 -1.03 0.00 0.00 54.13 55.14 2vjj s LEU 685 Cb -0.23 -4.23 0.01 0.00 0.03 0.00 0.00 46.19 41.78 2vjj s LEU 685 CO 0.27 -0.28 0.11 0.54 0.23 0.00 0.00 176.35 177.22 2vjj s VAL 686 N -2.09 -0.00 0.17 -1.59 0.11 0.01 -1.43 120.40 115.58 2vjj s VAL 686 Ca 0.56 0.01 -0.15 0.00 -2.93 0.00 0.00 61.98 59.47 2vjj s VAL 686 Cb -0.10 -0.16 0.02 0.00 -1.53 0.00 0.00 36.38 34.62 2vjj s VAL 686 CO 0.17 0.01 0.44 -0.83 -3.33 0.00 0.00 175.10 171.56 2vjj s GLY 687 N 0.13 -0.03 -0.29 6.54 0.00 -0.70 -1.12 107.32 111.86 2vjj s GLY 687 Ca -0.01 -0.31 -0.09 0.00 0.00 0.00 0.00 44.72 44.31 2vjj s GLY 687 CO -0.00 -0.39 0.14 0.14 0.00 0.00 0.00 173.10 172.99 2vjj s VAL 688 N -3.87 4.71 0.00 1.40 1.01 -1.26 -0.49 120.40 121.90 2vjj s VAL 688 Ca 0.09 -0.21 0.00 0.00 0.00 0.00 0.00 61.98 61.86 2vjj s VAL 688 Cb 0.01 -3.31 0.00 0.00 0.00 0.00 0.00 36.38 33.08 2vjj s VAL 688 CO -0.05 0.18 0.00 0.61 0.00 0.00 0.00 175.10 175.84 2vjj n GLY 689 N 4.99 4.24 2.73 4.51 0.00 0.29 -4.22 105.19 117.73 2vjj n GLY 689 Ca -0.14 -2.07 -0.19 0.00 0.00 0.00 0.00 46.02 43.62 2vjj n GLY 689 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2vjj s TYR 690 N 1.13 0.17 -0.50 1.61 5.04 -0.25 -1.67 117.35 122.88 2vjj s TYR 690 Ca 0.00 0.14 -0.16 0.00 -2.44 0.00 0.00 57.07 54.61 2vjj s TYR 690 Cb 0.00 -0.46 0.09 0.00 0.35 0.00 0.00 41.96 41.94 2vjj s TYR 690 CO 0.00 -0.18 0.44 -0.80 -1.34 0.00 0.00 175.55 173.68 2vjj s ASN 691 N 1.74 6.17 0.17 4.32 0.01 0.27 -0.79 114.94 126.82 2vjj s ASN 691 Ca -0.00 -1.49 -0.11 0.00 -0.71 0.00 0.00 52.86 50.55 2vjj s ASN 691 Cb -0.12 -2.20 0.06 0.00 0.41 0.00 0.00 41.25 39.40 2vjj s ASN 691 CO -0.03 -0.74 1.67 -0.33 -1.51 0.00 0.00 177.10 176.16 2vjj h GLU 692 N 8.82 0.95 -6.48 -0.60 5.08 -1.17 0.15 114.58 121.34 2vjj h GLU 692 Ca -0.29 -0.25 -0.67 0.00 -1.00 0.00 0.00 59.36 57.15 2vjj h GLU 692 Cb 1.11 -0.12 -0.17 0.00 0.50 0.00 0.00 28.75 30.07 2vjj h GLU 692 CO 0.94 0.90 -0.74 0.42 -1.00 0.00 0.00 179.01 179.53 2vjj s ILE 693 N -5.24 3.37 0.96 3.13 -1.09 -1.16 -4.73 121.20 116.45 2vjj s ILE 693 Ca -0.12 -1.11 -0.11 0.00 -2.23 0.00 0.00 60.65 57.07 2vjj s ILE 693 Cb 0.13 -2.53 0.17 0.00 -1.58 0.00 0.00 42.46 38.65 2vjj s ILE 693 CO 0.82 0.23 1.09 -0.83 -1.23 0.00 0.00 174.94 175.02 2vjj s GLY 694 N -1.87 1.62 0.00 6.18 0.00 -1.26 -4.79 107.32 107.20 2vjj s GLY 694 Ca 0.19 0.14 0.00 0.00 0.00 0.00 0.00 44.72 45.05 2vjj s GLY 694 CO 0.11 0.66 0.00 0.61 0.00 0.00 0.00 173.10 174.48 2vjj n GLY 695 N -0.22 4.96 3.72 0.20 0.00 -0.32 -4.96 105.19 108.57 2vjj n GLY 695 Ca 0.08 -0.95 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 2vjj n GLY 695 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vjj s VAL 696 N -1.09 2.75 0.11 1.61 1.01 -1.26 -4.43 120.40 119.10 2vjj s VAL 696 Ca 0.00 0.55 0.08 0.00 0.00 0.00 0.00 61.98 62.60 2vjj s VAL 696 Cb 0.00 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 32.99 2vjj s VAL 696 CO 0.00 0.05 -0.11 -0.13 0.00 0.00 0.00 175.10 174.91 2vjj s ARG 697 N 0.93 2.06 -0.04 2.72 1.81 -1.26 -4.94 118.95 120.23 2vjj s ARG 697 Ca 0.68 -1.07 -0.02 0.00 -1.72 0.00 0.00 55.73 53.60 2vjj s ARG 697 Cb -0.42 -2.26 0.03 0.00 -0.45 