#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 -0.15 -3.83 -0.58 -1.26 -0.74 120.64 114.01 1lwu n GLU 96 Ca 0.00 1.35 0.10 0.00 -0.42 0.00 0.00 57.16 58.18 1lwu n GLU 96 Cb 0.00 -2.14 0.16 0.00 -0.57 0.00 0.00 31.44 28.90 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 -5.32 2.63 -0.06 -4.62 7.94 -1.26 -4.50 117.00 111.81 1lwu n LEU 97 Ca 0.21 -3.10 -0.06 0.00 -1.11 0.00 0.00 56.01 51.95 1lwu n LEU 97 Cb 0.68 -0.45 -0.11 0.00 0.53 0.00 0.00 43.42 44.07 1lwu n LEU 97 CO -0.07 0.72 -0.92 -1.84 -1.11 0.00 0.00 177.39 174.17 1lwu n GLU 98 N -1.27 1.74 0.10 1.96 -0.00 0.08 -4.42 120.64 118.84 1lwu n GLU 98 Ca 0.17 -0.01 -0.08 0.00 -0.00 0.00 0.00 57.16 57.24 1lwu n GLU 98 Cb 0.69 -1.34 -0.05 0.00 -0.00 0.00 0.00 31.44 30.74 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 0.00 3.84 2.07 -1.47 -1.61 116.25 119.08 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 1.77 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.52 1lwu h VAL 99 CO 0.02 0.00 -0.18 0.03 0.02 0.00 0.00 177.57 177.46 1lwu h ARG 100 N -0.42 -0.22 0.00 1.57 3.08 -1.83 -1.95 114.38 114.61 1lwu h ARG 100 Ca -0.02 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1lwu h ARG 100 Cb 0.39 0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.49 1lwu h ARG 100 CO -0.07 -0.15 0.00 0.98 -1.07 0.00 0.00 179.97 179.66 1lwu n TYR 101 N -3.48 0.00 -0.28 3.04 9.36 -1.22 -0.04 117.16 124.54 1lwu n TYR 101 Ca -0.02 0.00 0.30 0.00 3.32 0.00 0.00 57.90 61.49 1lwu n TYR 101 Cb 0.13 -0.31 0.68 0.00 -0.63 0.00 0.00 39.34 39.21 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 0.11 1.15 2.98 0.02 -1.31 0.32 113.55 116.82 1lwu h SER 102 Ca 0.00 0.02 -0.14 0.00 -0.84 0.00 0.00 61.79 60.83 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 0.02 -0.89 1.05 -1.14 0.00 0.00 176.83 175.87 1lwu h GLU 103 N 0.10 0.00 0.00 3.45 4.11 -0.41 -1.84 114.58 119.99 1lwu h GLU 103 Ca 0.52 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.94 1lwu h GLU 103 Cb 1.89 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.14 1lwu h GLU 103 CO -0.07 0.48 -0.08 0.28 0.07 0.00 0.00 179.01 179.69 1lwu h VAL 104 N 0.00 0.17 0.26 -1.06 2.07 0.32 -1.89 116.25 116.12 1lwu h VAL 104 Ca -0.06 -0.86 -0.34 0.00 0.82 0.00 0.00 66.70 66.26 1lwu h VAL 104 Cb 1.51 1.74 0.04 0.00 -1.52 0.00 0.00 31.29 33.05 1lwu h VAL 104 CO 0.07 0.07 -1.49 0.25 0.02 0.00 0.00 177.57 176.49 1lwu h LEU 105 N 0.00 0.85 -1.55 2.57 5.85 -0.74 -2.99 115.31 119.30 1lwu h LEU 105 Ca -0.00 -0.91 0.00 0.00 0.84 0.00 0.00 57.88 57.81 1lwu h LEU 105 Cb 0.73 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.49 1lwu h LEU 105 CO 0.01 1.71 0.00 -2.11 -0.34 0.00 0.00 178.44 177.71 1lwu n ARG 106 N -3.71 2.01 0.00 1.25 1.85 -0.71 -2.27 116.66 115.08 1lwu n ARG 106 Ca -0.17 -0.88 0.02 0.00 -1.00 0.00 0.00 57.85 55.82 1lwu n ARG 106 Cb 1.11 -1.61 -0.02 0.00 -1.05 0.00 0.00 32.46 30.89 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 0.17 4.85 -0.03 2.89 4.07 -0.73 -4.01 120.64 127.84 1lwu n GLU 107 Ca 0.08 -0.11 -0.20 0.00 -0.06 0.00 0.00 57.16 56.87 1lwu n GLU 107 Cb 0.46 -0.74 -0.13 0.00 -0.06 0.00 0.00 31.44 30.96 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 