#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lwu n GLU 96 N 0.00 -0.07 -0.17 -3.83 -0.58 -1.26 -0.76 120.64 113.96 1lwu n GLU 96 Ca 0.00 1.35 0.09 0.00 -0.42 0.00 0.00 57.16 58.19 1lwu n GLU 96 Cb 0.00 -2.15 0.17 0.00 -0.57 0.00 0.00 31.44 28.89 1lwu n GLU 96 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 1lwu n LEU 97 N -5.33 2.66 -0.06 -4.62 7.94 -1.26 -4.50 117.00 111.83 1lwu n LEU 97 Ca 0.21 -3.13 -0.06 0.00 -1.11 0.00 0.00 56.01 51.91 1lwu n LEU 97 Cb 0.68 -0.46 -0.10 0.00 0.53 0.00 0.00 43.42 44.07 1lwu n LEU 97 CO -0.07 0.75 -0.92 -1.84 -1.11 0.00 0.00 177.39 174.20 1lwu n GLU 98 N -1.26 1.89 0.10 1.96 -0.00 0.06 -4.43 120.64 118.95 1lwu n GLU 98 Ca 0.17 -0.01 -0.08 0.00 -0.00 0.00 0.00 57.16 57.25 1lwu n GLU 98 Cb 0.69 -1.33 -0.05 0.00 -0.00 0.00 0.00 31.44 30.76 1lwu n GLU 98 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1lwu h VAL 99 N 0.00 0.00 -0.01 3.84 2.07 -1.48 -1.53 116.25 119.13 1lwu h VAL 99 Ca -0.35 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.18 1lwu h VAL 99 Cb 1.79 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.55 1lwu h VAL 99 CO 0.02 0.00 -0.15 0.03 0.02 0.00 0.00 177.57 177.49 1lwu h ARG 100 N -0.41 -0.17 0.00 1.57 3.08 -1.83 -1.94 114.38 114.68 1lwu h ARG 100 Ca -0.02 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1lwu h ARG 100 Cb 0.37 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.46 1lwu h ARG 100 CO -0.08 -0.12 0.00 0.98 -1.07 0.00 0.00 179.97 179.69 1lwu n TYR 101 N -3.34 0.00 -0.26 3.04 9.36 -1.22 -0.08 117.16 124.66 1lwu n TYR 101 Ca -0.02 0.00 0.29 0.00 3.32 0.00 0.00 57.90 61.49 1lwu n TYR 101 Cb 0.11 -0.34 0.68 0.00 -0.63 0.00 0.00 39.34 39.15 1lwu n TYR 101 CO 0.00 0.00 0.00 0.77 0.22 0.00 0.00 176.86 177.85 1lwu h SER 102 N 0.00 0.12 1.12 2.98 0.02 -1.29 0.27 113.55 116.77 1lwu h SER 102 Ca 0.00 0.02 -0.15 0.00 -0.84 0.00 0.00 61.79 60.82 1lwu h SER 102 Cb 0.00 -0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.52 1lwu h SER 102 CO 0.00 0.03 -0.92 1.05 -1.14 0.00 0.00 176.83 175.85 1lwu h GLU 103 N 0.11 0.00 0.00 3.45 4.11 -0.38 -1.87 114.58 120.00 1lwu h GLU 103 Ca 0.50 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.92 1lwu h GLU 103 Cb 1.80 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.05 1lwu h GLU 103 CO -0.07 0.52 -0.05 0.28 0.07 0.00 0.00 179.01 179.76 1lwu h VAL 104 N 0.00 0.11 0.25 -1.06 2.07 0.28 -1.88 116.25 116.02 1lwu h VAL 104 Ca -0.07 -0.77 -0.33 0.00 0.82 0.00 0.00 66.70 66.35 1lwu h VAL 104 Cb 1.54 1.69 0.04 0.00 -1.52 0.00 0.00 31.29 33.04 1lwu h VAL 104 CO 0.07 0.05 -1.47 0.25 0.02 0.00 0.00 177.57 176.49 1lwu h LEU 105 N 0.00 0.82 -1.54 2.57 5.85 -0.77 -3.00 115.31 119.24 1lwu h LEU 105 Ca -0.00 -0.92 0.00 0.00 0.84 0.00 0.00 57.88 57.80 1lwu h LEU 105 Cb 0.69 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.45 1lwu h LEU 105 CO 0.01 1.71 0.00 -2.11 -0.34 0.00 0.00 178.44 177.70 1lwu n ARG 106 N -3.74 1.98 0.00 1.25 1.85 -0.72 -2.23 116.66 115.06 1lwu n ARG 106 Ca -0.17 -0.86 0.02 0.00 -1.00 0.00 0.00 57.85 55.83 1lwu n ARG 106 Cb 1.09 -1.61 -0.01 0.00 -1.05 0.00 0.00 32.46 30.88 1lwu n ARG 106 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 177.63 175.71 1lwu n GLU 107 N 0.16 4.61 -0.03 2.89 4.07 -0.73 -4.01 120.64 127.59 1lwu n GLU 107 Ca 0.08 -0.14 -0.21 0.00 -0.06 0.00 0.00 57.16 56.83 1lwu n GLU 107 Cb 0.45 -0.76 -0.13 0.00 -0.06 0.00 0.00 31.44 30.94 1lwu n GLU 107 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 1lwu h LEU 108 N 0.16 0.23 -0.80 4.31 3.38 -1.32 -3.27 115.31 118.00 1lwu h LEU 108 Ca 0.00 -0.77 -0.06 0.00 0.09 0.00 0.00 57.88 57.14 1lwu h LEU 108 Cb 0.11 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 1lwu h LEU 108 CO 0.00 1.56 0.21 -0.33 0.09 0.00 0.00 178.44 179.97 1lwu h GLU 109 N -0.53 1.11 0.00 1.13 5.08 -1.79 0.93 114.58 120.50 1lwu h GLU 109 Ca -0.31 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 57.81 1lwu h GLU 109 Cb 1.59 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.68 1lwu h GLU 109 CO -0.03 0.95 0.00 2.89 -1.00 0.00 0.00 179.01 181.82 1lwu n ARG 110 N -4.25 0.03 -0.04 2.33 1.85 -1.26 0.10 116.66 115.42 1lwu n ARG 110 Ca 0.06 0.32 -0.02 0.00 -1.00 0.00 0.00 57.85 57.21 1lwu n ARG 110 Cb 0.23 -1.50 -0.08 0.00 -1.05 0.00 0.00 32.46 30.06 1lwu n ARG 110 CO 0.00 0.00 0.00 -2.13 -0.01 0.00 0.00 177.63 175.49 1lwu n ARG 111 N -1.44 1.80 0.01 2.89 0.63 0.35 -4.35 116.66 116.55 1lwu n ARG 111 Ca 0.02 -0.03 -0.22 0.00 -0.92 0.00 0.00 57.85 56.71 1lwu n ARG 111 Cb 0.08 -1.27 -0.14 0.00 0.45 0.00 0.00 32.46 31.59 1lwu n ARG 111 CO 0.00 0.00 0.00 0.82 -2.51 0.00 0.00 177.63 175.94 1lwu h ILE 112 N 0.00 0.66 0.00 5.15 2.04 0.16 -3.23 117.51 122.29 1lwu h ILE 112 Ca -0.21 -2.36 0.00 0.00 1.00 0.00 0.00 64.86 63.29 1lwu h ILE 112 Cb 1.35 2.54 0.00 0.00 -0.74 0.00 0.00 36.82 39.97 1lwu h ILE 112 CO 0.01 0.90 0.00 -0.29 0.00 0.00 0.00 178.15 178.77 1lwu h ILE 113 N 0.08 0.00 0.16 -0.67 2.10 0.43 -0.53 117.51 119.08 1lwu h ILE 113 Ca -0.41 -0.16 -0.26 0.00 1.08 0.00 0.00 64.86 65.10 1lwu h ILE 113 Cb 2.04 0.89 0.02 0.00 -1.09 0.00 0.00 36.82 38.68 1lwu h ILE 113 CO 0.10 0.00 -1.24 -0.74 -1.08 0.00 0.00 178.15 175.19 1lwu h HIS 114 N 0.00 0.62 -0.56 2.19 2.76 -1.71 -3.05 115.15 115.41 1lwu h HIS 114 Ca 0.00 -0.45 0.16 0.00 -2.20 0.00 0.00 60.37 57.88 1lwu h HIS 114 Cb 0.21 -0.02 -0.02 0.00 1.55 0.00 0.00 27.41 29.12 1lwu h HIS 114 CO 0.00 1.48 0.71 -0.07 -1.30 0.00 0.00 177.93 178.75 1lwu h LEU 115 N -0.19 0.00 0.18 0.26 3.38 -1.11 0.56 115.31 118.38 1lwu h LEU 115 Ca -0.24 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 1lwu h LEU 115 Cb 1.84 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.59 1lwu h LEU 115 CO 0.15 0.00 -0.09 1.56 0.09 0.00 0.00 178.44 180.15 1lwu h GLN 116 N 0.00 -0.23 -0.22 1.13 1.08 -1.41 -0.45 115.11 115.00 1lwu h GLN 116 Ca 0.27 0.02 0.06 0.00 -1.45 0.00 0.00 58.65 57.54 1lwu h GLN 116 Cb 1.68 0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 29.15 1lwu h GLN 116 CO -0.00 0.10 0.28 -0.09 -0.95 0.00 0.00 178.83 178.16 1lwu h ARG 117 N -0.97 0.00 0.12 1.46 1.12 0.04 0.32 114.38 116.46 1lwu h ARG 117 Ca -0.02 0.00 -0.19 0.00 -1.11 0.00 0.00 59.98 58.65 1lwu h ARG 117 Cb 0.43 0.00 0.02 0.00 -0.01 0.00 0.00 29.97 30.42 1lwu h ARG 117 CO 0.04 0.00 -0.82 -0.09 -3.11 0.00 0.00 179.97 175.99 1lwu h ARG 118 N 0.00 0.34 -0.77 0.20 2.43 -0.54 -2.82 114.38 113.21 1lwu h ARG 118 Ca 0.10 -0.53 -0.05 0.00 -0.81 0.00 0.00 59.98 58.70 1lwu h ARG 118 Cb 0.66 0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 30.37 1lwu h ARG 118 CO -0.00 1.23 0.30 0.82 -1.51 0.00 0.00 179.97 180.82 1lwu h ILE 119 N -0.29 1.26 -0.01 1.20 1.08 0.86 -0.23 117.51 121.39 1lwu h ILE 119 Ca -0.14 -0.82 0.01 0.00 -0.39 0.00 0.00 