#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4pah n VAL 118 N 0.00 0.00 -1.92 1.08 0.31 -1.26 -4.76 118.33 111.78 4pah n VAL 118 Ca 0.00 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 63.97 4pah n VAL 118 Cb 0.00 0.00 0.05 0.00 -0.91 0.00 0.00 33.84 32.98 4pah n VAL 118 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 4pah s PRO 119 N 0.00 2.84 0.49 5.55 0.04 -1.26 -4.94 135.00 137.72 4pah s PRO 119 Ca 0.00 1.93 -0.24 0.00 0.04 0.00 0.00 61.00 62.73 4pah s PRO 119 Cb 0.00 -1.92 -0.07 0.00 0.04 0.00 0.00 34.50 32.55 4pah s PRO 119 CO 0.00 -1.33 1.34 -0.46 0.04 0.00 0.00 177.00 176.59 4pah s TRP 120 N -1.51 2.50 0.01 0.56 -0.00 -1.26 -4.53 118.94 114.70 4pah s TRP 120 Ca 0.79 1.37 -0.07 0.00 -0.00 0.00 0.00 56.10 58.19 4pah s TRP 120 Cb -0.33 -3.75 0.00 0.00 -0.00 0.00 0.00 33.47 29.38 4pah s TRP 120 CO 0.36 -2.59 0.14 -0.59 -0.00 0.00 0.00 176.95 174.27 4pah s PHE 121 N -1.30 0.05 0.34 5.86 -0.71 -1.26 -4.78 117.98 116.17 4pah s PHE 121 Ca 0.65 -0.15 -0.28 0.00 -1.04 0.00 0.00 56.93 56.11 4pah s PHE 121 Cb -0.39 -0.05 -0.10 0.00 -1.21 0.00 0.00 43.02 41.27 4pah s PHE 121 CO 0.48 -0.30 1.29 -1.25 -1.34 0.00 0.00 175.22 174.11 4pah s PRO 122 N -1.46 4.34 -0.00 1.99 0.04 -1.26 -4.94 135.00 133.70 4pah s PRO 122 Ca -0.14 2.17 0.12 0.00 0.04 0.00 0.00 61.00 63.19 4pah s PRO 122 Cb -0.07 -3.04 -0.13 0.00 0.04 0.00 0.00 34.50 31.30 4pah s PRO 122 CO 0.01 -0.19 0.49 0.54 0.04 0.00 0.00 177.00 177.90 4pah n ARG 123 N 0.75 2.99 -4.22 4.56 1.74 -1.26 -4.86 116.66 116.36 4pah n ARG 123 Ca 0.00 -0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 56.94 4pah n ARG 123 Cb 0.42 -1.07 -0.10 0.00 -1.02 0.00 0.00 32.46 30.69 4pah n ARG 123 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 4pah s THR 124 N -2.14 1.07 0.43 0.55 -4.23 -1.26 -0.15 115.64 109.90 4pah s THR 124 Ca 0.04 -1.89 0.17 0.00 -1.18 0.00 0.00 61.69 58.83 4pah s THR 124 Cb 0.09 -1.65 0.19 0.00 1.34 0.00 0.00 72.50 72.47 4pah s THR 124 CO 0.49 -0.67 1.98 -0.29 -0.54 0.00 0.00 174.62 175.59 4pah h ILE 125 N 3.11 1.02 0.00 2.99 2.10 -1.81 -1.61 117.51 123.31 4pah h ILE 125 Ca -0.37 -0.72 -0.06 0.00 1.08 0.00 0.00 64.86 64.79 4pah h ILE 125 Cb 1.19 1.40 -0.01 0.00 -1.09 0.00 0.00 36.82 38.31 4pah h ILE 125 CO 0.59 0.20 -0.30 1.56 -1.08 0.00 0.00 178.15 179.12 4pah h GLN 126 N 0.00 0.00 0.00 2.19 7.50 -1.96 -2.81 115.11 120.03 4pah h GLN 126 Ca -0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 4pah h GLN 126 Cb 0.38 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.91 4pah h GLN 126 CO 0.03 0.30 0.00 0.39 -1.50 0.00 0.00 178.83 178.04 4pah n GLU 127 N -3.55 0.10 0.31 1.46 1.02 -0.61 -1.66 120.64 117.72 4pah n GLU 127 Ca -0.00 0.43 0.21 0.00 -0.02 0.00 0.00 57.16 57.78 4pah n GLU 127 Cb 0.44 -1.74 1.08 0.00 -0.02 0.00 0.00 31.44 31.21 4pah n GLU 127 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 4pah h LEU 128 N 0.00 0.00 -2.53 -4.62 3.38 -1.62 -1.05 115.31 108.87 4pah h LEU 128 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 4pah h LEU 128 Cb 0.20 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 4pah h LEU 128 CO 0.00 0.00 -0.00 0.44 0.09 0.00 0.00 178.44 178.97 4pah h ASP 129 N 0.00 0.00 0.41 -0.43 3.32 -1.56 -1.49 116.42 116.68 4pah h ASP 129 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 4pah h ASP 129 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 4pah h ASP 129 CO 0.00 0.00 0.00 -0.09 -1.72 0.00 0.00 179.24 177.43 4pah h ARG 130 N 0.00 0.00 -0.18 3.56 2.43 -1.41 -3.12 114.38 115.65 4pah h ARG 130 Ca -0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 4pah h ARG 130 Cb 0.00 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 4pah h ARG 130 CO 0.00 0.00 0.01 0.74 -1.51 0.00 0.00 179.97 179.21 4pah h PHE 131 N 0.00 0.26 -0.25 2.20 0.04 -1.48 -3.15 116.94 114.56 4pah h PHE 131 Ca 0.00 -0.01 0.07 0.00 2.80 0.00 0.00 57.97 60.83 4pah h PHE 131 Cb 0.21 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 38.26 4pah h PHE 131 CO 0.00 0.26 0.29 0.00 -0.60 0.00 0.00 178.31 178.26 4pah h ALA 132 N 1.76 1.87 -0.90 2.45 0.00 -1.76 0.10 119.26 122.79 4pah h ALA 132 Ca 0.06 -0.01 -0.43 0.00 0.00 0.00 0.00 54.91 54.53 4pah h ALA 132 Cb 0.16 0.02 -0.26 0.00 0.00 0.00 0.00 17.79 17.71 4pah h ALA 132 CO 0.00 -0.41 0.55 0.09 0.00 0.00 0.00 179.25 179.48 4pah n ASN 133 N -3.71 3.92 -0.42 0.00 3.02 -1.19 -4.13 115.26 112.74 4pah n ASN 133 Ca 0.03 -3.45 0.00 0.00 -0.03 0.00 0.00 54.58 51.14 4pah n ASN 133 Cb 0.42 -0.80 0.00 0.00 -0.61 0.00 0.00 39.78 38.79 4pah n ASN 133 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 4pah n GLN 134 N -0.86 0.00 -2.99 3.52 6.02 0.35 -5.11 117.38 118.30 4pah n GLN 134 Ca 0.53 -0.75 -0.23 0.00 -0.01 0.00 0.00 57.00 56.54 4pah n GLN 134 Cb 1.56 -0.41 0.01 0.00 1.02 0.00 0.00 30.24 32.43 4pah n GLN 134 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 4pah s ILE 135 N 0.00 3.97 -0.17 5.09 -4.36 -1.23 -4.46 121.20 120.04 4pah s ILE 135 Ca 0.00 -0.52 -0.29 0.00 -0.26 0.00 0.00 60.65 59.58 4pah s ILE 135 Cb 0.00 -3.47 -0.03 0.00 1.25 0.00 0.00 42.46 40.22 4pah s ILE 135 CO 0.00 -0.32 1.49 -0.22 0.24 0.00 0.00 174.94 176.13 4pah s LEU 136 N -4.55 4.08 0.40 0.37 2.96 -0.80 -4.91 118.68 116.24 4pah s LEU 136 Ca 0.48 1.75 0.22 0.00 -0.22 0.00 0.00 54.13 56.36 4pah s LEU 136 Cb -0.10 -3.53 0.67 0.00 0.50 0.00 0.00 46.19 43.73 4pah s LEU 136 CO 0.38 -1.02 1.72 0.28 -1.32 0.00 0.00 176.35 176.39 4pah h SER 137 N 9.57 0.00 -3.97 3.68 0.02 -1.96 -3.39 113.55 117.50 4pah h SER 137 Ca -0.32 0.00 -0.72 0.00 -0.84 0.00 0.00 61.79 59.91 4pah h SER 137 Cb 1.14 0.00 -0.32 0.00 0.14 0.00 0.00 62.40 63.35 4pah h SER 137 CO 0.98 0.28 -0.26 -0.31 -1.14 0.00 0.00 176.83 176.39 4pah s TYR 138 N -3.46 3.50 0.92 3.45 2.02 -1.26 -5.06 117.35 117.46 4pah s TYR 138 Ca 0.02 -2.46 -0.11 0.00 -0.37 0.00 0.00 57.07 54.15 4pah s TYR 138 Cb 0.09 -3.38 0.14 0.00 -0.40 0.00 0.00 41.96 38.42 4pah s TYR 138 CO 0.66 -0.89 1.10 0.20 -1.57 0.00 0.00 175.55 175.05 4pah s GLY 139 N 1.25 1.63 0.53 0.71 0.00 -1.26 -4.93 107.32 105.26 4pah s GLY 139 Ca 0.16 0.16 0.20 0.00 0.00 0.00 0.00 44.72 45.24 4pah s GLY 139 CO -0.05 0.64 2.12 0.00 0.00 0.00 0.00 173.10 175.81 4pah h ALA 140 N -1.73 2.06 0.00 3.20 0.00 -1.97 -0.17 119.26 120.65 4pah h ALA 140 Ca -0.49 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.42 4pah h ALA 140 Cb 1.28 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.08 4pah h ALA 140 CO 0.50 -0.17 0.00 -0.85 0.00 0.00 0.00 179.25 178.73 4pah n GLU 141 N -4.40 0.03 0.00 0.00 0.00 -1.26 -1.70 120.64 113.31 4pah n GLU 141 Ca 0.00 0.29 0.13 0.00 0.00 0.00 0.00 57.16 57.58 4pah n GLU 141 Cb 0.22 -1.57 0.40 0.00 0.00 0.00 0.00 31.44 30.49 4pah n GLU 141 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 4pah n LEU 142 N -1.63 0.67 -4.75 -1.84 4.77 -0.08 -4.47 117.00 109.67 4pah n LEU 142 Ca 0.03 -0.07 -0.40 0.00 -0.03 0.00 0.00 56.01 55.54 4pah n LEU 142 Cb 0.17 -0.20 -0.06 0.00 -2.33 0.00 0.00 43.42 41.00 4pah n LEU 142 CO 0.14 0.14 0.59 -1.81 -1.33 0.00 0.00 177.39 175.12 4pah s ASP 143 N -2.70 7.51 0.65 -1.43 1.01 -0.69 -4.92 116.67 116.10 4pah s ASP 143 Ca 0.20 1.79 0.40 0.00 0.71 0.00 0.00 52.55 55.64 4pah s ASP 143 Cb 0.19 -2.56 2.19 0.00 1.01 0.00 0.00 42.92 43.74 4pah s ASP 143 CO 0.57 0.10 2.28 0.00 0.21 0.00 0.00 175.17 178.33 4pah h ALA 144 N 4.69 1.18 0.00 5.23 0.00 -1.91 0.15 119.26 128.60 4pah h ALA 144 Ca -0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 4pah h ALA 144 Cb 1.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 4pah h ALA 144 CO 0.69 -0.07 0.00 0.22 0.00 0.00 0.00 179.25 180.09 4pah h ASP 145 N 0.00 0.00 -3.56 0.00 3.58 -1.93 -3.46 116.42 111.05 4pah h ASP 145 Ca 0.01 0.00 -0.52 0.00 0.42 0.00 0.00 57.03 56.94 4pah h ASP 145 Cb 0.13 0.00 0.04 0.00 1.72 0.00 0.00 39.33 41.22 4pah h ASP 145 CO -0.00 0.00 0.62 -2.28 -2.88 0.00 0.00 179.24 174.70 4pah s HIS 146 N -3.28 3.25 0.56 0.28 2.46 0.54 -4.90 115.29 114.20 4pah s HIS 146 Ca 0.07 1.33 0.28 0.00 0.47 0.00 0.00 55.06 57.21 4pah s HIS 146 Cb 0.09 -3.58 1.47 0.00 -0.13 0.00 0.00 32.58 30.43 4pah s HIS 146 CO 0.56 -1.69 1.96 -1.35 -2.47 0.00 0.00 174.74 171.75 4pah h PRO 147 N 4.68 0.00 -0.68 2.88 0.11 -1.90 -1.03 132.00 136.06 4pah h PRO 147 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 4pah h PRO 147 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 4pah h PRO 147 CO 0.73 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.93 4pah n GLY 148 N -1.59 2.56 0.25 -0.55 0.00 -1.26 -4.70 105.19 99.90 4pah n GLY 148 Ca 0.10 -0.75 -0.01 0.00 0.00 0.00 0.00 46.02 45.36 4pah n GLY 148 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 4pah h PHE 149 N 3.99 0.58 -0.10 1.61 3.57 -1.40 -2.22 116.94 122.95 4pah h PHE 149 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 4pah h PHE 149 Cb 0.99 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 39.57 4pah h PHE 149 CO 0.48 0.24 0.00 1.63 -2.23 0.00 0.00 178.31 178.42 4pah n LYS 150 N -4.87 1.37 -3.44 1.11 5.02 -1.26 -4.71 118.16 111.39 4pah n LYS 150 Ca 0.09 -0.57 -0.43 0.00 -2.02 0.00 0.00 58.31 55.37 4pah n LYS 150 Cb 0.22 -1.30 -0.07 0.00 -0.02 0.00 0.00 35.03 33.87 4pah n LYS 150 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 4pah s ASP 151 N -1.44 5.97 0.50 4.39 -1.08 -0.84 -4.96 116.67 119.21 4pah s ASP 151 Ca 0.26 -1.95 0.24 0.00 -0.52 0.00 0.00 52.55 50.58 4pah s ASP 151 Cb 0.13 -2.10 1.35 0.00 -1.46 0.00 0.00 42.92 40.84 4pah s ASP 151 CO 0.20 -0.75 2.06 1.55 0.52 0.00 0.00 175.17 178.75 4pah h PRO 152 N 8.54 0.00 -0.14 4.34 0.13 -1.84 -1.04 132.00 141.99 4pah h PRO 152 Ca -0.22 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.87 4pah h PRO 152 Cb 1.08 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.20 4pah h PRO 152 CO 0.92 0.14 -0.06 0.28 -0.23 0.00 0.00 178.00 179.05 4pah h VAL 153 N 0.00 1.31 -0.41 1.56 2.07 -1.95 -1.40 116.25 117.43 4pah h VAL 153 Ca -0.00 -1.08 0.01 0.00 0.82 0.00 0.00 66.70 66.45 4pah h VAL 153 Cb 0.33 1.