#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nrf n ARG 92 N 0.00 2.65 -1.71 3.49 5.12 -1.26 -5.02 116.66 119.93 2nrf n ARG 92 Ca 0.00 -0.01 -0.43 0.00 -1.93 0.00 0.00 57.85 55.48 2nrf n ARG 92 Cb 0.00 -1.18 -0.03 0.00 -1.16 0.00 0.00 32.46 30.09 2nrf n ARG 92 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2nrf n ALA 93 N -2.23 2.57 -0.51 7.54 0.00 -1.26 -4.97 120.51 121.65 2nrf n ALA 93 Ca -0.11 0.41 -0.09 0.00 0.00 0.00 0.00 53.44 53.65 2nrf n ALA 93 Cb 0.69 -2.49 0.14 0.00 0.00 0.00 0.00 19.45 17.80 2nrf n ALA 93 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nrf n GLY 94 N 3.67 -1.99 0.13 0.00 0.00 -1.26 -4.59 105.19 101.15 2nrf n GLY 94 Ca 0.15 -0.64 -0.13 0.00 0.00 0.00 0.00 46.02 45.40 2nrf n GLY 94 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2nrf h PRO 95 N 0.00 0.32 0.63 1.61 0.13 -1.97 -2.24 132.00 130.48 2nrf h PRO 95 Ca -0.19 -0.18 -0.03 0.00 -0.87 0.00 0.00 66.00 64.73 2nrf h PRO 95 Cb 0.65 0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.79 2nrf h PRO 95 CO 0.11 0.73 -0.32 0.28 -0.23 0.00 0.00 178.00 178.57 2nrf h VAL 96 N -0.06 0.00 -0.91 1.56 2.07 -1.94 0.97 116.25 117.94 2nrf h VAL 96 Ca 0.02 0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.74 2nrf h VAL 96 Cb 0.68 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.27 2nrf h VAL 96 CO 0.03 0.00 -0.15 0.74 0.02 0.00 0.00 177.57 178.21 2nrf h THR 97 N -0.87 0.10 0.11 2.57 2.02 -1.91 -1.51 112.91 113.42 2nrf h THR 97 Ca -0.09 -0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.08 2nrf h THR 97 Cb 0.67 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.17 2nrf h THR 97 CO 0.13 0.00 -0.06 -0.25 0.37 0.00 0.00 175.52 175.72 2nrf h TRP 98 N 0.01 -0.14 -0.15 3.16 2.91 -1.15 -2.62 115.95 117.97 2nrf h TRP 98 Ca 0.47 -0.00 -0.04 0.00 1.13 0.00 0.00 58.89 60.44 2nrf h TRP 98 Cb 0.78 0.05 -0.01 0.00 -0.51 0.00 0.00 29.16 29.47 2nrf h TRP 98 CO -0.64 0.07 -0.08 0.28 -1.03 0.00 0.00 178.44 177.04 2nrf h VAL 99 N -0.34 1.15 -0.30 2.65 2.07 -0.14 -1.77 116.25 119.58 2nrf h VAL 99 Ca -0.02 -0.64 -0.15 0.00 0.82 0.00 0.00 66.70 66.71 2nrf h VAL 99 Cb 0.28 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 2nrf h VAL 99 CO 0.03 0.20 -0.44 -0.03 0.02 0.00 0.00 177.57 177.35 2nrf h MET 100 N 0.22 0.75 -0.10 1.57 1.85 -1.25 0.76 114.93 118.73 2nrf h MET 100 Ca 0.05 -0.41 -0.03 0.00 -0.61 0.00 0.00 59.70 58.69 2nrf h MET 100 Cb 0.29 0.02 -0.00 0.00 0.43 0.00 0.00 31.60 32.34 2nrf h MET 100 CO 0.01 1.04 -0.06 0.52 -0.40 0.00 0.00 176.91 178.02 2nrf h MET 101 N 0.61 0.22 -0.86 0.39 2.86 -1.05 -2.03 114.93 115.06 2nrf h MET 101 Ca 0.04 -0.10 0.02 0.00 -2.06 0.00 0.00 59.70 57.60 2nrf h MET 101 Cb 1.00 -0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.61 2nrf h MET 101 CO 0.09 0.60 0.56 0.97 1.06 0.00 0.00 176.91 180.19 2nrf h ILE 102 N -0.16 1.18 -0.89 -1.22 2.10 -1.24 -1.81 117.51 115.47 2nrf h ILE 102 Ca 0.02 -0.39 0.04 0.00 1.08 0.00 0.00 64.86 65.62 2nrf h ILE 102 Cb 0.54 -0.04 -0.06 0.00 -1.09 0.00 0.00 36.82 36.17 2nrf h ILE 102 CO 0.02 0.21 0.57 0.00 -1.08 0.00 0.00 178.15 177.86 2nrf h ALA 103 N 1.33 1.19 -0.36 0.18 0.00 -0.78 0.68 119.26 121.50 2nrf h ALA 103 Ca 0.33 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 55.09 2nrf h ALA 103 Cb -0.07 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 2nrf h ALA 103 CO -0.09 0.40 -0.24 0.00 0.00 0.00 0.00 179.25 179.32 2nrf h VAL 105 N 0.62 1.41 -0.82 0.00 2.07 -1.13 0.13 116.25 118.54 2nrf h VAL 105 Ca 0.08 -1.28 0.10 0.00 0.82 0.00 0.00 66.70 66.42 2nrf h VAL 105 Cb 0.74 2.20 -0.06 0.00 -1.52 0.00 0.00 31.29 32.66 2nrf h VAL 105 CO 0.06 0.34 0.53 0.58 0.02 0.00 0.00 177.57 179.10 2nrf h VAL 106 N -0.42 0.94 0.06 2.57 2.07 -0.77 0.16 116.25 120.86 2nrf h VAL 106 Ca 0.00 -0.25 -0.10 0.00 0.82 0.00 0.00 66.70 67.16 2nrf h VAL 106 Cb 0.58 0.13 0.01 0.00 -1.52 0.00 0.00 31.29 30.49 2nrf h VAL 106 CO 0.01 0.14 -0.44 0.58 0.02 0.00 0.00 177.57 177.87 2nrf h VAL 107 N 0.74 1.60 -0.55 2.57 2.07 -1.15 -2.53 116.25 119.01 2nrf h VAL 107 Ca 0.38 -2.32 0.08 0.00 0.82 0.00 0.00 66.70 65.65 2nrf h VAL 107 Cb 0.48 3.12 -0.06 0.00 -1.52 0.00 0.00 31.29 33.31 2nrf h VAL 107 CO -0.15 0.64 0.21 0.15 0.02 0.00 0.00 177.57 178.43 2nrf h PHE 108 N -0.56 0.36 -0.21 1.57 3.04 -0.34 0.34 116.94 121.14 2nrf h PHE 108 Ca -0.07 0.03 0.05 0.00 3.98 0.00 0.00 57.97 61.95 2nrf h PHE 108 Cb 1.30 -0.08 -0.05 0.00 2.56 0.00 0.00 35.95 39.68 2nrf h PHE 108 CO 0.21 0.11 -0.08 0.82 -2.02 0.00 0.00 178.31 177.36 2nrf h ILE 109 N 0.39 0.72 -0.85 1.41 2.04 -0.74 0.29 117.51 120.78 2nrf h ILE 109 Ca 0.27 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.15 2nrf h ILE 109 Cb 0.29 0.72 -0.04 0.00 -0.74 0.00 0.00 36.82 37.05 2nrf h ILE 109 CO -0.26 0.00 0.56 0.00 0.00 0.00 0.00 178.15 178.45 2nrf h ALA 110 N 1.15 1.42 -0.23 1.87 0.00 -0.68 -0.31 119.26 122.49 2nrf h ALA 110 Ca 0.11 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 2nrf h ALA 110 Cb 0.21 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2nrf h ALA 110 CO -0.24 0.52 -0.05 0.52 0.00 0.00 0.00 179.25 180.00 2nrf h MET 111 N 1.12 0.43 -0.28 0.00 2.86 0.46 0.88 114.93 120.40 2nrf h MET 111 Ca 0.32 -0.16 0.03 0.00 -2.06 0.00 0.00 59.70 57.83 2nrf h MET 111 Cb -0.07 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 31.52 2nrf h MET 111 CO -0.08 0.66 -0.27 1.96 1.06 0.00 0.00 176.91 180.24 2nrf h GLN 112 N 0.17 -0.13 0.00 1.72 1.08 0.49 1.92 115.11 120.37 2nrf h GLN 112 Ca 0.06 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.27 2nrf h GLN 112 Cb 0.50 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.95 2nrf h GLN 112 CO 0.02 -0.08 0.00 -0.89 -0.95 0.00 0.00 178.83 176.93 2nrf n ILE 113 N -4.00 0.00 0.00 2.54 5.41 -0.22 -1.27 119.36 121.82 2nrf n ILE 113 Ca -0.01 0.56 0.00 0.00 1.00 0.00 0.00 62.75 64.30 2nrf n ILE 113 Cb 0.15 -1.23 0.00 0.00 -0.71 0.00 0.00 39.64 37.85 2nrf n ILE 113 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 2nrf n LEU 114 N -0.10 0.00 0.00 1.39 4.77 0.28 -4.86 117.00 118.48 2nrf n LEU 114 Ca 0.00 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 2nrf n LEU 114 Cb 0.00 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 2nrf n LEU 114 CO 0.00 -0.18 