64.86 63.53 1lwu h ILE 119 Cb 1.62 0.34 -0.02 0.00 -3.07 0.00 0.00 36.82 35.69 1lwu h ILE 119 CO 0.16 0.33 -0.08 0.78 -0.69 0.00 0.00 178.15 178.65 1lwu h ASN 120 N 1.13 -0.22 -0.69 1.72 2.35 -0.56 -0.19 115.58 119.11 1lwu h ASN 120 Ca 0.26 0.04 0.06 0.00 -0.55 0.00 0.00 56.30 56.11 1lwu h ASN 120 Cb 0.22 0.10 -0.06 0.00 0.05 0.00 0.00 38.32 38.63 1lwu h ASN 120 CO -0.02 -0.11 0.39 0.24 -1.65 0.00 0.00 177.43 176.27 1lwu h MET 121 N -0.13 0.68 -0.01 0.81 2.86 -1.19 -0.74 114.93 117.21 1lwu h MET 121 Ca 0.03 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1lwu h MET 121 Cb 0.17 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 31.68 1lwu h MET 121 CO -0.08 0.45 0.01 1.96 1.06 0.00 0.00 176.91 180.31 1lwu h GLN 122 N 0.70 0.00 -0.01 1.72 4.20 -0.04 0.24 115.11 121.93 1lwu h GLN 122 Ca 0.31 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.02 1lwu h GLN 122 Cb 0.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.99 1lwu h GLN 122 CO -0.19 0.00 -0.36 1.28 -0.67 0.00 0.00 178.83 178.89 1lwu n LEU 123 N -4.19 1.03 -0.05 1.46 4.77 -0.18 -1.79 117.00 118.05 1lwu n LEU 123 Ca -0.03 -0.28 -0.14 0.00 -0.03 0.00 0.00 56.01 55.54 1lwu n LEU 123 Cb 0.10 -0.13 -0.12 0.00 -2.33 0.00 0.00 43.42 40.94 1lwu n LEU 123 CO 0.31 0.20 0.43 1.56 -1.33 0.00 0.00 177.39 178.56 1lwu h GLN 124 N 1.06 0.02 -0.29 3.23 1.08 0.59 -2.85 115.11 117.94 1lwu h GLN 124 Ca 0.00 -0.03 -0.19 0.00 -1.45 0.00 0.00 58.65 56.99 1lwu h GLN 124 Cb 0.53 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.97 1lwu h GLN 124 CO 0.00 0.90 -0.55 1.96 -0.95 0.00 0.00 178.83 180.20 1lwu h GLN 125 N -0.85 0.89 -0.34 1.46 4.20 -1.45 -2.89 115.11 116.13 1lwu h GLN 125 Ca -0.01 -0.56 -0.03 0.00 0.06 0.00 0.00 58.65 58.11 1lwu h GLN 125 Cb 0.92 0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.75 1lwu h GLN 125 CO 0.01 1.20 0.07 -0.07 -0.67 0.00 0.00 178.83 179.37 1lwu h LEU 126 N 0.68 0.46 -0.19 1.46 3.38 -1.47 0.51 115.31 120.15 1lwu h LEU 126 Ca 0.01 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 1lwu h LEU 126 Cb 1.16 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.79 1lwu h LEU 126 CO 0.12 0.48 -0.17 0.74 0.09 0.00 0.00 178.44 179.71 1lwu h THR 127 N 0.50 1.33 -0.45 0.22 2.02 -1.46 -1.45 112.91 113.61 1lwu h THR 127 Ca 0.12 -1.31 -0.13 0.00 0.77 0.00 0.00 66.41 65.86 1lwu h THR 127 Cb 0.22 1.76 -0.01 0.00 -1.74 0.00 0.00 68.15 68.37 1lwu h THR 127 CO -0.00 0.39 -0.22 0.25 0.37 0.00 0.00 175.52 176.31 1lwu h LEU 128 N 0.12 0.95 -1.06 2.58 7.12 -1.28 -2.30 115.31 121.43 1lwu h LEU 128 Ca 0.03 -0.36 0.00 0.00 0.13 0.00 0.00 57.88 57.69 1lwu h LEU 128 Cb 0.70 -0.26 0.00 0.00 -0.53 0.00 0.00 40.66 40.56 1lwu h LEU 128 CO 0.04 1.13 0.00 0.25 -0.13 0.00 0.00 178.44 179.73 1lwu h LEU 129 N 0.80 0.00 0.20 2.25 5.85 0.09 -2.07 115.31 122.43 1lwu h LEU 129 Ca 0.11 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.51 1lwu h LEU 129 Cb 0.78 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.83 1lwu h LEU 129 CO 0.06 0.00 -1.48 -0.61 -0.34 0.00 0.00 178.44 176.07 1lwu h GLN 130 N 0.00 0.42 0.00 1.25 4.15 -0.76 -2.83 115.11 117.33 1lwu h GLN 130 Ca 0.00 -0.71 -0.04 0.00 0.77 0.00 0.00 58.65 58.67 1lwu h GLN 130 Cb 0.39 0.26 -0.01 0.00 0.21 0.00 0.00 27.48 28.34 1lwu h GLN 130 CO 0.00 1.34 -0.18 1.25 -1.93 0.00 0.00 178.83 179.31 1lwu h HIS 131 N -0.01 0.00 0.10 3.99 2.76 -1.01 -1.08 