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.80 4pah h VAL 153 CO 0.02 0.32 0.25 0.22 0.02 0.00 0.00 177.57 178.40 4pah h TYR 154 N -0.04 0.48 -0.59 1.57 3.20 -1.66 -0.16 116.97 119.77 4pah h TYR 154 Ca 0.03 0.01 0.07 0.00 3.14 0.00 0.00 58.73 61.99 4pah h TYR 154 Cb 0.52 -0.16 -0.06 0.00 1.54 0.00 0.00 36.73 38.57 4pah h TYR 154 CO 0.06 0.29 0.26 -0.09 -1.64 0.00 0.00 178.16 177.04 4pah h ARG 155 N 0.51 0.47 -0.26 1.82 9.65 -1.20 0.51 114.38 125.88 4pah h ARG 155 Ca 0.16 -0.03 -0.12 0.00 -1.10 0.00 0.00 59.98 58.89 4pah h ARG 155 Cb -0.02 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 28.44 4pah h ARG 155 CO -0.06 0.31 -0.34 0.00 2.80 0.00 0.00 179.97 182.68 4pah h ALA 156 N 1.36 0.91 -0.63 2.80 0.00 -0.79 -2.42 119.26 120.50 4pah h ALA 156 Ca 0.28 -0.41 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 4pah h ALA 156 Cb 0.28 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 4pah h ALA 156 CO -0.24 0.62 0.06 -0.09 0.00 0.00 0.00 179.25 179.60 4pah h ARG 157 N 0.48 1.06 -0.56 0.00 9.65 -0.22 -1.18 114.38 123.61 4pah h ARG 157 Ca 0.05 -0.30 -0.06 0.00 -1.10 0.00 0.00 59.98 58.58 4pah h ARG 157 Cb 0.83 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 29.27 4pah h ARG 157 CO 0.07 0.99 0.10 0.00 2.80 0.00 0.00 179.97 183.94 4pah h ARG 158 N 0.98 0.87 -0.48 0.20 2.47 -0.75 -1.82 114.38 115.85 4pah h ARG 158 Ca 0.19 -0.20 -0.09 0.00 -1.26 0.00 0.00 59.98 58.62 4pah h ARG 158 Cb 0.48 -0.12 -0.02 0.00 -1.65 0.00 0.00 29.97 28.66 4pah h ARG 158 CO 0.02 0.81 -0.06 -0.22 0.56 0.00 0.00 179.97 181.08 4pah h LYS 159 N 0.83 0.84 -0.34 0.04 3.11 -1.06 -0.03 116.57 119.97 4pah h LYS 159 Ca 0.18 -0.26 -0.01 0.00 -2.81 0.00 0.00 60.65 57.75 4pah h LYS 159 Cb 0.35 -0.08 -0.02 0.00 -1.00 0.00 0.00 32.23 31.48 4pah h LYS 159 CO 0.00 0.88 0.18 0.37 -2.81 0.00 0.00 179.45 178.08 4pah h GLN 160 N 0.77 0.47 -0.27 1.90 4.15 -0.58 0.01 115.11 121.55 4pah h GLN 160 Ca 0.14 -0.05 -0.12 0.00 0.77 0.00 0.00 58.65 59.38 4pah h GLN 160 Cb 0.55 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 28.13 4pah h GLN 160 CO 0.03 0.39 -0.32 0.74 -1.93 0.00 0.00 178.83 177.74 4pah h PHE 161 N 0.42 0.67 -0.76 3.99 0.04 -1.03 -2.54 116.94 117.73 4pah h PHE 161 Ca 0.12 -0.17 0.00 0.00 2.80 0.00 0.00 57.97 60.72 4pah h PHE 161 Cb 0.06 -0.15 -0.04 0.00 2.20 0.00 0.00 35.95 38.02 4pah h PHE 161 CO -0.03 0.83 0.47 0.00 -0.60 0.00 0.00 178.31 178.99 4pah h ALA 162 N 1.15 1.41 -0.34 2.45 0.00 -0.58 -1.96 119.26 121.39 4pah h ALA 162 Ca 0.06 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 4pah h ALA 162 Cb 0.80 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 4pah h ALA 162 CO 0.07 0.52 -0.21 -0.44 0.00 0.00 0.00 179.25 179.19 4pah h ASP 163 N 1.04 0.65 -0.62 0.00 3.32 -0.79 0.25 116.42 120.27 4pah h ASP 163 Ca 0.27 -0.22 -0.04 0.00 0.02 0.00 0.00 57.03 57.07 4pah h ASP 163 Cb -0.07 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.27 4pah h ASP 163 CO -0.05 0.85 0.24 0.40 -1.72 0.00 0.00 179.24 178.96 4pah h ILE 164 N 0.57 1.23 -0.38 0.35 2.04 -1.03 -2.12 117.51 118.18 4pah h ILE 164 Ca 0.09 -0.74 -0.14 0.00 1.00 0.00 0.00 64.86 65.06 4pah h ILE 164 Cb 0.67 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 4pah h ILE 164 CO 0.05 0.29 -0.32 0.00 0.00 0.00 0.00 178.15 178.17 4pah h ALA 165 N 1.09 0.55 -0.91 1.87 0.00 -1.06 -2.72 119.26 118.08 4pah h ALA 165 Ca 0.21 -0.43 0.06 0.00 0.00 0.00 0.00 54.91 54.75 4pah h ALA 165 Cb 0.22 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.83 4pah h ALA 165 CO -0.02 0.60 0.59 -0.92 0.00 0.00 0.00 179.25 179.51 4pah h TYR 166 N 0.69 1.06 -0.01 0.00 3.20 -0.71 -2.64 116.97 118.56 4pah h TYR 166 Ca 0.07 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.96 4pah h TYR 166 Cb 0.90 -0.35 0.00 0.00 1.54 0.00 0.00 36.73 38.82 4pah h TYR 166 CO 0.06 0.56 -0.22 0.09 -1.64 0.00 0.00 178.16 177.01 4pah n ASN 167 N -4.48 0.80 -4.77 -2.11 3.02 -0.82 -4.93 115.26 101.96 4pah n ASN 167 Ca 0.14 -0.72 -0.37 0.00 -0.03 0.00 0.00 54.58 53.60 4pah n ASN 167 Cb 0.19 0.07 -0.02 0.00 -0.61 0.00 0.00 39.78 39.41 4pah n ASN 167 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 4pah s TYR 168 N -2.54 2.96 0.01 3.10 5.04 -1.00 -5.04 117.35 119.89 4pah s TYR 168 Ca 0.25 1.56 0.02 0.00 -2.44 0.00 0.00 57.07 56.45 4pah s TYR 168 Cb 0.19 -3.32 -0.01 0.00 0.35 0.00 0.00 41.96 39.17 4pah s TYR 168 CO 0.52 -1.30 -0.06 1.03 -1.34 0.00 0.00 175.55 174.40 4pah s ARG 169 N -2.66 0.46 0.28 4.97 1.81 -1.26 -5.02 118.95 117.53 4pah s ARG 169 Ca 0.62 -0.40 -0.29 0.00 -1.72 0.00 0.00 55.73 53.95 4pah s ARG 169 Cb -0.27 -0.36 -0.14 0.00 -0.45 0.00 0.00 34.95 33.73 4pah s ARG 169 CO 0.33 0.09 1.09 1.58 -0.68 0.00 0.00 175.30 177.71 4pah n HIS 170 N 2.39 1.48 0.00 -0.53 -0.00 -1.26 -1.62 115.22 115.68 4pah n HIS 170 Ca -0.17 0.66 0.00 0.00 -0.00 0.00 0.00 57.72 58.22 4pah n HIS 170 Cb 0.57 -2.29 0.00 0.00 -0.00 0.00 0.00 29.99 28.27 4pah n HIS 170 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 4pah n GLY 171 N 1.29 3.19 3.83 1.57 0.00 -1.26 -5.06 105.19 108.75 4pah n GLY 171 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 4pah n GLY 171 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 4pah s GLN 172 N -0.48 4.11 0.59 1.61 -0.21 -0.64 -5.03 119.66 119.62 4pah s GLN 172 Ca 0.00 1.04 -0.18 0.00 0.02 0.00 0.00 55.36 56.24 4pah s GLN 172 Cb 0.00 -2.17 -0.04 0.00 1.00 0.00 0.00 33.01 31.81 4pah s GLN 172 CO 0.00 -0.12 1.17 -1.25 -2.12 0.00 0.00 175.29 172.96 4pah s PRO 173 N -3.54 3.06 0.06 2.91 0.04 -1.26 -4.95 135.00 131.31 4pah s PRO 173 Ca 0.61 1.70 -0.29 0.00 0.04 0.00 0.00 61.00 63.05 4pah s PRO 173 Cb -0.09 -1.96 -0.05 0.00 0.04 0.00 0.00 34.50 32.44 4pah s PRO 173 CO 0.21 -1.11 0.94 0.42 0.04 0.00 0.00 177.00 177.50 4pah s ILE 174 N -1.76 4.67 0.24 0.56 1.01 -1.26 -4.97 121.20 119.70 4pah s ILE 174 Ca 0.74 2.01 -0.31 0.00 0.00 0.00 0.00 60.65 63.10 4pah s ILE 174 Cb -0.27 -4.30 -0.14 0.00 0.01 0.00 0.00 42.46 37.77 4pah s ILE 174 CO 0.32 0.26 1.30 -2.65 0.00 0.00 0.00 174.94 174.17 4pah n PRO 175 N 3.24 1.78 -3.12 2.79 -0.02 -1.26 -4.48 135.00 133.93 4pah n PRO 175 Ca 0.03 0.63 -0.33 0.00 -2.02 0.00 0.00 63.50 61.81 4pah n PRO 175 Cb 0.50 -2.22 -0.06 0.00 -0.02 0.00 0.00 33.50 31.70 4pah n PRO 175 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 4pah s ARG 176 N -0.67 4.08 -0.01 -0.52 0.52 -1.26 -4.87 118.95 116.21 4pah s ARG 176 Ca 0.67 0.74 0.04 0.00 -0.52 0.00 0.00 55.73 56.66 4pah s ARG 176 Cb -0.69 -2.54 -0.01 0.00 0.52 0.00 0.00 34.95 32.23 4pah s ARG 176 CO 0.53 0.21 -0.13 0.08 0.02 0.00 0.00 175.30 176.00 4pah s VAL 177 N -1.87 1.06 -0.38 3.52 1.01 -1.26 -5.09 120.40 117.38 4pah s VAL 177 Ca 0.52 -0.57 -0.21 0.00 0.00 0.00 0.00 61.98 61.71 4pah s VAL 177 Cb -0.12 -0.88 0.01 0.00 0.00 0.00 0.00 36.38 35.39 4pah s VAL 177 CO 0.18 0.30 0.66 -0.70 0.00 0.00 0.00 175.10 175.54 4pah s GLU 178 N -0.32 3.59 0.36 2.72 2.12 -1.26 -5.02 118.70 120.89 4pah s GLU 178 Ca 0.05 -0.02 -0.25 0.00 0.36 0.00 0.00 54.97 55.12 4pah s GLU 178 Cb -0.05 -3.85 -0.10 0.00 0.26 0.00 0.00 34.13 30.39 4pah s GLU 178 CO -0.01 -0.83 0.97 0.71 -0.54 0.00 0.00 175.26 175.57 4pah s TYR 179 N 2.81 3.52 0.71 5.30 2.02 -1.26 -5.04 117.35 125.41 4pah s TYR 179 Ca 0.25 1.72 -0.11 0.00 -0.37 0.00 0.00 57.07 58.56 4pah s TYR 179 Cb -0.14 -2.95 0.02 0.00 -0.40 0.00 0.00 41.96 38.48 4pah s TYR 179 CO 0.16 -0.05 1.07 -1.64 -1.57 0.00 0.00 175.55 173.53 4pah s MET 180 N -2.39 2.79 0.28 -0.62 -1.94 -1.26 -4.83 119.30 111.33 4pah s MET 180 Ca 0.54 0.77 -0.03 0.00 -1.71 0.00 0.00 55.69 55.26 4pah s MET 180 Cb -0.17 -1.99 0.40 0.00 2.01 0.00 0.00 34.83 35.08 4pah s MET 180 CO 0.22 -1.15 1.95 0.93 -0.01 0.00 0.00 175.02 176.96 4pah h GLU 181 N -0.75 1.15 -0.57 2.03 4.39 -1.99 -0.93 114.58 117.91 4pah h GLU 181 Ca -0.45 -0.07 -0.03 0.00 0.34 0.00 0.00 59.36 59.15 4pah h GLU 181 Cb 1.23 -0.26 -0.03 0.00 -0.10 0.00 0.00 28.75 29.59 4pah h GLU 181 CO 0.59 0.76 0.21 0.93 -1.16 0.00 0.00 179.01 180.35 4pah h GLU 182 N 1.19 0.82 -0.27 2.33 3.07 -2.00 -1.15 114.58 118.57 4pah h GLU 182 Ca 0.34 -0.13 -0.19 0.00 -0.50 0.00 0.00 59.36 58.88 4pah h GLU 182 Cb -0.09 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 27.68 4pah h GLU 182 CO -0.08 0.69 -0.55 0.93 -1.40 0.00 0.00 179.01 178.59 4pah h GLU 183 N 0.81 0.86 -0.22 2.33 5.08 -1.64 -2.49 114.58 119.31 4pah h GLU 183 Ca 0.19 -0.56 -0.07 0.00 -1.00 0.00 0.00 59.36 57.93 4pah h GLU 183 Cb 0.18 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 4pah h GLU 183 CO -0.02 1.19 -0.17 0.87 -1.00 0.00 0.00 179.01 179.88 4pah h LYS 184 N 0.63 0.37 -0.35 2.33 1.57 -0.88 -1.88 116.57 118.38 4pah h LYS 184 Ca 0.01 -0.11 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 4pah h LYS 184 Cb 1.16 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.42 4pah h LYS 184 CO 0.12 0.54 0.18 -0.22 -0.57 0.00 0.00 179.45 179.50 4pah h LYS 185 N 0.35 0.50 -0.13 3.15 3.64 -1.06 0.32 116.57 123.34 4pah h LYS 185 Ca 0.06 -0.07 0.01 0.00 -1.27 0.00 0.00 60.65 59.38 4pah h LYS 185 Cb 0.50 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 4pah h LYS 185 CO 0.03 0.43 0.06 1.15 -2.27 0.00 0.00 179.45 178.86 4pah h THR 186 N 0.43 1.00 -0.49 1.00 2.02 -0.98 -1.61 112.91 114.27 4pah h THR 186 Ca 0.12 -0.05 0.07 0.00 0.77 0.00 0.00 66.41 67.32 4pah h THR 186 Cb 0.09 0.85 -0.06 0.00 -1.74 0.00 0.00 68.15 67.30 4pah h THR 186 CO -0.02 0.03 0.17 -0.25 0.37 0.00 0.00 175.52 175.81 4pah h TRP 187 N 0.14 0.29 -0.86 3.16 2.91 -1.21 -2.31 115.95 118.07 4pah h TRP 187 Ca 0.05 0.03 0.01 0.00 1.13 0.00 0.00 58.89 60.11 4pah h TRP 187 Cb 0.01 -0.06 -0.04 0.00 -0.51 0.00 0.00 29.16 28.56 4pah h TRP 187 CO -0.09 0.09 0.56 0.78 -1.03 0.00 0.00 178.44 178.75 4pah h GLY 188 N 0.34 1.21 1.00 2.65 0.00 -0.58 -0.19 103.07 107.50 4pah h GLY 188 Ca 0.24 -0.44 -0.01 0.00 0.00 0.00 0.00 47.33 47.12 4pah h GLY 188 CO -0.25 0.42 -0.06 -0.84 0.00 0.00 0.00 176.54 175.81 4pah h THR 189 N 1.14 0.87 -0.27 4.70 2.02 -1.00 -1.00 112.91 119.38 4pah h THR 189 Ca 0.32 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.50 4pah h THR 189 Cb -0.11 0.87 -0.01 0.00 -1.74 0.00 0.00 68.15 67.16 4pah h THR 189 CO -0.08 0.00 0.17 0.58 0.37 0.00 0.00 175.52 176.56 4pah h VAL 190 N -0.17 1.09 0.00 3.16 2.07 -1.13 -2.28 116.25 119.00 4pah h VAL 190 Ca -0.02 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.31 4pah h VAL 190 Cb 0.13 0.73 -0.00 0.00 -1.52 0.00 0.00 31.29 30.63 4pah h VAL 190 CO 0.03 0.09 -0.01 0.15 0.02 0.00 0.00 177.57 177.85 4pah h PHE 191 N 0.35 -0.02 -0.40 1.57 3.57 -0.99 -0.98 116.94 120.04 4pah h PHE 191 Ca 0.10 0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.49 4pah h PHE 191 Cb -0.00 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 4pah h PHE 191 CO -0.05 -0.01 -0.18 0.87 -2.23 0.00 0.00 178.31 176.70 4pah h LYS 192 N -0.02 0.75 -0.13 1.11 1.57 -1.14 -1.05 116.57 117.67 4pah h LYS 192 Ca 0.00 -0.28 -0.16 0.00 -1.87 0.00 0.00 60.65 58.34 4pah h LYS 192 Cb 0.02 -0.05 0.01 0.00 0.08 0.00 0.00 32.23 32.29 4pah h LYS 192 CO -0.01 0.88 -0.55 1.15 -0.57 0.00 0.00 179.45 180.36 4pah h THR 193 N 0.67 1.34 -0.04 -0.16 2.02 -1.25 -3.26 112.91 112.23 4pah h THR 193 Ca 0.10 -1.83 -0.15 0.00 0.77 0.00 0.00 66.41 65.30 4pah h THR 193 Cb 0.68 2.10 -0.01 0.00 -1.74 0.00 0.00 68.15 69.17 4pah h THR 193 CO 0.05 0.56 -0.64 -0.07 0.37 0.00 0.00 175.52 175.79 4pah h LEU 194 N 0.24 0.19 -1.74 2.58 3.38 -1.08 -3.30 115.31 115.58 4pah h LEU 194 Ca -0.03 -0.12 0.05 0.00 0.09 0.00 0.00 57.88 57.87 4pah h LEU 194 Cb 1.18 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.85 4pah h LEU 194 CO 0.11 0.78 0.26 0.50 0.09 0.00 0.00 178.44 180.18 4pah h LYS 195 N 0.12 0.32 0.00 1.13 3.64 -1.23 -0.02 116.57 120.53 4pah h LYS 195 Ca -0.01 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.35 4pah h LYS 195 Cb 1.16 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.90 4pah h LYS 195 CO 0.09 0.21 -0.01 0.66 -2.27 0.00 0.00 179.45 178.13 4pah h SER 196 N 0.33 0.00 0.67 4.20 4.64 -1.68 -3.05 113.55 118.65 4pah h SER 196 Ca 0.16 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.31 4pah h SER 196 Cb 0.24 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.30 4pah h SER 196 CO -0.04 0.01 -1.45 0.18 -0.87 0.00 0.00 176.83 174.67 4pah n LEU 197 N -3.40 0.82 -0.23 5.97 4.77 -0.02 -4.61 117.00 120.30 4pah n LEU 197 Ca -0.03 0.36 -0.01 0.00 -0.03 0.00 0.00 56.01 56.30 4pah n LEU 197 Cb 0.10 0.08 0.10 0.00 -2.33 0.00 0.00 43.42 41.37 4pah n LEU 197 CO 0.24 0.15 1.08 1.88 -1.33 0.00 0.00 177.39 179.41 4pah h TYR 198 N 0.00 0.67 -0.85 -1.77 0.05 -1.60 -0.29 116.97 113.18 4pah h TYR 198 Ca -0.17 0.03 0.11 0.00 0.05 0.00 0.00 58.73 58.74 4pah h TYR 198 Cb 1.59 -0.20 -0.06 0.00 1.01 0.00 0.00 36.73 39.07 4pah h TYR 198 CO 0.00 0.31 0.55 -0.22 -1.05 0.00 0.00 178.16 177.75 4pah h LYS 199 N 0.67 0.74 0.00 4.88 3.64 -1.82 -0.67 116.57 124.02 4pah h LYS 199 Ca 0.30 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.57 4pah h LYS 199 Cb 0.20 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 4pah h LYS 199 CO -0.19 0.49 -1.89 0.25 -2.27 0.00 0.00 179.45 175.84 4pah n THR 200 N -4.53 0.36 0.09 1.00 -2.24 -0.97 -4.67 114.28 103.32 4pah n THR 200 Ca 0.15 -0.57 0.05 0.00 -2.27 0.00 0.00 64.05 61.41 4pah n THR 200 Cb 0.36 -0.16 -0.08 0.00 -2.10 0.00 0.00 70.33 68.36 4pah n THR 200 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 4pah n HIS 201 N -2.42 0.00 -3.46 4.78 8.25 -0.16 -5.02 115.22 117.19 4pah n HIS 201 Ca -0.08 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.05 4pah n HIS 201 Cb 0.67 -0.20 -0.05 0.00 1.12 0.00 0.00 29.99 31.53 4pah n HIS 201 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 4pah s ALA 202 N -2.59 3.62 0.76 -1.41 0.00 -0.28 -1.00 121.76 120.86 4pah s ALA 202 Ca -0.02 -0.29 -0.14 0.00 0.00 0.00 0.00 51.96 51.50 4pah s ALA 202 Cb 0.07 -2.40 0.06 0.00 0.00 0.00 0.00 23.12 20.85 4pah s ALA 202 CO 0.44 0.52 1.21 0.00 0.00 0.00 0.00 175.76 177.94 4pah h TYR 204 N -0.53 0.48 -0.64 0.00 3.20 -1.97 -0.77 116.97 116.75 4pah h TYR 204 Ca -0.47 0.05 0.04 0.00 3.14 0.00 0.00 58.73 61.48 4pah h TYR 204 Cb 1.30 -0.07 -0.04 0.00 1.54 0.00 0.00 36.73 39.46 4pah h TYR 204 CO 0.47 -0.14 0.42 0.93 -1.64 0.00 0.00 178.16 178.20 4pah h GLU 205 N 0.29 0.72 0.15 1.82 3.07 -1.98 -0.39 114.58 118.25 4pah h GLU 205 Ca 0.55 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.36 59.36 4pah h GLU 205 Cb 1.09 -0.16 0.00 0.00 -0.84 0.00 0.00 28.75 28.83 4pah h GLU 205 CO -0.59 0.48 -0.07 -0.92 -1.40 0.00 0.00 179.01 176.50 4pah h TYR 206 N 0.74 -0.18 0.00 4.33 5.03 -1.45 -2.95 116.97 122.49 4pah h TYR 206 Ca 0.26 -0.00 -0.05 0.00 2.58 0.00 0.00 58.73 61.51 4pah h TYR 206 Cb 0.10 0.06 -0.01 0.00 1.55 0.00 0.00 36.73 38.43 4pah h TYR 206 CO -0.00 0.11 -0.23 -0.91 -1.32 0.00 0.00 178.16 175.81 4pah h ASN 207 N -0.49 0.00 -0.48 -2.11 2.35 -1.31 -1.20 115.58 112.34 4pah h ASN 207 Ca -0.02 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.65 4pah h ASN 207 Cb 0.38 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.73 4pah h ASN 207 CO 0.03 0.23 0.00 -0.74 -1.65 0.00 0.00 177.43 175.31 4pah h HIS 208 N 0.00 0.93 0.00 1.19 -0.00 -1.05 -3.25 115.15 112.97 4pah h HIS 208 Ca -0.00 -0.16 -0.16 0.00 -0.00 0.00 0.00 60.37 60.04 4pah h HIS 208 Cb 0.51 -0.24 -0.03 0.00 -0.00 0.00 0.00 27.41 27.65 4pah h HIS 208 CO 0.00 0.88 -1.37 0.97 -0.00 0.00 0.00 177.93 178.41 4pah h ILE 209 N 0.71 0.50 -0.75 6.26 6.09 -1.32 -3.40 117.51 125.59 4pah h ILE 209 Ca 0.14 -1.98 0.17 0.00 -1.37 0.00 0.00 64.86 61.82 4pah h ILE 209 Cb 0.51 2.04 -0.12 0.00 0.47 0.00 0.00 36.82 39.72 4pah h ILE 209 CO 0.02 0.29 0.16 0.15 -3.07 0.00 0.00 178.15 175.70 4pah h PHE 210 N 0.00 0.23 -0.82 2.19 3.57 -1.25 -0.45 116.94 120.40 4pah h PHE 210 Ca -0.15 0.05 0.06 0.00 3.53 0.00 0.00 57.97 61.45 4pah h PHE 210 Cb 1.57 0.02 -0.05 0.00 2.79 0.00 0.00 35.95 40.27 4pah h PHE 210 CO 0.00 -0.13 0.54 -1.35 -2.23 0.00 0.00 178.31 175.14 4pah h PRO 211 N 0.23 0.90 -0.25 6.41 0.11 -1.78 -1.00 132.00 136.63 4pah h PRO 211 Ca 0.43 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 66.37 4pah h PRO 211 Cb 0.75 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.65 4pah h PRO 211 CO -0.55 0.60 -0.33 -0.07 -0.21 0.00 0.00 178.00 177.44 4pah h LEU 212 N 0.93 0.56 -0.49 2.35 3.38 -1.35 -1.20 115.31 119.49 4pah h LEU 212 Ca 0.35 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 58.05 4pah h LEU 212 Cb 0.18 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 4pah h LEU 212 CO -0.12 0.85 0.13 -0.07 0.09 0.00 0.00 178.44 179.32 4pah h LEU 213 N 0.46 0.75 -0.58 1.67 3.38 -0.76 0.86 115.31 121.08 4pah h LEU 213 Ca 0.05 -0.23 0.04 0.00 0.09 0.00 0.00 57.88 57.83 4pah h LEU 213 Cb 0.79 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.30 4pah h LEU 213 CO 0.06 0.78 0.33 -0.33 0.09 0.00 0.00 178.44 179.38 4pah h GLU 214 N 0.68 0.63 0.04 1.13 5.08 -1.01 -0.13 114.58 120.99 4pah h GLU 214 Ca 0.16 -0.04 -0.19 0.00 -1.00 0.00 0.00 59.36 58.28 4pah h GLU 214 Cb 0.32 -0.14 0.02 0.00 0.50 0.00 0.00 28.75 29.45 4pah h GLU 214 CO 0.00 0.42 -0.78 0.87 -1.00 0.00 0.00 179.01 178.52 4pah h LYS 215 N 0.65 0.46 0.00 2.33 1.57 -1.07 -3.27 116.57 117.24 4pah h LYS 215 Ca 0.25 -0.55 0.00 0.00 -1.87 0.00 0.00 60.65 58.48 4pah h LYS 215 Cb 0.08 0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.56 4pah h LYS 215 CO -0.13 1.19 -1.23 0.66 -0.57 0.00 0.00 179.45 179.37 4pah n TYR 216 N -4.10 0.00 0.21 -1.35 4.02 0.28 -4.51 117.16 111.72 4pah n TYR 216 Ca -0.11 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 57.82 4pah n TYR 216 Cb 0.77 -0.16 0.06 0.00 -0.02 0.00 0.00 39.34 39.99 4pah n TYR 216 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 4pah n GLY 218 N 0.44 0.09 3.56 0.00 0.00 -1.07 -4.66 105.19 103.55 4pah n GLY 218 Ca 0.06 -0.53 -0.40 0.00 0.00 0.00 0.00 46.02 45.15 4pah n GLY 218 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 4pah s PHE 219 N -2.43 2.00 0.08 1.61 0.40 -1.08 -4.52 117.98 114.04 4pah s PHE 219 Ca 0.00 0.50 -0.20 0.00 -0.60 0.00 0.00 56.93 56.63 4pah s PHE 219 Cb 0.00 -4.30 0.05 0.00 0.51 0.00 0.00 43.02 39.28 4pah s PHE 219 CO 0.00 -2.20 0.47 -1.58 0.70 0.00 0.00 175.22 172.61 4pah s HIS 220 N 7.28 -0.34 0.49 0.36 2.46 -1.26 -4.42 115.29 119.86 4pah s HIS 220 Ca 0.57 0.24 0.27 0.00 0.47 0.00 0.00 55.06 56.60 4pah s HIS 220 Cb -0.12 0.32 1.57 0.00 -0.13 0.00 0.00 32.58 34.22 4pah s HIS 220 CO 0.22 -0.67 2.14 0.93 -2.47 0.00 0.00 174.74 174.89 4pah h GLU 221 N 2.61 0.00 -0.41 2.88 5.08 -1.91 -2.78 114.58 120.05 4pah h GLU 221 Ca -0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.04 4pah h GLU 221 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 4pah h GLU 221 CO 0.43 0.07 0.00 -0.25 -1.00 0.00 0.00 179.01 178.26 4pah n ASP 222 N -3.81 3.08 -3.75 1.42 8.00 -1.26 -3.74 116.55 116.49 4pah n ASP 222 Ca -0.02 -1.94 -0.13 0.00 0.71 0.00 0.00 54.79 53.40 4pah n ASP 222 Cb 0.17 -0.27 -0.13 0.00 -0.02 0.00 0.00 41.12 40.87 4pah n ASP 222 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 4pah s ASN 223 N -1.37 -0.21 -0.22 -2.24 2.47 -1.05 -5.04 114.94 107.28 4pah s ASN 223 Ca 0.38 0.43 -0.20 0.00 0.42 0.00 0.00 52.86 53.89 4pah s ASN 223 Cb 0.21 0.35 -0.02 0.00 -1.45 0.00 0.00 41.25 40.34 4pah s ASN 223 CO 0.30 -0.13 0.61 -0.63 -3.72 0.00 0.00 177.10 173.52 4pah s ILE 224 N 0.92 5.02 0.57 -5.21 1.01 -1.26 -4.25 121.20 118.01 4pah s ILE 224 Ca -0.07 1.12 -0.21 0.00 0.00 0.00 0.00 60.65 61.49 4pah s ILE 224 Cb -0.08 -3.92 -0.04 0.00 0.01 0.00 0.00 42.46 38.43 4pah s ILE 224 CO -0.05 0.08 1.34 -2.65 0.00 0.00 0.00 174.94 173.66 4pah n PRO 225 N 5.31 1.55 -3.25 2.79 -0.02 -1.26 -4.99 135.00 135.14 4pah n PRO 225 Ca -0.02 0.58 -0.39 0.00 -2.02 0.00 0.00 63.50 61.66 4pah n PRO 225 Cb 0.49 -2.56 -0.06 0.00 -0.02 0.00 0.00 33.50 31.35 4pah n PRO 225 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 4pah s GLN 226 N -3.00 4.23 0.36 -0.52 -1.52 -1.26 -4.98 119.66 112.97 4pah s GLN 226 Ca 0.74 0.77 0.03 0.00 -1.95 0.00 0.00 55.36 54.95 4pah s GLN 226 Cb -0.41 -3.25 0.69 0.00 -0.22 0.00 0.00 33.01 29.82 4pah s GLN 226 CO 0.47 0.62 2.02 -0.07 -0.25 0.00 0.00 175.29 178.07 4pah h LEU 227 N 4.61 0.67 -0.55 2.90 3.38 -1.91 -2.30 115.31 122.11 4pah h LEU 227 Ca -0.49 -0.02 0.06 0.00 0.09 0.00 0.00 57.88 57.52 4pah h LEU 227 Cb 1.21 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.74 4pah h LEU 227 CO 0.64 0.49 0.25 -0.08 0.09 0.00 0.00 178.44 179.83 4pah h GLU 228 N 0.79 0.47 -0.69 1.13 4.57 -1.90 0.30 114.58 119.25 4pah h GLU 228 Ca 0.22 -0.03 -0.08 0.00 -1.18 0.00 0.00 59.36 58.30 4pah h GLU 228 Cb -0.07 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.39 4pah h GLU 228 CO -0.05 0.31 0.14 -0.44 -1.18 0.00 0.00 179.01 177.79 4pah h ASP 229 N 0.48 1.08 -0.36 1.04 3.32 -1.81 0.26 116.42 120.44 4pah h ASP 229 Ca 0.25 -0.25 -0.15 0.00 0.02 0.00 0.00 57.03 56.91 4pah h ASP 229 Cb 0.21 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 4pah h ASP 229 CO -0.21 1.05 -0.35 0.58 -1.72 0.00 0.00 179.24 178.59 4pah h VAL 230 N 1.06 1.28 -0.58 -1.35 2.07 -1.07 -1.72 116.25 115.93 4pah h VAL 230 Ca 0.21 -1.53 -0.02 0.00 0.82 0.00 0.00 66.70 66.18 4pah h VAL 230 Cb 0.41 1.43 -0.03 0.00 -1.52 0.00 0.00 31.29 31.59 4pah h VAL 230 CO 0.01 0.51 0.28 -1.28 0.02 0.00 0.00 177.57 177.10 4pah h SER 231 N 0.68 0.77 -0.79 0.57 0.87 -0.16 0.60 113.55 116.08 4pah h SER 231 Ca 0.06 -0.14 -0.01 0.00 -1.23 0.00 0.00 61.79 60.47 4pah