#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 0.00 0.22 -3.83 -0.58 -1.26 -4.03 120.64 111.16 1lwu n GLU 96 Ca 0.00 0.00 0.18 0.00 -0.42 0.00 0.00 57.16 56.92 1lwu n GLU 96 Cb 0.00 0.00 0.85 0.00 -0.57 0.00 0.00 31.44 31.72 1lwu n GLU 96 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1lwu h LEU 97 N 0.00 0.00 -0.50 -4.62 3.38 -2.04 -2.86 115.31 108.68 1lwu h LEU 97 Ca 0.00 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.01 1lwu h LEU 97 Cb 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.69 1lwu h LEU 97 CO 0.00 0.00 -0.29 1.21 0.09 0.00 0.00 178.44 179.45 1lwu n GLU 98 N -3.62 -0.22 0.07 1.13 4.07 -1.26 0.19 120.64 120.99 1lwu n GLU 98 Ca 0.01 1.18 -0.12 0.00 -0.06 0.00 0.00 57.16 58.18 1lwu n GLU 98 Cb 0.34 -1.75 -0.02 0.00 -0.06 0.00 0.00 31.44 29.95 1lwu n GLU 98 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 1lwu h VAL 99 N 0.00 1.41 -0.63 6.31 2.07 -1.64 -0.14 116.25 123.62 1lwu h VAL 99 Ca 0.08 -2.40 0.10 0.00 0.82 0.00 0.00 66.70 65.30 1lwu h VAL 99 Cb 0.20 2.35 -0.08 0.00 -1.52 0.00 0.00 31.29 32.25 1lwu h VAL 99 CO -0.47 0.72 0.24 -0.09 0.02 0.00 0.00 177.57 177.98 1lwu h ARG 100 N 0.22 0.40 0.04 1.57 2.43 -0.98 0.89 114.38 118.95 1lwu h ARG 100 Ca -0.06 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.08 1lwu h ARG 100 Cb 1.51 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.97 1lwu h ARG 100 CO 0.15 0.27 -0.02 -0.92 -1.51 0.00 0.00 179.97 177.94 1lwu h TYR 101 N 0.41 -0.05 0.00 2.20 3.20 0.21 -2.78 116.97 120.16 1lwu h TYR 101 Ca 0.32 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.19 1lwu h TYR 101 Cb 0.41 0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.70 1lwu h TYR 101 CO -0.17 0.46 0.07 0.45 -1.64 0.00 0.00 178.16 177.33 1lwu n SER 102 N -4.86 0.00 -0.10 -2.11 2.88 -0.07 -0.61 113.62 108.74 1lwu n SER 102 Ca -0.09 0.24 -0.18 0.00 -1.33 0.00 0.00 58.87 57.51 1lwu n SER 102 Cb 0.27 -0.24 -0.08 0.00 -0.75 0.00 0.00 64.21 63.41 1lwu n SER 102 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1lwu n GLU 103 N -1.20 0.54 0.00 -1.46 1.02 0.21 -3.54 120.64 116.22 1lwu n GLU 103 Ca 0.00 0.48 0.00 0.00 -0.02 0.00 0.00 57.16 57.62 1lwu n GLU 103 Cb 0.07 -1.66 0.00 0.00 -0.02 0.00 0.00 31.44 29.83 1lwu n GLU 103 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1lwu n VAL 104 N -4.45 0.00 -0.06 2.62 0.31 0.21 -0.51 118.33 116.46 1lwu n VAL 104 Ca -0.29 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 63.91 1lwu n VAL 104 Cb 0.61 -0.66 -0.04 0.00 -0.91 0.00 0.00 33.84 32.83 1lwu n VAL 104 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1lwu n LEU 105 N -0.66 0.89 0.19 7.52 0.00 -1.09 -4.37 117.00 119.48 1lwu n LEU 105 Ca 0.00 0.15 0.04 0.00 0.00 0.00 0.00 56.01 56.20 1lwu n LEU 105 Cb 0.00 -0.36 0.39 0.00 0.00 0.00 0.00 43.42 43.45 1lwu n LEU 105 CO 0.00 0.26 0.74 0.03 0.00 0.00 0.00 177.39 178.42 1lwu h ARG 106 N -0.44 0.00 -1.26 1.96 3.08 -1.35 0.23 114.38 116.60 1lwu h ARG 106 Ca -0.31 0.00 -0.39 0.00 0.07 0.00 0.00 59.98 59.34 1lwu h ARG 106 Cb 1.28 0.00 -0.18 0.00 0.08 0.00 0.00 29.97 31.14 1lwu h ARG 106 CO -0.19 0.35 0.50 -1.91 -1.07 0.00 0.00 179.97 177.66 1lwu n GLU 107 N -3.95 1.97 0.00 0.04 0.00 0.34 -2.75 120.64 116.29 1lwu n GLU 107 Ca -0.02 -1.99 0.00 0.00 0.00 0.00 0.00 57.16 55.15 1lwu n GLU 107 Cb 0.41 -1.78 0.00 0.00 