0.12 0.23 -0.80 4.31 3.38 -1.32 -3.27 115.31 117.97 1lwu h LEU 108 Ca 0.00 -0.79 -0.05 0.00 0.09 0.00 0.00 57.88 57.13 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 1.51 0.29 -0.33 0.09 0.00 0.00 178.44 179.99 1lwu h GLU 109 N -0.57 1.18 0.00 1.13 5.08 -1.79 1.06 114.58 120.66 1lwu h GLU 109 Ca -0.28 -0.23 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1lwu h GLU 109 Cb 1.54 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.61 1lwu h GLU 109 CO -0.02 0.97 0.00 2.89 -1.00 0.00 0.00 179.01 181.85 1lwu n ARG 110 N -4.27 0.02 -0.04 2.33 1.85 -1.26 0.12 116.66 115.42 1lwu n ARG 110 Ca 0.07 0.35 -0.02 0.00 -1.00 0.00 0.00 57.85 57.24 1lwu n ARG 110 Cb 0.20 -1.50 -0.09 0.00 -1.05 0.00 0.00 32.46 30.03 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 -1.47 1.73 0.00 2.89 0.63 0.42 -4.35 116.66 116.52 1lwu n ARG 111 Ca 0.02 -0.03 -0.21 0.00 -0.92 0.00 0.00 57.85 56.70 1lwu n ARG 111 Cb 0.08 -1.27 -0.14 0.00 0.45 0.00 0.00 32.46 31.58 1lwu n ARG 111 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 1lwu n ILE 112 N -2.26 1.77 0.28 5.15 5.41 0.34 -3.41 119.36 126.64 1lwu n ILE 112 Ca -0.13 -0.62 0.12 0.00 1.00 0.00 0.00 62.75 63.12 1lwu n ILE 112 Cb 0.70 -1.76 0.59 0.00 -0.71 0.00 0.00 39.64 38.47 1lwu n ILE 112 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 176.55 176.26 1lwu h ILE 113 N 0.01 0.00 0.17 1.39 2.10 0.72 -0.38 117.51 121.51 1lwu h ILE 113 Ca -0.42 -0.13 -0.28 0.00 1.08 0.00 0.00 64.86 65.11 1lwu h ILE 113 Cb 1.99 0.78 0.02 0.00 -1.09 0.00 0.00 36.82 38.52 1lwu h ILE 113 CO 0.07 0.00 -1.35 -0.74 -1.08 0.00 0.00 178.15 175.06 1lwu h HIS 114 N 0.00 0.66 -0.53 2.19 2.76 -1.71 -3.06 115.15 115.46 1lwu h HIS 114 Ca 0.00 -0.48 0.15 0.00 -2.20 0.00 0.00 60.37 57.84 1lwu h HIS 114 Cb 0.19 -0.03 -0.02 0.00 1.55 0.00 0.00 27.41 29.10 1lwu h HIS 114 CO 0.00 1.52 0.68 -0.07 -1.30 0.00 0.00 177.93 178.76 1lwu h LEU 115 N -0.13 0.00 0.17 0.26 3.38 -1.09 0.49 115.31 118.40 1lwu h LEU 115 Ca -0.26 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 1lwu h LEU 115 Cb 1.90 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.65 1lwu h LEU 115 CO 0.16 0.00 -0.08 1.56 0.09 0.00 0.00 178.44 180.17 1lwu h GLN 116 N 0.00 -0.22 -0.22 1.13 1.08 -1.44 -0.44 115.11 115.00 1lwu h GLN 116 Ca 0.25 0.01 0.06 0.00 -1.45 0.00 0.00 58.65 57.53 1lwu h GLN 116 Cb 1.61 0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 29.08 1lwu h GLN 116 CO -0.00 0.12 0.27 -0.09 -0.95 0.00 0.00 178.83 178.18 1lwu h ARG 117 N -0.97 0.00 0.09 1.46 1.12 -0.10 0.33 114.38 116.31 1lwu h ARG 117 Ca -0.02 0.00 -0.15 0.00 -1.11 0.00 0.00 59.98 58.70 1lwu h ARG 117 Cb 0.44 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 -0.65 -0.09 -3.11 0.00 0.00 179.97 176.16 1lwu h ARG 118 N 0.00 0.28 -0.82 0.20 2.43 -0.60 -2.78 114.38 113.08 1lwu h ARG 118 Ca 0.10 -0.42 -0.02 0.00 -0.81 0.00 0.00 59.98 58.83 1lwu h ARG 118 Cb 0.64 0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 30.29 1lwu h ARG 118 CO -0.00 1.17 0.44 0.82 -1.51 0.00 0.00 179.97 180.88 1lwu h ILE 119 N -0.39 1.25 -0.07 1.20 1.08 0.81 0.25 117.51 121.64 1lwu h ILE 119 Ca -0.11 -0.64 0.02 