h SER 231 Cb 0.94 -0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 62.67 4pah h SER 231 CO 0.09 0.69 0.47 1.56 -0.53 0.00 0.00 176.83 179.10 4pah h GLN 232 N 0.80 1.08 -0.25 2.24 1.08 -0.80 0.00 115.11 119.27 4pah h GLN 232 Ca 0.20 -0.11 0.01 0.00 -1.45 0.00 0.00 58.65 57.30 4pah h GLN 232 Cb 0.13 -0.22 -0.02 0.00 -0.05 0.00 0.00 27.48 27.32 4pah h GLN 232 CO -0.02 0.78 0.15 0.35 -0.95 0.00 0.00 178.83 179.13 4pah h PHE 233 N 1.09 0.28 -0.92 2.96 3.57 -0.83 -2.16 116.94 120.92 4pah h PHE 233 Ca 0.28 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.80 4pah h PHE 233 Cb -0.02 -0.09 -0.05 0.00 2.79 0.00 0.00 35.95 38.59 4pah h PHE 233 CO -0.00 0.17 0.59 -0.07 -2.23 0.00 0.00 178.31 176.77 4pah h LEU 234 N 0.30 1.07 -1.01 0.59 3.38 -0.39 -2.22 115.31 117.04 4pah h LEU 234 Ca 0.09 -0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.09 4pah h LEU 234 Cb -0.01 -0.27 -0.07 0.00 0.09 0.00 0.00 40.66 40.40 4pah h LEU 234 CO -0.04 0.79 0.65 1.56 0.09 0.00 0.00 178.44 181.49 4pah h GLN 235 N 1.25 1.16 0.00 1.13 4.20 -0.53 -0.12 115.11 122.20 4pah h GLN 235 Ca 0.33 -0.07 -0.08 0.00 0.06 0.00 0.00 58.65 58.90 4pah h GLN 235 Cb -0.12 -0.26 -0.01 0.00 0.30 0.00 0.00 27.48 27.39 4pah h GLN 235 CO -0.07 0.77 -0.36 1.15 -0.67 0.00 0.00 178.83 179.65 4pah h THR 236 N 1.19 0.91 0.00 -0.54 2.02 -0.83 -0.76 112.91 114.91 4pah h THR 236 Ca 0.43 -1.42 -0.09 0.00 0.77 0.00 0.00 66.41 66.10 4pah h THR 236 Cb 0.14 1.85 -0.01 0.00 -1.74 0.00 0.00 68.15 68.39 4pah h THR 236 CO -0.17 0.35 -0.50 0.00 0.37 0.00 0.00 175.52 175.57 4pah n THR 238 N -4.55 0.08 -0.98 0.00 -2.24 -0.15 -4.81 114.28 101.63 4pah n THR 238 Ca -0.18 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 4pah n THR 238 Cb 0.54 1.25 0.00 0.00 -2.10 0.00 0.00 70.33 70.03 4pah n THR 238 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 4pah n GLY 239 N -0.04 0.58 3.81 3.38 0.00 -0.29 -4.98 105.19 107.65 4pah n GLY 239 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 4pah n GLY 239 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 4pah s PHE 240 N -2.46 3.11 0.13 1.61 0.08 -1.21 -4.76 117.98 114.47 4pah s PHE 240 Ca 0.00 1.57 0.00 0.00 0.12 0.00 0.00 56.93 58.62 4pah s PHE 240 Cb 0.00 -2.99 -0.04 0.00 -0.57 0.00 0.00 43.02 39.42 4pah s PHE 240 CO 0.00 -0.64 0.02 -0.98 -0.10 0.00 0.00 175.22 173.51 4pah s ARG 241 N -3.36 0.94 0.22 0.44 1.70 -0.36 -2.22 118.95 116.30 4pah s ARG 241 Ca 0.65 -1.43 0.09 0.00 -0.47 0.00 0.00 55.73 54.56 4pah s ARG 241 Cb -0.14 0.03 -0.04 0.00 -0.57 0.00 0.00 34.95 34.23 4pah s ARG 241 CO 0.21 -0.18 -0.01 -0.51 -1.08 0.00 0.00 175.30 173.73 4pah s LEU 242 N -3.07 3.23 -0.01 -1.89 1.43 -1.26 -1.06 118.68 116.04 4pah s LEU 242 Ca 0.21 -0.53 -0.01 0.00 -1.03 0.00 0.00 54.13 52.77 4pah s LEU 242 Cb 0.07 -1.82 0.00 0.00 0.03 0.00 0.00 46.19 44.47 4pah s LEU 242 CO 0.00 0.05 0.03 0.00 0.23 0.00 0.00 176.35 176.66 4pah s ARG 243 N -3.28 0.05 0.40 1.70 1.70 -0.86 -4.89 118.95 113.77 4pah s ARG 243 Ca 0.29 0.03 -0.26 0.00 -0.47 0.00 0.00 55.73 55.32 4pah s ARG 243 Cb -0.08 0.02 -0.09 0.00 -0.57 0.00 0.00 34.95 34.24 4pah s ARG 243 CO 0.19 -0.01 1.23 -1.25 -1.08 0.00 0.00 175.30 174.39 4pah s PRO 244 N -0.02 4.03 -0.04 3.89 0.04 -1.26 -0.41 135.00 141.23 4pah s PRO 244 Ca -0.00 2.00 0.03 0.00 0.04 0.00 0.00 61.00 63.06 4pah s PRO 244 Cb -0.00 -2.73 0.00 0.00 0.04 0.00 0.00 34.50 31.81 4pah s PRO 244 CO 0.00 -0.39 -0.13 0.54 0.04 0.00 0.00 177.00 177.07 4pah s VAL 245 N -1.33 1.10 0.00 -0.36 0.11 -0.51 -4.74 120.40 114.67 4pah s VAL 245 Ca 0.57 -0.51 0.00 0.00 -2.93 0.00 0.00 61.98 59.11 4pah s VAL 245 Cb -0.34 -0.98 0.00 0.00 -1.53 0.00 0.00 36.38 33.53 4pah s VAL 245 CO 0.44 0.33 0.42 0.00 -3.33 0.00 0.00 175.10 172.96 4pah n ALA 246 N 3.43 0.00 -3.00 1.54 0.00 -1.26 -4.60 120.51 116.62 4pah n ALA 246 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.24 4pah n ALA 246 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 4pah n ALA 246 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 4pah n GLY 247 N -0.36 2.41 3.62 0.00 0.00 -1.26 -4.84 105.19 104.74 4pah n GLY 247 Ca 0.00 -0.17 -0.39 0.00 0.00 0.00 0.00 46.02 45.45 4pah n GLY 247 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 4pah s LEU 248 N 0.00 4.05 0.47 0.99 2.01 -1.26 -4.94 118.68 120.01 4pah s LEU 248 Ca 0.00 0.41 -0.07 0.00 0.01 0.00 0.00 54.13 54.48 4pah s LEU 248 Cb 0.00 -2.54 -0.04 0.00 0.01 0.00 0.00 46.19 43.62 4pah s LEU 248 CO 0.00 -0.22 0.80 -0.76 1.01 0.00 0.00 176.35 177.18 4pah s LEU 249 N 2.11 3.65 0.88 1.79 1.43 -1.26 -1.91 118.68 125.38 4pah s LEU 249 Ca 0.18 1.02 -0.11 0.00 -1.03 0.00 0.00 54.13 54.19 4pah s LEU 249 Cb -0.16 -3.96 0.12 0.00 0.03 0.00 0.00 46.19 42.23 4pah s LEU 249 CO 0.09 -0.55 1.11 -0.94 0.23 0.00 0.00 176.35 176.29 4pah s SER 250 N -3.85 3.39 0.29 2.29 1.04 -1.26 -4.76 113.70 110.84 4pah s SER 250 Ca 0.49 1.89 -0.00 0.00 0.48 0.00 0.00 55.95 58.81 4pah s SER 250 Cb -0.10 -2.47 0.45 0.00 0.10 0.00 0.00 66.02 64.00 4pah s SER 250 CO 0.42 -2.75 1.86 0.28 0.98 0.00 0.00 173.24 174.02 4pah h SER 251 N -1.63 0.75 -0.36 7.02 0.02 -1.97 -1.37 113.55 116.01 4pah h SER 251 Ca -0.46 -0.12 0.04 0.00 -0.84 0.00 0.00 61.79 60.42 4pah h SER 251 Cb 1.26 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 63.57 4pah h SER 251 CO 0.48 0.71 0.13 -0.09 -1.14 0.00 0.00 176.83 176.92 4pah h ARG 252 N 0.79 0.28 -0.13 3.45 2.43 -1.92 -0.31 114.38 118.96 4pah h ARG 252 Ca 0.18 -0.02 -0.10 0.00 -0.81 0.00 0.00 59.98 59.23 4pah h ARG 252 Cb 0.23 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 4pah h ARG 252 CO -0.01 0.18 -0.32 -0.44 -1.51 0.00 0.00 179.97 177.87 4pah h ASP 253 N 0.29 0.51 -0.13 -3.80 3.32 -1.85 -0.68 116.42 114.08 4pah h ASP 253 Ca 0.16 -0.58 0.03 0.00 0.02 0.00 0.00 57.03 56.66 4pah h ASP 253 Cb 0.13 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 4pah h ASP 253 CO -0.16 1.00 -0.03 0.15 -1.72 0.00 0.00 179.24 178.48 4pah h PHE 254 N 0.05 -0.06 -0.57 4.55 3.57 -1.18 -2.07 116.94 121.24 4pah h PHE 254 Ca -0.00 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.41 4pah h PHE 254 Cb 0.93 0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.69 4pah h PHE 254 CO 0.10 -0.05 -0.04 -0.07 -2.23 0.00 0.00 178.31 176.02 4pah h LEU 255 N 0.01 1.00 -1.07 0.59 3.38 -1.09 -2.87 115.31 115.25 4pah h LEU 255 Ca 0.06 -0.30 0.09 0.00 0.09 0.00 0.00 57.88 57.82 4pah h LEU 255 Cb 0.09 -0.27 -0.07 0.00 0.09 0.00 0.00 40.66 40.50 4pah h LEU 255 CO -0.13 1.08 0.62 1.23 0.09 0.00 0.00 178.44 181.33 4pah h GLY 256 N 0.98 1.48 1.05 0.83 0.00 -0.84 -1.72 103.07 104.84 4pah h GLY 256 Ca 0.16 -0.43 0.08 0.00 0.00 0.00 0.00 47.33 47.14 4pah h GLY 256 CO 0.04 0.25 0.44 -1.33 0.00 0.00 0.00 176.54 175.94 4pah h GLY 257 N 1.04 0.81 1.88 4.60 0.00 -1.14 -2.13 103.07 108.13 4pah h GLY 257 Ca 0.44 -0.25 0.02 0.00 0.00 0.00 0.00 47.33 47.54 4pah h GLY 257 CO -0.20 0.17 0.05 1.41 0.00 0.00 0.00 176.54 177.97 4pah h LEU 258 N 0.62 0.01 -2.35 3.11 3.38 -1.24 -0.91 115.31 117.92 4pah h LEU 258 Ca 0.30 -0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.28 4pah h LEU 258 Cb 0.37 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 4pah h LEU 258 CO -0.10 0.01 0.06 0.00 0.09 0.00 0.00 178.44 178.50 4pah h ALA 259 N 1.97 1.66 -0.63 1.53 0.00 -1.46 0.23 119.26 122.55 4pah h ALA 259 Ca 0.03 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 4pah h ALA 259 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 4pah h ALA 259 CO -0.00 -0.08 0.00 1.19 0.00 0.00 0.00 179.25 180.36 4pah n PHE 260 N -3.92 1.21 -3.80 0.00 3.01 -0.42 -4.84 117.46 108.70 4pah n PHE 260 Ca -0.02 -0.58 -0.26 0.00 1.01 0.00 0.00 57.45 57.61 4pah n PHE 260 Cb 0.15 -0.15 0.03 0.00 -0.01 0.00 0.00 39.48 39.50 4pah n PHE 260 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 4pah n ARG 261 N 1.17 -5.38 -4.57 -1.08 1.74 0.07 -4.88 116.66 103.73 4pah n ARG 261 Ca 0.24 0.62 -0.33 0.00 -0.77 0.00 0.00 57.85 57.61 4pah n ARG 261 Cb 0.77 -5.37 -0.16 0.00 -1.02 0.00 0.00 32.46 26.68 4pah n ARG 261 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 4pah s VAL 262 N -3.47 2.40 -0.26 1.55 1.01 -0.75 -1.23 120.40 119.65 4pah s VAL 262 Ca 0.36 -0.86 -0.07 0.00 0.00 0.00 0.00 61.98 61.41 4pah s VAL 262 Cb -0.18 -1.99 -0.02 0.00 0.00 0.00 0.00 36.38 34.19 4pah s VAL 262 CO 0.82 0.53 0.06 0.12 0.00 0.00 0.00 175.10 176.63 4pah s PHE 263 N 0.84 3.09 -0.11 5.22 5.36 -0.23 -3.11 117.98 129.04 4pah s PHE 263 Ca -0.06 -0.59 -0.30 0.00 -0.96 0.00 0.00 56.93 55.02 4pah s PHE 263 Cb -0.15 -2.23 -0.01 0.00 -0.34 0.00 0.00 43.02 40.28 4pah s PHE 263 CO -0.01 -0.43 1.08 -1.01 -1.46 0.00 0.00 175.22 173.39 4pah s HIS 264 N 1.58 3.36 -0.04 10.12 3.76 -1.26 -2.03 115.29 130.78 4pah s HIS 264 Ca 0.06 1.43 0.04 0.00 -0.15 0.00 0.00 55.06 56.44 4pah s HIS 264 Cb -0.15 -3.29 -0.00 0.00 1.11 0.00 0.00 32.58 30.25 4pah s HIS 264 CO 0.03 -0.66 -0.16 0.00 -0.85 0.00 0.00 174.74 173.10 4pah s THR 266 N 0.03 4.50 -0.13 0.00 -4.23 -1.26 -1.43 115.64 113.11 4pah s THR 266 Ca -0.03 1.28 0.04 0.00 -1.18 0.00 0.00 61.69 61.81 4pah s THR 266 Cb -0.11 -3.66 -0.05 0.00 1.34 0.00 0.00 72.50 70.02 4pah s THR 266 CO 0.02 -0.48 0.15 1.67 -0.54 0.00 0.00 174.62 175.43 4pah n GLN 267 N -1.07 3.91 -2.18 3.99 7.27 -1.26 -4.26 117.38 123.77 4pah n GLN 267 Ca 0.06 -0.01 -0.27 0.00 0.07 0.00 0.00 57.00 56.85 4pah n GLN 267 Cb 0.54 -0.82 0.05 0.00 2.41 0.00 0.00 30.24 32.42 4pah n GLN 267 CO 0.00 0.00 0.00 1.52 0.07 0.00 0.00 177.06 178.65 4pah s TYR 268 N -1.67 3.13 0.17 3.69 -0.85 -1.26 -4.73 117.35 115.83 4pah s TYR 268 Ca 0.01 0.67 0.09 0.00 -0.52 0.00 0.00 57.07 57.32 4pah s TYR 268 Cb 0.03 -3.02 -0.04 0.00 0.38 0.00 0.00 41.96 39.31 4pah s TYR 268 CO 0.17 -1.17 -0.14 -1.50 -1.52 0.00 0.00 175.55 171.39 4pah s ILE 269 N -3.20 2.94 0.99 -3.49 2.07 -1.26 -0.64 121.20 118.62 4pah s ILE 269 Ca 0.57 -1.72 -0.11 0.00 -1.41 0.00 0.00 60.65 57.98 4pah s ILE 269 Cb -0.11 -2.43 0.19 0.00 0.13 0.00 0.00 42.46 40.24 4pah s ILE 269 CO 0.47 -0.08 1.10 0.00 -1.91 0.00 0.00 174.94 174.52 4pah s ARG 270 N -2.68 0.43 0.30 3.50 1.70 -1.26 -4.95 118.95 115.99 4pah s ARG 270 Ca 0.23 1.23 -0.29 0.00 -0.47 0.00 0.00 55.73 56.43 4pah s ARG 270 Cb -0.09 -1.68 -0.10 0.00 -0.57 0.00 0.00 34.95 32.51 4pah s ARG 270 CO 0.13 -2.93 1.27 -1.58 -1.08 0.00 0.00 175.30 171.11 4pah s HIS 271 N -2.62 3.18 -1.18 5.89 5.65 -1.26 -4.92 115.29 120.02 4pah s HIS 271 Ca 0.67 1.43 0.12 0.00 0.25 0.00 0.00 55.06 57.53 4pah s HIS 271 Cb -0.23 -3.60 