0.00 0.61 -1.33 0.00 0.00 177.39 176.49 2nrf n GLY 115 N -1.10 -1.40 0.16 -0.72 0.00 0.65 -4.17 105.19 98.60 2nrf n GLY 115 Ca 0.00 -1.48 -0.05 0.00 0.00 0.00 0.00 46.02 44.48 2nrf n GLY 115 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2nrf h ASP 116 N 0.00 0.05 -0.29 1.61 3.32 -1.72 -3.20 116.42 116.18 2nrf h ASP 116 Ca 0.00 0.06 0.03 0.00 0.02 0.00 0.00 57.03 57.14 2nrf h ASP 116 Cb 0.00 0.07 -0.05 0.00 0.22 0.00 0.00 39.33 39.57 2nrf h ASP 116 CO 0.00 0.06 -0.32 1.56 -1.72 0.00 0.00 179.24 178.83 2nrf h GLN 117 N 0.22 -0.17 -0.50 3.56 1.08 -1.89 -2.49 115.11 114.91 2nrf h GLN 117 Ca 0.18 0.01 0.10 0.00 -1.45 0.00 0.00 58.65 57.49 2nrf h GLN 117 Cb 0.20 0.04 -0.10 0.00 -0.05 0.00 0.00 27.48 27.56 2nrf h GLN 117 CO -0.22 -0.12 -0.30 0.93 -0.95 0.00 0.00 178.83 178.17 2nrf h GLU 118 N -0.18 -0.17 -0.04 1.46 4.39 -1.71 -1.34 114.58 116.98 2nrf h GLU 118 Ca 0.05 0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.73 2nrf h GLU 118 Cb 0.31 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 2nrf h GLU 118 CO -0.37 -0.11 -0.14 0.28 -1.16 0.00 0.00 179.01 177.51 2nrf h VAL 119 N -0.18 1.13 -0.24 3.13 2.07 -1.57 -2.24 116.25 118.35 2nrf h VAL 119 Ca 0.21 -0.58 -0.09 0.00 0.82 0.00 0.00 66.70 67.06 2nrf h VAL 119 Cb 0.53 1.25 -0.00 0.00 -1.52 0.00 0.00 31.29 31.54 2nrf h VAL 119 CO -0.61 0.17 -0.20 0.24 0.02 0.00 0.00 177.57 177.19 2nrf h MET 120 N 0.06 0.56 -0.95 1.57 2.86 -0.93 0.76 114.93 118.87 2nrf h MET 120 Ca 0.01 -0.28 0.28 0.00 -2.06 0.00 0.00 59.70 57.65 2nrf h MET 120 Cb 0.29 0.00 -0.17 0.00 0.06 0.00 0.00 31.60 31.79 2nrf h MET 120 CO 0.02 0.87 0.21 1.25 1.06 0.00 0.00 176.91 180.31 2nrf h LEU 121 N 0.27 -0.14 0.01 1.22 5.85 -0.67 0.80 115.31 122.66 2nrf h LEU 121 Ca 0.04 0.24 -0.29 0.00 0.84 0.00 0.00 57.88 58.71 2nrf h LEU 121 Cb 0.74 0.36 -0.04 0.00 0.37 0.00 0.00 40.66 42.09 2nrf h LEU 121 CO 0.05 -0.29 -1.68 -0.50 -0.34 0.00 0.00 178.44 175.68 2nrf h TRP 122 N 0.09 0.05 -0.11 1.25 4.06 -0.99 -3.40 115.95 116.90 2nrf h TRP 122 Ca 0.63 -0.04 0.00 0.00 2.06 0.00 0.00 58.89 61.54 2nrf h TRP 122 Cb 1.37 -0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.53 2nrf h TRP 122 CO -0.31 1.08 0.00 1.28 -3.56 0.00 0.00 178.44 176.92 2nrf n LEU 123 N -3.11 2.12 -4.80 -4.49 4.77 0.26 -4.88 117.00 106.86 2nrf n LEU 123 Ca -0.17 -1.39 -0.35 0.00 -0.03 0.00 0.00 56.01 54.08 2nrf n LEU 123 Cb 1.04 -0.07 -0.07 0.00 -2.33 0.00 0.00 43.42 42.00 2nrf n LEU 123 CO 0.45 0.47 0.64 0.00 -1.33 0.00 0.00 177.39 177.62 2nrf s ALA 124 N -0.83 3.13 0.20 -1.18 0.00 0.26 -2.66 121.76 120.68 2nrf s ALA 124 Ca 0.13 0.44 -0.31 0.00 0.00 0.00 0.00 51.96 52.22 2nrf s ALA 124 Cb 0.08 -3.15 -0.16 0.00 0.00 0.00 0.00 23.12 19.90 2nrf s ALA 124 CO 0.12 0.16 1.02 1.87 0.00 0.00 0.00 175.76 178.92 2nrf n TRP 125 N -0.08 0.97 -1.29 0.00 -0.00 -1.23 -4.63 117.44 111.17 2nrf n TRP 125 Ca 0.05 0.76 -0.52 0.00 -0.00 0.00 0.00 57.50 57.78 2nrf n TRP 125 Cb 0.52 -2.21 -0.08 0.00 -0.00 0.00 0.00 31.31 29.54 2nrf n TRP 125 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 177.69 175.39 2nrf n PRO 126 N 1.35 0.00 0.00 5.87 -0.02 -1.26 -4.82 135.00 136.12 2nrf n PRO 126 Ca 0.14 0.00 0.09 0.00 -2.02 0.00 0.00 63.50 61.71 2nrf n PRO 126 Cb 0.26 -1.17 -0.02 0.00 -0.02 0.00 0.00 33.50 32.54 2nrf n PRO 126 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 2nrf n PHE 127 N 3.64 0.00 -3.74 6.00 -1.74 -1.26 -4.89 117.46 115.47 2nrf n PHE 127 Ca 0.28 0.00 -0.13 0.00 -0.56 0.00 0.00 57.45 57.04 2nrf n PHE 127 Cb -0.04 0.00 -0.11 0.00 1.52 0.00 0.00 39.48 40.85 2nrf n PHE 127 CO 0.00 0.00 0.00 0.34 -0.56 0.00 0.00 176.76 176.54 2nrf s ASP 128 N -2.21 -0.39 0.33 5.98 -1.08 -1.26 -5.04 116.67 113.00 2nrf s ASP 128 Ca 0.13 0.74 0.12 0.00 -0.52 0.00 0.00 52.55 53.02 2nrf s ASP 128 Cb 0.14 0.74 1.05 0.00 -1.46 0.00 0.00 42.92 43.39 2nrf s ASP 128 CO 0.51 -0.13 1.52 -2.65 0.52 0.00 0.00 175.17 174.94 2nrf n PRO 129 N 3.03 -0.07 0.10 4.34 -0.02 -1.26 0.10 135.00 141.23 2nrf n PRO 129 Ca -0.14 1.38 0.20 0.00 -2.02 0.00 0.00 63.50 62.91 2nrf n PRO 129 Cb 0.57 -2.35 0.68 0.00 -0.02 0.00 0.00 33.50 32.38 2nrf n PRO 129 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 2nrf h THR 130 N 0.00 0.22 -0.01 3.45 1.35 -2.01 -0.26 112.91 115.64 2nrf h THR 130 Ca 0.72 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.58 2nrf h THR 130 Cb 1.74 0.52 0.00 0.00 -1.73 0.00 0.00 68.15 68.68 2nrf h THR 130 CO -0.81 0.00 -0.33 0.18 -0.25 0.00 0.00 175.52 174.30 2nrf n LEU 131 N -3.41 1.40 -0.49 3.87 4.32 0.11 -4.68 117.00 118.13 2nrf n LEU 131 Ca 0.08 -0.74 0.42 0.00 -0.02 0.00 0.00 56.01 55.75 2nrf n LEU 131 Cb 0.73 0.00 0.75 0.00 -1.62 0.00 0.00 43.42 43.28 2nrf n LEU 131 CO 0.23 0.28 1.37 0.07 -1.22 0.00 0.00 177.39 178.11 2nrf h LYS 132 N 1.41 0.04 -0.29 3.23 2.10 -0.96 0.33 116.57 122.42 2nrf h LYS 132 Ca 0.00 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2nrf h LYS 132 Cb 0.46 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.79 2nrf h LYS 132 CO 0.00 0.03 0.00 1.19 -2.00 0.00 0.00 179.45 178.67 2nrf n PHE 133 N -4.21 0.37 -2.69 0.07 3.01 -1.26 -4.65 117.46 108.11 2nrf n PHE 133 Ca 0.35 -0.19 -0.43 0.00 1.01 0.00 0.00 57.45 58.20 2nrf n PHE 133 Cb 1.55 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 41.01 2nrf n PHE 133 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 2nrf s GLU 134 N -1.63 3.81 0.54 -1.08 2.02 0.11 -4.85 118.70 117.62 2nrf s GLU 134 Ca 0.36 -1.75 0.25 0.00 0.02 0.00 0.00 54.97 53.85 2nrf s GLU 134 Cb 0.21 -5.30 1.41 0.00 0.10 0.00 0.00 34.13 30.54 2nrf s GLU 134 CO 0.29 -2.09 2.01 0.74 0.02 0.00 0.00 175.26 176.24 2nrf h PHE 135 N 8.48 0.00 -0.94 1.61 0.04 -1.84 -2.38 116.94 121.91 2nrf h PHE 135 Ca 0.30 0.00 0.02 0.00 2.80 0.00 0.00 57.97 61.08 2nrf h PHE 135 Cb 0.94 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 39.04 2nrf h PHE 135 CO 1.28 0.00 0.62 0.11 -0.60 0.00 0.00 178.31 179.73 2nrf h TRP 136 N 0.00 1.17 -0.97 -0.55 0.09 -1.98 -2.84 115.95 110.87 2nrf h TRP 136 Ca 0.22 0.03 0.25 0.00 0.09 0.00 0.00 58.89 59.49 2nrf h TRP 136 Cb 0.92 -0.39 -0.06 0.00 0.08 0.00 0.00 29.16 29.71 2nrf h TRP 136 CO 0.00 0.72 0.66 0.00 0.09 0.00 0.00 178.44 179.91 2nrf h ARG 137 N 1.24 0.21 0.00 0.12 