0.00 0.00 34.95 31.85 2vjj s ARG 697 CO 0.33 0.50 0.08 0.45 -0.68 0.00 0.00 175.30 175.97 2vjj s SER 698 N -2.24 0.46 0.02 0.23 0.15 -1.26 -0.97 113.70 110.09 2vjj s SER 698 Ca 0.21 0.14 -0.03 0.00 0.70 0.00 0.00 55.95 56.97 2vjj s SER 698 Cb -0.11 -0.00 -0.02 0.00 -1.71 0.00 0.00 66.02 64.18 2vjj s SER 698 CO 0.13 -0.19 0.03 0.68 1.20 0.00 0.00 173.24 175.09 2vjj s VAL 699 N 1.59 0.12 -0.24 4.45 -7.23 -0.31 -5.00 120.40 113.78 2vjj s VAL 699 Ca -0.03 -1.00 -0.02 0.00 -1.81 0.00 0.00 61.98 59.12 2vjj s VAL 699 Cb -0.12 -0.55 0.02 0.00 0.56 0.00 0.00 36.38 36.29 2vjj s VAL 699 CO -0.04 -0.55 -0.07 -0.94 -0.31 0.00 0.00 175.10 173.19 2vjj s SER 700 N -1.73 4.24 0.13 4.85 1.04 -1.26 -0.56 113.70 120.41 2vjj s SER 700 Ca -0.11 -0.84 0.08 0.00 0.48 0.00 0.00 55.95 55.57 2vjj s SER 700 Cb -0.06 -1.65 -0.04 0.00 0.10 0.00 0.00 66.02 64.37 2vjj s SER 700 CO -0.02 -0.11 -0.20 0.68 0.98 0.00 0.00 173.24 174.57 2vjj s VAL 701 N 1.33 1.75 -0.22 5.02 -7.23 -0.11 -4.95 120.40 115.98 2vjj s VAL 701 Ca 0.01 -1.70 -0.17 0.00 -1.81 0.00 0.00 61.98 58.30 2vjj s VAL 701 Cb -0.16 -1.67 -0.03 0.00 0.56 0.00 0.00 36.38 35.07 2vjj s VAL 701 CO -0.05 -0.17 0.47 -0.60 -0.31 0.00 0.00 175.10 174.44 2vjj s ARG 702 N -2.29 4.14 0.08 4.82 6.06 -1.26 -0.56 118.95 129.93 2vjj s ARG 702 Ca 0.10 0.30 0.09 0.00 -2.50 0.00 0.00 55.73 53.73 2vjj s ARG 702 Cb -0.08 -3.59 -0.03 0.00 0.06 0.00 0.00 34.95 31.31 2vjj s ARG 702 CO 0.05 -0.18 -0.23 -0.51 -2.50 0.00 0.00 175.30 171.93 2vjj s LEU 703 N 1.77 2.43 -0.38 -0.88 1.43 0.32 -0.16 118.68 123.20 2vjj s LEU 703 Ca 0.21 -0.59 -0.23 0.00 -1.03 0.00 0.00 54.13 52.50 2vjj s LEU 703 Cb -0.15 -1.38 0.01 0.00 0.03 0.00 0.00 46.19 44.70 2vjj s LEU 703 CO 0.09 0.22 0.76 -0.32 0.23 0.00 0.00 176.35 177.33 2vjj s MET 704 N -1.69 3.67 -0.10 1.70 -2.45 -0.18 -0.87 119.30 119.40 2vjj s MET 704 Ca 0.14 0.19 -0.22 0.00 -1.25 0.00 0.00 55.69 54.55 2vjj s MET 704 Cb -0.10 -3.83 -0.04 0.00 1.25 0.00 0.00 34.83 32.11 2vjj s MET 704 CO 0.05 -0.88 0.65 -0.51 1.05 0.00 0.00 175.02 175.39 2vjj s LEU 705 N 3.06 4.28 -0.01 4.11 1.43 -0.37 -1.87 118.68 129.31 2vjj s LEU 705 Ca 0.30 1.07 0.06 0.00 -1.03 0.00 0.00 54.13 54.52 2vjj s LEU 705 Cb -0.13 -2.99 -0.01 0.00 0.03 0.00 0.00 46.19 43.09 2vjj s LEU 705 CO 0.17 -0.12 -0.18 -1.10 0.23 0.00 0.00 176.35 175.35 2vjj s GLN 706 N 0.95 1.50 -0.24 1.70 -0.21 0.68 -1.24 119.66 122.80 2vjj s GLN 706 Ca 0.34 -0.66 -0.02 0.00 0.02 0.00 0.00 55.36 55.04 2vjj s GLN 706 Cb -0.17 -1.45 0.08 0.00 1.00 0.00 0.00 33.01 32.47 2vjj s GLN 706 CO 0.15 0.40 0.06 0.50 -2.12 0.00 0.00 175.29 174.28 2vjj s ARG 707 N -0.43 0.64 -0.52 2.91 3.52 0.14 -0.41 118.95 124.80 2vjj s ARG 707 Ca 0.07 -0.66 0.00 0.00 -0.13 0.00 0.00 55.73 55.01 2vjj s ARG 707 Cb -0.07 -1.97 0.00 0.00 -1.56 0.00 0.00 34.95 31.34 2vjj s ARG 707 CO -0.01 -0.80 0.00 1.04 -0.81 0.00 0.00 175.30 174.73 2vjj n GLN 708 N 5.00 -1.19 0.00 5.12 6.02 -1.26 -1.86 117.38 129.21 2vjj n GLN 708 Ca -0.06 0.56 0.00 0.00 -0.01 0.00 0.00 57.00 57.49 2vjj n GLN 708 Cb 0.45 -4.58 0.00 0.00 1.02 0.00 0.00 30.24 27.13 2vjj n GLN 708 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38