0.56 0.00 -1.18 0.00 0.00 32.58 28.14 4pah s HIS 271 CO 0.60 -1.63 1.35 0.41 -0.65 0.00 0.00 174.74 174.83 4pah n GLY 272 N 1.13 -0.82 0.23 1.59 0.00 -1.26 -3.03 105.19 103.02 4pah n GLY 272 Ca 0.01 -0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.10 4pah n GLY 272 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 4pah h SER 273 N 0.00 0.00 -2.25 1.61 4.64 -1.91 -3.35 113.55 112.28 4pah h SER 273 Ca 0.00 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.74 4pah h SER 273 Cb 0.17 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 61.87 4pah h SER 273 CO 0.00 0.12 -1.00 0.29 -0.87 0.00 0.00 176.83 175.37 4pah n LYS 274 N -3.18 0.54 0.15 4.77 5.02 -1.17 -4.99 118.16 119.31 4pah n LYS 274 Ca 0.02 -3.31 0.18 0.00 -2.02 0.00 0.00 58.31 53.18 4pah n LYS 274 Cb 0.47 -1.55 0.79 0.00 -0.02 0.00 0.00 35.03 34.72 4pah n LYS 274 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 4pah h PRO 275 N 4.95 0.00 -0.66 1.97 0.13 -1.74 -2.12 132.00 134.54 4pah h PRO 275 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 4pah h PRO 275 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 4pah h PRO 275 CO 0.44 0.00 0.00 -1.33 -0.23 0.00 0.00 178.00 176.88 4pah n MET 276 N -3.84 2.67 -4.11 0.86 2.81 -1.26 -4.73 117.12 109.52 4pah n MET 276 Ca 0.04 -2.40 -0.17 0.00 -1.81 0.00 0.00 57.70 53.36 4pah n MET 276 Cb 0.44 -1.56 -0.15 0.00 -0.71 0.00 0.00 33.22 31.23 4pah n MET 276 CO 0.00 0.00 0.00 -0.47 1.51 0.00 0.00 175.97 177.01 4pah s TYR 277 N -1.23 0.49 -0.10 2.03 5.04 -0.80 -4.89 117.35 117.89 4pah s TYR 277 Ca 0.44 -0.09 -0.07 0.00 -2.44 0.00 0.00 57.07 54.91 4pah s TYR 277 Cb 0.24 -0.40 0.04 0.00 0.35 0.00 0.00 41.96 42.18 4pah s TYR 277 CO 0.29 -0.08 0.25 -0.08 -1.34 0.00 0.00 175.55 174.60 4pah s THR 278 N 0.37 -0.02 -1.38 4.34 -1.32 -1.26 -4.84 115.64 111.53 4pah s THR 278 Ca -0.04 0.08 0.09 0.00 -1.21 0.00 0.00 61.69 60.62 4pah s THR 278 Cb -0.08 -0.38 0.37 0.00 -1.51 0.00 0.00 72.50 70.91 4pah s THR 278 CO -0.00 0.03 1.21 -0.81 -2.21 0.00 0.00 174.62 172.84 4pah n PRO 279 N 3.71 2.37 -3.67 7.08 -0.04 -1.26 -4.91 135.00 138.27 4pah n PRO 279 Ca -0.20 -1.46 -0.08 0.00 -0.04 0.00 0.00 63.50 61.72 4pah n PRO 279 Cb 0.55 -1.56 -0.02 0.00 -0.04 0.00 0.00 33.50 32.43 4pah n PRO 279 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 4pah s GLU 280 N -1.68 1.44 0.63 0.54 -1.05 -1.26 -5.12 118.70 112.20 4pah s GLU 280 Ca 0.26 -0.71 -0.17 0.00 -0.15 0.00 0.00 54.97 54.20 4pah s GLU 280 Cb 0.17 0.55 -0.02 0.00 -0.44 0.00 0.00 34.13 34.39 4pah s GLU 280 CO 0.13 -0.65 1.14 -1.25 0.95 0.00 0.00 175.26 175.57 4pah s PRO 281 N -3.69 2.90 0.22 -4.83 0.04 -1.26 -5.02 135.00 123.36 4pah s PRO 281 Ca 0.08 1.54 0.00 0.00 0.04 0.00 0.00 61.00 62.66 4pah s PRO 281 Cb -0.03 -1.95 -0.00 0.00 0.04 0.00 0.00 34.50 32.56 4pah s PRO 281 CO -0.01 -1.20 0.27 -0.40 0.04 0.00 0.00 177.00 175.70 4pah n ASP 282 N -2.04 -0.75 0.22 6.66 5.75 -1.26 -4.97 116.55 120.16 4pah n ASP 282 Ca 0.11 -2.24 0.07 0.00 -0.01 0.00 0.00 54.79 52.72 4pah n ASP 282 Cb 0.51 1.46 0.52 0.00 -1.03 0.00 0.00 41.12 42.57 4pah n ASP 282 CO 0.00 0.00 0.00 -0.29 -0.11 0.00 0.00 177.20 176.80 4pah h ILE 283 N 1.65 0.97 -0.42 2.12 2.10 -1.06 -2.00 117.51 120.87 4pah h ILE 283 Ca -0.16 -0.88 -0.04 0.00 1.08 0.00 0.00 64.86 64.86 4pah h ILE 283 Cb 0.75 1.50 -0.02 0.00 -1.09 0.00 0.00 36.82 37.96 4pah h ILE 283 CO 0.23 0.23 0.12 0.00 -1.08 0.00 0.00 178.15 177.65 4pah h HIS 285 N 0.54 0.93 -0.01 0.00 -0.00 -1.78 -0.85 115.15 113.99 4pah h HIS 285 Ca 0.13 -0.10 -0.00 0.00 -0.00 0.00 0.00 60.37 60.40 4pah h HIS 285 Cb 0.28 -0.27 -0.00 0.00 -0.00 0.00 0.00 27.41 27.42 4pah h HIS 285 CO 0.01 0.79 0.00 0.93 -0.00 0.00 0.00 177.93 179.66 4pah h GLU 286 N 0.81 0.01 -0.02 5.26 4.39 -1.18 0.18 114.58 124.03 4pah h GLU 286 Ca 0.18 -0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.62 4pah h GLU 286 Cb 0.31 -0.00 0.02 0.00 -0.10 0.00 0.00 28.75 28.98 4pah h GLU 286 CO -0.00 0.21 -0.99 -0.07 -1.16 0.00 0.00 179.01 176.99 4pah h LEU 287 N -0.19 0.90 0.00 1.33 3.38 -1.21 -0.76 115.31 118.76 4pah h LEU 287 Ca 0.00 -0.73 -0.05 0.00 0.09 0.00 0.00 57.88 57.20 4pah h LEU 287 Cb 0.20 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 4pah h LEU 287 CO -0.00 1.51 -1.01 -0.07 0.09 0.00 0.00 178.44 178.96 4pah h LEU 288 N 0.39 0.00 0.00 1.67 3.38 -1.23 -3.37 115.31 116.15 4pah h LEU 288 Ca -0.12 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.59 4pah h LEU 288 Cb 1.65 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.36 4pah h LEU 288 CO 0.20 0.18 -1.65 0.61 0.09 0.00 0.00 178.44 177.86 4pah n GLY 289 N 1.23 -0.64 0.11 0.83 0.00 0.62 -4.74 105.19 102.59 4pah n GLY 289 Ca -0.02 -0.10 -0.22 0.00 0.00 0.00 0.00 46.02 45.68 4pah n GLY 289 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 4pah h HIS 290 N -1.00 0.06 -0.86 1.61 3.86 -1.16 -3.38 115.15 114.28 4pah h HIS 290 Ca -0.39 -0.05 0.19 0.00 -1.16 0.00 0.00 60.37 58.96 4pah h HIS 290 Cb 1.28 -0.00 -0.12 0.00 1.06 0.00 0.00 27.41 29.63 4pah h HIS 290 CO -0.11 1.53 0.37 0.28 0.86 0.00 0.00 177.93 180.86 4pah h VAL 291 N -0.86 0.54 -0.44 2.45 2.07 -1.33 -2.10 116.25 116.57 4pah h VAL 291 Ca -0.36 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 66.99 4pah h VAL 291 Cb 1.40 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 31.22 4pah h VAL 291 CO -0.17 0.08 0.17 -0.65 0.02 0.00 0.00 177.57 177.01 4pah h PRO 292 N 0.43 0.63 -0.02 1.57 0.11 -1.80 -2.56 132.00 130.36 4pah h PRO 292 Ca 0.52 -0.09 -0.17 0.00 0.11 0.00 0.00 66.00 66.37 4pah h PRO 292 Cb 0.91 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.89 4pah h PRO 292 CO -0.49 0.53 -0.75 -0.07 -0.21 0.00 0.00 178.00 177.01 4pah h LEU 293 N 0.63 0.21 0.00 2.35 -0.00 -1.64 -2.82 115.31 114.04 4pah h LEU 293 Ca 0.15 -0.15 0.00 0.00 -0.00 0.00 0.00 57.88 57.89 4pah h LEU 293 Cb 0.14 -0.06 0.00 0.00 -0.00 0.00 0.00 40.66 40.74 4pah h LEU 293 CO -0.01 0.88 0.00 0.49 -0.00 0.00 0.00 178.44 179.80 4pah n PHE 294 N -3.74 0.00 0.94 1.13 3.72 -0.97 -1.25 117.46 117.29 4pah n PHE 294 Ca -0.03 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.50 4pah n PHE 294 Cb 0.72 -0.41 0.40 0.00 -0.94 0.00 0.00 39.48 39.25 4pah n PHE 294 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 4pah n SER 295 N -1.41 0.33 -4.75 4.37 7.64 -1.06 -4.62 113.62 114.11 4pah n SER 295 Ca 0.03 0.14 -0.37 0.00 1.01 0.00 0.00 58.87 59.68 4pah n SER 295 Cb 0.08 -0.13 -0.06 0.00 -1.01 0.00 0.00 64.21 63.09 4pah n SER 295 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 4pah s ASP 296 N -3.20 6.63 0.17 6.43 2.15 -0.38 -4.67 116.67 123.79 4pah s ASP 296 Ca 0.12 0.74 -0.13 0.00 0.43 0.00 0.00 52.55 53.71 4pah s ASP 296 Cb 0.17 -2.24 0.06 0.00 -0.30 0.00 0.00 42.92 40.62 4pah s ASP 296 CO 0.63 0.12 1.78 -0.09 -0.17 0.00 0.00 175.17 177.44 4pah h ARG 297 N 6.18 0.76 -0.45 4.34 2.43 -1.87 -0.33 114.38 125.44 4pah h ARG 297 Ca -0.44 -0.09 -0.13 0.00 -0.81 0.00 0.00 59.98 58.51 4pah h ARG 297 Cb 1.18 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.57 4pah h ARG 297 CO 0.72 0.58 -0.23 0.77 -1.51 0.00 0.00 179.97 180.30 4pah h SER 298 N 0.73 0.96 -0.85 -3.80 0.02 -1.94 -1.47 113.55 107.20 4pah h SER 298 Ca 0.19 -0.37 -0.03 0.00 -0.84 0.00 0.00 61.79 60.74 4pah h SER 298 Cb 0.04 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.27 4pah h SER 298 CO -0.03 1.15 0.41 0.15 -1.14 0.00 0.00 176.83 177.36 4pah h PHE 299 N 0.81 1.23 -0.60 3.45 3.57 -1.80 -0.49 116.94 123.11 4pah h PHE 299 Ca 0.10 -0.06 -0.00 0.00 3.53 0.00 0.00 57.97 61.54 4pah h PHE 299 Cb 0.80 -0.38 -0.03 0.00 2.79 0.00 0.00 35.95 39.13 4pah h PHE 299 CO 0.05 0.89 0.38 0.00 -2.23 0.00 0.00 178.31 177.40 4pah h ALA 300 N 1.22 0.77 -0.45 2.41 0.00 -0.79 0.29 119.26 122.71 4pah h ALA 300 Ca 0.29 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 4pah h ALA 300 Cb 0.13 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 4pah h ALA 300 CO -0.04 0.23 0.05 1.96 0.00 0.00 0.00 179.25 181.46 4pah h GLN 301 N 0.82 0.76 -0.14 0.00 4.20 -1.09 -1.48 115.11 118.18 4pah h GLN 301 Ca 0.22 -0.22 0.01 0.00 0.06 0.00 0.00 58.65 58.72 4pah h GLN 301 Cb -0.04 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.64 4pah h GLN 301 CO -0.04 0.80 0.04 0.35 -0.67 0.00 0.00 178.83 179.30 4pah h PHE 302 N 0.62 0.07 -0.78 2.96 3.57 -0.65 -1.70 116.94 121.02 4pah h PHE 302 Ca 0.13 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.64 4pah h PHE 302 Cb 0.42 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.11 4pah h PHE 302 CO 0.03 0.03 0.47 0.77 -2.23 0.00 0.00 178.31 177.38 4pah h SER 303 N 0.10 0.95 -0.51 0.41 0.02 -0.34 -2.36 113.55 111.82 4pah h SER 303 Ca 0.06 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 4pah h SER 303 Cb 0.04 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.32 4pah h SER 303 CO -0.07 0.74 0.33 -0.61 -1.14 0.00 0.00 176.83 176.08 4pah h GLN 304 N 1.08 0.68 -0.49 3.45 4.15 -1.12 -2.33 115.11 120.53 4pah h GLN 304 Ca 0.28 -0.04 -0.05 0.00 0.77 0.00 0.00 58.65 59.61 4pah h GLN 304 Cb -0.03 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 27.49 4pah h GLN 304 CO -0.05 0.46 0.09 1.49 -1.93 0.00 0.00 178.83 178.89 4pah h GLU 305 N 0.70 0.75 -0.47 1.69 4.57 -0.77 0.13 114.58 121.17 4pah h GLU 305 Ca 0.19 -0.15 -0.04 0.00 -1.18 0.00 0.00 59.36 58.17 4pah h GLU 305 Cb -0.07 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 28.39 4pah h GLU 305 CO -0.04 0.70 0.13 0.82 -1.18 0.00 0.00 179.01 179.44 4pah h ILE 306 N 0.72 1.23 -0.40 2.32 2.04 -1.26 -0.83 117.51 121.33 4pah h ILE 306 Ca 0.16 -0.79 -0.01 0.00 1.00 0.00 0.00 64.86 65.22 4pah h ILE 306 Cb 0.31 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 37.21 4pah h ILE 306 CO 0.00 0.28 0.22 1.23 0.00 0.00 0.00 178.15 179.88 4pah h GLY 307 N 0.64 0.60 1.38 5.37 0.00 -0.90 -2.51 103.07 107.65 4pah h GLY 307 Ca 0.15 -0.27 -0.06 0.00 0.00 0.00 0.00 47.33 47.15 4pah h GLY 307 CO -0.00 0.26 0.07 1.41 0.00 0.00 0.00 176.54 178.28 4pah h LEU 308 N 0.52 0.72 -1.69 3.11 3.38 -0.50 -2.27 115.31 118.59 4pah h LEU 308 Ca 0.14 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 4pah h LEU 308 Cb 0.06 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 4pah h LEU 308 CO -0.02 0.75 -0.08 0.00 0.09 0.00 0.00 178.44 179.18 4pah h ALA 309 N 1.34 1.74 0.00 1.53 0.00 -0.88 -2.86 119.26 120.13 4pah h ALA 309 Ca 0.16 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 4pah h ALA 309 Cb 0.35 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 4pah