3.08 -1.72 0.43 114.38 117.74 2nrf h ARG 137 Ca 0.35 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.39 2nrf h ARG 137 Cb -0.09 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 29.91 2nrf h ARG 137 CO -0.09 0.14 0.00 1.88 -1.07 0.00 0.00 179.97 180.83 2nrf h TYR 138 N 0.21 0.00 0.00 3.04 -1.99 -1.70 -3.26 116.97 113.28 2nrf h TYR 138 Ca 0.49 0.00 -0.12 0.00 2.00 0.00 0.00 58.73 61.10 2nrf h TYR 138 Cb 1.57 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 40.28 2nrf h TYR 138 CO -0.00 0.00 -1.42 1.19 -0.00 0.00 0.00 178.16 177.93 2nrf n PHE 139 N -2.80 0.00 0.30 4.88 3.01 -0.03 -4.52 117.46 118.31 2nrf n PHE 139 Ca -0.01 0.00 0.09 0.00 1.01 0.00 0.00 57.45 58.55 2nrf n PHE 139 Cb 0.16 -0.27 0.50 0.00 -0.01 0.00 0.00 39.48 39.86 2nrf n PHE 139 CO 0.00 0.00 0.00 1.79 1.01 0.00 0.00 176.76 179.56 2nrf h THR 140 N -0.18 0.00 -0.06 4.37 1.35 -1.19 -1.35 112.91 115.84 2nrf h THR 140 Ca -0.18 0.00 0.02 0.00 -0.55 0.00 0.00 66.41 65.70 2nrf h THR 140 Cb 1.19 0.41 -0.00 0.00 -1.73 0.00 0.00 68.15 68.02 2nrf h THR 140 CO -0.09 0.00 0.05 1.12 -0.25 0.00 0.00 175.52 176.35 2nrf h HIS 141 N 0.00 0.00 0.00 4.73 2.07 -1.59 -1.46 115.15 118.90 2nrf h HIS 141 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2nrf h HIS 141 Cb 1.03 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.01 2nrf h HIS 141 CO 0.00 0.00 0.00 0.00 -3.07 0.00 0.00 177.93 174.86 2nrf n ALA 142 N -2.49 1.96 0.42 6.11 0.00 -0.51 -2.84 120.51 123.17 2nrf n ALA 142 Ca -0.02 -0.08 0.12 0.00 0.00 0.00 0.00 53.44 53.47 2nrf n ALA 142 Cb 0.15 -1.33 0.17 0.00 0.00 0.00 0.00 19.45 18.45 2nrf n ALA 142 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2nrf h LEU 143 N 0.00 0.00 -9.55 0.00 4.07 -1.47 -3.30 115.31 105.07 2nrf h LEU 143 Ca 0.00 -0.10 -0.64 0.00 0.08 0.00 0.00 57.88 57.22 2nrf h LEU 143 Cb 0.29 0.00 -0.08 0.00 1.08 0.00 0.00 40.66 41.95 2nrf h LEU 143 CO 0.00 0.05 -0.42 -0.04 -1.08 0.00 0.00 178.44 176.94 2nrf s MET 144 N -3.21 3.72 0.11 1.13 -1.94 -1.13 -4.50 119.30 113.47 2nrf s MET 144 Ca 0.06 -0.04 0.06 0.00 -1.71 0.00 0.00 55.69 54.05 2nrf s MET 144 Cb 0.11 -3.26 -0.03 0.00 2.01 0.00 0.00 34.83 33.66 2nrf s MET 144 CO 0.71 0.63 -0.15 -1.01 -0.01 0.00 0.00 175.02 175.19 2nrf s HIS 145 N -0.66 1.41 -0.87 -0.03 3.76 -1.26 0.22 115.29 117.86 2nrf s HIS 145 Ca 0.15 -0.51 0.09 0.00 -0.15 0.00 0.00 55.06 54.64 2nrf s HIS 145 Cb -0.13 -0.76 0.19 0.00 1.11 0.00 0.00 32.58 33.00 2nrf s HIS 145 CO 0.04 0.13 1.07 1.19 -0.85 0.00 0.00 174.74 176.32 2nrf n PHE 146 N 0.82 0.25 -3.49 1.40 3.01 -1.26 -4.91 117.46 113.28 2nrf n PHE 146 Ca -0.18 -0.33 -0.13 0.00 1.01 0.00 0.00 57.45 57.82 2nrf n PHE 146 Cb 0.56 -0.02 -0.04 0.00 -0.01 0.00 0.00 39.48 39.97 2nrf n PHE 146 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2nrf s SER 147 N -0.92 -0.53 0.18 4.37 1.04 -1.26 -4.99 113.70 111.59 2nrf s SER 147 Ca 0.16 0.29 -0.13 0.00 0.48 0.00 0.00 55.95 56.75 2nrf s SER 147 Cb 0.09 0.50 0.17 0.00 0.10 0.00 0.00 66.02 66.87 2nrf s SER 147 CO 0.12 -0.70 1.74 0.25 0.98 0.00 0.00 173.24 175.63 2nrf h LEU 148 N 2.41 0.10 -1.67 2.42 5.85 -1.99 0.58 115.31 123.01 2nrf h LEU 148 Ca -0.27 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.51 2nrf h LEU 148 Cb 1.22 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.32 2nrf h LEU 148 CO 0.36 0.09 -0.04 0.24 -0.34 0.00 0.00 178.44 178.74 2nrf h MET 149 N 0.30 0.00 0.28 1.25 2.86 -1.99 -1.20 114.93 116.42 2nrf h MET 149 Ca 0.23 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.86 2nrf h MET 149 Cb 0.27 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.93 2nrf h MET 149 CO -0.27 0.04 -0.13 1.25 1.06 0.00 0.00 176.91 178.87 2nrf h HIS 150 N 0.00 -0.34 0.00 -0.22 -0.00 -1.32 -3.07 115.15 110.20 2nrf h HIS 150 Ca -0.00 -0.01 -0.04 0.00 -0.00 0.00 0.00 60.37 60.32 2nrf h HIS 150 Cb 0.46 0.11 -0.01 0.00 -0.00 0.00 0.00 27.41 27.98 2nrf h HIS 150 CO 0.00 -0.21 -0.21 0.97 -0.00 0.00 0.00 177.93 178.48 2nrf h ILE 151 N -0.71 0.78 0.20 6.26 2.10 -1.27 -2.94 117.51 121.93 2nrf h ILE 151 Ca -0.04 -0.84 -0.01 0.00 1.08 0.00 0.00 64.86 65.05 2nrf h ILE 151 Cb 0.28 1.51 0.00 0.00 -1.09 0.00 0.00 36.82 37.53 2nrf h ILE 151 CO 0.06 0.21 -0.10 0.25 -1.08 0.00 0.00 178.15 177.49 2nrf h LEU 152 N 0.00 -0.23 -2.36 2.19 5.85 -1.26 -1.39 115.31 118.11 2nrf h LEU 152 Ca -0.00 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.74 2nrf h LEU 152 Cb 0.49 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.58 2nrf h LEU 152 CO 0.03 -0.14 0.07 -0.26 -0.34 0.00 0.00 178.44 177.79 2nrf h PHE 153 N -0.31 0.00 0.22 1.25 -1.00 -1.61 -0.87 116.94 114.62 2nrf h PHE 153 Ca -0.03 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.74 2nrf h PHE 153 Cb 0.21 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.77 2nrf h PHE 153 CO 0.15 0.00 -0.10 -0.91 -1.61 0.00 0.00 178.31 175.83 2nrf h ASN 154 N 0.00 -0.25 0.64 2.17 -0.26 -1.44 -1.82 115.58 114.62 2nrf h ASN 154 Ca 0.03 -0.26 0.00 0.00 -0.56 0.00 0.00 56.30 55.51 2nrf h ASN 154 Cb 0.17 0.06 0.00 0.00 -1.06 0.00 0.00 38.32 37.50 2nrf h ASN 154 CO -0.00 0.16 0.00 -0.07 -1.06 0.00 0.00 177.43 176.46 2nrf h LEU 155 N -0.71 0.00 -0.02 1.61 3.38 -0.43 -1.45 115.31 117.69 2nrf h LEU 155 Ca -0.03 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 2nrf h LEU 155 Cb 0.49 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.24 2nrf h LEU 155 CO 0.05 0.00 -0.34 -0.07 0.09 0.00 0.00 178.44 178.17 2nrf h LEU 156 N 0.00 0.34 -0.93 1.67 3.38 -0.81 -1.62 115.31 117.35 2nrf h LEU 156 Ca 0.00 -0.73 -0.10 0.00 0.09 0.00 0.00 57.88 57.14 2nrf h LEU 156 Cb 0.32 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2nrf h LEU 156 CO 0.00 1.02 -0.49 -0.50 0.09 0.00 0.00 178.44 178.56 2nrf h TRP 157 N -0.31 0.00 -0.12 1.13 4.06 -1.01 -0.51 115.95 119.19 2nrf h TRP 157 Ca -0.04 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 60.87 2nrf h TRP 157 Cb 1.05 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.21 2nrf h TRP 157 CO 0.15 0.49 -0.09 2.35 -3.56 0.00 0.00 178.44 177.78 2nrf h TRP 158 N 0.00 0.33 -0.39 0.49 2.91 -1.25 0.20 115.95 118.24 2nrf h TRP 158 Ca -0.00 -0.09 -0.10 0.00 1.13 0.00 0.00 58.89 59.82 2nrf h TRP 158 Cb 0.94 -0.07 -0.01 0.00 -0.51 0.00 0.00 