0.00 0.00 0.00 31.44 30.07 1lwu n GLU 107 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.13 177.02 1lwu n LEU 108 N -0.17 0.00 0.03 4.31 7.94 -0.53 -4.62 117.00 123.96 1lwu n LEU 108 Ca 0.39 0.00 0.11 0.00 -1.11 0.00 0.00 56.01 55.40 1lwu n LEU 108 Cb 0.80 0.00 0.01 0.00 0.53 0.00 0.00 43.42 44.76 1lwu n LEU 108 CO 0.46 0.02 -0.04 1.21 -1.11 0.00 0.00 177.39 177.92 1lwu n GLU 109 N 0.00 0.36 -0.13 1.96 2.13 0.71 -3.73 120.64 121.94 1lwu n GLU 109 Ca 0.00 0.00 -0.27 0.00 0.66 0.00 0.00 57.16 57.55 1lwu n GLU 109 Cb 0.02 -1.62 -0.11 0.00 0.27 0.00 0.00 31.44 30.00 1lwu n GLU 109 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1lwu n ARG 110 N -2.08 0.59 0.18 5.31 1.74 -1.12 -3.81 116.66 117.47 1lwu n ARG 110 Ca 0.01 0.34 0.08 0.00 -0.77 0.00 0.00 57.85 57.52 1lwu n ARG 110 Cb 0.46 -1.57 0.45 0.00 -1.02 0.00 0.00 32.46 30.78 1lwu n ARG 110 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1lwu h ARG 111 N -0.91 0.00 0.10 5.56 2.43 -1.82 1.12 114.38 120.86 1lwu h ARG 111 Ca -0.59 0.00 -0.36 0.00 -0.81 0.00 0.00 59.98 58.22 1lwu h ARG 111 Cb 1.56 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 31.09 1lwu h ARG 111 CO -0.33 0.00 -1.98 -0.89 -1.51 0.00 0.00 179.97 175.25 1lwu n ILE 112 N -2.17 1.74 0.15 1.20 2.08 -1.24 -2.13 119.36 118.98 1lwu n ILE 112 Ca -0.01 -0.68 0.00 0.00 0.56 0.00 0.00 62.75 62.62 1lwu n ILE 112 Cb 0.27 -1.60 0.20 0.00 -0.75 0.00 0.00 39.64 37.76 1lwu n ILE 112 CO 0.00 0.00 0.00 0.40 0.56 0.00 0.00 176.55 177.51 1lwu h ILE 113 N 0.06 1.32 0.07 1.39 1.08 0.11 -1.96 117.51 119.57 1lwu h ILE 113 Ca -0.41 -2.00 -0.00 0.00 -0.39 0.00 0.00 64.86 62.05 1lwu h ILE 113 Cb 2.03 2.11 0.00 0.00 -3.07 0.00 0.00 36.82 37.89 1lwu h ILE 113 CO 0.08 0.56 -0.03 -0.74 -0.69 0.00 0.00 178.15 177.32 1lwu h HIS 114 N 0.00 -0.08 0.00 1.37 -0.00 0.83 -2.75 115.15 114.51 1lwu h HIS 114 Ca -0.01 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.36 1lwu h HIS 114 Cb 1.06 0.03 0.00 0.00 -0.00 0.00 0.00 27.41 28.50 1lwu h HIS 114 CO 0.00 0.40 0.00 -0.11 -0.00 0.00 0.00 177.93 178.22 1lwu n LEU 115 N -4.89 0.00 0.10 0.26 7.94 -0.90 -1.00 117.00 118.51 1lwu n LEU 115 Ca -0.09 0.46 -0.23 0.00 -1.11 0.00 0.00 56.01 55.05 1lwu n LEU 115 Cb 0.27 -0.46 -0.14 0.00 0.53 0.00 0.00 43.42 43.62 1lwu n LEU 115 CO 0.32 -0.36 -0.09 -0.61 -1.11 0.00 0.00 177.39 175.54 1lwu h GLN 116 N 0.00 0.51 0.24 1.96 5.75 -1.06 -3.16 115.11 119.34 1lwu h GLN 116 Ca 0.00 -0.78 0.00 0.00 -0.15 0.00 0.00 58.65 57.72 1lwu h GLN 116 Cb 0.10 0.28 -0.03 0.00 1.07 0.00 0.00 27.48 28.89 1lwu h GLN 116 CO 0.00 1.36 -0.46 -0.09 -2.65 0.00 0.00 178.83 176.99 1lwu h ARG 117 N 0.06 -0.72 -0.63 1.69 2.43 -0.92 -1.11 114.38 115.19 1lwu h ARG 117 Ca -0.20 0.05 0.09 0.00 -0.81 0.00 0.00 59.98 59.11 1lwu h ARG 117 Cb 1.92 0.16 -0.11 0.00 -0.42 0.00 0.00 29.97 31.52 1lwu h ARG 117 CO 0.23 -0.48 -0.45 0.00 -1.51 0.00 0.00 179.97 177.76 1lwu h ARG 118 N -0.75 -0.20 0.00 0.20 3.08 -1.67 0.93 114.38 115.98 1lwu h ARG 118 Ca -0.03 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1lwu h ARG 118 Cb 0.70 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.80 1lwu h ARG 118 CO -0.17 -0.13 0.00 -0.89 -1.07 0.00 0.00 179.97 177.70 1lwu n ILE 119 N -5.40 0.00 -0.02 2.04 5.41 -1.03 -0.29 119.36 120.07 1lwu n ILE 119 Ca 0.02 0.00 -0.01 0.00 1.00 0.00 0.00 