#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sxe n SER 106 N 0.00 -5.05 -3.47 1.61 2.88 -1.26 -4.91 113.62 103.41 1sxe n SER 106 Ca 0.00 1.01 -0.18 0.00 -1.33 0.00 0.00 58.87 58.38 1sxe n SER 106 Cb 0.00 -3.02 0.08 0.00 -0.75 0.00 0.00 64.21 60.52 1sxe n SER 106 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1sxe n HIS 107 N -3.03 -2.15 -4.01 0.66 8.25 -1.26 -4.99 115.22 108.69 1sxe n HIS 107 Ca -0.04 0.92 -0.01 0.00 -0.26 0.00 0.00 57.72 58.34 1sxe n HIS 107 Cb 0.39 -4.97 -0.00 0.00 1.12 0.00 0.00 29.99 26.53 1sxe n HIS 107 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1sxe n MET 108 N -4.15 0.02 0.05 -0.41 2.00 -1.26 -5.08 117.12 108.29 1sxe n MET 108 Ca -0.29 -0.13 -0.10 0.00 0.00 0.00 0.00 57.70 57.17 1sxe n MET 108 Cb 0.67 0.11 -0.07 0.00 0.00 0.00 0.00 33.22 33.93 1sxe n MET 108 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 1sxe h GLU 109 N 0.00 -0.20 -5.98 0.03 3.07 -2.04 -3.48 114.58 105.98 1sxe h GLU 109 Ca -0.01 0.01 -0.32 0.00 -0.50 0.00 0.00 59.36 58.54 1sxe h GLU 109 Cb 0.05 0.04 0.08 0.00 -0.84 0.00 0.00 28.75 28.08 1sxe h GLU 109 CO 0.01 0.23 -0.76 -1.91 -1.40 0.00 0.00 179.01 175.19 1sxe n GLU 110 N -4.91 -1.46 -4.63 2.33 2.13 -1.26 -5.01 120.64 107.84 1sxe n GLU 110 Ca -0.07 0.77 -0.26 0.00 0.66 0.00 0.00 57.16 58.26 1sxe n GLU 110 Cb 0.26 -4.53 -0.14 0.00 0.27 0.00 0.00 31.44 27.30 1sxe n GLU 110 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1sxe s LYS 111 N -4.98 1.42 0.00 5.31 2.20 -1.26 -4.69 119.74 117.74 1sxe s LYS 111 Ca 0.32 -1.01 0.00 0.00 -0.36 0.00 0.00 55.97 54.93 1sxe s LYS 111 Cb -0.10 -1.57 0.00 0.00 -1.51 0.00 0.00 37.83 34.65 1sxe s LYS 111 CO 0.82 0.40 0.00 0.72 -0.36 0.00 0.00 175.35 176.93 1sxe n HIS 112 N 1.71 0.00 -1.91 4.03 8.25 -1.26 -4.94 115.22 121.10 1sxe n HIS 112 Ca -0.17 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.86 1sxe n HIS 112 Cb 0.53 -0.10 -0.03 0.00 1.12 0.00 0.00 29.99 31.51 1sxe n HIS 112 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1sxe s MET 113 N 0.00 4.08 0.17 -0.41 -1.94 -1.26 -4.95 119.30 114.99 1sxe s MET 113 Ca 0.00 2.23 -0.31 0.00 -1.71 0.00 0.00 55.69 55.90 1sxe s MET 113 Cb 0.00 -4.06 -0.10 0.00 2.01 0.00 0.00 34.83 32.69 1sxe s MET 113 CO 0.00 -0.98 1.50 -2.14 -0.01 0.00 0.00 175.02 173.39 1sxe s PRO 114 N 4.33 4.25 0.27 2.03 0.02 -1.26 -4.96 135.00 139.67 1sxe s PRO 114 Ca 0.78 2.29 -0.28 0.00 0.02 0.00 0.00 61.00 63.81 1sxe s PRO 114 Cb -0.35 -3.16 -0.15 0.00 0.02 0.00 0.00 34.50 30.86 1sxe s PRO 114 CO 0.33 -0.53 0.95 -0.35 -0.33 0.00 0.00 177.00 177.07 1sxe n PRO 115 N 3.62 1.13 -0.78 5.54 -0.04 -1.26 -4.55 135.00 138.66 1sxe n PRO 115 Ca 0.12 0.40 -0.33 0.00 -0.04 0.00 0.00 63.50 63.65 1sxe n PRO 115 Cb 0.40 -1.72 -0.08 0.00 -0.04 0.00 0.00 33.50 32.06 1sxe n PRO 115 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 1sxe n PRO 116 N 0.85 0.00 0.00 0.54 -0.02 -1.26 -4.77 135.00 130.34 1sxe n PRO 116 Ca 0.11 0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.61 1sxe n PRO 116 Cb 0.30 -0.89 0.10 0.00 -0.02 0.00 0.00 33.50 32.99 1sxe n PRO 116 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1sxe n ASN 117 N 4.91 0.00 -3.61 2.55 3.02 -1.26 -4.86 115.26 116.02 1sxe n ASN 117 Ca 0.34 -1.68 -0.00 0.00 -0.03 0.00 0.00 54.58 53.21 1sxe n ASN 117 Cb -0.01 