115.15 119.91 1lwu h HIS 131 Ca -0.28 0.00 -0.14 0.00 -2.20 0.00 0.00 60.37 57.75 1lwu h HIS 131 Cb 2.02 0.00 0.02 0.00 1.55 0.00 0.00 27.41 30.99 1lwu h HIS 131 CO 0.13 0.18 -0.62 -0.91 -1.30 0.00 0.00 177.93 175.41 1lwu h ASN 132 N 0.00 0.37 -0.80 3.26 -0.26 -1.45 -2.30 115.58 114.40 1lwu h ASN 132 Ca -0.00 -0.95 0.02 0.00 -0.56 0.00 0.00 56.30 54.81 1lwu h ASN 132 Cb 0.70 -0.12 -0.04 0.00 -1.06 0.00 0.00 38.32 37.79 1lwu h ASN 132 CO 0.02 1.29 0.53 0.40 -1.06 0.00 0.00 177.43 178.61 1lwu h ILE 133 N -0.49 1.16 -0.23 2.81 2.04 -1.43 -0.97 117.51 120.40 1lwu h ILE 133 Ca -0.11 -0.35 0.06 0.00 1.00 0.00 0.00 64.86 65.46 1lwu h ILE 133 Cb 1.47 0.04 -0.07 0.00 -0.74 0.00 0.00 36.82 37.52 1lwu h ILE 133 CO 0.12 0.19 -0.26 0.50 0.00 0.00 0.00 178.15 178.69 1lwu h LYS 134 N 1.03 -0.27 -1.10 2.37 1.63 -1.16 -1.20 116.57 117.87 1lwu h LYS 134 Ca 0.31 0.02 -0.34 0.00 -0.85 0.00 0.00 60.65 59.79 1lwu h LYS 134 Cb -0.03 0.06 -0.18 0.00 -0.60 0.00 0.00 32.23 31.48 1lwu h LYS 134 CO -0.08 -0.18 0.43 0.25 -3.45 0.00 0.00 179.45 176.42 1lwu n THR 135 N -5.39 2.49 0.00 1.00 -2.24 -0.45 -3.39 114.28 106.31 1lwu n THR 135 Ca -0.01 -1.35 0.00 0.00 -2.27 0.00 0.00 64.05 60.41 1lwu n THR 135 Cb 0.30 -0.84 0.00 0.00 -2.10 0.00 0.00 70.33 67.69 1lwu n THR 135 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1lwu n GLN 136 N -0.35 1.74 0.09 -0.78 7.27 -0.74 -4.42 117.38 120.19 1lwu n GLN 136 Ca 0.36 0.00 -0.05 0.00 0.07 0.00 0.00 57.00 57.38 1lwu n GLN 136 Cb 1.05 -0.67 0.01 0.00 2.41 0.00 0.00 30.24 33.04 1lwu n GLN 136 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 1lwu h VAL 137 N 0.00 1.56 -0.01 1.69 2.07 -1.32 -0.29 116.25 119.95 1lwu h VAL 137 Ca 0.00 -2.74 -0.04 0.00 0.82 0.00 0.00 66.70 64.74 1lwu h VAL 137 Cb 0.29 2.49 0.00 0.00 -1.52 0.00 0.00 31.29 32.56 1lwu h VAL 137 CO 0.00 0.79 -0.16 -1.28 0.02 0.00 0.00 177.57 176.94 1lwu h SER 138 N 0.03 0.16 -0.08 0.57 0.87 -1.79 -2.47 113.55 110.84 1lwu h SER 138 Ca -0.02 -0.74 -0.00 0.00 -1.23 0.00 0.00 61.79 59.80 1lwu h SER 138 Cb 1.46 -0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 63.37 1lwu h SER 138 CO 0.11 0.88 0.04 -0.61 -0.53 0.00 0.00 176.83 176.72 1lwu h GLN 139 N -0.55 0.11 -0.19 2.24 4.15 -1.76 -1.37 115.11 117.74 1lwu h GLN 139 Ca -0.02 -0.01 -0.04 0.00 0.77 0.00 0.00 58.65 59.34 1lwu h GLN 139 Cb 0.89 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.55 1lwu h GLN 139 CO 0.03 0.16 -0.08 0.82 -1.93 0.00 0.00 178.83 177.84 1lwu h ILE 140 N 0.03 1.17 0.24 2.39 2.04 -1.16 -1.03 117.51 121.19 1lwu h ILE 140 Ca 0.03 -0.71 -0.01 0.00 1.00 0.00 0.00 64.86 65.17 1lwu h ILE 140 Cb 0.09 1.12 0.00 0.00 -0.74 0.00 0.00 36.82 37.28 1lwu h ILE 140 CO -0.00 0.23 -0.11 0.25 0.00 0.00 0.00 178.15 178.51 1lwu h LEU 141 N 0.28 -0.27 -0.35 1.44 5.85 -1.07 -1.72 115.31 119.47 1lwu h LEU 141 Ca 0.06 -0.20 0.08 0.00 0.84 0.00 0.00 57.88 58.66 1lwu h LEU 141 Cb 0.32 0.07 -0.08 0.00 0.37 0.00 0.00 40.66 41.34 1lwu h LEU 141 CO 0.02 0.06 -0.18 -0.09 -0.34 0.00 0.00 178.44 177.91 1lwu h ARG 142 N -0.63 -0.12 -0.62 1.25 9.65 -1.03 -1.41 114.38 121.47 1lwu h ARG 142 Ca -0.03 0.01 0.11 0.00 -1.10 0.00 0.00 59.98 58.96 1lwu h ARG 142 Cb 0.45 0.03 -0.08 0.00 -1.39 0.00 0.00 29.97 28.98 1lwu h ARG 142 CO 0.05 -0.08 0.19 0.28 2.80 0.00 0.00 179.97 183.21 1lwu h VAL 143 N -0.13 0.69 -0.93 0.20 2.07 -1.13 -0.13 116.25 