62.75 63.76 1lwu n ILE 119 Cb 0.35 -0.65 -0.05 0.00 -0.71 0.00 0.00 39.64 38.58 1lwu n ILE 119 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 1lwu n ASN 120 N -0.84 3.61 0.08 4.38 5.15 0.26 -4.39 115.26 123.50 1lwu n ASN 120 Ca 0.06 0.00 -0.22 0.00 -0.60 0.00 0.00 54.58 53.83 1lwu n ASN 120 Cb 0.03 0.78 -0.12 0.00 -0.53 0.00 0.00 39.78 39.94 1lwu n ASN 120 CO 0.00 0.00 0.00 -0.03 1.40 0.00 0.00 177.26 178.63 1lwu h MET 121 N 0.00 0.64 0.00 1.20 4.05 0.20 -2.86 114.93 118.16 1lwu h MET 121 Ca -0.12 -0.81 0.00 0.00 -0.28 0.00 0.00 59.70 58.49 1lwu h MET 121 Cb 1.11 0.26 0.00 0.00 -0.80 0.00 0.00 31.60 32.17 1lwu h MET 121 CO 0.01 1.37 0.00 1.04 0.23 0.00 0.00 176.91 179.55 1lwu n GLN 122 N -3.80 0.16 -0.06 0.39 6.02 0.60 -1.45 117.38 119.25 1lwu n GLN 122 Ca -0.13 0.49 -0.10 0.00 -0.01 0.00 0.00 57.00 57.25 1lwu n GLN 122 Cb 0.97 -1.87 -0.09 0.00 1.02 0.00 0.00 30.24 30.27 1lwu n GLN 122 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1lwu h LEU 123 N 0.00 0.00 -0.59 1.08 3.38 -1.71 -1.70 115.31 115.77 1lwu h LEU 123 Ca 0.00 -0.64 0.07 0.00 0.09 0.00 0.00 57.88 57.40 1lwu h LEU 123 Cb 0.23 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.92 1lwu h LEU 123 CO 0.00 0.85 0.26 1.56 0.09 0.00 0.00 178.44 181.20 1lwu h GLN 124 N -1.00 0.46 0.46 1.13 4.20 -1.32 0.21 115.11 119.24 1lwu h GLN 124 Ca -0.01 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 1lwu h GLN 124 Cb 0.68 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.34 1lwu h GLN 124 CO -0.01 0.30 -0.33 1.96 -0.67 0.00 0.00 178.83 180.09 1lwu h GLN 125 N 0.47 -0.74 0.00 1.46 4.20 -1.35 -1.95 115.11 117.20 1lwu h GLN 125 Ca 0.28 0.05 0.00 0.00 0.06 0.00 0.00 58.65 59.04 1lwu h GLN 125 Cb 0.28 0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.23 1lwu h GLN 125 CO -0.24 -0.49 0.00 -0.07 -0.67 0.00 0.00 178.83 177.35 1lwu h LEU 126 N -0.77 0.00 -0.36 1.46 4.07 -0.68 0.46 115.31 119.50 1lwu h LEU 126 Ca -0.05 0.00 -0.19 0.00 0.08 0.00 0.00 57.88 57.73 1lwu h LEU 126 Cb 0.65 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.38 1lwu h LEU 126 CO 0.02 0.00 -0.81 0.74 -1.08 0.00 0.00 178.44 177.30 1lwu h THR 127 N 0.00 1.46 0.05 0.22 2.02 0.15 -2.71 112.91 114.10 1lwu h THR 127 Ca 0.00 -2.45 -0.00 0.00 0.77 0.00 0.00 66.41 64.73 1lwu h THR 127 Cb 0.11 2.34 0.00 0.00 -1.74 0.00 0.00 68.15 68.86 1lwu h THR 127 CO 0.00 0.72 -0.03 -0.07 0.37 0.00 0.00 175.52 176.51 1lwu h LEU 128 N 0.14 -0.06 -1.23 2.58 3.38 -0.55 -2.96 115.31 116.60 1lwu h LEU 128 Ca -0.04 -0.07 0.09 0.00 0.09 0.00 0.00 57.88 57.95 1lwu h LEU 128 Cb 1.41 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 42.17 1lwu h LEU 128 CO 0.13 0.47 0.73 0.25 0.09 0.00 0.00 178.44 180.10 1lwu h LEU 129 N -1.01 0.00 0.07 1.67 5.85 -1.14 1.15 115.31 121.89 1lwu h LEU 129 Ca -0.01 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.55 1lwu h LEU 129 Cb 0.13 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.18 1lwu h LEU 129 CO 0.01 0.00 -0.66 -0.61 -0.34 0.00 0.00 178.44 176.84 1lwu h GLN 130 N 0.00 0.33 -0.01 1.25 4.15 -1.49 -2.83 115.11 116.51 1lwu h GLN 130 Ca 0.14 -0.44 -0.15 0.00 0.77 0.00 0.00 58.65 58.97 1lwu h GLN 130 Cb 1.61 0.15 -0.02 0.00 0.21 0.00 0.00 27.48 29.43 1lwu h GLN 130 CO -0.00 1.15 -0.70 1.25 -1.93 0.00 0.00 178.83 178.61 1lwu h HIS 131 N -0.28 0.10 -0.41 