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.17 1sxe n ASN 117 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1sxe s MET 118 N -2.00 0.80 -0.03 3.52 0.23 -1.26 -4.90 119.30 115.67 1sxe s MET 118 Ca 0.05 -0.50 0.04 0.00 -1.03 0.00 0.00 55.69 54.25 1sxe s MET 118 Cb 0.02 0.24 0.06 0.00 -1.53 0.00 0.00 34.83 33.62 1sxe s MET 118 CO 0.04 -0.37 1.00 -2.37 -2.03 0.00 0.00 175.02 171.29 1sxe n THR 119 N -0.70 0.42 -2.73 3.16 5.66 -1.26 -5.01 114.28 113.82 1sxe n THR 119 Ca -0.02 -0.51 -0.21 0.00 -3.05 0.00 0.00 64.05 60.26 1sxe n THR 119 Cb 0.60 0.37 0.06 0.00 -1.55 0.00 0.00 70.33 69.80 1sxe n THR 119 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 1sxe s THR 120 N -0.64 2.49 0.00 1.09 2.01 -1.26 -4.76 115.64 114.57 1sxe s THR 120 Ca 0.07 -0.74 0.00 0.00 0.31 0.00 0.00 61.69 61.33 1sxe s THR 120 Cb 0.06 -2.75 0.00 0.00 0.01 0.00 0.00 72.50 69.82 1sxe s THR 120 CO 0.01 0.00 0.00 -3.20 -0.69 0.00 0.00 174.62 170.74 1sxe n ASN 121 N -2.40 0.00 -1.29 3.53 5.15 -1.19 -3.00 115.26 116.07 1sxe n ASN 121 Ca 0.11 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.09 1sxe n ASN 121 Cb 0.60 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.85 1sxe n ASN 121 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 1sxe n GLU 122 N 0.00 -3.69 -1.74 1.20 2.13 -1.26 -4.74 120.64 112.54 1sxe n GLU 122 Ca 0.00 2.76 -0.20 0.00 0.66 0.00 0.00 57.16 60.38 1sxe n GLU 122 Cb 0.00 -3.14 -0.07 0.00 0.27 0.00 0.00 31.44 28.51 1sxe n GLU 122 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1sxe n ARG 123 N -1.06 -1.50 0.00 5.31 1.74 -1.26 -4.61 116.66 115.28 1sxe n ARG 123 Ca 0.00 1.13 0.00 0.00 -0.77 0.00 0.00 57.85 58.21 1sxe n ARG 123 Cb 0.04 -5.55 0.00 0.00 -1.02 0.00 0.00 32.46 25.92 1sxe n ARG 123 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1sxe n ARG 124 N -2.45 0.00 0.00 5.56 1.74 -1.26 -4.98 116.66 115.28 1sxe n ARG 124 Ca -0.21 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.87 1sxe n ARG 124 Cb 0.66 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.10 1sxe n ARG 124 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1sxe n VAL 125 N -1.67 0.00 -3.15 1.55 0.31 -1.26 -5.06 118.33 109.05 1sxe n VAL 125 Ca 0.00 -0.13 -0.09 0.00 -0.01 0.00 0.00 64.34 64.10 1sxe n VAL 125 Cb 0.00 0.60 0.01 0.00 -0.91 0.00 0.00 33.84 33.54 1sxe n VAL 125 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1sxe n ILE 126 N -1.08 -8.88 -3.76 2.52 -0.00 -1.26 -4.91 119.36 101.98 1sxe n ILE 126 Ca 0.00 0.14 -0.10 0.00 -0.00 0.00 0.00 62.75 62.79 1sxe n ILE 126 Cb 0.00 -6.15 -0.05 0.00 -0.00 0.00 0.00 39.64 33.44 1sxe n ILE 126 CO 0.00 0.00 0.00 0.68 -0.00 0.00 0.00 176.55 177.23 1sxe s VAL 127 N -2.76 0.06 0.17 1.39 -7.23 -1.16 -4.85 120.40 106.02 1sxe s VAL 127 Ca 0.10 -0.87 -0.31 0.00 -1.81 0.00 0.00 61.98 59.10 1sxe s VAL 127 Cb -0.02 -1.49 -0.09 0.00 0.56 0.00 0.00 36.38 35.34 1sxe s VAL 127 CO 0.79 -0.25 1.42 -2.16 -0.31 0.00 0.00 175.10 174.59 1sxe s PRO 128 N -3.87 4.30 0.00 4.82 0.04 -1.26 -3.14 135.00 135.89 1sxe s PRO 128 Ca 0.09 2.18 0.00 0.00 0.04 0.00 0.00 61.00 63.30 1sxe s PRO 128 Cb 0.01 -3.19 0.00 0.00 0.04 0.00 0.00 34.50 31.37 1sxe s PRO 128 CO -0.06 -0.43 0.04 0.00 0.04 0.00 0.00 177.00 176.60 1sxe n ALA 129 N 3.31 1.31 -3.67 8.56 0.00 -1.26 -3.93 120.51 124.84 1sxe n ALA 129 