0.00 -0.39 0.00 0.00 64.86 63.75 1lwu h ILE 119 Cb 1.46 0.16 -0.02 0.00 -3.07 0.00 0.00 36.82 35.35 1lwu h ILE 119 CO 0.12 0.28 -0.06 0.78 -0.69 0.00 0.00 178.15 178.58 1lwu h ASN 120 N 1.15 -0.20 -0.67 1.72 2.35 -0.53 -0.36 115.58 119.05 1lwu h ASN 120 Ca 0.29 0.04 0.07 0.00 -0.55 0.00 0.00 56.30 56.15 1lwu h ASN 120 Cb 0.06 0.10 -0.06 0.00 0.05 0.00 0.00 38.32 38.47 1lwu h ASN 120 CO -0.04 -0.09 0.36 0.24 -1.65 0.00 0.00 177.43 176.24 1lwu h MET 121 N -0.08 0.63 -0.12 0.81 2.86 -1.14 -0.97 114.93 116.92 1lwu h MET 121 Ca 0.05 -0.04 0.03 0.00 -2.06 0.00 0.00 59.70 57.69 1lwu h MET 121 Cb 0.15 -0.14 -0.00 0.00 0.06 0.00 0.00 31.60 31.67 1lwu h MET 121 CO -0.12 0.42 0.09 1.96 1.06 0.00 0.00 176.91 180.32 1lwu h GLN 122 N 0.65 0.00 -0.01 1.72 4.20 0.10 0.22 115.11 121.99 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 0.23 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.01 1lwu h GLN 122 CO -0.20 0.00 -0.36 1.28 -0.67 0.00 0.00 178.83 178.87 1lwu n LEU 123 N -4.37 0.90 -0.04 1.46 4.77 -0.25 -1.68 117.00 117.80 1lwu n LEU 123 Ca -0.00 -0.21 -0.15 0.00 -0.03 0.00 0.00 56.01 55.62 1lwu n LEU 123 Cb 0.21 -0.15 -0.12 0.00 -2.33 0.00 0.00 43.42 41.02 1lwu n LEU 123 CO 0.33 0.18 0.39 1.56 -1.33 0.00 0.00 177.39 178.52 1lwu h GLN 124 N 0.85 0.07 -0.24 3.23 1.08 0.59 -2.82 115.11 117.87 1lwu h GLN 124 Ca 0.00 -0.09 -0.20 0.00 -1.45 0.00 0.00 58.65 56.91 1lwu h GLN 124 Cb 0.51 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.98 1lwu h GLN 124 CO 0.00 0.94 -0.63 1.96 -0.95 0.00 0.00 178.83 180.14 1lwu h GLN 125 N -0.75 0.85 -0.39 1.46 4.20 -1.42 -2.91 115.11 116.15 1lwu h GLN 125 Ca -0.02 -0.59 -0.03 0.00 0.06 0.00 0.00 58.65 58.06 1lwu h GLN 125 Cb 0.99 0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.85 1lwu h GLN 125 CO 0.03 1.22 0.10 -0.07 -0.67 0.00 0.00 178.83 179.43 1lwu h LEU 126 N 0.63 0.52 -0.19 1.46 3.38 -1.44 0.52 115.31 120.19 1lwu h LEU 126 Ca -0.01 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 1lwu h LEU 126 Cb 1.25 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.86 1lwu h LEU 126 CO 0.14 0.52 -0.12 0.74 0.09 0.00 0.00 178.44 179.81 1lwu h THR 127 N 0.56 1.32 -0.48 0.22 2.02 -1.47 -1.43 112.91 113.64 1lwu h THR 127 Ca 0.13 -1.21 -0.13 0.00 0.77 0.00 0.00 66.41 65.97 1lwu h THR 127 Cb 0.21 1.70 -0.01 0.00 -1.74 0.00 0.00 68.15 68.30 1lwu h THR 127 CO -0.00 0.36 -0.20 0.25 0.37 0.00 0.00 175.52 176.30 1lwu h LEU 128 N 0.10 1.00 -1.23 2.58 7.12 -1.29 -2.22 115.31 121.36 1lwu h LEU 128 Ca 0.04 -0.37 0.00 0.00 0.13 0.00 0.00 57.88 57.68 1lwu h LEU 128 Cb 0.62 -0.27 0.00 0.00 -0.53 0.00 0.00 40.66 40.48 1lwu h LEU 128 CO 0.03 1.16 0.00 0.25 -0.13 0.00 0.00 178.44 179.76 1lwu h LEU 129 N 0.85 0.00 0.18 2.25 5.85 0.10 -2.07 115.31 122.48 1lwu h LEU 129 Ca 0.11 0.00 -0.28 0.00 0.84 0.00 0.00 57.88 58.55 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 -1.32 -0.61 -0.34 0.00 0.00 178.44 176.24 1lwu h GLN 130 N 0.00 0.39 0.00 1.25 4.15 -0.72 -2.80 115.11 117.38 1lwu h GLN 130 Ca 0.00 -0.67 -0.03 0.00 0.77 0.00 0.00 58.65 58.72 1lwu h GLN 130 Cb 0.37 0.25 -0.00 0.00 0.21 0.00 0.00 27.48 28.31 1lwu h GLN 130 CO 0.00 1.32 -0.16 1.25 -1.93 0.00 0.00 178.83 179.31 1lwu h HIS 131 N -0.10 0.00 0.11 3.99 2.76 -0.97 -1.11 115.15 119.82 1lwu h HIS 131 Ca -0.25 0.00 -0.15 0.00 -2.20 0.00 0.00 60.37 57.77 1lwu h HIS 131 Cb 1.93 0.00 0.02 0.00 1.55 0.00 0.00 27.41 30.90 1lwu h HIS 131 CO 0.14 0.16 -0.65 -0.91 -1.30 0.00 0.00 177.93 175.38 1lwu h ASN 132 N 0.00 0.38 -0.82 3.26 -0.26 -1.45 -2.38 115.58 114.30 1lwu h ASN 132 Ca -0.00 -0.96 0.02 0.00 -0.56 0.00 0.00 56.30 54.80 1lwu h ASN 132 Cb 0.63 -0.12 -0.04 0.00 -1.06 0.00 0.00 38.32 37.73 1lwu h ASN 132 CO 0.02 1.31 0.54 0.40 -1.06 0.00 0.00 177.43 178.64 1lwu h ILE 133 N -0.48 1.18 -0.27 2.81 2.04 -1.42 -0.85 117.51 120.51 1lwu h ILE 133 Ca -0.11 -0.37 0.07 0.00 1.00 0.00 0.00 64.86 65.45 1lwu h ILE 133 Cb 1.50 0.01 -0.07 0.00 -0.74 0.00 0.00 36.82 37.52 1lwu h ILE 133 CO 0.12 0.20 -0.23 0.50 0.00 0.00 0.00 178.15 178.74 1lwu h LYS 134 N 1.07 -0.21 -1.08 2.37 1.63 -1.19 -1.29 116.57 117.87 1lwu h LYS 134 Ca 0.31 0.01 -0.35 0.00 -0.85 0.00 0.00 60.65 59.78 1lwu h LYS 134 Cb -0.06 0.05 -0.19 0.00 -0.60 0.00 0.00 32.23 31.43 1lwu h LYS 134 CO -0.08 -0.14 0.44 0.25 -3.45 0.00 0.00 179.45 176.47 1lwu n THR 135 N -5.37 2.53 0.00 1.00 -2.24 -0.40 -3.41 114.28 106.39 1lwu n THR 135 Ca -0.00 -1.39 0.00 0.00 -2.27 0.00 0.00 64.05 60.39 1lwu n THR 135 Cb 0.29 -0.80 0.00 0.00 -2.10 0.00 0.00 70.33 67.71 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 -0.42 1.97 0.09 -0.78 7.27 -0.74 -4.39 117.38 120.38 1lwu n GLN 136 Ca 0.38 0.00 -0.08 0.00 0.07 0.00 0.00 57.00 57.38 1lwu n GLN 136 Cb 1.10 -0.69 -0.01 0.00 2.41 0.00 0.00 30.24 33.05 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 1.54 0.02 1.69 2.07 -1.34 -0.58 116.25 119.65 1lwu h VAL 137 Ca 0.00 -2.74 -0.00 0.00 0.82 0.00 0.00 66.70 64.78 1lwu h VAL 137 Cb 0.30 2.52 0.00 0.00 -1.52 0.00 0.00 31.29 32.59 1lwu h VAL 137 CO 0.00 0.79 -0.01 -1.28 0.02 0.00 0.00 177.57 177.09 1lwu h SER 138 N 0.07 -0.03 0.03 0.57 0.87 -1.79 -2.37 113.55 110.89 1lwu h SER 138 Ca -0.04 -0.62 0.00 0.00 -1.23 0.00 0.00 61.79 59.91 1lwu h SER 138 Cb 1.52 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 63.48 1lwu h SER 138 CO 0.13 0.63 -0.04 -0.61 -0.53 0.00 0.00 176.83 176.41 1lwu h GLN 139 N -0.70 -0.08 -0.28 2.24 4.15 -1.76 -1.20 115.11 117.47 1lwu h GLN 139 Ca -0.00 0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.39 1lwu h GLN 139 Cb 0.65 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.34 1lwu h GLN 139 CO 0.01 -0.05 0.04 0.82 -1.93 0.00 0.00 178.83 177.71 1lwu h ILE 140 N -0.08 1.15 0.14 2.39 2.04 -1.21 -0.86 117.51 121.09 1lwu h ILE 140 Ca 0.01 -0.57 -0.01 0.00 1.00 0.00 0.00 64.86 65.29 1lwu h ILE 140 Cb 0.09 0.90 0.00 0.00 -0.74 0.00 0.00 36.82 37.07 1lwu h ILE 140 CO -0.02 0.20 -0.07 0.25 0.00 0.00 0.00 178.15 178.51 1lwu h LEU 141 N 0.41 -0.16 -0.19 1.44 5.85 -0.93 -1.43 115.31 120.29 1lwu h LEU 141 Ca 0.10 -0.22 0.06 0.00 0.84 0.00 0.00 57.88 58.65 1lwu h LEU 141 Cb 0.21 0.04 -0.07 0.00 0.37 0.00 0.00 40.66 41.22 1lwu h LEU 141 CO 0.00 0.13 -0.25 -0.09 -0.34 0.00 0.00 178.44 177.89 1lwu h ARG 142 N -0.47 -0.27 -0.58 1.25 9.65 -0.93 -1.86 114.38 121.17 1lwu h ARG 142 Ca -0.02 0.02 0.12 0.00 -1.10 0.00 0.00 59.98 58.99 1lwu h ARG 142 Cb 0.37 0.06 -0.09 0.00 -1.39 0.00 0.00 29.97 28.92 1lwu h ARG 142 CO 0.03 -0.18 0.04 0.28 2.80 0.00 0.00 179.97 182.94 1lwu h VAL 143 N -0.28 0.57 -0.90 0.20 2.07 -1.07 -0.10 116.25 116.74 1lwu h VAL 143 Ca 0.12 -0.05 0.06 0.00 0.82 0.00 0.00 66.70 67.65 1lwu h VAL 143 Cb 0.47 0.40 -0.06 0.00 -1.52 0.00 0.00 31.29 30.58 1lwu h VAL 143 CO -0.36 0.03 0.59 -0.08 0.02 0.00 0.00 177.57 177.77 1lwu h GLU 144 N 0.16 1.01 -0.02 1.57 4.81 -0.44 0.17 114.58 121.84 1lwu h GLU 144 Ca 0.30 -0.06 -0.22 0.00 -0.13 0.00 0.00 59.36 59.25 1lwu h GLU 144 Cb 0.47 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 29.62 1lwu h GLU 144 CO -0.46 0.67 -0.89 0.28 -0.73 0.00 0.00 179.01 177.88 1lwu h VAL 145 N 1.04 1.39 -0.89 0.32 2.07 -0.85 0.93 116.25 120.26 1lwu h VAL 145 Ca 0.38 -2.35 0.08 0.00 0.82 0.00 0.00 66.70 65.62 1lwu h VAL 145 Cb 0.16 2.33 -0.06 0.00 -1.52 0.00 0.00 31.29 32.20 1lwu h VAL 145 CO -0.14 0.71 0.58 0.44 0.02 0.00 0.00 177.57 179.18 1lwu h ASP 146 N 0.26 0.86 0.17 0.57 3.45 -0.02 0.95 116.42 122.66 1lwu h ASP 146 Ca -0.07 0.01 -0.27 0.00 0.43 0.00 0.00 57.03 57.13 1lwu h ASP 146 Cb 1.51 -0.17 0.02 0.00 -0.56 0.00 0.00 39.33 40.13 1lwu h ASP 146 CO 0.16 0.53 -1.12 0.40 -1.57 0.00 0.00 179.24 177.64 1lwu h ILE 147 N 0.96 1.32 -0.57 0.35 2.04 -0.49 -2.28 117.51 118.84 1lwu h ILE 147 Ca 0.39 -2.43 -0.04 0.00 1.00 0.00 0.00 64.86 63.78 1lwu h ILE 147 Cb 0.28 2.55 -0.03 0.00 -0.74 0.00 0.00 36.82 38.89 1lwu h ILE 147 CO -0.16 0.74 0.19 -0.78 0.00 0.00 0.00 178.15 178.14 1lwu h ASP 148 N 0.29 0.79 -0.34 1.72 3.58 -0.09 -0.92 116.42 121.46 1lwu h ASP 148 Ca -0.14 -0.12 -0.09 0.00 0.42 0.00 0.00 57.03 57.10 1lwu h ASP 148 Cb 1.78 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 42.62 1lwu h ASP 148 CO 0.21 0.74 -0.12 0.58 -2.88 0.00 0.00 179.24 177.77 1lwu h VAL 149 N 0.84 1.28 0.49 2.25 2.07 -0.85 -3.05 116.25 119.28 1lwu h VAL 149 Ca 0.19 -1.21 -0.02 0.00 0.82 0.00 0.00 66.70 66.48 1lwu h VAL 149 Cb 0.23 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.37 1lwu h VAL 149 CO -0.01 0.39 -0.24 0.00 0.02 0.00 0.00 177.57 177.74 1lwu h ALA 150 N 0.79 -0.66 -1.01 1.67 0.00 -1.18 -3.22 119.26 115.65 1lwu h ALA 150 Ca 0.08 -0.17 0.33 0.00 0.00 0.00 0.00 54.91 55.14 1lwu h ALA 150 Cb 0.64 0.26 -0.15 0.00 0.00 0.00 0.00 17.79 18.54 1lwu h ALA 150 CO 0.04 -0.64 0.58 -0.07 0.00 0.00 0.00 179.25 179.16 1lwu h LEU 151 N -1.11 0.51 -1.86 0.00 4.07 -1.30 1.29 115.31 116.91 1lwu h LEU 151 Ca -0.07 0.19 -0.02 0.00 0.08 0.00 0.00 57.88 58.06 1lwu h LEU 151 Cb 0.56 0.14 -0.00 0.00 1.08 0.00 0.00 40.66 42.43 1lwu h LEU 151 CO 0.11 -0.14 -0.11 -0.09 -1.08 0.00 0.00 178.44 177.14 1lwu h ARG 152 N 0.32 0.00 -0.42 1.13 2.43 -1.57 -1.78 114.38 114.49 1lwu h ARG 152 Ca 0.74 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.91 1lwu h ARG 152 Cb 1.70 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 31.23 1lwu h ARG 152 CO -0.60 0.11 0.27 0.00 -1.51 0.00 0.00 179.97 178.24 1lwu h ALA 153 N 1.89 1.69 0.00 2.80 0.00 0.17 -2.64 119.26 123.17 1lwu h ALA 153 Ca -0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1lwu h ALA 153 Cb 0.20 