3.99 2.76 0.13 -1.85 115.15 119.59 1lwu h HIS 131 Ca -0.10 -0.04 -0.09 0.00 -2.20 0.00 0.00 60.37 57.93 1lwu h HIS 131 Cb 1.44 -0.01 -0.01 0.00 1.55 0.00 0.00 27.41 30.37 1lwu h HIS 131 CO 0.18 0.74 -0.11 -0.91 -1.30 0.00 0.00 177.93 176.53 1lwu h ASN 132 N 0.05 0.80 0.42 3.26 -0.26 -0.68 -0.81 115.58 118.36 1lwu h ASN 132 Ca -0.01 -0.37 -0.07 0.00 -0.56 0.00 0.00 56.30 55.30 1lwu h ASN 132 Cb 1.23 -0.22 -0.01 0.00 -1.06 0.00 0.00 38.32 38.26 1lwu h ASN 132 CO 0.10 0.98 -0.31 0.40 -1.06 0.00 0.00 177.43 177.54 1lwu h ILE 133 N 0.61 1.07 -0.24 2.81 2.04 -1.46 0.43 117.51 122.78 1lwu h ILE 133 Ca 0.10 -1.13 -0.09 0.00 1.00 0.00 0.00 64.86 64.74 1lwu h ILE 133 Cb 0.64 1.63 -0.01 0.00 -0.74 0.00 0.00 36.82 38.34 1lwu h ILE 133 CO 0.04 0.31 -0.25 0.50 0.00 0.00 0.00 178.15 178.75 1lwu h LYS 134 N 0.00 0.46 0.12 2.37 3.11 -0.50 0.45 116.57 122.58 1lwu h LYS 134 Ca -0.00 -0.17 -0.28 0.00 -2.81 0.00 0.00 60.65 57.39 1lwu h LYS 134 Cb 0.61 -0.03 -0.00 0.00 -1.00 0.00 0.00 32.23 31.81 1lwu h LYS 134 CO 0.04 0.68 -1.40 1.79 -2.81 0.00 0.00 179.45 177.75 1lwu h THR 135 N 0.40 1.05 -0.46 1.00 1.35 -0.25 -3.15 112.91 112.86 1lwu h THR 135 Ca 0.06 -2.42 0.03 0.00 -0.55 0.00 0.00 66.41 63.53 1lwu h THR 135 Cb 0.66 2.75 -0.03 0.00 -1.73 0.00 0.00 68.15 69.79 1lwu h THR 135 CO 0.05 0.71 0.26 -0.61 -0.25 0.00 0.00 175.52 175.68 1lwu h GLN 136 N -0.28 0.50 -0.13 4.72 4.15 -0.19 0.49 115.11 124.37 1lwu h GLN 136 Ca -0.30 -0.03 0.04 0.00 0.77 0.00 0.00 58.65 59.13 1lwu h GLN 136 Cb 1.78 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 29.35 1lwu h GLN 136 CO 0.07 0.33 0.12 -0.24 -1.93 0.00 0.00 178.83 177.18 1lwu h VAL 137 N 0.51 0.64 0.00 2.39 3.04 -1.03 0.23 116.25 122.03 1lwu h VAL 137 Ca 0.19 0.00 -0.04 0.00 -1.01 0.00 0.00 66.70 65.84 1lwu h VAL 137 Cb 0.04 0.91 -0.01 0.00 -2.01 0.00 0.00 31.29 30.22 1lwu h VAL 137 CO -0.10 0.00 -0.22 -1.28 -1.01 0.00 0.00 177.57 174.96 1lwu h SER 138 N 0.00 0.00 -0.65 3.17 0.87 -0.77 -3.10 113.55 113.07 1lwu h SER 138 Ca 0.06 -0.76 0.09 0.00 -1.23 0.00 0.00 61.79 59.95 1lwu h SER 138 Cb 0.30 0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 62.19 1lwu h SER 138 CO -0.00 1.01 0.28 -0.61 -0.53 0.00 0.00 176.83 176.98 1lwu h GLN 139 N -1.00 0.47 -0.99 2.24 4.15 0.51 -1.28 115.11 119.22 1lwu h GLN 139 Ca -0.06 -0.03 0.02 0.00 0.77 0.00 0.00 58.65 59.35 1lwu h GLN 139 Cb 0.91 -0.11 -0.05 0.00 0.21 0.00 0.00 27.48 28.44 1lwu h GLN 139 CO -0.03 0.31 0.65 0.82 -1.93 0.00 0.00 178.83 178.65 1lwu h ILE 140 N 0.49 1.23 -0.11 2.39 1.08 -0.70 -1.68 117.51 120.20 1lwu h ILE 140 Ca 0.32 -0.45 -0.09 0.00 -0.39 0.00 0.00 64.86 64.25 1lwu h ILE 140 Cb 0.37 -0.20 -0.01 0.00 -3.07 0.00 0.00 36.82 33.91 1lwu h ILE 140 CO -0.29 0.24 -0.33 0.25 -0.69 0.00 0.00 178.15 177.33 1lwu h LEU 141 N 1.32 0.23 0.46 1.44 5.85 -1.19 -0.99 115.31 122.42 1lwu h LEU 141 Ca 0.37 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.99 1lwu h LEU 141 Cb -0.11 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 40.86 1lwu h LEU 141 CO -0.09 0.56 -0.22 -0.09 -0.34 0.00 0.00 178.44 178.25 1lwu h ARG 142 N 0.20 -0.60 -0.95 1.25 2.43 -0.41 -2.46 114.38 113.85 1lwu h ARG 142 Ca 0.03 0.04 0.11 0.00 -0.81 0.00 0.00 59.98 59.35 1lwu h ARG 142 Cb 0.69 0.14 -0.08 0.00 -0.42 0.00 0.00 29.97 30.30 1lwu h ARG 142 CO 0.05 -0.30 0.58 0.28 -1.51 0.00 0.00 179.97 179.07 1lwu h VAL 143 N -0.84 0.92 -0.77 0.20 2.07 -1.32 -0.45 116.25 116.06 1lwu h VAL 143 Ca -0.06 -0.32 0.18 0.00 0.82 0.00 0.00 66.70 67.32 1lwu h VAL 143 Cb 0.57 -0.10 -0.13 0.00 -1.52 0.00 0.00 31.29 30.11 1lwu h VAL 143 CO 0.10 0.17 0.10 -0.08 0.02 0.00 0.00 177.57 177.88 1lwu h GLU 144 N 0.93 0.16 0.12 1.57 4.22 -0.84 0.39 114.58 121.13 1lwu h GLU 144 Ca 0.46 -0.01 -0.28 0.00 0.08 0.00 0.00 59.36 59.62 1lwu h GLU 144 Cb 0.44 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1lwu h GLU 144 CO -0.26 0.11 -1.27 -0.24 -2.18 0.00 0.00 179.01 175.16 1lwu h VAL 145 N 0.16 1.46 -0.29 0.32 3.04 -0.70 -2.56 116.25 117.69 1lwu h VAL 145 Ca 0.44 -3.04 -0.01 0.00 -1.01 0.00 0.00 66.70 63.08 1lwu h VAL 145 Cb 0.80 2.92 -0.01 0.00 -2.01 0.00 0.00 31.29 32.98 1lwu h VAL 145 CO -0.62 0.89 0.14 0.44 -1.01 0.00 0.00 177.57 177.40 1lwu h ASP 146 N 0.07 0.37 -0.67 3.17 3.45 0.23 0.99 116.42 124.03 1lwu h ASP 146 Ca -0.14 -0.12 -0.02 0.00 0.43 0.00 0.00 57.03 57.18 1lwu h ASP 146 Cb 1.97 -0.10 -0.03 0.00 -0.56 0.00 0.00 39.33 40.61 1lwu h ASP 146 CO 0.20 0.39 0.36 0.40 -1.57 0.00 0.00 179.24 179.01 1lwu h ILE 147 N 0.33 1.21 0.09 0.35 2.04 -0.36 0.11 117.51 121.29 1lwu h ILE 147 Ca 0.10 -0.57 0.00 0.00 1.00 0.00 0.00 64.86 65.40 1lwu h ILE 147 Cb 0.11 0.30 -0.01 0.00 -0.74 0.00 0.00 36.82 36.49 1lwu h ILE 147 CO -0.01 0.24 -0.08 -0.78 0.00 0.00 0.00 178.15 177.53 1lwu h ASP 148 N 0.97 -0.20 -0.75 1.72 -0.00 -0.90 0.07 116.42 117.34 1lwu h ASP 148 Ca 0.24 0.02 -0.03 0.00 -0.00 0.00 0.00 57.03 57.26 1lwu h ASP 148 Cb 0.06 0.07 -0.03 0.00 -0.00 0.00 0.00 39.33 39.42 1lwu h ASP 148 CO -0.04 -0.12 0.34 0.58 -0.00 0.00 0.00 179.24 180.00 1lwu h VAL 149 N -0.18 1.25 0.71 2.25 2.07 -0.45 -3.07 116.25 118.83 1lwu h VAL 149 Ca 0.00 -0.72 -0.03 0.00 0.82 0.00 0.00 66.70 66.76 1lwu h VAL 149 Cb 0.16 0.33 0.01 0.00 -1.52 0.00 0.00 31.29 30.28 1lwu h VAL 149 CO -0.01 0.30 -0.34 0.00 0.02 0.00 0.00 177.57 177.53 1lwu h ALA 150 N 1.17 -0.96 -1.00 1.67 0.00 -0.44 -3.17 119.26 116.53 1lwu h ALA 150 Ca 0.25 -0.22 0.27 0.00 0.00 0.00 0.00 54.91 55.22 1lwu h ALA 150 Cb 0.15 0.37 -0.13 0.00 0.00 0.00 0.00 17.79 18.18 1lwu h ALA 150 CO -0.03 -0.90 0.58 -0.07 0.00 0.00 0.00 179.25 178.83 1lwu h LEU 151 N -1.22 0.63 -2.47 0.00 3.38 -1.05 1.24 115.31 115.82 1lwu h LEU 151 Ca -0.10 0.15 0.02 0.00 0.09 0.00 0.00 57.88 58.04 1lwu h LEU 151 Cb 0.75 0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.56 1lwu h LEU 151 CO 0.16 0.03 0.07 -0.09 0.09 0.00 0.00 178.44 178.71 1lwu h ARG 152 N 0.50 0.00 0.00 1.13 2.43 -1.51 0.95 114.38 117.88 1lwu h ARG 152 Ca 0.67 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.80 1lwu h ARG 152 Cb 1.36 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.90 1lwu h ARG 152 CO -0.52 0.00 -0.20 0.00 -1.51 0.00 0.00 179.97 177.75 1lwu h ALA 153 N 1.90 1.50 0.00 2.80 0.00 0.16 -2.90 119.26 122.72 1lwu h ALA 153 Ca 0.02 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1lwu h ALA 153 Cb 0.17 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1lwu h ALA 153 CO -0.00 0.25 -0.22 0.00 0.00 0.00 0.00 179.25 179.28 1lwu h LYS 155 N 0.00 0.55 -0.68 0.00 3.64 -1.61 0.18 116.57 118.66 1lwu h LYS 155 Ca -0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1lwu h LYS 155 Cb 0.80 