29.16 29.51 2nrf h TRP 158 CO 0.00 0.66 -0.15 2.35 -1.03 0.00 0.00 178.44 180.28 2nrf h TRP 159 N -0.09 0.91 0.24 2.65 7.01 -1.28 1.28 115.95 126.66 2nrf h TRP 159 Ca 0.02 -0.21 -0.01 0.00 2.11 0.00 0.00 58.89 60.80 2nrf h TRP 159 Cb 0.59 -0.21 0.00 0.00 -2.10 0.00 0.00 29.16 27.44 2nrf h TRP 159 CO 0.08 0.95 -0.11 -0.92 -2.79 0.00 0.00 178.44 175.64 2nrf h TYR 160 N 0.60 -0.29 0.20 2.65 3.20 -1.04 -2.56 116.97 119.73 2nrf h TYR 160 Ca 0.09 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.95 2nrf h TYR 160 Cb 0.69 0.10 0.00 0.00 1.54 0.00 0.00 36.73 39.06 2nrf h TYR 160 CO 0.05 0.09 -0.10 -0.07 -1.64 0.00 0.00 178.16 176.50 2nrf h LEU 161 N -0.83 -0.23 -0.12 2.82 3.38 -0.68 -2.82 115.31 116.83 2nrf h LEU 161 Ca -0.03 -0.23 0.05 0.00 0.09 0.00 0.00 57.88 57.75 2nrf h LEU 161 Cb 0.51 0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.26 2nrf h LEU 161 CO 0.05 0.31 -0.26 1.23 0.09 0.00 0.00 178.44 179.86 2nrf h GLY 162 N -0.97 -0.30 0.00 0.83 0.00 0.15 -1.93 103.07 100.85 2nrf h GLY 162 Ca -0.03 0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.62 2nrf h GLY 162 CO 0.05 -0.21 0.00 0.61 0.00 0.00 0.00 176.54 176.99 2nrf n GLY 163 N -1.38 -3.06 0.37 4.60 0.00 -0.96 -1.33 105.19 103.42 2nrf n GLY 163 Ca -0.03 0.52 0.02 0.00 0.00 0.00 0.00 46.02 46.53 2nrf n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nrf h ALA 164 N -1.14 0.39 0.08 4.61 0.00 -1.19 0.10 119.26 122.10 2nrf h ALA 164 Ca 0.00 0.32 0.02 0.00 0.00 0.00 0.00 54.91 55.25 2nrf h ALA 164 Cb 0.00 0.87 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 2nrf h ALA 164 CO 0.00 -0.51 -0.21 0.28 0.00 0.00 0.00 179.25 178.81 2nrf h VAL 165 N -0.01 0.53 -0.27 0.00 2.07 -0.92 -0.88 116.25 116.77 2nrf h VAL 165 Ca 0.40 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.96 2nrf h VAL 165 Cb 0.65 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 2nrf h VAL 165 CO -0.98 0.00 0.19 -0.08 0.02 0.00 0.00 177.57 176.71 2nrf h GLU 166 N -0.37 0.20 0.05 1.57 4.81 0.44 0.92 114.58 122.21 2nrf h GLU 166 Ca 0.04 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.25 2nrf h GLU 166 Cb 0.41 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.74 2nrf h GLU 166 CO -0.14 0.13 -0.03 -0.22 -0.73 0.00 0.00 179.01 178.03 2nrf h LYS 167 N 0.21 -0.07 0.00 1.92 3.64 -0.71 -2.89 116.57 118.66 2nrf h LYS 167 Ca 0.12 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.42 2nrf h LYS 167 Cb 0.21 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 2nrf h LYS 167 CO -0.02 0.40 -0.41 0.00 -2.27 0.00 0.00 179.45 177.15 2nrf h ARG 168 N -0.97 0.00 0.00 1.90 3.08 -0.92 -3.37 114.38 114.10 2nrf h ARG 168 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2nrf h ARG 168 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.55 2nrf h ARG 168 CO 0.01 0.41 0.00 1.28 -1.07 0.00 0.00 179.97 180.60 2nrf n LEU 169 N -3.33 0.36 0.00 3.04 4.77 0.32 -5.04 117.00 117.12 2nrf n LEU 169 Ca 0.01 -0.61 0.00 0.00 -0.03 0.00 0.00 56.01 55.38 2nrf n LEU 169 Cb 0.62 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.71 2nrf n LEU 169 CO 0.38 0.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 2nrf n GLY 170 N 0.51 2.07 0.09 -0.72 0.00 -1.09 -4.48 105.19 101.57 2nrf n GLY 170 Ca 0.00 -1.96 -0.07 0.00 0.00 0.00 0.00 46.02 43.99 2nrf n GLY 170 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2nrf h SER 171 N 0.00 0.10 0.44 1.61 0.02 -1.88 -3.24 113.55 110.60 2nrf h SER 171 Ca 0.00 -0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 60.84 2nrf h SER 171 Cb 0.00 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 62.51 2nrf h SER 171 CO 0.00 0.98 -0.26 1.23 -1.14 0.00 0.00 176.83 177.64 2nrf h GLY 172 N 2.42 -0.69 -0.29 -3.77 0.00 -1.95 0.10 103.07 98.90 2nrf h GLY 172 Ca -0.03 0.28 0.24 0.00 0.00 0.00 0.00 47.33 47.82 2nrf h GLY 172 CO 0.13 -0.26 0.39 1.70 0.00 0.00 0.00 176.54 178.51 2nrf h LYS 173 N -0.66 0.35 -0.05 4.80 1.63 -1.78 -1.04 116.57 119.82 2nrf h LYS 173 Ca -0.05 -0.02 -0.18 0.00 -0.85 0.00 0.00 60.65 59.55 2nrf h LYS 173 Cb 0.53 -0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 32.08 2nrf h LYS 173 CO 0.06 0.23 -0.75 1.25 -3.45 0.00 0.00 179.45 176.79 2nrf h LEU 174 N 0.36 0.38 -0.21 5.20 5.85 -1.40 -2.63 115.31 122.86 2nrf h LEU 174 Ca 0.59 -0.26 -0.03 0.00 0.84 0.00 0.00 57.88 59.02 2nrf h LEU 174 Cb 1.16 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 42.07 2nrf h LEU 174 CO -0.56 1.00 0.02 0.40 -0.34 0.00 0.00 178.44 178.95 2nrf h ILE 175 N 0.21 1.24 0.00 4.05 2.04 0.37 -1.40 117.51 124.02 2nrf h ILE 175 Ca -0.03 -0.80 -0.10 0.00 1.00 0.00 0.00 64.86 64.93 2nrf h ILE 175 Cb 1.32 1.37 -0.01 0.00 -0.74 0.00 0.00 36.82 38.76 2nrf h ILE 175 CO 0.12 0.25 -0.47 0.58 0.00 0.00 0.00 178.15 178.63 2nrf h VAL 176 N 0.13 1.24 -0.24 1.67 2.07 -1.29 0.33 116.25 120.16 2nrf h VAL 176 Ca 0.06 -1.66 -0.16 0.00 0.82 0.00 0.00 66.70 65.76 2nrf h VAL 176 Cb 0.35 1.92 -0.01 0.00 -1.52 0.00 0.00 31.29 32.04 2nrf h VAL 176 CO 0.01 0.46 -0.51 0.40 0.02 0.00 0.00 177.57 177.95 2nrf h ILE 177 N 0.00 1.30 -0.23 4.57 2.04 -1.41 -2.42 117.51 121.36 2nrf h ILE 177 Ca -0.00 -1.72 -0.17 0.00 1.00 0.00 0.00 64.86 63.97 2nrf h ILE 177 Cb 0.88 1.66 -0.00 0.00 -0.74 0.00 0.00 36.82 38.61 2nrf h ILE 177 CO 0.06 0.55 -0.54 0.74 0.00 0.00 0.00 178.15 178.95 2nrf h THR 178 N 0.53 1.30 0.05 -0.27 2.02 -0.44 -2.61 112.91 113.48 2nrf h THR 178 Ca 0.02 -1.76 -0.00 0.00 0.77 0.00 0.00 66.41 65.43 2nrf h THR 178 Cb 1.06 1.71 0.00 0.00 -1.74 0.00 0.00 68.15 69.18 2nrf h THR 178 CO 0.10 0.56 -0.02 -0.07 0.37 0.00 0.00 175.52 176.46 2nrf h LEU 179 N 0.53 -0.05 -1.01 2.58 3.38 -0.35 -2.90 115.31 117.48 2nrf h LEU 179 Ca 0.01 -0.60 -0.03 0.00 0.09 0.00 0.00 57.88 57.35 2nrf h LEU 179 Cb 1.11 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.84 2nrf h LEU 179 CO 0.11 0.62 0.33 0.40 0.09 0.00 0.00 178.44 179.99 2nrf h ILE 180 N -0.77 1.23 -0.03 1.22 2.04 -1.53 -1.90 117.51 117.77 2nrf h ILE 180 Ca -0.01 -0.67 -0.16 0.00 1.00 0.00 0.00 64.86 65.02 2nrf h ILE 180 Cb 0.65 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 37.03 2nrf h ILE 180 CO 0.01 0.28 -0.69 0.77 0.00 0.00 0.00 178.15 178.52 2nrf h SER 181 N 1.03 0.20 -0.38 1.72 4.64 -1.59 -1.37 113.55 117.80 