h ALA 309 CO 0.01 0.19 -0.19 0.66 0.00 0.00 0.00 179.25 179.92 4pah h SER 310 N 0.09 0.00 -2.34 0.00 4.64 -0.98 -3.42 113.55 111.55 4pah h SER 310 Ca 0.02 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.79 4pah h SER 310 Cb 0.21 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.30 4pah h SER 310 CO 0.01 0.19 1.28 -0.76 -0.87 0.00 0.00 176.83 176.68 4pah s LEU 311 N -6.37 4.08 -0.30 5.97 1.43 -1.08 -1.46 118.68 120.94 4pah s LEU 311 Ca 0.04 2.28 0.00 0.00 -1.03 0.00 0.00 54.13 55.42 4pah s LEU 311 Cb 0.07 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.77 4pah s LEU 311 CO 0.67 -1.33 0.00 0.61 0.23 0.00 0.00 176.35 176.54 4pah n GLY 312 N 4.87 0.50 3.80 -3.19 0.00 -1.26 -5.01 105.19 104.89 4pah n GLY 312 Ca 0.22 -0.14 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 4pah n GLY 312 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4pah s ALA 313 N -1.72 2.84 0.65 4.61 0.00 -0.53 -4.48 121.76 123.12 4pah s ALA 313 Ca 0.00 0.52 -0.17 0.00 0.00 0.00 0.00 51.96 52.31 4pah s ALA 313 Cb 0.00 -3.24 -0.01 0.00 0.00 0.00 0.00 23.12 19.87 4pah s ALA 313 CO 0.00 -0.47 1.19 -2.14 0.00 0.00 0.00 175.76 174.34 4pah s PRO 314 N -3.54 2.67 0.27 0.00 0.02 -1.26 -4.76 135.00 128.39 4pah s PRO 314 Ca 0.66 1.74 -0.00 0.00 0.02 0.00 0.00 61.00 63.42 4pah s PRO 314 Cb -0.16 -1.90 0.56 0.00 0.02 0.00 0.00 34.50 33.02 4pah s PRO 314 CO 0.26 -1.42 1.76 -0.44 -0.33 0.00 0.00 177.00 176.82 4pah h ASP 315 N 0.36 0.54 0.71 2.53 3.32 -1.99 0.32 116.42 122.20 4pah h ASP 315 Ca -0.49 0.10 -0.02 0.00 0.02 0.00 0.00 57.03 56.64 4pah h ASP 315 Cb 1.29 0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.85 4pah h ASP 315 CO 0.53 0.21 -0.09 1.05 -1.72 0.00 0.00 179.24 179.22 4pah h GLU 316 N 0.62 0.00 0.00 3.56 9.09 -2.01 -2.18 114.58 123.66 4pah h GLU 316 Ca 0.48 0.00 -0.16 0.00 0.05 0.00 0.00 59.36 59.73 4pah h GLU 316 Cb 0.69 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.77 4pah h GLU 316 CO -0.37 0.09 -0.92 1.88 0.05 0.00 0.00 179.01 179.74 4pah h TYR 317 N 0.00 0.00 -0.95 2.06 -1.99 -0.75 -3.11 116.97 112.24 4pah h TYR 317 Ca -0.00 0.00 0.01 0.00 2.00 0.00 0.00 58.73 60.74 4pah h TYR 317 Cb 0.47 0.00 -0.05 0.00 2.00 0.00 0.00 36.73 39.15 4pah h TYR 317 CO 0.00 0.68 0.61 0.82 -0.00 0.00 0.00 178.16 180.28 4pah h ILE 318 N 0.00 1.25 -0.30 -2.88 1.08 -0.75 -0.23 117.51 115.67 4pah h ILE 318 Ca -0.06 -0.47 -0.08 0.00 -0.39 0.00 0.00 64.86 63.86 4pah h ILE 318 Cb 1.57 -0.13 -0.02 0.00 -3.07 0.00 0.00 36.82 35.17 4pah h ILE 318 CO 0.08 0.24 -0.17 -0.08 -0.69 0.00 0.00 178.15 177.53 4pah h GLU 319 N 1.29 0.54 -0.45 2.37 4.22 -1.46 0.16 114.58 121.25 4pah h GLU 319 Ca 0.34 -0.18 -0.08 0.00 0.08 0.00 0.00 59.36 59.53 4pah h GLU 319 Cb -0.13 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.06 4pah h GLU 319 CO -0.07 0.69 -0.04 0.87 -2.18 0.00 0.00 179.01 178.28 4pah h LYS 320 N 0.49 0.81 -0.10 1.92 1.57 -1.39 -1.80 116.57 118.08 4pah h LYS 320 Ca 0.08 -0.28 -0.08 0.00 -1.87 0.00 0.00 60.65 58.50 4pah h LYS 320 Cb 0.57 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 4pah h LYS 320 CO 0.04 0.89 -0.32 -0.07 -0.57 0.00 0.00 179.45 179.42 4pah h LEU 321 N 0.65 0.20 -0.64 2.94 3.38 -0.48 -1.46 115.31 119.90 4pah h LEU 321 Ca 0.12 -0.07 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 4pah h LEU 321 Cb 0.55 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 4pah h LEU 321 CO 0.03 0.51 -0.15 0.00 0.09 0.00 0.00 178.44 178.93 4pah h ALA 322 N 1.50 0.84 -0.62 1.53 0.00 -0.55 0.96 119.26 122.91 4pah h ALA 322 Ca 0.02 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.50 4pah h ALA 322 Cb 0.66 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 4pah h ALA 322 CO 0.05 0.65 0.10 1.15 0.00 0.00 0.00 179.25 181.19 4pah h THR 323 N 0.81 1.26 -0.46 0.00 2.02 -1.01 -0.59 112.91 114.94 4pah h THR 323 Ca 0.12 -1.02 -0.01 0.00 0.77 0.00 0.00 66.41 66.27 4pah h THR 323 Cb 0.68 0.71 -0.02 0.00 -1.74 0.00 0.00 68.15 67.78 4pah h THR 323 CO 0.05 0.38 0.24 0.40 0.37 0.00 0.00 175.52 176.95 4pah h ILE 324 N 0.94 1.17 -0.47 3.11 2.04 -0.96 -1.20 117.51 122.15 4pah h ILE 324 Ca 0.19 -0.47 0.07 0.00 1.00 0.00 0.00 64.86 65.65 4pah h ILE 324 Cb 0.44 0.64 -0.06 0.00 -0.74 0.00 0.00 36.82 37.10 4pah h ILE 324 CO 0.01 0.19 0.11 0.22 0.00 0.00 0.00 178.15 178.69 4pah h TYR 325 N 0.60 0.19 -0.54 1.37 5.03 -0.58 -1.80 116.97 121.24 4pah h TYR 325 Ca 0.16 0.03 0.03 0.00 2.58 0.00 0.00 58.73 61.53 4pah h TYR 325 Cb 0.08 -0.02 -0.04 0.00 1.55 0.00 0.00 36.73 38.31 4pah h TYR 325 CO -0.01 0.03 0.31 2.35 -1.32 0.00 0.00 178.16 179.51 4pah h TRP 326 N 0.26 0.57 -0.01 -3.82 2.91 -0.60 -0.48 115.95 114.78 4pah h TRP 326 Ca 0.23 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.27 4pah h TRP 326 Cb 0.28 -0.18 0.00 0.00 -0.51 0.00 0.00 29.16 28.75 4pah h TRP 326 CO -0.20 0.30 0.00 1.19 -1.03 0.00 0.00 178.44 178.70 4pah n PHE 327 N -4.82 0.01 0.00 2.65 3.72 -0.50 -0.39 117.46 118.13 4pah n PHE 327 Ca 0.05 -0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.44 4pah n PHE 327 Cb 0.11 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.65 4pah n PHE 327 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 4pah n THR 328 N -0.76 0.00 -0.34 4.37 -2.24 -0.72 -3.40 114.28 111.18 4pah n THR 328 Ca 0.21 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 62.08 4pah n THR 328 Cb 0.14 -0.49 0.26 0.00 -2.10 0.00 0.00 70.33 68.14 4pah n THR 328 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 4pah h VAL 329 N 0.00 0.80 0.06 2.28 2.07 -1.33 0.11 116.25 120.25 4pah h VAL 329 Ca 0.00 -0.28 -0.37 0.00 0.82 0.00 0.00 66.70 66.87 4pah h VAL 329 Cb 0.00 -0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 29.63 4pah h VAL 329 CO 0.00 0.15 -2.16 -0.62 0.02 0.00 0.00 177.57 174.96 4pah n GLU 330 N -4.73 0.71 -1.08 1.57 -0.58 -0.91 -0.72 120.64 114.90 4pah n GLU 330 Ca 0.20 0.21 0.05 0.00 -0.42 0.00 0.00 57.16 57.20 4pah n GLU 330 Cb 0.44 -1.64 0.10 0.00 -0.57 0.00 0.00 31.44 29.78 4pah n GLU 330 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 4pah n PHE 331 N -3.31 0.00 -2.83 -0.32 3.72 0.47 0.03 117.46 115.21 4pah n PHE 331 Ca -0.35 -0.92 -0.33 0.00 -0.05 0.00 0.00 57.45 55.80 4pah n PHE 331 Cb 1.04 -0.19 -0.07 0.00 -0.94 0.00 0.00 39.48 39.32 4pah n PHE 331 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 4pah s GLY 332 N -2.52 2.35 0.08 1.37 0.00 0.38 -4.63 107.32 104.35 4pah s GLY 332 Ca 0.35 0.33 0.06 0.00 0.00 0.00 0.00 44.72 45.46 4pah s GLY 332 CO -0.12 0.59 -0.10 1.08 0.00 0.00 0.00 173.10 174.56 4pah s LEU 333 N -3.23 3.05 0.06 0.66 1.02 -1.07 -1.49 118.68 117.68 4pah s LEU 333 Ca 0.61 -0.33 0.05 0.00 0.02 0.00 0.00 54.13 54.47 4pah s LEU 333 Cb -0.09 -1.82 -0.04 0.00 0.02 0.00 0.00 46.19 44.26 4pah s LEU 333 CO 0.15 0.20 -0.05 0.00 0.02 0.00 0.00 176.35 176.67 4pah s LYS 335 N -1.94 4.32 -0.41 0.00 2.20 0.27 -2.18 119.74 122.00 4pah s LYS 335 Ca 0.21 0.59 0.02 0.00 -0.36 0.00 0.00 55.97 56.43 4pah s LYS 335 Cb -0.11 -3.49 0.15 0.00 -1.51 0.00 0.00 37.83 32.87 4pah s LYS 335 CO 0.13 0.01 0.27 -1.14 -0.36 0.00 0.00 175.35 174.25 4pah s GLN 336 N 1.09 0.98 7.06 4.03 0.74 0.73 -4.79 119.66 129.50 4pah s GLN 336 Ca 0.29 -1.84 0.00 0.00 0.05 0.00 0.00 55.36 53.87 4pah s GLN 336 Cb -0.16 -1.78 0.00 0.00 1.10 0.00 0.00 33.01 32.17 4pah s GLN 336 CO 0.12 -1.24 0.00 0.41 -0.55 0.00 0.00 175.29 174.03 4pah n GLY 337 N 3.49 1.89 0.75 2.59 0.00 -1.26 -1.48 105.19 111.18 4pah n GLY 337 Ca 0.15 -0.42 0.12 0.00 0.00 0.00 0.00 46.02 45.87 4pah n GLY 337 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 4pah n ASP 338 N 7.03 2.30 -4.93 1.61 8.00 -1.26 -4.91 116.55 124.39 4pah n ASP 338 Ca 0.00 -1.78 -0.19 0.00 0.71 0.00 0.00 54.79 53.53 4pah n ASP 338 Cb 0.00 -0.09 -0.02 0.00 -0.02 0.00 0.00 41.12 41.00 4pah n ASP 338 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 4pah s SER 339 N -1.76 5.27 -0.04 -2.24 0.15 -0.55 -5.13 113.70 109.41 4pah s SER 339 Ca 0.34 -0.63 0.03 0.00 0.70 0.00 0.00 55.95 56.39 4pah s SER 339 Cb 0.20 -0.60 0.00 0.00 -1.71 0.00 0.00 66.02 63.91 4pah s SER 339 CO 0.30 -0.69 -0.12 -0.63 1.20 0.00 0.00 173.24 173.30 4pah s ILE 340 N -2.43 1.04 0.32 6.45 -1.09 -1.26 -0.19 121.20 124.04 4pah s ILE 340 Ca 0.51 -0.49 0.06 0.00 -2.23 0.00 0.00 60.65 58.49 4pah s ILE 340 Cb -0.06 -0.91 -0.03 0.00 -1.58 0.00 0.00 42.46 39.88 4pah s ILE 340 CO 0.30 0.31 0.24 -0.54 -1.23 0.00 0.00 174.94 174.02 4pah s LYS 341 N 0.21 1.70 -0.11 2.79 -0.14 -0.93 -4.97 119.74 118.29 4pah s LYS 341 Ca -0.05 -1.98 -0.04 0.00 -1.36 0.00 0.00 55.97 52.54 4pah s LYS 341 Cb -0.10 0.21 -0.04 0.00 -1.68 0.00 0.00 37.83 36.22 4pah s LYS 341 CO 0.01 -0.59 0.06 0.00 -0.76 0.00 0.00 175.35 174.07 4pah s ALA 342 N -3.52 3.52 0.00 5.17 0.00 -0.17 -0.25 121.76 126.51 4pah s ALA 342 Ca 0.39 -0.74 0.00 0.00 0.00 0.00 0.00 51.96 51.61 4pah s ALA 342 Cb 0.03 -1.70 0.00 0.00 0.00 0.00 0.00 23.12 21.45 4pah s ALA 342 CO 0.24 0.57 0.01 2.48 0.00 0.00 0.00 175.76 179.06 4pah n TYR 343 N 2.19 0.00 -2.22 0.00 0.18 -0.70 -1.05 117.16 115.55 4pah n TYR 343 Ca -0.19 0.00 -0.41 0.00 1.88 0.00 0.00 57.90 59.18 4pah n TYR 343 Cb 0.54 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.47 4pah n TYR 343 CO 0.00 0.00 0.00 0.20 -2.08 0.00 0.00 176.86 174.98 4pah s GLY 344 N -0.59 2.45 0.40 -7.48 0.00 -0.56 -4.84 107.32 96.71 4pah s GLY 344 Ca 0.00 1.10 0.08 0.00 0.00 0.00 0.00 44.72 45.89 4pah s GLY 344 CO 0.00 2.07 2.03 0.00 0.00 0.00 0.00 173.10 177.20 4pah h ALA 345 N 5.43 1.75 0.00 3.20 0.00 -0.47 -0.78 119.26 128.39 4pah h ALA 345 Ca -0.45 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.36 4pah h ALA 345 Cb 1.21 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 4pah h ALA 345 CO 0.77 0.20 -0.40 0.78 0.00 0.00 0.00 179.25 180.61 4pah h GLY 346 N 0.59 0.00 0.59 0.00 0.00 -0.63 -2.39 103.07 101.23 4pah h GLY 346 Ca 0.21 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.34 4pah h GLY 346 CO -0.05 0.00 -0.93 1.41 0.00 0.00 0.00 176.54 176.97 4pah h LEU 347 N 0.00 0.40 -0.23 3.11 3.38 -1.23 -3.20 115.31 117.54 4pah h LEU 347 Ca -0.00 -0.92 0.00 0.00 0.09 0.00 0.00 57.88 57.05 4pah h LEU 347 Cb 0.88 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.50 4pah h LEU 347 CO 0.05 1.43 0.00 0.18 0.09 0.00 0.00 178.44 180.19 4pah n LEU 348 N -4.11 0.16 -0.37 1.67 4.77 -0.41 -1.66 117.00 117.06 4pah n LEU 348 Ca -0.17 0.55 0.07 0.00 -0.03 0.00 0.00 56.01 56.43 4pah n LEU 348 Cb 0.82 -0.54 0.14 0.00 -2.33 0.00 0.00 43.42 41.51 4pah n LEU 