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.25 1sxe n ALA 129 Cb 0.41 -1.00 -0.15 0.00 0.00 0.00 0.00 19.45 18.71 1sxe n ALA 129 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1sxe s ASP 130 N -0.02 3.71 0.00 0.00 -1.08 -1.26 -3.36 116.67 114.65 1sxe s ASP 130 Ca 0.00 -1.41 0.00 0.00 -0.52 0.00 0.00 52.55 50.62 1sxe s ASP 130 Cb 0.00 -0.65 0.00 0.00 -1.46 0.00 0.00 42.92 40.81 1sxe s ASP 130 CO 0.00 -0.41 0.08 -2.65 0.52 0.00 0.00 175.17 172.71 1sxe n PRO 131 N 5.01 0.09 -0.11 4.34 -0.02 -1.25 -2.28 135.00 140.78 1sxe n PRO 131 Ca -0.04 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.30 1sxe n PRO 131 Cb 0.43 -1.36 -0.14 0.00 -0.02 0.00 0.00 33.50 32.41 1sxe n PRO 131 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1sxe n THR 132 N 0.84 1.45 0.18 3.45 -2.24 -1.26 -4.00 114.28 112.70 1sxe n THR 132 Ca 0.00 -0.72 0.12 0.00 -2.27 0.00 0.00 64.05 61.18 1sxe n THR 132 Cb 0.04 -0.95 0.24 0.00 -2.10 0.00 0.00 70.33 67.55 1sxe n THR 132 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1sxe n LEU 133 N -3.01 3.58 -4.68 3.22 4.77 -0.96 -0.37 117.00 119.55 1sxe n LEU 133 Ca -0.39 -1.60 -0.47 0.00 -0.03 0.00 0.00 56.01 53.53 1sxe n LEU 133 Cb 1.08 -0.30 -0.04 0.00 -2.33 0.00 0.00 43.42 41.83 1sxe n LEU 133 CO 0.35 0.79 1.52 0.79 -1.33 0.00 0.00 177.39 179.52 1sxe n TRP 134 N 1.54 2.37 -1.14 -1.77 7.02 -1.26 -4.82 117.44 119.38 1sxe n TRP 134 Ca 0.20 -0.09 -0.30 0.00 -1.02 0.00 0.00 57.50 56.29 1sxe n TRP 134 Cb 0.61 -2.70 0.12 0.00 -2.42 0.00 0.00 31.31 26.93 1sxe n TRP 134 CO 0.00 0.00 0.00 -1.12 -2.02 0.00 0.00 177.69 174.55 1sxe s SER 135 N 4.21 3.81 0.17 -0.99 0.01 -1.26 0.71 113.70 120.37 1sxe s SER 135 Ca 0.92 1.74 -0.11 0.00 1.31 0.00 0.00 55.95 59.81 1sxe s SER 135 Cb -0.63 -2.39 0.20 0.00 0.21 0.00 0.00 66.02 63.41 1sxe s SER 135 CO 0.50 -2.46 1.10 0.35 0.41 0.00 0.00 173.24 173.14 1sxe n THR 136 N -3.79 -0.36 0.09 1.44 -2.24 -1.26 -0.37 114.28 107.79 1sxe n THR 136 Ca 0.08 1.65 -0.14 0.00 -2.27 0.00 0.00 64.05 63.38 1sxe n THR 136 Cb 0.54 -2.21 -0.11 0.00 -2.10 0.00 0.00 70.33 66.45 1sxe n THR 136 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 1sxe h ASP 137 N 0.00 0.37 0.59 3.42 3.58 -1.87 -3.08 116.42 119.42 1sxe h ASP 137 Ca 0.27 -0.37 0.00 0.00 0.42 0.00 0.00 57.03 57.34 1sxe h ASP 137 Cb 0.44 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 41.38 1sxe h ASP 137 CO -0.71 1.26 0.00 1.41 -2.88 0.00 0.00 179.24 178.32 1sxe n HIS 138 N -3.55 0.64 0.00 0.28 8.25 0.49 -0.53 115.22 120.80 1sxe n HIS 138 Ca -0.07 0.26 -0.22 0.00 -0.26 0.00 0.00 57.72 57.44 1sxe n HIS 138 Cb 0.97 -0.92 -0.14 0.00 1.12 0.00 0.00 29.99 31.02 1sxe n HIS 138 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1sxe h VAL 139 N 0.00 0.85 0.00 1.59 2.07 -0.62 -3.06 116.25 117.07 1sxe h VAL 139 Ca 0.00 -2.36 -0.06 0.00 0.82 0.00 0.00 66.70 65.10 1sxe h VAL 139 Cb 0.29 2.58 -0.01 0.00 -1.52 0.00 0.00 31.29 32.63 1sxe h VAL 139 CO 0.00 0.75 -0.28 -0.09 0.02 0.00 0.00 177.57 177.97 1sxe h ARG 140 N -0.19 0.00 0.52 1.57 1.12 -1.46 0.16 114.38 116.10 1sxe h ARG 140 Ca -0.36 0.00 -0.03 0.00 -1.11 0.00 0.00 59.98 58.48 1sxe h ARG 140 Cb 1.86 0.00 0.01 0.00 -0.01 0.00 0.00 29.97 31.82 1sxe h ARG 140 CO 0.05 0.28 -0.25 0.37 -3.11 0.00 0.00 179.97 177.32 1sxe h GLN 141 N 0.00 -0.68 0.21 0.20 4.15 -0.84 0.69 115.11 118.85 1sxe h GLN 141 Ca -0.00 0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.47 1sxe h GLN 141 Cb 0.57 0.15 -0.02 0.00 0.21 0.00 0.00 27.48 28.39 1sxe h GLN 141 CO 0.04 -0.45 -0.20 2.35 -1.93 0.00 0.00 178.83 178.63 1sxe h TRP 142 N -0.76 -0.53 -0.97 3.99 7.01 -1.43 0.15 115.95 123.41 1sxe h TRP 142 Ca -0.07 0.00 0.30 0.00 2.11 0.00 0.00 58.89 61.23 1sxe h TRP 142 Cb 0.54 0.21 -0.15 0.00 -2.10 0.00 0.00 29.16 27.65 1sxe h TRP 142 CO 0.09 -0.30 0.44 1.25 -2.79 0.00 0.00 178.44 177.13 1sxe h LEU 143 N -0.44 0.30 0.07 0.65 5.85 -0.71 1.53 115.31 122.56 1sxe h LEU 143 Ca -0.00 0.20 -0.00 0.00 0.84 0.00 0.00 57.88 58.92 1sxe h LEU 143 Cb 0.41 0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.65 1sxe h LEU 143 CO -0.04 -0.18 -0.03 -0.33 -0.34 0.00 0.00 178.44 177.51 1sxe h GLU 144 N 0.25 -0.09 0.00 1.25 5.08 -0.51 -2.58 114.58 117.97 1sxe h GLU 144 Ca 0.69 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 59.05 1sxe h GLU 144 Cb 1.54 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.81 1sxe h GLU 144 CO -0.65 0.48 0.09 1.87 -1.00 0.00 0.00 179.01 179.80 1sxe n TRP 145 N -4.81 0.00 -0.10 4.33 -0.00 0.48 -0.62 117.44 116.72 1sxe n TRP 145 Ca -0.08 0.00 -0.19 0.00 -0.00 0.00 0.00 57.50 57.23 1sxe n TRP 145 Cb 0.30 -0.36 -0.09 0.00 -0.00 0.00 0.00 31.31 31.17 1sxe n TRP 145 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1sxe n ALA 146 N -1.35 0.80 -0.30 5.87 0.00 0.50 -1.50 120.51 124.54 1sxe n ALA 146 Ca 0.00 -0.61 0.17 0.00 0.00 0.00 0.00 53.44 53.00 1sxe n ALA 146 Cb 0.09 -0.27 0.44 0.00 0.00 0.00 0.00 19.45 19.71 1sxe n ALA 146 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1sxe h VAL 147 N -1.00 0.67 -0.22 0.00 2.07 -0.98 0.29 116.25 117.07 1sxe h VAL 147 Ca -0.32 -0.18 -0.07 0.00 0.82 0.00 0.00 66.70 66.94 1sxe h VAL 147 Cb 1.18 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 1sxe h VAL 147 CO -0.20 0.10 -0.13 0.11 0.02 0.00 0.00 177.57 177.48 1sxe h LYS 148 N 0.54 0.48 0.00 1.57 1.79 -0.92 -2.61 116.57 117.43 1sxe h LYS 148 Ca 0.53 -0.22 -0.23 0.00 -2.18 0.00 0.00 60.65 58.55 1sxe h LYS 148 Cb 1.12 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 31.72 1sxe h LYS 148 CO -0.26 0.77 -1.16 1.49 -1.08 0.00 0.00 179.45 179.20 1sxe h GLU 149 N 0.19 0.00 -0.02 3.15 4.57 -0.46 -3.38 114.58 118.64 1sxe h GLU 149 Ca 0.05 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 1sxe h GLU 149 Cb 0.63 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.23 1sxe h GLU 149 CO 0.04 0.89 -0.21 0.66 -1.18 0.00 0.00 179.01 179.20 1sxe n TYR 150 N -3.28 0.00 -2.51 0.92 4.01 0.93 -4.97 117.16 112.26 1sxe n TYR 150 Ca -0.04 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.64 1sxe n TYR 150 Cb 0.97 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 40.03 1sxe n TYR 150 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1sxe n GLY 151 N 1.11 0.17 3.54 2.72 0.00 -1.01 -5.00 105.19 106.72 1sxe n GLY 151 Ca 0.08 -0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.41 1sxe n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1sxe s LEU 152 N -3.51 4.49 -0.16 0.99 1.43 -1.03 -4.96 118.68 115.93 1sxe s LEU 152 Ca 0.01 -0.27 -0.22 0.00 -1.03 0.00 0.00 54.13 52.62 1sxe s LEU 152 Cb -0.00 -2.39 -0.23 0.00 0.03 0.00 0.00 46.19 43.60 1sxe s LEU 152 CO 0.25 -0.40 0.44 1.55 0.23 0.00 0.00 176.35 178.43 1sxe h PRO 153 N 8.50 0.07 -0.64 1.29 0.14 -1.94 -3.39 132.00 136.03 1sxe h PRO 153 Ca -0.29 -0.11 0.00 0.00 0.14 0.00 0.00 66.00 65.74 1sxe h PRO 153 Cb 1.13 0.04 0.00 0.00 0.14 0.00 0.00 31.00 32.32 1sxe h PRO 153 CO 0.72 1.05 0.00 -3.47 0.14 0.00 0.00 178.00 176.45 1sxe n ASP 154 N -4.33 3.73 -4.65 1.44 2.03 -1.26 -4.88 116.55 108.64 1sxe n ASP 154 Ca -0.25 -2.41 -0.43 0.00 0.52 0.00 0.00 54.79 52.23 1sxe n ASP 154 Cb 0.69 -0.53 -0.03 0.00 -0.72 0.00 0.00 41.12 40.54 1sxe n ASP 154 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1sxe s VAL 155 N -1.89 4.71 -1.13 5.18 1.01 -1.26 -4.73 120.40 122.29 1sxe s VAL 155 Ca 0.37 1.80 -0.12 0.00 0.00 0.00 0.00 61.98 64.02 1sxe s VAL 155 Cb 0.25 -4.26 0.21 0.00 0.00 0.00 0.00 36.38 32.59 1sxe s VAL 155 CO 0.16 -0.19 1.25 0.21 0.00 0.00 0.00 175.10 176.52 1sxe s ASN 156 N 1.33 7.13 0.28 3.32 3.04 -1.26 -4.85 114.94 123.93 1sxe s ASN 156 Ca 0.41 -3.17 0.05 0.00 0.04 0.00 0.00 52.86 50.20 1sxe s ASN 156 Cb -0.15 -2.31 0.40 0.00 -1.54 0.00 0.00 41.25 37.65 1sxe s ASN 156 CO 0.08 -0.57 1.67 0.16 -3.04 0.00 0.00 177.10 175.40 1sxe h ILE 157 N 4.34 1.32 0.00 -5.21 3.07 -1.93 -2.87 117.51 116.23 1sxe h ILE 157 Ca 0.24 -1.60 0.00 0.00 1.55 0.00 0.00 64.86 65.05 1sxe h ILE 157 Cb 0.89 1.72 0.00 0.00 -0.27 0.00 0.00 36.82 39.17 1sxe h ILE 157 CO 1.12 0.48 0.00 0.00 -1.05 0.00 0.00 178.15 178.70 1sxe n LEU 158 N -4.00 0.00 0.00 0.16 -0.00 -1.26 -0.90 117.00 111.00 1sxe n LEU 158 Ca -0.02 0.00 0.11 0.00 -0.00 0.00 0.00 56.01 56.10 1sxe n LEU 158 Cb 0.50 0.00 -0.15 0.00 -0.00 0.00 0.00 43.42 43.78 1sxe n LEU 158 CO 0.42 0.00 -0.63 0.18 -0.00 0.00 0.00 177.39 177.36 1sxe n LEU 159 N -0.58 0.14 -0.04 1.47 4.32 -1.08 -4.25 117.00 116.97 1sxe n LEU 159 Ca 0.01 0.01 0.11 0.00 -0.02 0.00 0.00 56.01 56.12 1sxe n LEU 159 Cb 0.00 -0.01 0.03 0.00 -1.62 0.00 0.00 43.42 41.83 1sxe n LEU 159 CO 0.01 -0.01 0.17 0.49 -1.22 0.00 0.00 177.39 176.83 1sxe n PHE 160 N -2.26 0.00 -0.49 -1.77 3.01 -0.08 -4.43 117.46 111.45 1sxe n PHE 160 Ca -0.03 0.00 0.42 0.00 1.01 0.00 0.00 57.45 58.85 1sxe n PHE 160 Cb 0.55 -0.09 0.77 0.00 -0.01 0.00 0.00 39.48 40.71 1sxe n PHE 160 CO 0.00 0.00 0.00 1.96 1.01 0.00 0.00 176.76 179.73 1sxe h GLN 161 N 0.19 0.01 -0.25 -1.08 4.20 -1.74 0.65 115.11 117.11 1sxe h GLN 161 Ca 0.00 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1sxe h GLN 161 Cb 0.52 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.29 1sxe h GLN 161 CO 0.00 0.01 0.00 0.09 -0.67 0.00 0.00 178.83 178.26 1sxe n ASN 162 N -4.12 3.23 -4.70 1.46 5.03 -1.26 -4.66 115.26 110.24 1sxe n ASN 162 Ca 0.34 -1.97 -0.36 0.00 0.87 0.00 0.00 54.58 53.46 1sxe n ASN 162 Cb 1.56 -0.15 -0.09 0.00 -1.02 0.00 0.00 39.78 40.08 1sxe n ASN 162 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1sxe s ILE 163 N -1.62 5.39 0.76 2.41 1.01 0.23 -4.99 121.20 124.38 1sxe s ILE 163 Ca 0.33 0.19 -0.07 0.00 0.00 0.00 0.00 60.65 61.09 1sxe s ILE 163 Cb 0.21 -3.48 0.10 0.00 0.01 0.00 0.00 42.46 39.30 1sxe s ILE 163 CO 0.30 0.40 1.07 -1.81 0.00 0.00 0.00 174.94 174.90 1sxe s ASP 164 N 0.67 4.39 0.51 3.58 1.11 -1.26 -4.35 116.67 121.32 1sxe s ASP 164 Ca 0.08 0.28 0.23 0.00 0.18 0.00 0.00 52.55 53.31 1sxe s ASP 164 Cb -0.12 -0.76 1.35 0.00 1.07 0.00 0.00 42.92 44.46 1sxe