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.49 1lwu h LYS 155 CO 0.03 0.36 0.00 0.41 -2.27 0.00 0.00 179.45 177.98 1lwu n GLY 156 N -1.33 2.17 0.00 5.01 0.00 -1.15 -4.26 105.19 105.63 1lwu n GLY 156 Ca 0.17 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.62 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 0.51 0.63 -4.46 1.61 2.88 0.44 -5.11 113.62 110.12 1lwu n SER 157 Ca 0.17 -0.03 -0.25 0.00 -1.33 0.00 0.00 58.87 57.43 1lwu n SER 157 Cb 0.76 0.18 -0.11 0.00 -0.75 0.00 0.00 64.21 64.29 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 2.71 -0.51 -3.50 0.00 0.00 -1.92 -3.41 119.26 112.64 1lwu h ALA 159 Ca -0.43 -0.05 -0.66 0.00 0.00 0.00 0.00 54.91 53.76 1lwu h ALA 159 Cb 1.23 0.46 -0.23 0.00 0.00 0.00 0.00 17.79 19.25 1lwu h ALA 159 CO 0.54 -0.84 -0.72 0.50 0.00 0.00 0.00 179.25 178.74 1lwu s ARG 160 N -6.04 3.19 -0.18 0.00 6.06 -1.26 -5.10 118.95 115.62 1lwu s ARG 160 Ca -0.16 -0.61 -0.12 0.00 -2.50 0.00 0.00 55.73 52.34 1lwu s ARG 160 Cb 0.08 -2.67 -0.05 0.00 0.06 0.00 0.00 34.95 32.37 1lwu s ARG 160 CO 0.65 0.39 0.23 -0.47 -2.50 0.00 0.00 175.30 173.60 1lwu s TYR 161 N -0.08 3.43 0.00 5.12 5.04 -1.26 -4.95 117.35 124.65 1lwu s TYR 161 Ca -0.00 0.49 0.00 0.00 -2.44 0.00 0.00 57.07 55.11 1lwu s TYR 161 Cb -0.13 -2.28 0.00 0.00 0.35 0.00 0.00 41.96 39.90 1lwu s TYR 161 CO 0.03 0.24 0.00 -0.11 -1.34 0.00 0.00 175.55 174.38 1lwu n LEU 162 N 3.60 0.00 0.00 6.97 0.00 -1.26 -5.07 117.00 121.25 1lwu n LEU 162 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 56.01 55.88 1lwu n LEU 162 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.94 1lwu n LEU 162 CO 0.39 0.00 0.00 1.21 0.00 0.00 0.00 177.39 178.99 1lwu n GLU 163 N 0.00 0.00 -3.87 1.96 4.07 -1.26 -5.12 120.64 116.42 1lwu n GLU 163 Ca 0.00 0.00 -0.12 0.00 -0.06 0.00 0.00 57.16 56.98 1lwu n GLU 163 Cb 0.00 0.00 -0.14 0.00 -0.06 0.00 0.00 31.44 31.24 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 -1.87 -0.01 0.84 4.31 5.04 -1.26 -5.10 117.35 119.29 1lwu s TYR 164 Ca 0.00 0.01 -0.14 0.00 -2.44 0.00 0.00 57.07 54.50 1lwu s TYR 164 Cb 0.00 0.00 0.19 0.00 0.35 0.00 0.00 41.96 42.51 1lwu s TYR 164 CO 0.00 -0.00 1.07 2.89 -1.34 0.00 0.00 175.55 178.17 1lwu n ARG 165 N 3.08 -1.30 0.00 4.97 1.85 -1.26 -5.10 116.66 118.90 1lwu n ARG 165 Ca -0.12 -1.67 0.00 0.00 -1.00 0.00 0.00 57.85 55.06 1lwu n ARG 165 Cb 0.60 -1.16 0.00 0.00 -1.05 0.00 0.00 32.46 30.85 1lwu n ARG 165 CO 0.00 0.00 0.00 -0.11 -0.01 0.00 0.00 177.63 177.51 1lwu n LEU 166 N 0.00 0.00 0.00 2.89 0.00 -1.26 -5.01 117.00 113.62 1lwu n LEU 166 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.15 1lwu n LEU 166 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.90 1lwu n LEU 166 CO 0.35 0.00 0.00 -0.90 0.00 0.00 0.00 177.39 176.84 1lwu n ASP 167 N 0.00 0.00 -1.77 1.96 5.75 -1.26 -5.17 116.55 116.06 1lwu n ASP 167 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 1lwu n ASP 167 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1lwu n ASP 167 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1lwu n LYS 168 N 0.00 -4.89 -0.00 0.11 4.76 -1.26 -4.96 118.16 111.93 1lwu n LYS 168 Ca 0.00 3.52 0.04 0.00 -2.87 0.00 0.00 58.31 59.00 1lwu n LYS 168 Cb 0.00 -3.83 -0.06 0.00 -1.84 0.00 0.00 35.03 29.30 1lwu n LYS 168 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 1lwu n GLU 169 N 0.81 