2nrf h SER 181 Ca 0.25 -0.13 -0.11 0.00 -0.47 0.00 0.00 61.79 61.33 2nrf h SER 181 Cb 0.12 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 2nrf h SER 181 CO -0.03 0.83 -0.20 0.00 -0.87 0.00 0.00 176.83 176.56 2nrf h ALA 182 N 1.17 0.53 0.29 5.18 0.00 -1.40 -0.63 119.26 124.40 2nrf h ALA 182 Ca -0.02 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 2nrf h ALA 182 Cb 1.23 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2nrf h ALA 182 CO 0.10 0.49 -0.14 -0.07 0.00 0.00 0.00 179.25 179.63 2nrf h LEU 183 N 0.60 -0.33 -1.05 0.00 3.38 -1.36 -1.99 115.31 114.57 2nrf h LEU 183 Ca 0.08 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 2nrf h LEU 183 Cb 0.76 0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.56 2nrf h LEU 183 CO 0.06 0.15 0.18 0.25 0.09 0.00 0.00 178.44 179.17 2nrf h LEU 184 N -0.98 0.80 -0.12 1.67 6.46 -1.32 -1.43 115.31 120.39 2nrf h LEU 184 Ca -0.04 -0.13 -0.18 0.00 -0.12 0.00 0.00 57.88 57.41 2nrf h LEU 184 Cb 0.48 -0.21 -0.03 0.00 -0.73 0.00 0.00 40.66 40.18 2nrf h LEU 184 CO 0.07 0.75 -0.86 0.77 -0.62 0.00 0.00 178.44 178.54 2nrf h SER 185 N 0.84 0.00 0.86 1.25 4.64 -1.22 -2.79 113.55 117.13 2nrf h SER 185 Ca 0.19 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.37 2nrf h SER 185 Cb 0.25 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.32 2nrf h SER 185 CO -0.01 0.86 -0.66 1.23 -0.87 0.00 0.00 176.83 177.38 2nrf h GLY 186 N 2.90 0.00 0.76 -0.77 0.00 -1.07 -2.42 103.07 102.47 2nrf h GLY 186 Ca -0.01 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 2nrf h GLY 186 CO 0.11 0.00 -0.04 -1.82 0.00 0.00 0.00 176.54 174.79 2nrf h TYR 187 N 0.00 0.33 -0.28 5.60 3.20 -1.23 0.02 116.97 124.60 2nrf h TYR 187 Ca -0.01 -0.07 0.01 0.00 3.14 0.00 0.00 58.73 61.80 2nrf h TYR 187 Cb 1.27 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 39.44 2nrf h TYR 187 CO 0.00 0.58 0.15 0.28 -1.64 0.00 0.00 178.16 177.54 2nrf h VAL 188 N -0.01 1.01 0.25 1.81 2.07 -1.45 0.32 116.25 120.25 2nrf h VAL 188 Ca 0.04 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 2nrf h VAL 188 Cb 0.48 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 2nrf h VAL 188 CO 0.02 0.06 -0.25 -0.61 0.02 0.00 0.00 177.57 176.80 2nrf h GLN 189 N 0.32 -0.49 -0.49 1.57 5.75 -1.34 -0.74 115.11 119.70 2nrf h GLN 189 Ca 0.11 0.03 0.07 0.00 -0.15 0.00 0.00 58.65 58.71 2nrf h GLN 189 Cb 0.01 0.11 -0.09 0.00 1.07 0.00 0.00 27.48 28.58 2nrf h GLN 189 CO -0.06 -0.32 -0.50 0.37 -2.65 0.00 0.00 178.83 175.66 2nrf h GLN 190 N -0.50 -0.31 -0.88 1.69 -0.00 -0.71 1.12 115.11 115.52 2nrf h GLN 190 Ca -0.03 0.02 0.15 0.00 -0.00 0.00 0.00 58.65 58.78 2nrf h GLN 190 Cb 0.44 0.07 -0.15 0.00 0.00 0.00 0.00 27.48 27.84 2nrf h GLN 190 CO -0.03 -0.20 -0.35 -0.22 0.00 0.00 0.00 178.83 178.02 2nrf h LYS 191 N -0.32 -0.04 0.00 1.69 1.63 0.02 0.65 116.57 120.20 2nrf h LYS 191 Ca 0.12 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.92 2nrf h LYS 191 Cb 0.58 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.22 2nrf h LYS 191 CO -0.64 -0.03 -1.21 1.19 -3.45 0.00 0.00 179.45 175.31 2nrf n PHE 192 N -5.48 0.52 -1.85 1.91 3.01 -0.32 -4.50 117.46 110.75 2nrf n PHE 192 Ca 0.09 0.15 0.02 0.00 1.01 0.00 0.00 57.45 58.73 2nrf n PHE 192 Cb 0.40 -0.68 0.03 0.00 -0.01 0.00 0.00 39.48 39.22 2nrf n PHE 192 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2nrf n SER 193 N -2.34 0.57 0.00 4.37 7.64 0.38 -5.09 113.62 119.15 2nrf n SER 193 Ca -0.00 -2.25 0.00 0.00 1.01 0.00 0.00 58.87 57.62 2nrf n SER 193 Cb 0.51 -0.26 0.00 0.00 -1.01 0.00 0.00 64.21 63.45 2nrf n SER 193 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2nrf n GLY 194 N -0.27 -2.16 0.01 0.23 0.00 0.22 -4.65 105.19 98.57 2nrf n GLY 194 Ca 0.04 -1.69 0.11 0.00 0.00 0.00 0.00 46.02 44.47 2nrf n GLY 194 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2nrf n PRO 195 N -0.12 0.09 -2.88 1.61 -0.04 -1.26 -2.56 135.00 129.84 2nrf n PRO 195 Ca 0.00 -0.01 -0.43 0.00 -0.04 0.00 0.00 63.50 63.02 2nrf n PRO 195 Cb 0.00 -1.52 -0.04 0.00 -0.04 0.00 0.00 33.50 31.90 2nrf n PRO 195 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2nrf s TRP 196 N -3.06 2.74 0.07 0.54 0.52 -1.26 -4.07 118.94 114.41 2nrf s TRP 196 Ca 0.07 -0.66 -0.03 0.00 0.02 0.00 0.00 56.10 55.50 2nrf s TRP 196 Cb 0.16 -4.27 0.01 0.00 -1.15 0.00 0.00 33.47 28.22 2nrf s TRP 196 CO 0.82 -1.61 0.15 1.97 0.02 0.00 0.00 176.95 178.30 2nrf n PHE 197 N 7.51 -1.22 0.00 -1.98 1.16 -1.26 -5.11 117.46 116.56 2nrf n PHE 197 Ca -0.02 -0.34 0.00 0.00 -1.87 0.00 0.00 57.45 55.22 2nrf n PHE 197 Cb 0.45 0.17 0.00 0.00 -1.61 0.00 0.00 39.48 38.50 2nrf n PHE 197 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2nrf n GLY 198 N -0.10 -0.83 0.00 4.97 0.00 -1.26 -4.91 105.19 103.06 2nrf n GLY 198 Ca -0.02 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.94 2nrf n GLY 198 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nrf n GLY 199 N -0.25 2.94 1.64 -0.02 0.00 0.61 -4.80 105.19 105.30 2nrf n GLY 199 Ca 0.00 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.18 2nrf n GLY 199 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2nrf n LEU 200 N 0.00 5.34 0.10 0.99 7.94 -1.24 -4.22 117.00 125.91 2nrf n LEU 200 Ca 0.00 -3.17 -0.06 0.00 -1.11 0.00 0.00 56.01 51.67 2nrf n LEU 200 Cb 0.00 -0.68 0.04 0.00 0.53 0.00 0.00 43.42 43.31 2nrf n LEU 200 CO 0.00 0.78 0.33 0.77 -1.11 0.00 0.00 177.39 178.16 2nrf h SER 201 N 2.58 0.12 -0.24 1.96 4.64 -1.92 -2.33 113.55 118.36 2nrf h SER 201 Ca 0.15 -0.09 -0.03 0.00 -0.47 0.00 0.00 61.79 61.35 2nrf h SER 201 Cb 2.00 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 64.05 2nrf h SER 201 CO 0.54 0.86 0.04 1.23 -0.87 0.00 0.00 176.83 178.63 2nrf h GLY 202 N 2.05 0.43 2.00 -0.77 0.00 -1.87 -2.06 103.07 102.85 2nrf h GLY 202 Ca -0.02 -0.29 -0.05 0.00 0.00 0.00 0.00 47.33 46.97 2nrf h GLY 202 CO 0.11 0.27 -0.25 -2.08 0.00 0.00 0.00 176.54 174.59 2nrf h VAL 203 N 0.21 0.70 -0.06 4.60 2.07 -1.80 -2.81 116.25 119.16 2nrf h VAL 203 Ca 0.07 -1.09 -0.17 0.00 0.82 0.00 0.00 66.70 66.33 2nrf h VAL 203 Cb 0.32 1.