s ASP 164 CO 0.01 -1.87 2.08 1.23 1.18 0.00 0.00 175.17 177.80 1sxe h GLY 165 N -0.80 0.00 2.00 0.21 0.00 0.18 -1.17 103.07 103.50 1sxe h GLY 165 Ca -0.43 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 46.87 1sxe h GLY 165 CO 0.52 0.00 -0.14 0.07 0.00 0.00 0.00 176.54 176.99 1sxe h LYS 166 N 0.00 0.00 0.00 4.80 2.10 -0.90 0.16 116.57 122.74 1sxe h LYS 166 Ca -0.00 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1sxe h LYS 166 Cb 0.26 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.59 1sxe h LYS 166 CO 0.02 0.14 -0.61 0.39 -2.00 0.00 0.00 179.45 177.39 1sxe n GLU 167 N -3.54 0.47 -0.25 0.07 -0.58 -0.68 -3.93 120.64 112.19 1sxe n GLU 167 Ca -0.01 0.47 0.15 0.00 -0.42 0.00 0.00 57.16 57.35 1sxe n GLU 167 Cb 0.28 -1.65 0.44 0.00 -0.57 0.00 0.00 31.44 29.95 1sxe n GLU 167 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1sxe h LEU 168 N -1.00 0.54 -0.00 -4.62 5.85 -1.18 0.20 115.31 115.09 1sxe h LEU 168 Ca -0.00 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1sxe h LEU 168 Cb 0.61 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.57 1sxe h LEU 168 CO -0.00 0.25 -0.03 0.00 -0.34 0.00 0.00 178.44 178.32 1sxe n LYS 170 N -1.47 2.04 -3.53 0.00 5.02 0.67 -4.97 118.16 115.92 1sxe n LYS 170 Ca 0.08 -3.14 -0.34 0.00 -2.02 0.00 0.00 58.31 52.89 1sxe n LYS 170 Cb 0.33 -1.98 -0.05 0.00 -0.02 0.00 0.00 35.03 33.30 1sxe n LYS 170 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1sxe s MET 171 N -3.30 3.79 0.42 1.97 -1.94 -0.96 -5.00 119.30 114.29 1sxe s MET 171 Ca 0.50 0.21 0.08 0.00 -1.71 0.00 0.00 55.69 54.77 1sxe s MET 171 Cb 0.44 -2.93 0.01 0.00 2.01 0.00 0.00 34.83 34.36 1sxe s MET 171 CO 0.04 0.51 0.54 0.95 -0.01 0.00 0.00 175.02 177.05 1sxe s THR 172 N -1.49 2.92 -1.76 2.05 -4.23 -1.26 -4.97 115.64 106.90 1sxe s THR 172 Ca 0.36 -1.06 0.10 0.00 -1.18 0.00 0.00 61.69 59.92 1sxe s THR 172 Cb -0.14 -2.98 0.24 0.00 1.34 0.00 0.00 72.50 70.97 1sxe s THR 172 CO 0.19 0.00 1.12 1.17 -0.54 0.00 0.00 174.62 176.56 1sxe n LYS 173 N -1.81 0.25 -0.06 3.99 4.81 -1.26 -1.63 118.16 122.45 1sxe n LYS 173 Ca 0.07 0.08 -0.10 0.00 -0.87 0.00 0.00 58.31 57.49 1sxe n LYS 173 Cb 0.60 -1.50 -0.15 0.00 0.02 0.00 0.00 35.03 34.00 1sxe n LYS 173 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1sxe n ASP 174 N -1.12 0.63 0.09 3.14 -0.08 -1.26 -3.30 116.55 114.65 1sxe n ASP 174 Ca 0.06 0.20 -0.02 0.00 -1.51 0.00 0.00 54.79 53.52 1sxe n ASP 174 Cb 0.05 0.33 0.22 0.00 2.34 0.00 0.00 41.12 44.06 1sxe n ASP 174 CO 0.00 0.00 0.00 0.44 0.12 0.00 0.00 177.20 177.76 1sxe h ASP 175 N 0.00 0.25 1.33 1.67 3.32 -1.69 -2.18 116.42 119.12 1sxe h ASP 175 Ca -0.42 -0.11 -0.07 0.00 0.02 0.00 0.00 57.03 56.45 1sxe h ASP 175 Cb 2.11 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 41.58 1sxe h ASP 175 CO 0.05 0.64 -0.33 -0.26 -1.72 0.00 0.00 179.24 177.63 1sxe h PHE 176 N 0.20 0.00 0.00 4.55 -1.00 -1.64 -3.22 116.94 115.83 1sxe h PHE 176 Ca 0.02 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.80 1sxe h PHE 176 Cb 0.82 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.38 1sxe h PHE 176 CO 0.01 0.33 0.00 1.04 -1.61 0.00 0.00 178.31 178.08 1sxe n GLN 177 N -3.28 0.08 0.00 1.51 6.02 -0.82 0.10 117.38 120.99 1sxe n GLN 177 Ca 0.01 0.18 0.11 0.00 -0.01 0.00 0.00 57.00 57.30 1sxe n GLN 177 Cb 0.59 -1.50 -0.00 0.00 1.02 0.00 0.00 30.24 30.35 1sxe n GLN 177 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 177.06 178.94 1sxe n ARG 178 N -1.43 1.02 0.00 -1.09 1.85 -1.22 -4.22 116.66 111.57 1sxe n ARG 178 Ca 0.05 -0.84 0.00 0.00 -1.00 0.00 0.00 57.85 56.07 1sxe n ARG 178 Cb 0.18 -1.48 0.00 0.00 -1.05 0.00 0.00 32.46 30.11 1sxe n ARG 178 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1sxe n LEU 179 N -0.26 0.00 -3.15 2.89 4.77 -0.55 -5.01 117.00 115.69 1sxe n LEU 179 Ca 0.09 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 56.11 1sxe n LEU 179 Cb 0.44 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.53 1sxe n LEU 179 CO 0.30 0.00 0.16 -0.89 -1.33 0.00 0.00 177.39 175.63 1sxe s THR 180 N -1.76 -0.93 1.33 -5.08 2.01 0.29 -4.07 115.64 107.43 1sxe s THR 180 Ca 0.00 0.00 -0.19 0.00 0.31 0.00 0.00 61.69 61.81 1sxe s THR 180 Cb 0.00 -0.94 0.33 0.00 0.01 0.00 0.00 72.50 71.90 1sxe s THR 180 CO 0.00 0.00 0.86 -2.65 -0.69 0.00 0.00 174.62 172.14 1sxe n PRO 181 N 5.40 -3.70 -1.54 4.92 -0.02 -1.25 -3.85 135.00 134.95 1sxe n PRO 181 Ca 0.04 -1.08 -0.37 0.00 -2.02 0.00 0.00 63.50 60.06 1sxe n PRO 181 Cb 0.54 -1.98 -0.05 0.00 -0.02 0.00 0.00 33.50 31.99 1sxe n PRO 181 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1sxe n SER 182 N -5.06 2.10 0.00 2.55 7.64 -1.26 -3.09 113.62 116.50 1sxe n SER 182 Ca 0.08 -0.36 0.00 0.00 1.01 0.00 0.00 58.87 59.60 1sxe n SER 182 Cb 0.57 -1.49 0.00 0.00 -1.01 0.00 0.00 64.21 62.27 1sxe n SER 182 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1sxe n TYR 183 N 14.87 0.00 0.01 1.43 9.36 -1.26 -4.90 117.16 136.67 1sxe n TYR 183 Ca 0.41 0.00 0.02 0.00 3.32 0.00 0.00 57.90 61.65 1sxe n TYR 183 Cb 0.47 0.00 -0.10 0.00 -0.63 0.00 0.00 39.34 39.07 1sxe n TYR 183 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 1sxe n ASN 184 N 0.00 0.53 0.10 2.98 5.03 -1.18 -3.79 115.26 118.92 1sxe n ASN 184 Ca 0.00 0.22 -0.12 0.00 0.87 0.00 0.00 54.58 55.55 1sxe n ASN 184 Cb 0.00 0.74 -0.06 0.00 -1.02 0.00 0.00 39.78 39.44 1sxe n ASN 184 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1sxe h ALA 185 N 1.55 -0.26 0.00 5.41 0.00 -1.66 -0.22 119.26 124.08 1sxe h ALA 185 Ca -0.17 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1sxe h ALA 185 Cb 1.50 0.24 0.00 0.00 0.00 0.00 0.00 17.79 19.53 1sxe h ALA 185 CO 0.03 -0.68 0.00 -0.25 0.00 0.00 0.00 179.25 178.35 1sxe n ASP 186 N -5.28 0.00 -0.06 0.00 9.92 -1.26 -1.37 116.55 118.50 1sxe n ASP 186 Ca -0.07 0.42 -0.05 0.00 -0.53 0.00 0.00 54.79 54.56 1sxe n ASP 186 Cb 0.20 -0.43 -0.02 0.00 -0.64 0.00 0.00 41.12 40.24 1sxe n ASP 186 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 1sxe n ILE 187 N -1.43 1.08 -0.15 0.53 5.41 -0.43 -4.11 119.36 120.26 1sxe n ILE 187 Ca 0.00 0.26 -0.03 0.00 1.00 0.00 0.00 62.75 63.98 1sxe n ILE 187 Cb 0.01 -2.14 0.06 0.00 -0.71 0.00 0.00 39.64 36.85 1sxe n ILE 187 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1sxe h LEU 188 N -0.74 0.17 0.07 1.39 3.38 -0.98 -1.80 115.31 116.80 1sxe h LEU 188 Ca 0.00 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 1sxe h LEU 188 Cb 0.58 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1sxe h LEU 188 CO 0.00 0.13 -0.03 0.25 0.09 0.00 0.00 178.44 178.87 1sxe h LEU 189 N 0.34 -0.08 -0.88 1.67 5.85 -1.45 -0.11 115.31 120.65 1sxe h LEU 189 