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1lwu h ALA 153 CO 0.01 0.28 -0.01 0.00 0.00 0.00 0.00 179.25 179.54 1lwu h LYS 155 N 0.00 -0.18 -0.23 0.00 3.64 -1.62 0.30 116.57 118.48 1lwu h LYS 155 Ca -0.00 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1lwu h LYS 155 Cb 0.06 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1lwu h LYS 155 CO 0.00 -0.12 0.00 0.41 -2.27 0.00 0.00 179.45 177.47 1lwu n GLY 156 N -1.34 -0.08 0.00 5.01 0.00 -1.05 -4.05 105.19 103.68 1lwu n GLY 156 Ca -0.01 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.05 4.31 -4.68 1.61 2.88 0.11 -5.10 113.62 112.70 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 0.16 0.37 -0.07 0.00 -0.75 0.00 0.00 64.21 63.91 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 2.68 0.92 -4.28 0.00 0.00 -1.90 -3.41 119.26 113.26 1lwu h ALA 159 Ca -0.47 0.04 -0.65 0.00 0.00 0.00 0.00 54.91 53.83 1lwu h ALA 159 Cb 1.20 -0.08 -0.30 0.00 0.00 0.00 0.00 17.79 18.61 1lwu h ALA 159 CO 0.59 -0.01 -0.87 1.03 0.00 0.00 0.00 179.25 179.98 1lwu s ARG 160 N -6.08 2.07 -0.08 0.00 0.52 -1.26 -5.13 118.95 109.00 1lwu s ARG 160 Ca -0.13 -0.82 0.02 0.00 -0.52 0.00 0.00 55.73 54.28 1lwu s ARG 160 Cb 0.17 -1.89 0.01 0.00 0.52 0.00 0.00 34.95 33.76 1lwu s ARG 160 CO 0.76 0.43 -0.14 -0.47 0.02 0.00 0.00 175.30 175.90 1lwu s TYR 161 N -0.35 1.66 0.00 -0.53 5.04 -1.26 -4.95 117.35 116.96 1lwu s TYR 161 Ca 0.03 -0.66 0.00 0.00 -2.44 0.00 0.00 57.07 54.01 1lwu s TYR 161 Cb -0.11 -1.20 0.00 0.00 0.35 0.00 0.00 41.96 41.00 1lwu s TYR 161 CO 0.01 -0.33 0.00 1.28 -1.34 0.00 0.00 175.55 175.17 1lwu n LEU 162 N 3.87 0.00 0.00 6.97 7.99 -1.26 -5.07 117.00 129.50 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 0.25 0.00 0.00 1.21 -1.51 0.00 0.00 177.39 177.34 1lwu n GLU 163 N 0.00 0.00 -3.12 3.23 4.07 -1.26 -5.12 120.64 118.44 1lwu n GLU 163 Ca 0.00 0.00 -0.39 0.00 -0.06 0.00 0.00 57.16 56.71 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 3.64 -0.18 4.31 5.04 -1.26 -5.05 117.35 123.85 1lwu s TYR 164 Ca 0.00 1.23 -0.04 0.00 -2.44 0.00 0.00 57.07 55.82 1lwu s TYR 164 Cb 0.00 -2.71 -0.02 0.00 0.35 0.00 0.00 41.96 39.58 1lwu s TYR 164 CO 0.00 0.23 -0.04 -0.98 -1.34 0.00 0.00 175.55 173.42 1lwu s ARG 165 N 0.26 3.56 0.00 4.97 3.03 -1.26 -5.05 118.95 124.46 1lwu s ARG 165 Ca 0.34 -0.56 0.00 0.00 2.03 0.00 0.00 55.73 57.54 1lwu s ARG 165 Cb -0.18 -2.96 0.00 0.00 -1.03 0.00 0.00 34.95 30.78 1lwu s ARG 165 CO 0.18 0.06 0.00 1.28 -1.13 0.00 0.00 175.30 175.69 1lwu n LEU 166 N 4.05 0.00 0.00 -1.89 4.77 -1.26 -5.08 117.00 117.59 1lwu n LEU 166 Ca -0.18 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 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 -0.33 0.00 -0.67 -1.33 0.00 0.00 177.39 175.37 1lwu n ASP 167 N -0.68 0.00 -4.84 -1.43 -0.08 -1.26 -5.16 116.55 103.10 1lwu n ASP 167 Ca 0.00 0.00 -0.33 0.00 -1.51 0.00 0.00 54.79 52.95 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 3.38 4.07 0.00 -0.67 -2.85 -1.26 -4.94 119.74 117.46 1lwu s LYS 168 Ca 0.00 0.78 0.14 0.00 -1.00 0.00 0.00 55.97 55.89 1lwu s LYS 168 Cb 0.00 -2.40 0.31 0.00 -2.06 0.00 0.00 37.83 33.69 1lwu s LYS 168 CO 0.00 0.13 1.22 -0.85 0.10 