116.90 1lwu h VAL 143 Ca 0.18 -0.12 0.05 0.00 0.82 0.00 0.00 66.70 67.63 1lwu h VAL 143 Cb 0.40 0.33 -0.06 0.00 -1.52 0.00 0.00 31.29 30.44 1lwu h VAL 143 CO -0.43 0.06 0.60 -0.08 0.02 0.00 0.00 177.57 177.74 1lwu h GLU 144 N 0.34 1.10 -0.06 1.57 4.81 -0.31 0.19 114.58 122.22 1lwu h GLU 144 Ca 0.32 -0.07 -0.19 0.00 -0.13 0.00 0.00 59.36 59.30 1lwu h GLU 144 Cb 0.45 -0.25 -0.00 0.00 0.63 0.00 0.00 28.75 29.58 1lwu h GLU 144 CO -0.36 0.73 -0.77 0.28 -0.73 0.00 0.00 179.01 178.15 1lwu h VAL 145 N 1.13 1.39 -0.81 0.32 2.07 -0.93 0.15 116.25 119.58 1lwu h VAL 145 Ca 0.39 -2.22 0.05 0.00 0.82 0.00 0.00 66.70 65.73 1lwu h VAL 145 Cb 0.07 2.19 -0.05 0.00 -1.52 0.00 0.00 31.29 31.98 1lwu h VAL 145 CO -0.14 0.67 0.53 0.44 0.02 0.00 0.00 177.57 179.08 1lwu h ASP 146 N 0.25 0.81 0.19 0.57 3.45 0.07 0.62 116.42 122.38 1lwu h ASP 146 Ca -0.04 -0.00 -0.29 0.00 0.43 0.00 0.00 57.03 57.13 1lwu h ASP 146 Cb 1.36 -0.18 0.02 0.00 -0.56 0.00 0.00 39.33 39.98 1lwu h ASP 146 CO 0.13 0.54 -1.20 0.40 -1.57 0.00 0.00 179.24 177.54 1lwu h ILE 147 N 0.93 1.31 -0.51 0.35 2.04 -0.39 -2.46 117.51 118.78 1lwu h ILE 147 Ca 0.34 -2.49 -0.04 0.00 1.00 0.00 0.00 64.86 63.66 1lwu h ILE 147 Cb 0.15 2.65 -0.02 0.00 -0.74 0.00 0.00 36.82 38.86 1lwu h ILE 147 CO -0.11 0.76 0.15 -0.78 0.00 0.00 0.00 178.15 178.17 1lwu h ASP 148 N 0.27 0.70 -0.35 1.72 3.58 -0.07 -0.72 116.42 121.55 1lwu h ASP 148 Ca -0.17 -0.11 -0.12 0.00 0.42 0.00 0.00 57.03 57.06 1lwu h ASP 148 Cb 1.87 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 42.73 1lwu h ASP 148 CO 0.22 0.67 -0.23 0.58 -2.88 0.00 0.00 179.24 177.60 1lwu h VAL 149 N 0.75 1.29 0.30 2.25 2.07 -0.91 -3.08 116.25 118.91 1lwu h VAL 149 Ca 0.17 -1.38 -0.01 0.00 0.82 0.00 0.00 66.70 66.30 1lwu h VAL 149 Cb 0.23 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 31.41 1lwu h VAL 149 CO -0.01 0.45 -0.14 0.00 0.02 0.00 0.00 177.57 177.89 1lwu h ALA 150 N 0.77 -0.40 -0.97 1.67 0.00 -1.20 -3.25 119.26 115.88 1lwu h ALA 150 Ca 0.07 -0.18 0.30 0.00 0.00 0.00 0.00 54.91 55.10 1lwu h ALA 150 Cb 0.80 0.15 -0.15 0.00 0.00 0.00 0.00 17.79 18.59 1lwu h ALA 150 CO 0.06 -0.44 0.48 -0.07 0.00 0.00 0.00 179.25 179.29 1lwu h LEU 151 N -0.97 0.38 -2.10 0.00 4.07 -1.25 1.47 115.31 116.92 1lwu h LEU 151 Ca -0.04 0.19 -0.01 0.00 0.08 0.00 0.00 57.88 58.10 1lwu h LEU 151 Cb 0.49 0.17 -0.00 0.00 1.08 0.00 0.00 40.66 42.40 1lwu h LEU 151 CO 0.07 -0.14 -0.07 -0.09 -1.08 0.00 0.00 178.44 177.13 1lwu h ARG 152 N 0.30 0.00 -0.36 1.13 2.43 -1.59 -1.50 114.38 114.78 1lwu h ARG 152 Ca 0.69 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.83 1lwu h ARG 152 Cb 1.53 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 31.06 1lwu h ARG 152 CO -0.62 0.07 0.08 0.00 -1.51 0.00 0.00 179.97 177.99 1lwu h ALA 153 N 1.93 1.47 -0.01 2.80 0.00 0.20 -2.80 119.26 122.86 1lwu h ALA 153 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1lwu h ALA 153 Cb 0.15 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1lwu h ALA 153 CO 0.01 0.39 0.02 0.00 0.00 0.00 0.00 179.25 179.67 1lwu h LYS 155 N 0.00 -0.30 -0.38 0.00 3.64 -1.64 0.37 116.57 118.26 1lwu h LYS 155 Ca 0.01 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1lwu h LYS 155 Cb 0.05 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 1lwu h LYS 155 CO -0.00 -0.20 0.00 0.41 -2.27 0.00 0.00 179.45 177.39 1lwu n GLY 156 N -1.39 0.31 0.00 