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.78 2nrf h VAL 203 CO 0.00 0.25 -0.72 0.58 0.02 0.00 0.00 177.57 177.70 2nrf h VAL 204 N 0.00 1.41 0.00 2.57 2.07 -1.09 -1.55 116.25 119.66 2nrf h VAL 204 Ca -0.00 -2.19 -0.09 0.00 0.82 0.00 0.00 66.70 65.23 2nrf h VAL 204 Cb 0.67 2.15 -0.01 0.00 -1.52 0.00 0.00 31.29 32.59 2nrf h VAL 204 CO 0.03 0.65 -0.43 1.88 0.02 0.00 0.00 177.57 179.73 2nrf h TYR 205 N 0.21 0.00 0.07 1.57 -1.99 -1.13 -1.02 116.97 114.67 2nrf h TYR 205 Ca -0.03 0.00 -0.19 0.00 2.00 0.00 0.00 58.73 60.51 2nrf h TYR 205 Cb 1.28 0.00 0.02 0.00 2.00 0.00 0.00 36.73 40.03 2nrf h TYR 205 CO 0.03 0.43 -0.80 0.00 -0.00 0.00 0.00 178.16 177.82 2nrf h ALA 206 N 1.57 0.00 -0.43 3.88 0.00 -1.36 -2.42 119.26 120.52 2nrf h ALA 206 Ca -0.00 -0.65 -0.10 0.00 0.00 0.00 0.00 54.91 54.15 2nrf h ALA 206 Cb 0.76 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 2nrf h ALA 206 CO 0.06 0.43 -0.15 -0.07 0.00 0.00 0.00 179.25 179.51 2nrf h LEU 207 N -0.11 0.80 -0.44 0.00 3.38 -1.16 -0.54 115.31 117.24 2nrf h LEU 207 Ca -0.12 -0.26 -0.04 0.00 0.09 0.00 0.00 57.88 57.55 2nrf h LEU 207 Cb 1.55 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 42.06 2nrf h LEU 207 CO 0.15 0.96 0.13 0.24 0.09 0.00 0.00 178.44 180.01 2nrf h MET 208 N 0.71 0.69 -0.56 1.13 2.86 -1.23 0.49 114.93 119.02 2nrf h MET 208 Ca 0.11 -0.15 -0.06 0.00 -2.06 0.00 0.00 59.70 57.54 2nrf h MET 208 Cb 0.65 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.20 2nrf h MET 208 CO 0.05 0.68 0.11 0.78 1.06 0.00 0.00 176.91 179.58 2nrf h GLY 209 N 0.57 0.98 0.46 8.32 0.00 -1.18 0.28 103.07 112.51 2nrf h GLY 209 Ca 0.14 -0.64 -0.02 0.00 0.00 0.00 0.00 47.33 46.80 2nrf h GLY 209 CO -0.00 0.60 -0.22 -1.82 0.00 0.00 0.00 176.54 175.09 2nrf h TYR 210 N 0.81 -0.58 -0.74 5.60 3.20 -0.92 -0.81 116.97 123.54 2nrf h TYR 210 Ca 0.17 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.13 2nrf h TYR 210 Cb 0.39 0.19 -0.12 0.00 1.54 0.00 0.00 36.73 38.73 2nrf h TYR 210 CO 0.03 -0.36 -0.47 0.28 -1.64 0.00 0.00 178.16 176.00 2nrf h VAL 211 N -0.76 0.04 0.42 1.81 2.07 -0.89 0.82 116.25 119.75 2nrf h VAL 211 Ca -0.06 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.44 2nrf h VAL 211 Cb 0.48 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 2nrf h VAL 211 CO 0.10 0.00 -0.30 -0.25 0.02 0.00 0.00 177.57 177.14 2nrf h TRP 212 N -0.15 -0.82 -0.58 1.57 7.01 -0.99 -2.00 115.95 120.00 2nrf h TRP 212 Ca 0.20 -0.00 0.12 0.00 2.11 0.00 0.00 58.89 61.31 2nrf h TRP 212 Cb 0.54 0.30 -0.11 0.00 -2.10 0.00 0.00 29.16 27.79 2nrf h TRP 212 CO -0.82 -0.43 -0.14 1.25 -2.79 0.00 0.00 178.44 175.51 2nrf h LEU 213 N -0.69 -0.53 -1.15 0.65 6.46 -0.28 -1.21 115.31 118.55 2nrf h LEU 213 Ca -0.06 0.17 0.09 0.00 -0.12 0.00 0.00 57.88 57.97 2nrf h LEU 213 Cb 0.57 0.36 -0.07 0.00 -0.73 0.00 0.00 40.66 40.79 2nrf h LEU 213 CO 0.03 -0.19 0.59 0.03 -0.62 0.00 0.00 178.44 178.28 2nrf h ARG 214 N 0.00 0.92 -0.44 1.25 2.47 0.83 -2.16 114.38 117.25 2nrf h ARG 214 Ca 0.28 -0.06 -0.11 0.00 -1.26 0.00 0.00 59.98 58.83 2nrf h ARG 214 Cb 0.42 -0.21 -0.02 0.00 -1.65 0.00 0.00 29.97 28.52 2nrf h ARG 214 CO -0.59 0.61 -0.19 0.78 0.56 0.00 0.00 179.97 181.14 2nrf h GLY 215 N 0.94 0.92 1.08 0.04 0.00 -0.48 0.63 103.07 106.21 2nrf h GLY 215 Ca 0.42 -0.77 -0.11 0.00 0.00 0.00 0.00 47.33 46.87 2nrf h GLY 215 CO -0.18 0.70 -0.07 -2.09 0.00 0.00 0.00 176.54 174.90 2nrf h GLU 216 N 0.75 1.02 0.01 4.80 4.57 -0.94 -2.98 114.58 121.81 2nrf h GLU 216 Ca 0.11 -0.36 -0.21 0.00 -1.18 0.00 0.00 59.36 57.72 2nrf h GLU 216 Cb 0.71 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.20 2nrf h GLU 216 CO 0.05 1.05 -1.14 0.00 -1.18 0.00 0.00 179.01 177.80 2nrf h ARG 217 N 0.90 0.01 -3.23 1.92 3.08 -1.38 -3.42 114.38 112.27 2nrf h ARG 217 Ca 0.15 -0.02 -0.69 0.00 0.07 0.00 0.00 59.98 59.48 2nrf h ARG 217 Cb 0.64 0.01 -0.36 0.00 0.08 0.00 0.00 29.97 30.33 2nrf h ARG 217 CO 0.04 1.01 -0.13 -3.47 -1.07 0.00 0.00 179.97 176.35 2nrf n ASP 218 N -4.42 4.13 -0.07 7.04 -0.08 0.22 -4.90 116.55 118.47 2nrf n ASP 218 Ca -0.29 -3.16 -0.09 0.00 -1.51 0.00 0.00 54.79 49.73 2nrf n ASP 218 Cb 0.67 -1.01 -0.02 0.00 2.34 0.00 0.00 41.12 43.10 2nrf n ASP 218 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2nrf h PRO 219 N 5.82 0.34 0.00 -0.67 0.11 -1.65 -2.76 132.00 133.20 2nrf h PRO 219 Ca 0.16 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.25 2nrf h PRO 219 Cb 0.79 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.82 2nrf h PRO 219 CO 0.86 0.23 0.00 0.37 -0.21 0.00 0.00 178.00 179.25 2nrf h GLN 220 N 0.35 0.00 0.00 1.05 4.15 -1.90 -2.59 115.11 116.17 2nrf h GLN 220 Ca 0.09 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.51 2nrf h GLN 220 Cb -0.03 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.66 2nrf h GLN 220 CO -0.02 0.00 0.10 -1.13 -1.93 0.00 0.00 178.83 175.85 2nrf n SER 221 N -2.52 0.48 0.00 -0.69 3.41 -1.04 -4.78 113.62 108.48 2nrf n SER 221 Ca -0.00 0.69 0.00 0.00 -0.26 0.00 0.00 58.87 59.29 2nrf n SER 221 Cb 0.14 -0.72 0.00 0.00 -0.26 0.00 0.00 64.21 63.37 2nrf n SER 221 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2nrf n GLY 222 N -1.29 3.04 3.82 5.00 0.00 -0.97 -5.02 105.19 109.76 2nrf n GLY 222 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 2nrf n GLY 222 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2nrf s ILE 223 N -2.66 4.57 -0.21 -0.61 2.07 -1.26 -5.06 121.20 118.05 2nrf s ILE 223 Ca 0.00 1.27 -0.36 0.00 -1.41 0.00 0.00 60.65 60.15 2nrf s ILE 223 Cb 0.00 -3.85 0.15 0.00 0.13 0.00 0.00 42.46 38.89 2nrf s ILE 223 CO 0.00 0.19 1.34 -0.72 -1.91 0.00 0.00 174.94 173.84 2nrf s TYR 224 N -1.54 -0.04 -0.31 3.50 -0.85 -1.26 -3.36 117.35 113.48 2nrf s TYR 224 Ca 0.43 0.02 -0.10 0.00 -0.52 0.00 0.00 57.07 56.91 2nrf s TYR 224 Cb -0.16 0.51 -0.01 0.00 0.38 0.00 0.00 41.96 42.68 2nrf s TYR 224 CO 0.21 -0.09 0.15 -1.17 -1.52 0.00 0.00 175.55 173.13 2nrf s LEU 225 N -2.29 4.12 -0.12 -3.49 0.20 -1.26 -4.89 118.68 110.94 2nrf s LEU 225 Ca 0.12 -0.54 -0.41 0.00 0.69 0.00 0.00 54.13 54.00 2nrf s LEU 225 Cb 0.01 -2.00 -0.18 0.00 -0.43 0.00 0.00 46.19 43.58 2nrf s LEU 225 CO -0.04 -0.20 1.36 1.67 -0.29 0.00 0.00 176.35 178.85 2nrf n GLN 226 N 4.98 0.49 -0.41 1.98 0.00 -1.26 -4.41 117.38 118.75 2nrf n GLN 226 Ca -0.14 0.18 0.33 0.00 -0.00 0.00 0.00 57.00 57.37 2nrf n GLN 226 Cb 0.49 -1.75 0.61 0.00 0.00 0.00 0.00 30.24 29.60 2nrf