0.00 0.00 175.35 175.95 1lwu n GLU 169 N -0.38 2.31 0.33 1.78 -0.00 -1.26 -4.36 120.64 119.06 1lwu n GLU 169 Ca 0.04 -1.97 0.16 0.00 -0.00 0.00 0.00 57.16 55.39 1lwu n GLU 169 Cb 0.53 -1.33 0.82 0.00 -0.00 0.00 0.00 31.44 31.46 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 2.67 0.00 -0.01 3.44 3.11 -2.01 1.65 116.57 125.42 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 31.95 1lwu h LYS 170 CO 0.00 0.00 -0.64 -0.97 -2.81 0.00 0.00 179.45 175.03 1lwu h ASN 171 N 0.00 0.03 1.11 4.20 -0.73 -2.00 -2.75 115.58 115.44 1lwu h ASN 171 Ca 0.01 -0.02 -0.04 0.00 1.87 0.00 0.00 56.30 58.12 1lwu h ASN 171 Cb 0.68 -0.01 -0.01 0.00 0.27 0.00 0.00 38.32 39.26 1lwu h ASN 171 CO -0.00 0.67 -0.17 -0.07 -0.37 0.00 0.00 177.43 177.49 1lwu h LEU 172 N 0.02 0.00 0.28 0.34 3.38 0.21 0.12 115.31 119.66 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 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1lwu h LEU 172 CO 0.09 0.17 -0.13 1.56 0.09 0.00 0.00 178.44 180.21 1lwu h GLN 173 N 0.00 -0.36 -0.70 1.13 1.08 -1.41 -2.82 115.11 112.02 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 0.77 0.08 -0.10 0.00 -0.05 0.00 0.00 27.48 28.18 1lwu h GLN 173 CO 0.02 -0.24 0.16 -0.07 -0.95 0.00 0.00 178.83 177.75 1lwu h LEU 174 N -0.96 -0.00 -2.09 1.46 3.38 -1.45 0.63 115.31 116.28 1lwu h LEU 174 Ca -0.04 0.14 0.05 0.00 0.09 0.00 0.00 57.88 58.12 1lwu h LEU 174 Cb 0.29 0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 1lwu h LEU 174 CO 0.06 -0.03 0.15 -0.08 0.09 0.00 0.00 178.44 178.63 1lwu h GLU 175 N 0.26 0.00 -0.05 1.13 4.22 -0.85 -1.89 114.58 117.40 1lwu h GLU 175 Ca 0.39 0.00 -0.04 0.00 0.08 0.00 0.00 59.36 59.79 1lwu h GLU 175 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1lwu h GLU 175 CO -0.49 0.00 -0.12 -0.22 -2.18 0.00 0.00 179.01 176.01 1lwu h LYS 176 N 0.00 0.17 0.31 1.92 1.63 0.53 -2.73 116.57 118.40 1lwu h LYS 176 Ca 0.09 -0.11 -0.01 0.00 -0.85 0.00 0.00 60.65 59.76 1lwu h LYS 176 Cb 0.38 0.02 -0.00 0.00 -0.60 0.00 0.00 32.23 32.02 1lwu h LYS 176 CO -0.00 0.71 -0.21 0.00 -3.45 0.00 0.00 179.45 176.50 1lwu h ALA 177 N 0.46 -1.03 -0.98 5.00 0.00 -0.94 1.47 119.26 123.24 1lwu h ALA 177 Ca -0.00 -0.10 0.28 0.00 0.00 0.00 0.00 54.91 55.09 1lwu h ALA 177 Cb 0.71 0.34 -0.04 0.00 0.00 0.00 0.00 17.79 18.80 1lwu h ALA 177 CO 0.03 -1.02 0.96 0.00 0.00 0.00 0.00 179.25 179.22 1lwu n ALA 178 N -2.38 0.94 -0.06 0.00 0.00 -0.77 0.18 120.51 118.42 1lwu n ALA 178 Ca -0.06 0.32 -0.13 0.00 0.00 0.00 0.00 53.44 53.58 1lwu n ALA 178 Cb 0.21 -0.56 -0.04 0.00 0.00 0.00 0.00 19.45 19.05 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 -2.94 1.35 -0.28 0.00 3.41 -0.87 -4.62 113.62 109.67 1lwu n SER 179 Ca 0.22 0.22 0.02 0.00 -0.26 0.00 0.00 58.87 59.07 1lwu n SER 179 Cb 1.25 -0.52 0.15 0.00 -0.26 0.00 0.00 64.21 64.83 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 -0.59 0.80 -0.08 7.33 -1.99 0.39 -2.88 116.97 119.95 1lwu h TYR 180 Ca -0.24 0.03 -0.60 0.00 2.00 0.00 0.00 58.73 59.92 1lwu h TYR 180 Cb 1.04 -0.24 0.04 0.00 2.00 0.00 0.00 36.73 39.57 1lwu h TYR 180 CO -0.14 0.34 2.06 0.44 -0.00 0.00 0.00 178.16 180.86 1lwu n ILE 181 N -4.76 1.75 -0.58 -2.88 -6.64 