5.01 0.00 -1.07 -4.03 105.19 104.01 1lwu n GLY 156 Ca -0.02 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1lwu n GLY 156 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1lwu n SER 157 N -0.02 4.16 -4.65 1.61 2.88 0.38 -5.09 113.62 112.88 1lwu n SER 157 Ca 0.05 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.32 1lwu n SER 157 Cb 0.22 0.39 -0.08 0.00 -0.75 0.00 0.00 64.21 63.99 1lwu n SER 157 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1lwu h ALA 159 N 2.76 1.00 -4.28 0.00 0.00 -1.90 -3.41 119.26 113.43 1lwu h ALA 159 Ca -0.47 0.03 -0.64 0.00 0.00 0.00 0.00 54.91 53.83 1lwu h ALA 159 Cb 1.20 -0.11 -0.30 0.00 0.00 0.00 0.00 17.79 18.58 1lwu h ALA 159 CO 0.57 0.04 -0.87 1.03 0.00 0.00 0.00 179.25 180.03 1lwu s ARG 160 N -6.07 2.03 -0.08 0.00 0.52 -1.26 -5.13 118.95 108.96 1lwu s ARG 160 Ca -0.13 -0.81 0.02 0.00 -0.52 0.00 0.00 55.73 54.29 1lwu s ARG 160 Cb 0.18 -1.86 0.01 0.00 0.52 0.00 0.00 34.95 33.80 1lwu s ARG 160 CO 0.77 0.43 -0.13 -0.47 0.02 0.00 0.00 175.30 175.91 1lwu s TYR 161 N -0.35 1.60 0.00 -0.53 5.04 -1.26 -4.94 117.35 116.91 1lwu s TYR 161 Ca 0.04 -0.64 0.00 0.00 -2.44 0.00 0.00 57.07 54.02 1lwu s TYR 161 Cb -0.11 -1.18 0.00 0.00 0.35 0.00 0.00 41.96 41.03 1lwu s TYR 161 CO 0.01 -0.34 0.00 1.28 -1.34 0.00 0.00 175.55 175.16 1lwu n LEU 162 N 3.96 0.00 0.00 6.97 7.99 -1.26 -5.07 117.00 129.59 1lwu n LEU 162 Ca -0.21 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.79 1lwu n LEU 162 Cb 0.52 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.83 1lwu n LEU 162 CO 0.24 0.00 0.00 1.21 -1.51 0.00 0.00 177.39 177.33 1lwu n GLU 163 N 0.00 0.00 -3.03 3.23 4.07 -1.26 -5.12 120.64 118.54 1lwu n GLU 163 Ca 0.00 0.00 -0.40 0.00 -0.06 0.00 0.00 57.16 56.70 1lwu n GLU 163 Cb 0.00 0.00 -0.05 0.00 -0.06 0.00 0.00 31.44 31.33 1lwu n GLU 163 CO 0.00 0.00 0.00 -0.47 -0.06 0.00 0.00 177.13 176.60 1lwu s TYR 164 N 0.00 3.69 -0.19 4.31 5.04 -1.26 -5.04 117.35 123.90 1lwu s TYR 164 Ca 0.00 1.38 -0.04 0.00 -2.44 0.00 0.00 57.07 55.97 1lwu s TYR 164 Cb 0.00 -2.79 -0.02 0.00 0.35 0.00 0.00 41.96 39.50 1lwu s TYR 164 CO 0.00 0.23 -0.03 -0.98 -1.34 0.00 0.00 175.55 173.43 1lwu s ARG 165 N 0.15 3.55 0.00 4.97 3.03 -1.26 -5.05 118.95 124.34 1lwu s ARG 165 Ca 0.37 -0.56 0.00 0.00 2.03 0.00 0.00 55.73 57.57 1lwu s ARG 165 Cb -0.19 -2.98 0.00 0.00 -1.03 0.00 0.00 34.95 30.75 1lwu s ARG 165 CO 0.21 0.04 0.00 1.28 -1.13 0.00 0.00 175.30 175.70 1lwu n LEU 166 N 4.11 0.00 0.00 -1.89 4.77 -1.26 -5.08 117.00 117.65 1lwu n LEU 166 Ca -0.17 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.81 1lwu n LEU 166 Cb 0.52 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 1lwu n LEU 166 CO 0.31 -0.39 0.00 -0.67 -1.33 0.00 0.00 177.39 175.31 1lwu n ASP 167 N -0.92 0.00 -4.84 -1.43 -0.08 -1.26 -5.16 116.55 102.85 1lwu n ASP 167 Ca 0.00 0.00 -0.32 0.00 -1.51 0.00 0.00 54.79 52.96 1lwu n ASP 167 Cb 0.00 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.40 1lwu n ASP 167 CO 0.00 0.00 0.00 -1.59 0.12 0.00 0.00 177.20 175.73 1lwu s LYS 168 N 3.33 4.03 0.00 -0.67 -2.85 -1.26 -4.94 119.74 117.38 1lwu s LYS 168 Ca 0.00 0.74 0.14 0.00 -1.00 0.00 0.00 55.97 55.84 1lwu s LYS 168 Cb 0.00 -2.39 0.32 0.00 -2.06 0.00 0.00 37.83 33.70 1lwu s LYS 168 CO 0.00 0.12 1.23 -0.85 0.10 0.00 0.00 175.35 175.95 1lwu n GLU 169 N -0.43 2.37 0.33 1.78 -0.00 -1.26 -4.37 120.64 119.07 