1.70 0.00 1.97 4.07 -1.26 -4.33 120.64 123.60 1lwu n GLU 169 Ca 0.00 -0.05 0.00 0.00 -0.06 0.00 0.00 57.16 57.05 1lwu n GLU 169 Cb 0.00 -1.09 0.00 0.00 -0.06 0.00 0.00 31.44 30.29 1lwu n GLU 169 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 1lwu n LYS 170 N -1.58 0.00 -0.04 5.31 5.02 -1.26 0.96 118.16 126.57 1lwu n LYS 170 Ca -0.00 0.04 -0.05 0.00 -2.02 0.00 0.00 58.31 56.28 1lwu n LYS 170 Cb 0.19 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.64 1lwu n LYS 170 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1lwu n ASN 171 N -1.02 3.14 -0.11 4.39 3.02 -1.26 -3.67 115.26 119.75 1lwu n ASN 171 Ca 0.00 -0.03 0.15 0.00 -0.03 0.00 0.00 54.58 54.67 1lwu n ASN 171 Cb 0.00 0.27 0.72 0.00 -0.61 0.00 0.00 39.78 40.16 1lwu n ASN 171 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1lwu n LEU 172 N -2.54 0.38 -0.06 3.41 0.00 0.27 -3.10 117.00 115.36 1lwu n LEU 172 Ca -0.15 -0.01 -0.11 0.00 0.00 0.00 0.00 56.01 55.74 1lwu n LEU 172 Cb 0.72 -0.13 -0.04 0.00 0.00 0.00 0.00 43.42 43.98 1lwu n LEU 172 CO 0.13 0.07 -0.69 0.00 0.00 0.00 0.00 177.39 176.90 1lwu n GLN 173 N -0.89 0.38 0.00 1.96 1.13 0.17 -4.28 117.38 115.84 1lwu n GLN 173 Ca 0.18 0.16 0.00 0.00 -1.94 0.00 0.00 57.00 55.39 1lwu n GLN 173 Cb 0.23 -1.15 0.02 0.00 0.11 0.00 0.00 30.24 29.45 1lwu n GLN 173 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1lwu n LEU 174 N -4.06 0.00 -0.09 1.08 4.77 -1.24 -0.80 117.00 116.65 1lwu n LEU 174 Ca -0.19 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.65 1lwu n LEU 174 Cb 0.49 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.50 1lwu n LEU 174 CO 0.10 0.00 -0.41 1.05 -1.33 0.00 0.00 177.39 176.80 1lwu h GLU 175 N 0.00 0.00 0.00 3.23 4.11 -1.75 -3.22 114.58 116.96 1lwu h GLU 175 Ca 0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.41 1lwu h GLU 175 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1lwu h GLU 175 CO 0.00 0.61 -0.12 0.87 0.07 0.00 0.00 179.01 180.44 1lwu h LYS 176 N -1.00 0.00 0.39 1.06 1.57 -1.15 -0.44 116.57 117.00 1lwu h LYS 176 Ca -0.20 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.56 1lwu h LYS 176 Cb 0.97 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.28 1lwu h LYS 176 CO -0.12 0.12 -0.19 0.00 -0.57 0.00 0.00 179.45 178.69 1lwu h ALA 177 N 1.88 -0.52 0.00 3.86 0.00 -1.30 -1.57 119.26 121.61 1lwu h ALA 177 Ca -0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1lwu h ALA 177 Cb 0.53 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1lwu h ALA 177 CO 0.02 -0.55 0.00 0.00 0.00 0.00 0.00 179.25 178.71 1lwu n ALA 178 N -2.62 1.61 0.03 0.00 0.00 -1.15 -2.31 120.51 116.07 1lwu n ALA 178 Ca -0.09 0.07 -0.09 0.00 0.00 0.00 0.00 53.44 53.33 1lwu n ALA 178 Cb 0.27 -1.35 -0.13 0.00 0.00 0.00 0.00 19.45 18.24 1lwu n ALA 178 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1lwu h SER 179 N 0.00 0.07 0.86 0.00 0.87 -0.97 -3.34 113.55 111.04 1lwu h SER 179 Ca 0.00 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 1lwu h SER 179 Cb 0.32 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.26 1lwu h SER 179 CO 0.00 1.08 -0.90 -1.22 -0.53 0.00 0.00 176.83 175.26 1lwu n TYR 180 N -3.25 0.73 -0.53 2.24 0.53 -0.60 -4.16 117.16 112.12 1lwu n TYR 180 Ca -0.10 0.21 -0.05 0.00 -1.02 0.00 0.00 57.90 56.95 1lwu n TYR 180 Cb 1.00 -0.79 -0.06 0.00 -1.03 0.00 0.00 