0.49 -4.57 119.36 102.16 1lwu n ILE 181 Ca 0.12 -1.58 -0.17 0.00 -1.77 0.00 0.00 62.75 59.35 1lwu n ILE 181 Cb 0.25 -2.28 0.09 0.00 -1.44 0.00 0.00 39.64 36.26 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 8.66 4.75 0.07 -1.28 0.00 -1.09 -4.44 120.51 127.18 1lwu n ALA 182 Ca 0.49 -1.89 0.01 0.00 0.00 0.00 0.00 53.44 52.04 1lwu n ALA 182 Cb 0.41 -1.34 0.03 0.00 0.00 0.00 0.00 19.45 18.56 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 -0.33 0.00 -0.33 0.00 3.02 -1.26 -2.57 115.26 113.79 1lwu n ASN 183 Ca 0.37 0.22 0.00 0.00 -0.03 0.00 0.00 54.58 55.15 1lwu n ASN 183 Cb 1.01 -0.24 0.17 0.00 -0.61 0.00 0.00 39.78 40.11 1lwu n ASN 183 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1lwu h LEU 184 N 0.00 1.03 -0.96 3.41 3.38 -1.94 -3.08 115.31 117.16 1lwu h LEU 184 Ca 0.00 -0.02 0.13 0.00 0.09 0.00 0.00 57.88 58.08 1lwu h LEU 184 Cb 0.01 -0.25 -0.14 0.00 0.09 0.00 0.00 40.66 40.37 1lwu h LEU 184 CO 0.00 0.72 -0.45 0.11 0.09 0.00 0.00 178.44 178.91 1lwu h LYS 185 N 1.21 -0.02 0.00 1.13 1.57 -1.79 -3.45 116.57 115.21 1lwu h LYS 185 Ca 0.36 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 1lwu h LYS 185 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.27 1lwu h LYS 185 CO -0.10 -0.01 0.00 0.34 -0.57 0.00 0.00 179.45 179.11 1lwu n PHE 186 N -5.40 0.00 -3.15 -1.35 7.35 -1.17 -4.98 117.46 108.76 1lwu n PHE 186 Ca 0.07 0.00 0.05 0.00 -0.76 0.00 0.00 57.45 56.81 1lwu n PHE 186 Cb 0.35 0.00 -0.00 0.00 0.35 0.00 0.00 39.48 40.18 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 0.00 0.29 0.00 -4.13 2.12 -1.26 -4.92 118.70 110.80 1lwu s GLU 187 Ca 0.00 0.33 0.00 0.00 0.36 0.00 0.00 54.97 55.66 1lwu s GLU 187 Cb 0.00 0.16 0.00 0.00 0.26 0.00 0.00 34.13 34.55 1lwu s GLU 187 CO 0.00 -0.51 0.00 2.89 -0.54 0.00 0.00 175.26 177.10 1lwu n ARG 188 N 5.26 -1.45 0.00 4.30 0.00 -1.26 -5.05 116.66 118.46 1lwu n ARG 188 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.91 1lwu n ARG 188 Cb 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 33.02 1lwu n ARG 188 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 1lwu n PHE 189 N -2.79 0.00 0.00 2.89 3.01 -1.26 -4.73 117.46 114.59 1lwu n PHE 189 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1lwu n PHE 189 Cb 0.00 0.07 0.00 0.00 -0.01 0.00 0.00 39.48 39.54 1lwu n PHE 189 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92 1lwu n GLU 190 N -1.96 0.00 -0.32 -1.08 0.28 -1.26 -0.85 120.64 115.44 1lwu n GLU 190 Ca 0.00 0.38 0.19 0.00 -0.16 0.00 0.00 57.16 57.57 1lwu n GLU 190 Cb 0.15 -1.52 0.44 0.00 1.43 0.00 0.00 31.44 31.93 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 0.00 0.51 -7.06 3.44 4.11 -1.91 -3.40 114.58 110.27 1lwu h GLU 191 Ca 0.00 -0.03 -0.45 0.00 0.07 0.00 0.00 59.36 58.95 1lwu h GLU 191 Cb 0.04 -0.12 0.06 0.00 0.50 0.00 0.00 28.75 29.24 1lwu h GLU 191 CO 0.00 0.34 0.10 0.08 0.07 0.00 0.00 179.01 179.59 1lwu s VAL 192 N -5.63 2.68 -2.36 -1.06 1.01 -0.03 -4.81 120.40 110.20 1lwu s VAL 192 Ca -0.10 -0.42 0.19 0.00 0.00 0.00 0.00 61.98 61.66 1lwu s VAL 192 Cb 0.25 -3.08 0.15 0.00 0.00 0.00 0.00 36.38 33.70 1lwu s VAL 192 CO 0.80 -0.07 1.10 0.52 0.00 0.00 0.00 175.10 177.45