Ca 0.23 -0.26 0.15 0.00 0.84 0.00 0.00 57.88 58.84 1sxe h LEU 189 Cb 0.24 0.02 -0.10 0.00 0.37 0.00 0.00 40.66 41.20 1sxe h LEU 189 CO -0.24 0.22 0.48 0.28 -0.34 0.00 0.00 178.44 178.84 1sxe h SER 190 N -0.38 0.60 -0.50 1.25 0.02 -1.68 -0.52 113.55 112.33 1sxe h SER 190 Ca -0.01 0.09 -0.05 0.00 -0.84 0.00 0.00 61.79 60.98 1sxe h SER 190 Cb 0.34 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.84 1sxe h SER 190 CO 0.02 0.25 0.12 0.45 -1.14 0.00 0.00 176.83 176.52 1sxe h HIS 191 N 0.67 0.85 -0.47 3.45 3.86 -0.92 -2.31 115.15 120.28 1sxe h HIS 191 Ca 0.48 -0.10 -0.05 0.00 -1.16 0.00 0.00 60.37 59.54 1sxe h HIS 191 Cb 0.68 -0.24 -0.02 0.00 1.06 0.00 0.00 27.41 28.89 1sxe h HIS 191 CO -0.07 0.76 0.11 1.25 0.86 0.00 0.00 177.93 180.83 1sxe h LEU 192 N 0.69 0.72 -0.17 2.43 5.85 0.28 0.02 115.31 125.14 1sxe h LEU 192 Ca 0.16 -0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.64 1sxe h LEU 192 Cb 0.34 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.18 1sxe h LEU 192 CO 0.00 0.77 0.00 1.41 -0.34 0.00 0.00 178.44 180.29 1sxe n HIS 193 N -4.48 0.24 -0.05 1.25 8.25 -0.33 -2.87 115.22 117.24 1sxe n HIS 193 Ca 0.01 0.09 -0.21 0.00 -0.26 0.00 0.00 57.72 57.35 1sxe n HIS 193 Cb 0.22 -0.64 -0.13 0.00 1.12 0.00 0.00 29.99 30.56 1sxe n HIS 193 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 1sxe n TYR 194 N -1.71 0.82 -0.35 4.41 9.36 -0.51 -3.96 117.16 125.21 1sxe n TYR 194 Ca 0.04 0.18 -0.01 0.00 3.32 0.00 0.00 57.90 61.43 1sxe n TYR 194 Cb 0.22 -1.11 0.15 0.00 -0.63 0.00 0.00 39.34 37.97 1sxe n TYR 194 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 1sxe h LEU 195 N -0.02 1.09 0.00 2.98 3.38 -0.93 -1.40 115.31 120.41 1sxe h LEU 195 Ca -0.48 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.47 1sxe h LEU 195 Cb 1.95 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 42.44 1sxe h LEU 195 CO 0.01 0.78 0.00 -2.11 0.09 0.00 0.00 178.44 177.20 1sxe n ARG 196 N -4.40 0.71 0.00 1.13 1.85 -1.14 -3.05 116.66 111.76 1sxe n ARG 196 Ca 0.12 0.00 0.07 0.00 -1.00 0.00 0.00 57.85 57.04 1sxe n ARG 196 Cb 0.04 -1.50 0.33 0.00 -1.05 0.00 0.00 32.46 30.28 1sxe n ARG 196 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 1sxe n GLU 197 N -1.01 0.18 -3.26 2.89 -0.58 -0.53 -3.42 120.64 114.92 1sxe n GLU 197 Ca 0.17 0.17 -0.25 0.00 -0.42 0.00 0.00 57.16 56.83 1sxe n GLU 197 Cb 0.08 -1.50 -0.08 0.00 -0.57 0.00 0.00 31.44 29.37 1sxe n GLU 197 CO 0.00 0.00 0.00 -2.37 -0.48 0.00 0.00 177.13 174.28 1sxe n THR 198 N -1.30 -0.84 -1.61 2.62 5.66 -1.17 -5.14 114.28 112.50 1sxe n THR 198 Ca 0.06 -3.83 -0.38 0.00 -3.05 0.00 0.00 64.05 56.85 1sxe n THR 198 Cb 0.11 -1.86 0.05 0.00 -1.55 0.00 0.00 70.33 67.08 1sxe n THR 198 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1sxe n PRO 199 N 1.87 0.94 -1.80 1.09 -0.04 -1.22 -4.64 135.00 131.21 1sxe n PRO 199 Ca 0.24 0.36 -0.41 0.00 -0.04 0.00 0.00 63.50 63.65 1sxe n PRO 199 Cb 0.51 -2.16 -0.01 0.00 -0.04 0.00 0.00 33.50 31.80 1sxe n PRO 199 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 1sxe s LEU 200 N -1.88 4.34 0.00 1.53 -0.00 -1.26 -4.87 118.68 116.54 1sxe s LEU 200 Ca 0.74 2.94 0.18 0.00 -0.00 0.00 0.00 54.13 58.00 1sxe s LEU 200 Cb -0.43 -3.64 1.10 0.00 -0.00 0.00 0.00 46.19 43.22 1sxe s LEU 200 CO 0.48 -0.89 1.49 -2.65 -0.00 0.00 0.00 176.35 174.78