1lwu n GLU 169 Ca 0.04 -1.99 0.16 0.00 -0.00 0.00 0.00 57.16 55.37 1lwu n GLU 169 Cb 0.53 -1.33 0.86 0.00 -0.00 0.00 0.00 31.44 31.50 1lwu n GLU 169 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.13 176.91 1lwu h LYS 170 N 2.63 0.00 -0.01 3.44 3.11 -2.01 1.45 116.57 125.19 1lwu h LYS 170 Ca 0.00 0.00 -0.14 0.00 -2.81 0.00 0.00 60.65 57.70 1lwu h LYS 170 Cb 0.74 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 31.96 1lwu h LYS 170 CO 0.00 0.00 -0.66 -0.97 -2.81 0.00 0.00 179.45 175.01 1lwu h ASN 171 N 0.00 0.03 1.19 4.20 -0.73 -2.00 -2.77 115.58 115.50 1lwu h ASN 171 Ca 0.00 -0.02 -0.03 0.00 1.87 0.00 0.00 56.30 58.13 1lwu h ASN 171 Cb 0.61 -0.01 -0.00 0.00 0.27 0.00 0.00 38.32 39.19 1lwu h ASN 171 CO -0.00 0.68 -0.12 -0.07 -0.37 0.00 0.00 177.43 177.55 1lwu h LEU 172 N 0.02 0.00 0.27 0.34 3.38 0.17 0.15 115.31 119.64 1lwu h LEU 172 Ca -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1lwu h LEU 172 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1lwu h LEU 172 CO 0.09 0.12 -0.13 1.56 0.09 0.00 0.00 178.44 180.17 1lwu h GLN 173 N 0.00 -0.35 -0.73 1.13 1.08 -1.40 -2.89 115.11 111.95 1lwu h GLN 173 Ca -0.00 0.02 0.15 0.00 -1.45 0.00 0.00 58.65 57.37 1lwu h GLN 173 Cb 0.75 0.08 -0.10 0.00 -0.05 0.00 0.00 27.48 28.16 1lwu h GLN 173 CO 0.02 -0.23 0.24 -0.07 -0.95 0.00 0.00 178.83 177.83 1lwu h LEU 174 N -1.01 0.15 -2.13 1.46 3.38 -1.44 0.51 115.31 116.23 1lwu h LEU 174 Ca -0.04 0.12 0.03 0.00 0.09 0.00 0.00 57.88 58.09 1lwu h LEU 174 Cb 0.27 0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 1lwu h LEU 174 CO 0.06 0.04 0.08 -0.08 0.09 0.00 0.00 178.44 178.63 1lwu h GLU 175 N 0.35 0.00 -0.06 1.13 4.22 -0.79 -1.97 114.58 117.47 1lwu h GLU 175 Ca 0.40 0.00 -0.04 0.00 0.08 0.00 0.00 59.36 59.80 1lwu h GLU 175 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1lwu h GLU 175 CO -0.44 0.00 -0.14 -0.22 -2.18 0.00 0.00 179.01 176.03 1lwu h LYS 176 N 0.00 0.20 0.20 1.92 1.63 0.25 -2.69 116.57 118.08 1lwu h LYS 176 Ca 0.05 -0.13 -0.01 0.00 -0.85 0.00 0.00 60.65 59.71 1lwu h LYS 176 Cb 0.22 0.02 -0.00 0.00 -0.60 0.00 0.00 32.23 31.87 1lwu h LYS 176 CO -0.00 0.73 -0.13 0.00 -3.45 0.00 0.00 179.45 176.60 1lwu h ALA 177 N 0.47 -0.97 -0.93 5.00 0.00 -0.99 1.84 119.26 123.66 1lwu h ALA 177 Ca -0.00 -0.06 0.27 0.00 0.00 0.00 0.00 54.91 55.12 1lwu h ALA 177 Cb 0.73 0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.74 1lwu h ALA 177 CO 0.03 -0.97 0.94 0.00 0.00 0.00 0.00 179.25 179.25 1lwu n ALA 178 N -2.29 0.90 -0.06 0.00 0.00 -0.79 0.18 120.51 118.44 1lwu n ALA 178 Ca -0.04 0.31 -0.13 0.00 0.00 0.00 0.00 53.44 53.58 1lwu n ALA 178 Cb 0.13 -0.54 -0.04 0.00 0.00 0.00 0.00 19.45 19.00 1lwu n ALA 178 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1lwu n SER 179 N -2.89 1.38 -0.28 0.00 3.41 -0.82 -4.62 113.62 109.80 1lwu n SER 179 Ca 0.21 0.23 0.02 0.00 -0.26 0.00 0.00 58.87 59.06 1lwu n SER 179 Cb 1.22 -0.54 0.15 0.00 -0.26 0.00 0.00 64.21 64.78 1lwu n SER 179 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 1lwu h TYR 180 N -0.61 0.84 0.00 7.33 -1.99 0.50 -1.76 116.97 121.28 1lwu h TYR 180 Ca -0.25 0.03 -0.41 0.00 2.00 0.00 0.00 58.73 60.09 1lwu h TYR 180 Cb 1.06 -0.26 0.02 0.00 2.00 0.00 0.00 36.73 39.55 1lwu h TYR 180 CO -0.14 0.37 2.43 0.44 -0.00 0.00 0.00 178.16 181.26 1lwu n ILE 181 N -4.73 2.13 -0.60 -2.88 -6.64 0.46 -4.45 119.36 