39.34 38.46 1lwu n TYR 180 CO 0.00 0.00 0.00 0.44 -1.02 0.00 0.00 176.86 176.28 1lwu n ILE 181 N -2.40 1.76 1.49 -0.72 -5.35 -0.98 -3.89 119.36 109.28 1lwu n ILE 181 Ca 0.01 -0.72 0.03 0.00 -0.27 0.00 0.00 62.75 61.80 1lwu n ILE 181 Cb 0.50 -1.62 0.09 0.00 -1.74 0.00 0.00 39.64 36.88 1lwu n ILE 181 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1lwu n ALA 182 N 2.19 2.48 0.00 -1.28 0.00 -1.26 -3.75 120.51 118.89 1lwu n ALA 182 Ca 0.16 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1lwu n ALA 182 Cb 0.50 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.96 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 -0.03 0.00 -1.62 0.00 3.02 -1.25 -2.25 115.26 113.12 1lwu n ASN 183 Ca 0.06 0.22 0.00 0.00 -0.03 0.00 0.00 54.58 54.83 1lwu n ASN 183 Cb 0.14 -0.22 0.00 0.00 -0.61 0.00 0.00 39.78 39.09 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 -1.20 3.34 0.00 3.41 4.77 -1.25 -3.08 117.00 123.00 1lwu n LEU 184 Ca 0.00 -1.51 0.00 0.00 -0.03 0.00 0.00 56.01 54.47 1lwu n LEU 184 Cb 0.03 -0.70 0.00 0.00 -2.33 0.00 0.00 43.42 40.42 1lwu n LEU 184 CO 0.00 0.63 -0.49 1.17 -1.33 0.00 0.00 177.39 177.36 1lwu n LYS 185 N 1.59 0.00 -0.78 3.23 4.81 -0.96 -4.41 118.16 121.64 1lwu n LYS 185 Ca 0.00 0.00 -0.24 0.00 -0.87 0.00 0.00 58.31 57.20 1lwu n LYS 185 Cb 0.32 -0.69 -0.08 0.00 0.02 0.00 0.00 35.03 34.60 1lwu n LYS 185 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1lwu n PHE 186 N -2.80 0.37 -4.03 5.64 7.35 -1.18 -4.89 117.46 117.92 1lwu n PHE 186 Ca 0.00 0.25 -0.33 0.00 -0.76 0.00 0.00 57.45 56.60 1lwu n PHE 186 Cb 0.49 -1.27 -0.15 0.00 0.35 0.00 0.00 39.48 38.90 1lwu n PHE 186 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 1lwu s GLU 187 N 4.54 2.60 0.34 -4.13 2.02 -1.26 -5.04 118.70 117.77 1lwu s GLU 187 Ca 0.72 -1.12 -0.29 0.00 0.02 0.00 0.00 54.97 54.31 1lwu s GLU 187 Cb -0.71 -2.87 -0.10 0.00 0.10 0.00 0.00 34.13 30.55 1lwu s GLU 187 CO 0.28 -0.44 1.34 0.50 0.02 0.00 0.00 175.26 176.96 1lwu s ARG 188 N 1.22 4.31 0.16 1.61 6.06 -1.26 -4.92 118.95 126.13 1lwu s ARG 188 Ca -0.03 2.28 0.23 0.00 -2.50 0.00 0.00 55.73 55.71 1lwu s ARG 188 Cb -0.17 -3.05 0.05 0.00 0.06 0.00 0.00 34.95 31.84 1lwu s ARG 188 CO -0.06 -0.25 1.06 1.19 -2.50 0.00 0.00 175.30 174.74 1lwu n PHE 189 N 0.74 0.75 0.48 5.12 3.01 -1.26 -3.89 117.46 122.42 1lwu n PHE 189 Ca 0.00 0.22 -0.05 0.00 1.01 0.00 0.00 57.45 58.63 1lwu n PHE 189 Cb 0.41 -0.81 0.04 0.00 -0.01 0.00 0.00 39.48 39.11 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 -2.46 1.28 -0.10 -1.08 0.28 -1.26 -3.17 120.64 114.12 1lwu n GLU 190 Ca 0.01 -0.67 -0.11 0.00 -0.16 0.00 0.00 57.16 56.23 1lwu n GLU 190 Cb 0.52 -1.26 -0.16 0.00 1.43 0.00 0.00 31.44 31.97 1lwu n GLU 190 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 1lwu n GLU 191 N 0.16 0.69 -2.97 3.44 0.28 -1.25 -4.97 120.64 116.01 1lwu n GLU 191 Ca 0.13 0.01 -0.34 0.00 -0.16 0.00 0.00 57.16 56.80 1lwu n GLU 191 Cb 0.75 -1.52 -0.06 0.00 1.43 0.00 0.00 31.44 32.04 1lwu n GLU 191 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 1lwu s VAL 192 N -2.49 4.50 -2.14 3.84 1.01 -1.19 -5.17 120.40 118.76 1lwu s VAL 192 Ca -0.12 1.31 0.31 0.00 0.00 0.00 0.00 61.98 63.47 1lwu s VAL 192 Cb 0.06 -3.70 0.81 0.00 0.00 0.00 0.00 36.38 33.55 1lwu s VAL 192 CO 0.81 -0.12 2.10 0.52 0.00 0.00 0.00 175.10 178.40