348 CO 0.45 -0.41 0.60 -1.54 -1.33 0.00 0.00 177.39 175.16 4pah n SER 349 N -1.69 2.78 -3.93 -1.43 3.41 -0.91 -4.68 113.62 107.17 4pah n SER 349 Ca 0.02 -2.65 -0.31 0.00 -0.26 0.00 0.00 58.87 55.68 4pah n SER 349 Cb 0.13 -0.33 -0.15 0.00 -0.26 0.00 0.00 64.21 63.60 4pah n SER 349 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 4pah s SER 350 N -1.90 4.15 0.22 4.04 0.15 -0.66 -4.93 113.70 114.76 4pah s SER 350 Ca 0.26 -1.51 -0.08 0.00 0.70 0.00 0.00 55.95 55.32 4pah s SER 350 Cb 0.21 -1.26 0.32 0.00 -1.71 0.00 0.00 66.02 63.58 4pah s SER 350 CO 0.06 -0.30 1.74 0.15 1.20 0.00 0.00 173.24 176.10 4pah h PHE 351 N 7.88 0.43 -0.09 3.44 3.57 -1.90 -0.42 116.94 129.85 4pah h PHE 351 Ca -0.14 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.31 4pah h PHE 351 Cb 1.05 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.69 4pah h PHE 351 CO 0.48 0.10 -0.27 0.78 -2.23 0.00 0.00 178.31 177.16 4pah h GLY 352 N 0.43 0.38 2.00 2.40 0.00 -1.95 -3.18 103.07 103.15 4pah h GLY 352 Ca 0.33 -0.49 -0.12 0.00 0.00 0.00 0.00 47.33 47.05 4pah h GLY 352 CO -0.33 0.44 -0.59 -2.09 0.00 0.00 0.00 176.54 173.97 4pah h GLU 353 N -0.12 0.00 -0.75 4.80 4.81 -1.86 -2.21 114.58 119.26 4pah h GLU 353 Ca -0.01 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 4pah h GLU 353 Cb 0.90 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.24 4pah h GLU 353 CO 0.06 0.59 0.38 1.25 -0.73 0.00 0.00 179.01 180.56 4pah h LEU 354 N 0.00 0.95 -0.16 1.64 5.85 -1.11 0.01 115.31 122.49 4pah h LEU 354 Ca -0.01 -0.10 -0.23 0.00 0.84 0.00 0.00 57.88 58.39 4pah h LEU 354 Cb 1.06 -0.24 0.01 0.00 0.37 0.00 0.00 40.66 41.86 4pah h LEU 354 CO 0.08 0.79 -0.82 1.56 -0.34 0.00 0.00 178.44 179.70 4pah h GLN 355 N 1.06 0.73 -0.58 1.25 4.20 -1.51 -3.29 115.11 116.97 4pah h GLN 355 Ca 0.26 -0.63 -0.08 0.00 0.06 0.00 0.00 58.65 58.27 4pah h GLN 355 Cb 0.08 0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.97 4pah h GLN 355 CO -0.04 1.23 0.05 -0.92 -0.67 0.00 0.00 178.83 178.49 4pah h TYR 356 N 0.48 1.03 0.00 2.96 3.20 -1.08 -3.14 116.97 120.41 4pah h TYR 356 Ca -0.06 -0.15 0.00 0.00 3.14 0.00 0.00 58.73 61.66 4pah h TYR 356 Cb 1.45 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 39.44 4pah h TYR 356 CO 0.08 0.90 0.00 0.00 -1.64 0.00 0.00 178.16 177.50 4pah n LEU 358 N -2.95 4.32 0.00 0.00 4.77 -1.19 -4.88 117.00 117.08 4pah n LEU 358 Ca -0.01 -2.71 -0.08 0.00 -0.03 0.00 0.00 56.01 53.18 4pah n LEU 358 Cb 0.16 -0.53 0.03 0.00 -2.33 0.00 0.00 43.42 40.75 4pah n LEU 358 CO 0.22 0.71 0.15 -1.54 -1.33 0.00 0.00 177.39 175.59 4pah n SER 359 N 0.27 0.83 -0.02 -1.43 3.41 -0.75 -5.00 113.62 110.93 4pah n SER 359 Ca 0.22 -1.61 0.14 0.00 -0.26 0.00 0.00 58.87 57.36 4pah n SER 359 Cb 0.88 -0.17 0.57 0.00 -0.26 0.00 0.00 64.21 65.24 4pah n SER 359 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 4pah n GLU 360 N -1.50 0.18 0.01 4.33 0.28 -1.26 -4.37 120.64 118.31 4pah n GLU 360 Ca 0.06 -0.04 -0.13 0.00 -0.16 0.00 0.00 57.16 56.90 4pah n GLU 360 Cb 0.24 -1.50 -0.10 0.00 1.43 0.00 0.00 31.44 31.51 4pah n GLU 360 CO 0.00 0.00 0.00 0.87 -0.16 0.00 0.00 177.13 177.84 4pah h LYS 361 N 0.09 -0.06 -7.36 3.44 1.79 -1.95 -3.46 116.57 109.06 4pah h LYS 361 Ca 0.00 0.00 -0.50 0.00 -2.18 0.00 0.00 60.65 57.97 4pah h LYS 361 Cb 0.44 0.01 0.11 0.00 -1.58 0.00 0.00 32.23 31.22 4pah h LYS 361 CO 0.00 0.41 0.33 -1.25 -1.08 0.00 0.00 179.45 177.86 4pah s PRO 362 N -4.19 2.29 -0.07 3.15 0.04 -1.26 -5.02 135.00 129.93 4pah s PRO 362 Ca -0.15 0.87 -0.18 0.00 0.04 0.00 0.00 61.00 61.58 4pah s PRO 362 Cb 0.02 -1.92 -0.05 0.00 0.04 0.00 0.00 34.50 32.58 4pah s PRO 362 CO 0.64 -1.54 0.47 0.21 0.04 0.00 0.00 177.00 176.83 4pah s LYS 363 N -5.04 4.23 -0.17 4.56 2.20 -0.41 -4.99 119.74 120.12 4pah s LYS 363 Ca 0.60 0.47 -0.05 0.00 -0.36 0.00 0.00 55.97 56.64 4pah s LYS 363 Cb -0.15 -3.37 -0.03 0.00 -1.51 0.00 0.00 37.83 32.77 4pah s LYS 363 CO 0.55 0.33 -0.01 -0.51 -0.36 0.00 0.00 175.35 175.35 4pah s LEU 364 N 0.05 3.37 0.11 5.43 1.02 -1.26 -1.70 118.68 125.69 4pah s LEU 364 Ca 0.26 -0.09 0.07 0.00 0.02 0.00 0.00 54.13 54.38 4pah s LEU 364 Cb -0.16 -1.83 -0.03 0.00 0.02 0.00 0.00 46.19 44.19 4pah s LEU 364 CO 0.12 0.16 -0.17 -0.76 0.02 0.00 0.00 176.35 175.72 4pah s LEU 365 N 0.44 2.34 0.37 1.79 1.43 -0.34 -4.99 118.68 119.72 4pah s LEU 365 Ca -0.02 -0.72 -0.26 0.00 -1.03 0.00 0.00 54.13 52.10 4pah s LEU 365 Cb -0.14 -0.70 -0.09 0.00 0.03 0.00 0.00 46.19 45.30 4pah s LEU 365 CO 0.02 -0.04 1.19 -2.16 0.23 0.00 0.00 176.35 175.59 4pah s PRO 366 N -2.16 4.17 0.06 1.29 0.04 -1.26 -0.32 135.00 136.81 4pah s PRO 366 Ca 0.06 1.90 -0.30 0.00 0.04 0.00 0.00 61.00 62.70 4pah s PRO 366 Cb -0.08 -2.80 -0.09 0.00 0.04 0.00 0.00 34.50 31.57 4pah s PRO 366 CO 0.04 -0.24 1.90 -1.17 0.04 0.00 0.00 177.00 177.57 4pah s LEU 367 N -2.26 4.42 -0.22 -3.56 2.96 -0.85 -4.73 118.68 114.44 4pah s LEU 367 Ca 0.54 2.67 -0.04 0.00 -0.22 0.00 0.00 54.13 57.08 4pah s LEU 367 Cb -0.32 -3.54 0.08 0.00 0.50 0.00 0.00 46.19 42.91 4pah s LEU 367 CO 0.41 -1.03 0.14 -1.61 -1.32 0.00 0.00 176.35 172.95 4pah s GLU 368 N 3.87 0.15 0.34 1.98 2.02 -1.26 -5.01 118.70 120.78 4pah s GLU 368 Ca 0.85 -0.18 0.05 0.00 0.02 0.00 0.00 54.97 55.70 4pah s GLU 368 Cb -0.43 -1.41 0.60 0.00 0.10 0.00 0.00 34.13 32.99 4pah s GLU 368 CO 0.39 -0.81 1.86 -0.07 0.02 0.00 0.00 175.26 176.65 4pah h LEU 369 N 8.39 0.46 -1.75 1.80 3.38 -1.93 0.20 115.31 125.86 4pah h LEU 369 Ca -0.17 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 4pah h LEU 369 Cb 1.10 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 4pah h LEU 369 CO 0.34 0.56 -0.04 -0.08 0.09 0.00 0.00 178.44 179.31 4pah h GLU 370 N 0.47 0.11 0.00 1.13 4.81 -1.98 0.85 114.58 119.97 4pah h GLU 370 Ca 0.10 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.24 4pah h GLU 370 Cb 0.37 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 4pah h GLU 370 CO 0.02 0.16 -0.46 -0.22 -0.73 0.00 0.00 179.01 177.78 4pah h LYS 371 N 0.11 0.00 -0.67 1.92 3.64 -1.49 -3.38 116.57 116.70 4pah h LYS 371 Ca 0.03 0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.46 4pah h LYS 371 Cb 0.14 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.91 4pah h LYS 371 CO 0.01 0.76 0.39 1.15 -2.27 0.00 0.00 179.45 179.49 4pah h THR 372 N -1.00 1.00 -0.48 1.00 2.02 -0.56 -2.71 112.91 112.18 4pah h THR 372 Ca -0.11 -0.25 0.14 0.00 0.77 0.00 0.00 66.41 66.96 4pah h THR 372 Cb 0.91 0.21 -0.02 0.00 -1.74 0.00 0.00 68.15 67.51 4pah h THR 372 CO -0.07 0.13 0.50 0.00 0.37 0.00 0.00 175.52 176.45 4pah h ALA 373 N 1.33 2.21 -0.12 6.16 0.00 -1.00 -1.79 119.26 126.06 4pah h ALA 373 Ca 0.29 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.19 4pah h ALA 373 Cb 0.14 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.97 4pah h ALA 373 CO -0.16 -0.75 0.00 0.44 0.00 0.00 0.00 179.25 178.78 4pah n ILE 374 N -3.72 0.63 -2.25 0.00 -5.35 -1.04 -4.57 119.36 103.06 4pah n ILE 374 Ca 0.09 -0.81 -0.41 0.00 -0.27 0.00 0.00 62.75 61.35 4pah n ILE 374 Cb 0.69 0.73 -0.03 0.00 -1.74 0.00 0.00 39.64 39.30 4pah n ILE 374 CO 0.00 0.00 0.00 -1.58 -1.76 0.00 0.00 176.55 173.21 4pah s GLN 375 N -0.81 4.44 0.52 6.28 2.00 -0.67 -5.02 119.66 126.40 4pah s GLN 375 Ca 0.10 2.04 -0.13 0.00 -2.00 0.00 0.00 55.36 55.37 4pah s GLN 375 Cb 0.06 -3.16 -0.06 0.00 0.80 0.00 0.00 33.01 30.65 4pah s GLN 375 CO 0.08 -0.12 0.95 -0.80 -0.50 0.00 0.00 175.29 174.89 4pah s ASN 376 N -0.17 6.48 0.10 6.67 0.01 -1.26 -5.05 114.94 121.72 4pah s ASN 376 Ca 0.52 1.41 -0.12 0.00 -0.71 0.00 0.00 52.86 53.95 4pah s ASN 376 Cb -0.36 -2.45 0.02 0.00 0.41 0.00 0.00 41.25 38.87 4pah s ASN 376 CO 0.43 -0.63 0.29 -0.72 -1.51 0.00 0.00 177.10 174.96 4pah s TYR 377 N -2.74 -0.03 0.16 2.20 -0.85 -1.26 -5.07 117.35 109.76 4pah s TYR 377 Ca 0.56 -0.32 0.08 0.00 -0.52 0.00 0.00 57.07 56.87 4pah s TYR 377 Cb -0.10 0.10 -0.04 0.00 0.38 0.00 0.00 41.96 42.29 4pah s TYR 377 CO 0.38 -0.61 -0.10 0.99 -1.52 0.00 0.00 175.55 174.69 4pah s THR 378 N -3.71 3.20 -2.23 -3.49 2.01 -1.26 -5.03 115.64 105.14 4pah s THR 378 Ca 0.03 -1.54 0.20 0.00 0.31 0.00 0.00 61.69 60.69 4pah s THR 378 Cb 0.03 -2.55 0.09 0.00 0.01 0.00 0.00 72.50 70.08 4pah s THR 378 CO -0.11 -0.03 1.07 1.33 -0.69 0.00 0.00 174.62 176.19 4pah n VAL 379 N 0.28 0.00 0.27 3.82 0.24 -1.26 -4.52 118.33 117.16 4pah n VAL 379 Ca -0.12 -0.42 0.10 0.00 -2.04 0.00 0.00 64.34 61.86 4pah n VAL 379 Cb 0.54 1.35 -0.14 0.00 -1.47 0.00 0.00 33.84 34.12 4pah n VAL 379 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 4pah n THR 380 N 0.67 0.00 -4.68 3.34 -2.24 -1.26 -5.01 114.28 105.10 4pah n THR 380 Ca 0.10 -0.33 -0.30 0.00 -2.27 0.00 0.00 64.05 61.25 4pah n THR 380 Cb 0.47 0.34 -0.09 0.00 -2.10 0.00 0.00 70.33 68.95 4pah n THR 380 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 4pah s GLU 381 N -3.20 2.08 0.46 -0.78 2.02 -1.26 -5.10 118.70 112.92 4pah s GLU 381 Ca -0.03 -2.28 -0.24 0.00 0.02 0.00 0.00 54.97 52.44 4pah s GLU 381 Cb 0.13 -1.39 -0.07 0.00 0.10 0.00 0.00 34.13 32.90 4pah s GLU 381 CO 0.81 -0.30 1.28 -0.06 0.02 0.00 0.00 175.26 177.01 4pah s PHE 382 N -2.91 2.67 0.17 1.61 0.08 -1.26 -4.91 117.98 113.43 4pah s PHE 382 Ca 0.16 1.43 -0.31 0.00 0.12 0.00 0.00 56.93 58.33 4pah s PHE 382 Cb 0.04 -3.63 -0.10 0.00 -0.57 0.00 0.00 43.02 38.77 4pah s PHE 382 CO 0.08 -2.17 1.49 -0.65 -0.10 0.00 0.00 175.22 173.87 4pah s GLN 383 N -2.58 4.26 0.46 0.44 -1.52 -1.26 -4.91 119.66 114.54 4pah s GLN 383 Ca 0.63 2.27 0.26 0.00 -1.95 0.00 0.00 55.36 56.58 4pah s GLN 383 Cb -0.36 -3.17 0.91 0.00 -0.22 0.00 0.00 33.01 30.17 4pah s GLN 383 CO 0.44 -0.51 1.81 -1.00 -0.25 0.00 0.00 175.29 175.79 4pah h PRO 384 N 6.34 0.00 -3.34 2.91 0.13 -1.95 -3.46 132.00 132.63 4pah h PRO 384 Ca -0.43 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.56 4pah h PRO 384 Cb 1.21 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.13 4pah h PRO 384 CO 0.87 0.14 -0.42 -0.48 -0.23 0.00 0.00 178.00 177.88 4pah s LEU 385 N -6.49 1.30 0.06 1.56 2.34 -1.26 -1.29 118.68 114.91 4pah s LEU 385 Ca 0.02 -0.07 0.03 0.00 0.06 0.00 0.00 54.13 54.18 4pah s LEU 385 Cb 0.09 0.87 -0.03 0.00 -0.56 0.00 0.00 46.19 46.56 4pah s LEU 385 CO 0.62 -0.37 -0.10 -0.31 -1.06 0.00 0.00 176.35 175.13 4pah s TYR 386 N -1.26 0.91 -0.12 3.48 2.02 -0.69 -4.96 117.35 116.73 4pah s TYR 386 Ca -0.13 -0.54 -0.05 0.00 -0.37 0.00 0.00 57.07 55.98 4pah s TYR 386 Cb -0.06 -0.52 -0.04 0.00 -0.40 0.00 0.00 41.96 40.94 4pah s TYR 386 CO 0.02 -0.03 0.08 0.71 -1.57 0.00 0.00 175.55 