102.66 1lwu n ILE 181 Ca 0.12 -1.38 -0.10 0.00 -1.77 0.00 0.00 62.75 59.63 1lwu n ILE 181 Cb 0.23 -2.13 0.03 0.00 -1.44 0.00 0.00 39.64 36.33 1lwu n ILE 181 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1lwu n ALA 182 N 5.00 4.52 -1.00 -1.28 0.00 -0.67 -4.70 120.51 122.38 1lwu n ALA 182 Ca 0.43 -1.00 0.00 0.00 0.00 0.00 0.00 53.44 52.87 1lwu n ALA 182 Cb 0.18 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.42 1lwu n ALA 182 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1lwu n ASN 183 N 0.69 0.00 0.00 0.00 3.02 -1.26 -4.62 115.26 113.09 1lwu n ASN 183 Ca 0.18 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.73 1lwu n ASN 183 Cb 0.59 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.76 1lwu n ASN 183 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1lwu n LEU 184 N 0.00 0.00 0.00 3.41 4.77 -1.26 -4.41 117.00 119.51 1lwu n LEU 184 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1lwu n LEU 184 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1lwu n LEU 184 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.39 176.35 1lwu n LYS 185 N 3.90 0.00 -0.12 3.23 5.02 -1.26 -4.78 118.16 124.14 1lwu n LYS 185 Ca 0.00 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.27 1lwu n LYS 185 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 34.99 1lwu n LYS 185 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1lwu n PHE 186 N 0.00 0.01 -3.60 2.13 7.35 -1.26 -4.82 117.46 117.27 1lwu n PHE 186 Ca 0.00 0.00 -0.40 0.00 -0.76 0.00 0.00 57.45 56.29 1lwu n PHE 186 Cb 0.00 -0.06 -0.08 0.00 0.35 0.00 0.00 39.48 39.69 1lwu n PHE 186 CO 0.00 0.00 0.00 -2.00 -0.76 0.00 0.00 176.76 174.00 1lwu s GLU 187 N 0.60 2.59 -0.50 -4.13 2.12 -1.26 -4.79 118.70 113.32 1lwu s GLU 187 Ca 0.11 -2.07 -0.32 0.00 0.36 0.00 0.00 54.97 53.05 1lwu s GLU 187 Cb -0.07 -3.90 -0.16 0.00 0.26 0.00 0.00 34.13 30.26 1lwu s GLU 187 CO 0.05 -1.19 1.80 0.54 -0.54 0.00 0.00 175.26 175.92 1lwu n ARG 188 N 4.36 0.00 0.08 4.30 5.12 -1.26 -4.80 116.66 124.47 1lwu n ARG 188 Ca -0.00 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 55.83 1lwu n ARG 188 Cb 0.41 -1.18 -0.04 0.00 -1.16 0.00 0.00 32.46 30.49 1lwu n ARG 188 CO 0.00 0.00 0.00 0.74 -1.93 0.00 0.00 177.63 176.44 1lwu h PHE 189 N 7.70 0.28 0.00 -1.55 -1.00 -2.01 -3.13 116.94 117.23 1lwu h PHE 189 Ca -0.07 -0.17 0.00 0.00 2.81 0.00 0.00 57.97 60.54 1lwu h PHE 189 Cb 1.09 -0.03 0.00 0.00 3.61 0.00 0.00 35.95 40.63 1lwu h PHE 189 CO 0.79 1.02 0.00 -0.85 -1.61 0.00 0.00 178.31 177.66 1lwu n GLU 190 N -3.60 0.47 0.03 1.51 0.28 -1.26 -1.52 120.64 116.56 1lwu n GLU 190 Ca -0.04 0.00 -0.10 0.00 -0.16 0.00 0.00 57.16 56.87 1lwu n GLU 190 Cb 0.85 -1.01 -0.13 0.00 1.43 0.00 0.00 31.44 32.58 1lwu n GLU 190 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 177.13 178.02 1lwu h GLU 191 N 0.02 0.06 -5.17 3.44 4.11 -1.91 -3.42 114.58 111.69 1lwu h GLU 191 Ca 0.00 -0.10 -0.01 0.00 0.07 0.00 0.00 59.36 59.33 1lwu h GLU 191 Cb 0.01 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.29 1lwu h GLU 191 CO 0.00 0.86 0.06 0.28 0.07 0.00 0.00 179.01 180.29 1lwu n VAL 192 N -3.28 0.00 0.00 -1.06 0.31 -0.57 -5.06 118.33 108.67 1lwu n VAL 192 Ca -0.09 -0.21 0.00 0.00 -0.01 0.00 0.00 64.34 64.03 1lwu n VAL 192 Cb 1.00 -1.91 0.00 0.00 -0.91 0.00 0.00 33.84 32.02 1lwu n VAL 192 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03