n GLN 226 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.06 176.97 2nrf h ARG 227 N 4.49 0.16 -0.07 3.69 2.43 -1.99 0.83 114.38 123.93 2nrf h ARG 227 Ca -0.48 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 58.63 2nrf h ARG 227 Cb 1.37 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.89 2nrf h ARG 227 CO 0.80 0.11 -0.14 0.78 -1.51 0.00 0.00 179.97 180.01 2nrf h GLY 228 N 0.17 0.23 0.85 2.80 0.00 -1.98 -3.01 103.07 102.12 2nrf h GLY 228 Ca 0.75 -0.28 0.02 0.00 0.00 0.00 0.00 47.33 47.83 2nrf h GLY 228 CO -0.38 0.25 0.08 1.41 0.00 0.00 0.00 176.54 177.90 2nrf h LEU 229 N -0.28 0.09 -0.78 3.11 3.38 0.02 0.82 115.31 121.67 2nrf h LEU 229 Ca 0.00 0.02 0.18 0.00 0.09 0.00 0.00 57.88 58.17 2nrf h LEU 229 Cb 0.73 0.01 -0.13 0.00 0.09 0.00 0.00 40.66 41.35 2nrf h LEU 229 CO 0.03 0.08 0.06 0.40 0.09 0.00 0.00 178.44 179.10 2nrf h ILE 230 N 0.18 0.35 0.00 1.22 2.04 0.10 1.21 117.51 122.60 2nrf h ILE 230 Ca 0.09 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.90 2nrf h ILE 230 Cb 0.05 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 36.33 2nrf h ILE 230 CO -0.09 0.02 0.00 -0.38 0.00 0.00 0.00 178.15 177.71 2nrf n ILE 231 N -5.31 0.80 -0.44 -0.67 2.08 -0.16 -0.50 119.36 115.16 2nrf n ILE 231 Ca 0.15 0.17 -0.10 0.00 0.56 0.00 0.00 62.75 63.53 2nrf n ILE 231 Cb 0.51 -1.06 0.17 0.00 -0.75 0.00 0.00 39.64 38.50 2nrf n ILE 231 CO 0.00 0.00 0.00 0.49 0.56 0.00 0.00 176.55 177.60 2nrf n PHE 232 N -2.14 1.88 0.00 1.39 0.99 0.42 0.32 117.46 120.32 2nrf n PHE 232 Ca 0.03 -1.14 0.00 0.00 -0.00 0.00 0.00 57.45 56.34 2nrf n PHE 232 Cb 0.25 -0.62 0.00 0.00 -1.00 0.00 0.00 39.48 38.11 2nrf n PHE 232 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2nrf n ALA 233 N -0.31 2.41 0.04 4.37 0.00 -0.47 -4.69 120.51 121.86 2nrf n ALA 233 Ca 0.34 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.72 2nrf n ALA 233 Cb 1.18 0.06 -0.11 0.00 0.00 0.00 0.00 19.45 20.58 2nrf n ALA 233 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2nrf h LEU 234 N 0.00 0.00 -1.48 0.00 3.38 -0.49 0.97 115.31 117.70 2nrf h LEU 234 Ca 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2nrf h LEU 234 Cb 0.12 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2nrf h LEU 234 CO 0.00 0.93 -0.27 0.40 0.09 0.00 0.00 178.44 179.59 2nrf h ILE 235 N 0.00 1.14 0.13 1.22 2.04 0.49 0.26 117.51 122.79 2nrf h ILE 235 Ca -0.10 -0.93 -0.26 0.00 1.00 0.00 0.00 64.86 64.57 2nrf h ILE 235 Cb 1.80 1.51 0.03 0.00 -0.74 0.00 0.00 36.82 39.41 2nrf h ILE 235 CO 0.10 0.26 -1.09 -0.50 0.00 0.00 0.00 178.15 176.92 2nrf h TRP 236 N 0.00 0.84 0.00 1.37 4.06 -1.50 2.01 115.95 122.74 2nrf h TRP 236 Ca -0.00 -0.55 -0.05 0.00 2.06 0.00 0.00 58.89 60.34 2nrf h TRP 236 Cb 0.49 -0.06 -0.01 0.00 -1.00 0.00 0.00 29.16 28.58 2nrf h TRP 236 CO 0.00 1.41 -0.24 0.97 -3.56 0.00 0.00 178.44 177.01 2nrf h ILE 237 N 0.04 0.68 -0.63 1.49 2.10 0.12 -1.80 117.51 119.51 2nrf h ILE 237 Ca -0.17 -1.08 0.00 0.00 1.08 0.00 0.00 64.86 64.69 2nrf h ILE 237 Cb 1.81 1.69 0.00 0.00 -1.09 0.00 0.00 36.82 39.23 2nrf h ILE 237 CO 0.21 0.24 0.00 0.52 -1.08 0.00 0.00 178.15 178.04 2nrf n VAL 238 N -3.53 1.94 -2.37 2.19 0.31 0.90 -1.92 118.33 115.85 2nrf n VAL 238 Ca -0.01 -1.19 0.03 0.00 -0.01 0.00 0.00 64.34 63.16 2nrf n VAL 238 Cb 0.40 0.05 0.06 0.00 -0.91 0.00 0.00 33.84 33.43 2nrf n VAL 238 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2nrf n ALA 239 N 1.05 2.74 0.00 3.52 0.00 0.68 -0.12 120.51 128.37 2nrf n ALA 239 Ca 0.26 -2.64 0.00 0.00 0.00 0.00 0.00 53.44 51.06 2nrf n ALA 239 Cb 0.93 -0.67 0.00 0.00 0.00 0.00 0.00 19.45 19.71 2nrf n ALA 239 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nrf n GLY 240 N -0.00 0.00 0.14 0.00 0.00 -1.14 -4.30 105.19 99.87 2nrf n GLY 240 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 2nrf n GLY 240 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 2nrf n TRP 241 N -0.45 0.08 -0.01 1.61 -0.00 -0.81 -3.54 117.44 114.33 2nrf n TRP 241 Ca 0.00 0.03 -0.00 0.00 -0.00 0.00 0.00 57.50 57.52 2nrf n TRP 241 Cb 0.00 -1.01 -0.00 0.00 -0.00 0.00 0.00 31.31 30.30 2nrf n TRP 241 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 177.69 178.88 2nrf n PHE 242 N -3.98 0.01 0.27 5.87 0.99 -1.22 -4.30 117.46 115.10 2nrf n PHE 242 Ca -0.51 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 56.94 2nrf n PHE 242 Cb 0.91 -0.06 0.00 0.00 -1.00 0.00 0.00 39.48 39.33 2nrf n PHE 242 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 2nrf n ASP 243 N -2.59 0.31 0.00 4.37 -0.08 0.82 -4.85 116.55 114.54 2nrf n ASP 243 Ca -0.01 -0.54 0.00 0.00 -1.51 0.00 0.00 54.79 52.74 2nrf n ASP 243 Cb 0.03 -0.13 0.00 0.00 2.34 0.00 0.00 41.12 43.35 2nrf n ASP 243 CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21 2nrf n LEU 244 N 0.40 0.00 0.00 -2.67 0.00 -1.26 -4.34 117.00 109.14 2nrf n LEU 244 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.01 2nrf n LEU 244 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.49 2nrf n LEU 244 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 177.39 177.72 2nrf n PHE 245 N 0.00 0.00 0.00 1.96 7.35 -1.23 -4.60 117.46 120.94 2nrf n PHE 245 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 2nrf n PHE 245 Cb 0.00 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.83 2nrf n PHE 245 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2nrf n GLY 246 N 0.00 -1.31 0.11 7.13 0.00 -1.26 -4.98 105.19 104.88 2nrf n GLY 246 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2nrf n GLY 246 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2nrf n MET 247 N 0.00 0.00 -3.29 1.61 2.81 -1.26 -5.07 117.12 111.91 2nrf n MET 247 Ca 0.00 0.00 -0.08 0.00 -1.81 0.00 0.00 57.70 55.81 2nrf n MET 247 Cb 0.00 0.00 -0.06 0.00 -0.71 0.00 0.00 33.22 32.45 2nrf n MET 247 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 2nrf s SER 248 N 0.57 0.16 0.00 7.83 0.01 -1.26 -4.70 113.70 116.30 2nrf s SER 248 Ca 0.00 -0.23 0.08 0.00 1.31 0.00 0.00 55.95 57.11 2nrf s SER 248 Cb 0.00 1.21 0.47 0.00 0.21 0.00 0.00 66.02 67.91 2nrf s SER 248 CO 0.00 -0.34 0.91 0.80 0.41 0.00 0.00 173.24 175.02 2nrf n MET 249 N 5.36 0.26 -1.86 12.44 0.00 -1.26 -4.45 117.12 127.61 2nrf n MET 249 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 