174.76 4pah s TYR 387 N -1.66 3.39 -0.28 2.71 2.02 -1.26 -1.20 117.35 121.07 4pah s TYR 387 Ca -0.04 0.34 -0.10 0.00 -0.37 0.00 0.00 57.07 56.91 4pah s TYR 387 Cb -0.08 -1.91 -0.04 0.00 -0.40 0.00 0.00 41.96 39.53 4pah s TYR 387 CO 0.01 0.55 0.16 0.08 -1.57 0.00 0.00 175.55 174.77 4pah s VAL 388 N -0.74 5.00 0.10 0.71 1.01 0.56 -2.58 120.40 124.46 4pah s VAL 388 Ca 0.12 0.02 -0.20 0.00 0.00 0.00 0.00 61.98 61.92 4pah s VAL 388 Cb -0.12 -3.39 -0.07 0.00 0.00 0.00 0.00 36.38 32.80 4pah s VAL 388 CO 0.03 0.25 0.62 0.00 0.00 0.00 0.00 175.10 175.99 4pah s ALA 389 N 1.71 3.55 0.15 5.51 0.00 0.53 -2.01 121.76 131.21 4pah s ALA 389 Ca 0.07 0.10 -0.11 0.00 0.00 0.00 0.00 51.96 52.02 4pah s ALA 389 Cb -0.16 -2.70 0.01 0.00 0.00 0.00 0.00 23.12 20.27 4pah s ALA 389 CO 0.09 0.38 1.57 0.93 0.00 0.00 0.00 175.76 178.72 4pah h GLU 390 N 4.40 0.95 -1.95 0.00 4.39 -1.90 0.80 114.58 121.27 4pah h GLU 390 Ca -0.49 -0.37 0.21 0.00 0.34 0.00 0.00 59.36 59.06 4pah h GLU 390 Cb 1.21 -0.05 -0.12 0.00 -0.10 0.00 0.00 28.75 29.68 4pah h GLU 390 CO 0.64 1.03 0.63 -1.54 -1.16 0.00 0.00 179.01 178.61 4pah s SER 391 N -6.58 -0.18 0.28 1.42 1.04 -1.26 -4.36 113.70 104.06 4pah s SER 391 Ca -0.12 -0.18 0.10 0.00 0.48 0.00 0.00 55.95 56.23 4pah s SER 391 Cb 0.12 0.33 0.40 0.00 0.10 0.00 0.00 66.02 66.96 4pah s SER 391 CO 0.85 -0.58 1.64 -0.26 0.98 0.00 0.00 173.24 175.87 4pah h PHE 392 N 2.00 0.04 -0.68 5.02 0.04 -1.91 -1.69 116.94 119.76 4pah h PHE 392 Ca -0.23 -0.02 -0.06 0.00 2.80 0.00 0.00 57.97 60.47 4pah h PHE 392 Cb 1.22 -0.01 -0.03 0.00 2.20 0.00 0.00 35.95 39.33 4pah h PHE 392 CO 0.32 0.60 0.20 -0.91 -0.60 0.00 0.00 178.31 177.93 4pah h ASN 393 N 0.03 0.98 -0.26 2.17 -0.26 -1.96 -0.62 115.58 115.67 4pah h ASN 393 Ca -0.01 -0.18 -0.11 0.00 -0.56 0.00 0.00 56.30 55.44 4pah h ASN 393 Cb 1.03 -0.26 -0.00 0.00 -1.06 0.00 0.00 38.32 38.03 4pah h ASN 393 CO 0.08 0.93 -0.27 -0.78 -1.06 0.00 0.00 177.43 176.32 4pah h ASP 394 N 1.01 0.68 -0.77 5.81 3.58 -1.90 -2.06 116.42 122.78 4pah h ASP 394 Ca 0.22 -0.48 0.01 0.00 0.42 0.00 0.00 57.03 57.20 4pah h ASP 394 Cb 0.30 -0.19 -0.04 0.00 1.72 0.00 0.00 39.33 41.12 4pah h ASP 394 CO -0.01 1.02 0.51 0.00 -2.88 0.00 0.00 179.24 177.89 4pah h ALA 395 N 0.68 1.45 -0.68 -0.78 0.00 -1.12 -0.90 119.26 117.90 4pah h ALA 395 Ca 0.04 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 4pah h ALA 395 Cb 0.84 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 4pah h ALA 395 CO 0.07 0.51 0.31 -0.22 0.00 0.00 0.00 179.25 179.92 4pah h LYS 396 N 1.05 0.99 -0.62 0.00 3.64 -0.84 -0.07 116.57 120.72 4pah h LYS 396 Ca 0.28 -0.15 -0.09 0.00 -1.27 0.00 0.00 60.65 59.42 4pah h LYS 396 Cb -0.12 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.50 4pah h LYS 396 CO -0.06 0.79 0.02 0.93 -2.27 0.00 0.00 179.45 178.86 4pah h GLU 397 N 0.95 1.07 -0.75 1.90 4.39 -0.76 -1.04 114.58 120.34 4pah h GLU 397 Ca 0.23 -0.33 -0.06 0.00 0.34 0.00 0.00 59.36 59.55 4pah h GLU 397 Cb 0.14 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 28.65 4pah h GLU 397 CO -0.03 1.03 0.24 0.87 -1.16 0.00 0.00 179.01 179.96 4pah h LYS 398 N 0.98 1.16 -0.35 2.33 1.57 -0.81 -1.04 116.57 120.42 4pah h LYS 398 Ca 0.18 -0.25 -0.05 0.00 -1.87 0.00 0.00 60.65 58.66 4pah h LYS 398 Cb 0.53 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 4pah h LYS 398 CO 0.03 0.99 0.04 0.28 -0.57 0.00 0.00 179.45 180.22 4pah h VAL 399 N 1.12 1.24 -0.89 0.50 2.07 -0.73 -0.69 116.25 118.87 4pah h VAL 399 Ca 0.24 -0.87 0.07 0.00 0.82 0.00 0.00 66.70 66.97 4pah h VAL 399 Cb 0.31 1.13 -0.06 0.00 -1.52 0.00 0.00 31.29 31.14 4pah h VAL 399 CO -0.01 0.29 0.58 -0.09 0.02 0.00 0.00 177.57 178.36 4pah h ARG 400 N 0.42 0.94 -0.29 1.57 2.43 -0.88 0.26 114.38 118.84 4pah h ARG 400 Ca 0.11 -0.06 -0.16 0.00 -0.81 0.00 0.00 59.98 59.06 4pah h ARG 400 Cb 0.38 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 29.72 4pah h ARG 400 CO 0.01 0.62 -0.45 -0.91 -1.51 0.00 0.00 179.97 177.72 4pah h ASN 401 N 0.96 0.90 -0.63 -3.80 2.35 -0.95 -2.88 115.58 111.53 4pah h ASN 401 Ca 0.39 -0.52 -0.03 0.00 -0.55 0.00 0.00 56.30 55.60 4pah h ASN 401 Cb 0.27 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.35 4pah h ASN 401 CO -0.15 1.24 0.30 0.15 -1.65 0.00 0.00 177.43 177.32 4pah h PHE 402 N 0.58 0.94 -0.07 1.19 3.57 -0.22 -2.44 116.94 120.49 4pah h PHE 402 Ca 0.02 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.46 4pah h PHE 402 Cb 1.06 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 39.50 4pah h PHE 402 CO 0.08 0.70 -0.08 0.00 -2.23 0.00 0.00 178.31 176.77 4pah h ALA 403 N 1.39 1.74 0.00 2.41 0.00 -0.31 -0.72 119.26 123.77 4pah h ALA 403 Ca 0.23 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.02 4pah h ALA 403 Cb 0.12 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.87 4pah h ALA 403 CO -0.03 0.20 0.00 0.00 0.00 0.00 0.00 179.25 179.42 4pah h ALA 404 N 1.82 1.00 -0.01 0.00 0.00 -1.25 -1.64 119.26 119.19 4pah h ALA 404 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 4pah h ALA 404 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.00 4pah h ALA 404 CO 0.01 0.00 -0.30 0.25 0.00 0.00 0.00 179.25 179.21 4pah n THR 405 N -2.95 0.00 -2.69 0.00 -2.24 -0.28 -4.84 114.28 101.29 4pah n THR 405 Ca -0.01 -0.10 -0.43 0.00 -2.27 0.00 0.00 64.05 61.24 4pah n THR 405 Cb 0.17 0.35 -0.02 0.00 -2.10 0.00 0.00 70.33 68.73 4pah n THR 405 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 4pah s ILE 406 N -2.61 4.75 -0.38 2.28 1.01 -0.62 -4.95 121.20 120.69 4pah s ILE 406 Ca 0.22 2.01 -0.28 0.00 0.00 0.00 0.00 60.65 62.60 4pah s ILE 406 Cb 0.19 -4.30 -0.03 0.00 0.01 0.00 0.00 42.46 38.33 4pah s ILE 406 CO 0.56 -0.07 1.98 -2.16 0.00 0.00 0.00 174.94 175.25 4pah s PRO 407 N 2.48 3.01 -0.00 2.79 0.04 -1.26 -4.91 135.00 137.14 4pah s PRO 407 Ca 0.46 1.41 0.01 0.00 0.04 0.00 0.00 61.00 62.91 4pah s PRO 407 Cb -0.17 -4.32 0.00 0.00 0.04 0.00 0.00 34.50 30.05 4pah s PRO 407 CO 0.13 -2.25 -0.02 1.03 0.04 0.00 0.00 177.00 175.94 4pah s ARG 408 N 6.38 0.16 0.00 4.56 0.52 -1.26 -4.64 118.95 124.67 4pah s ARG 408 Ca 0.84 -0.05 0.00 0.00 -0.52 0.00 0.00 55.73 56.00 4pah s ARG 408 Cb -0.22 -0.17 0.00 0.00 0.52 0.00 0.00 34.95 35.08 4pah s ARG 408 CO 0.31 0.03 0.51 -0.35 0.02 0.00 0.00 175.30 175.82 4pah n PRO 409 N 3.12 0.92 -3.83 3.54 -0.04 -1.26 -4.83 135.00 132.62 4pah n PRO 409 Ca -0.13 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.24 4pah n PRO 409 Cb 0.59 -1.41 0.01 0.00 -0.04 0.00 0.00 33.50 32.65 4pah n PRO 409 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 4pah s PHE 410 N -0.88 0.12 0.19 0.54 -0.12 -1.26 -5.07 117.98 111.50 4pah s PHE 410 Ca 0.00 -0.75 0.10 0.00 -0.05 0.00 0.00 56.93 56.23 4pah s PHE 410 Cb 0.00 0.78 -0.04 0.00 -0.63 0.00 0.00 43.02 43.12 4pah s PHE 410 CO 0.00 -1.51 -0.21 0.45 -0.05 0.00 0.00 175.22 173.90 4pah s SER 411 N -3.06 3.11 0.07 1.98 0.15 0.10 -4.96 113.70 111.10 4pah s SER 411 Ca 0.16 -0.88 0.05 0.00 0.70 0.00 0.00 55.95 55.98 4pah s SER 411 Cb -0.05 -0.21 -0.03 0.00 -1.71 0.00 0.00 66.02 64.02 4pah s SER 411 CO 0.11 0.05 -0.15 0.68 1.20 0.00 0.00 173.24 175.13 4pah s VAL 412 N -1.90 1.16 -0.00 4.45 -7.23 -1.26 -0.65 120.40 114.97 4pah s VAL 412 Ca 0.19 -1.29 -0.01 0.00 -1.81 0.00 0.00 61.98 59.07 4pah s VAL 412 Cb -0.07 -1.11 0.00 0.00 0.56 0.00 0.00 36.38 35.77 4pah s VAL 412 CO 0.09 -0.18 0.01 -0.13 -0.31 0.00 0.00 175.10 174.58 4pah s ARG 413 N -1.68 0.03 0.01 4.82 0.52 -0.50 -4.97 118.95 117.18 4pah s ARG 413 Ca -0.01 -0.00 -0.14 0.00 -0.52 0.00 0.00 55.73 55.06 4pah s ARG 413 Cb -0.10 0.01 -0.06 0.00 0.52 0.00 0.00 34.95 35.33 4pah s ARG 413 CO 0.02 -0.00 0.41 -0.47 0.02 0.00 0.00 175.30 175.28 4pah s TYR 414 N -0.05 3.71 -0.36 -0.53 5.04 -1.26 0.08 117.35 123.98 4pah s TYR 414 Ca -0.01 0.97 -0.01 0.00 -2.44 0.00 0.00 57.07 55.59 4pah s TYR 414 Cb -0.00 -2.27 0.09 0.00 0.35 0.00 0.00 41.96 40.12 4pah s TYR 414 CO -0.00 0.63 0.10 0.34 -1.34 0.00 0.00 175.55 175.28 4pah s ASP 415 N -1.16 5.02 0.61 4.32 2.15 -0.16 -4.93 116.67 122.52 4pah s ASP 415 Ca 0.25 -1.84 0.37 0.00 0.43 0.00 0.00 52.55 51.76 4pah s ASP 415 Cb -0.16 -1.74 1.96 0.00 -0.30 0.00 0.00 42.92 42.67 4pah s ASP 415 CO 0.14 -0.42 2.23 1.55 -0.17 0.00 0.00 175.17 178.50 4pah h PRO 416 N 7.93 0.00 -0.29 4.34 0.13 -1.97 0.27 132.00 142.41 4pah h PRO 416 Ca -0.13 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.87 4pah h PRO 416 Cb 1.04 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.16 4pah h PRO 416 CO 0.61 0.03 -0.36 1.88 -0.23 0.00 0.00 178.00 179.92 4pah h TYR 417 N 0.00 0.77 -0.01 1.56 0.05 -1.96 -3.28 116.97 114.11 4pah h TYR 417 Ca -0.00 -0.21 0.00 0.00 0.05 0.00 0.00 58.73 58.57 4pah h TYR 417 Cb 0.16 -0.17 0.00 0.00 1.01 0.00 0.00 36.73 37.73 4pah h TYR 417 CO 0.00 0.92 -0.24 0.25 -1.05 0.00 0.00 178.16 178.04 4pah n THR 418 N -4.05 0.00 -3.48 -2.88 -2.24 -0.93 -5.00 114.28 95.70 4pah n THR 418 Ca -0.01 -0.38 -0.19 0.00 -2.27 0.00 0.00 64.05 61.20 4pah n THR 418 Cb 0.50 1.10 0.09 0.00 -2.10 0.00 0.00 70.33 69.91 4pah n THR 418 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 4pah n GLN 419 N -0.42 -6.98 -4.13 -0.78 6.02 0.92 -4.91 117.38 107.11 4pah n GLN 419 Ca 0.04 0.84 -0.15 0.00 -0.01 0.00 0.00 57.00 57.72 4pah n GLN 419 Cb 0.20 -5.87 -0.12 0.00 1.02 0.00 0.00 30.24 25.47 4pah n GLN 419 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 4pah s ARG 420 N -5.63 0.59 0.05 -1.09 0.52 -1.15 -2.31 118.95 109.92 4pah s ARG 420 Ca 0.16 -0.68 -0.21 0.00 -0.52 0.00 0.00 55.73 54.49 4pah s ARG 420 Cb -0.07 -0.45 -0.06 0.00 0.52 0.00 0.00 34.95 34.89 4pah s ARG 420 CO 0.73 0.10 0.62 0.42 0.02 0.00 0.00 175.30 177.19 4pah s ILE 421 N -1.08 4.77 -0.20 1.52 -1.09 0.78 -0.98 121.20 124.91 4pah s ILE 421 Ca -0.06 1.31 -0.06 0.00 -2.23 0.00 0.00 60.65 59.62 4pah s ILE 421 Cb -0.08 -3.96 -0.03 0.00 -1.58 0.00 0.00 42.46 36.81 4pah s ILE 421 CO 0.01 0.48 0.02 -1.61 -1.23 0.00 0.00 174.94 172.61 4pah s GLU 422 N -0.65 3.71 -0.32 2.79 0.41 0.11 -4.92 118.70 119.84 4pah s GLU 422 Ca 0.31 -0.47 -0.12 0.00 -0.41 0.00 0.00 54.97 54.28 4pah s GLU 422 Cb -0.19 -3.14 -0.03 0.00 -1.78 0.00 0.00 34.13 28.99 4pah s GLU 422 CO 0.19 0.06 0.22 0.08 -0.49 0.00 0.00 175.26 175.33 4pah s VAL 423 N 0.90 5.28 -2.92 2.63 1.01 -1.26 -1.42 120.40 124.63 4pah s VAL 423 Ca 0.02 -0.09 0.25 0.00 0.00 0.00 0.00 61.98 62.15 4pah s VAL 423 Cb -0.14 -3.65 0.24 0.00 0.00 0.00 0.00 36.38 32.83 4pah s VAL 423 CO 0.02 0.07 1.33 0.18 0.00 0.00 0.00 175.10 176.71