57.70 57.49 2nrf n MET 249 Cb 0.50 -1.47 -0.06 0.00 0.00 0.00 0.00 33.22 32.19 2nrf n MET 249 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2nrf s ALA 250 N -2.00 1.28 0.39 -5.12 0.00 -1.26 -4.88 121.76 110.18 2nrf s ALA 250 Ca 0.12 -1.24 -0.16 0.00 0.00 0.00 0.00 51.96 50.68 2nrf s ALA 250 Cb 0.05 -4.57 -0.09 0.00 0.00 0.00 0.00 23.12 18.52 2nrf s ALA 250 CO 0.09 -5.26 0.83 1.21 0.00 0.00 0.00 175.76 172.64 2nrf s ASN 251 N 9.11 6.74 0.00 0.00 3.84 -1.26 -5.02 114.94 128.35 2nrf s ASN 251 Ca 0.79 1.39 0.00 0.00 0.21 0.00 0.00 52.86 55.25 2nrf s ASN 251 Cb -0.09 -2.42 0.00 0.00 -0.55 0.00 0.00 41.25 38.19 2nrf s ASN 251 CO 0.03 -0.34 0.72 0.61 -2.79 0.00 0.00 177.10 175.33 2nrf n GLY 252 N -0.80 -3.12 0.08 1.21 0.00 -1.26 -2.14 105.19 99.16 2nrf n GLY 252 Ca 0.05 0.62 0.08 0.00 0.00 0.00 0.00 46.02 46.77 2nrf n GLY 252 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nrf n ALA 253 N -2.07 1.39 0.52 4.61 0.00 -1.26 -3.21 120.51 120.49 2nrf n ALA 253 Ca 0.00 0.06 0.13 0.00 0.00 0.00 0.00 53.44 53.63 2nrf n ALA 253 Cb 0.00 -1.26 0.29 0.00 0.00 0.00 0.00 19.45 18.48 2nrf n ALA 253 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2nrf h HIS 254 N 0.00 0.00 0.02 0.00 3.86 -1.79 -3.13 115.15 114.11 2nrf h HIS 254 Ca 0.00 0.00 -0.26 0.00 -1.16 0.00 0.00 60.37 58.95 2nrf h HIS 254 Cb 0.18 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.62 2nrf h HIS 254 CO 0.00 0.00 -1.36 0.82 0.86 0.00 0.00 177.93 178.25 2nrf h ILE 255 N 0.00 1.28 -0.05 2.45 2.04 -1.53 -2.66 117.51 119.05 2nrf h ILE 255 Ca 0.00 -3.04 -0.13 0.00 1.00 0.00 0.00 64.86 62.69 2nrf h ILE 255 Cb 0.80 2.66 0.01 0.00 -0.74 0.00 0.00 36.82 39.55 2nrf h ILE 255 CO 0.00 0.76 -0.48 0.00 0.00 0.00 0.00 178.15 178.42 2nrf h ALA 256 N 0.92 0.12 -0.50 1.87 0.00 -1.75 -0.41 119.26 119.52 2nrf h ALA 256 Ca -0.16 -0.51 0.06 0.00 0.00 0.00 0.00 54.91 54.30 2nrf h ALA 256 Cb 1.90 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.65 2nrf h ALA 256 CO 0.11 0.31 0.20 0.78 0.00 0.00 0.00 179.25 180.65 2nrf h GLY 257 N -0.07 0.68 0.98 0.00 0.00 -1.65 -1.10 103.07 101.91 2nrf h GLY 257 Ca -0.05 -0.12 -0.02 0.00 0.00 0.00 0.00 47.33 47.15 2nrf h GLY 257 CO 0.10 0.03 0.26 -2.00 0.00 0.00 0.00 176.54 174.93 2nrf h LEU 258 N 0.39 0.71 -1.25 3.11 5.85 -1.43 -2.63 115.31 120.06 2nrf h LEU 258 Ca 0.24 -0.13 0.04 0.00 0.84 0.00 0.00 57.88 58.86 2nrf h LEU 258 Cb 0.23 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.03 2nrf h LEU 258 CO -0.22 0.64 0.52 0.00 -0.34 0.00 0.00 178.44 179.04 2nrf h ALA 259 N 1.10 1.52 0.54 1.25 0.00 -0.55 0.27 119.26 123.40 2nrf h ALA 259 Ca 0.19 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 2nrf h ALA 259 Cb 0.12 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 17.64 2nrf h ALA 259 CO -0.02 0.40 -0.26 0.28 0.00 0.00 0.00 179.25 179.64 2nrf h VAL 260 N 0.97 0.42 -0.25 0.00 2.07 -0.84 -0.35 116.25 118.27 2nrf h VAL 260 Ca 0.32 -0.24 0.05 0.00 0.82 0.00 0.00 66.70 67.65 2nrf h VAL 260 Cb 0.05 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 30.29 2nrf h VAL 260 CO -0.09 0.04 -0.03 1.23 0.02 0.00 0.00 177.57 178.73 2nrf h GLY 261 N -0.88 0.21 1.57 2.17 0.00 -1.41 0.11 103.07 104.84 2nrf h GLY 261 Ca -0.07 0.06 0.06 0.00 0.00 0.00 0.00 47.33 47.37 2nrf h GLY 261 CO 0.12 -0.07 0.16 1.41 0.00 0.00 0.00 176.54 178.15 2nrf h LEU 262 N 0.04 0.00 0.39 3.11 3.38 -0.87 0.45 115.31 121.81 2nrf h LEU 262 Ca 0.12 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 2nrf h LEU 262 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2nrf h LEU 262 CO -0.23 0.00 -0.19 0.00 0.09 0.00 0.00 178.44 178.11 2nrf h ALA 263 N 1.89 -0.73 -0.47 1.53 0.00 0.75 -1.97 119.26 120.26 2nrf h ALA 263 Ca 0.10 -0.12 0.10 0.00 0.00 0.00 0.00 54.91 55.00 2nrf h ALA 263 Cb 0.42 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2nrf h ALA 263 CO -0.00 -0.69 0.33 0.52 0.00 0.00 0.00 179.25 179.41 2nrf h MET 264 N -0.80 0.18 0.17 0.00 2.86 -0.73 -1.17 114.93 115.45 2nrf h MET 264 Ca -0.05 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 2nrf h MET 264 Cb 0.40 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.02 2nrf h MET 264 CO 0.09 0.12 -0.08 0.00 1.06 0.00 0.00 176.91 178.09 2nrf h ALA 265 N 1.76 -0.23 -0.67 6.32 0.00 -0.99 -0.08 119.26 125.37 2nrf h ALA 265 Ca 0.22 -0.21 0.16 0.00 0.00 0.00 0.00 54.91 55.08 2nrf h ALA 265 Cb 0.63 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 2nrf h ALA 265 CO -0.04 -0.41 0.46 0.35 0.00 0.00 0.00 179.25 179.62 2nrf h PHE 266 N -0.68 0.24 0.07 0.00 3.57 -0.91 0.22 116.94 119.44 2nrf h PHE 266 Ca -0.02 0.01 -0.25 0.00 3.53 0.00 0.00 57.97 61.23 2nrf h PHE 266 Cb 0.49 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.16 2nrf h PHE 266 CO 0.06 0.09 -1.09 0.28 -2.23 0.00 0.00 178.31 175.42 2nrf h VAL 267 N 0.20 1.45 0.00 1.41 2.07 -1.01 -3.14 116.25 117.23 2nrf h VAL 267 Ca 0.32 -2.74 -0.07 0.00 0.82 0.00 0.00 66.70 65.02 2nrf h VAL 267 Cb 0.98 2.68 -0.01 0.00 -1.52 0.00 0.00 31.29 33.42 2nrf h VAL 267 CO -0.06 0.81 -0.44 0.44 0.02 0.00 0.00 177.57 178.34 2nrf h ASP 268 N 0.15 0.00 -0.48 0.57 3.32 0.04 -2.98 116.42 117.03 2nrf h ASP 268 Ca -0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.94 2nrf h ASP 268 Cb 1.77 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.32 2nrf h ASP 268 CO 0.18 0.34 0.00 -1.54 -1.72 0.00 0.00 179.24 176.50 2nrf n SER 269 N -3.14 3.23 -0.02 6.45 3.41 -0.04 -3.83 113.62 119.69 2nrf n SER 269 Ca 0.02 -2.20 0.06 0.00 -0.26 0.00 0.00 58.87 56.49 2nrf n SER 269 Cb 0.67 -0.43 -0.12 0.00 -0.26 0.00 0.00 64.21 64.07 2nrf n SER 269 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 2nrf n LEU 270 N 0.84 0.00 0.00 1.04 7.94 -1.13 -4.71 117.00 120.98 2nrf n LEU 270 Ca 0.18 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.08 2nrf n LEU 270 Cb 0.58 0.06 0.00 0.00 0.53 0.00 0.00 43.42 44.59 2nrf n LEU 270 CO 0.15 0.06 0.30 -3.20 -1.11 0.00 0.00 177.39 173.58 2nrf n ASN 271 N -2.13 0.00 0.00 1.96 2.85 -1.24 -5.10 115.26 111.60 2nrf n ASN 271 Ca -0.06 0.59 0.09 0.00 -0.11 0.00 0.00 54.58 55.09 2nrf n ASN 271 Cb 0.50 -0.09 0.51 0.00 1.24 0.00 0.00 39.78 41.94 2nrf n ASN 271 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15