#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 5.58 -3.66 1.61 7.64 -1.26 -4.69 113.62 118.84 1sxe n SER 106 Ca 0.00 -2.63 -0.06 0.00 1.01 0.00 0.00 58.87 57.20 1sxe n SER 106 Cb 0.00 -1.28 -0.07 0.00 -1.01 0.00 0.00 64.21 61.85 1sxe n SER 106 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 1sxe s HIS 107 N 0.05 -1.01 -0.32 1.43 2.46 -1.26 -5.14 115.29 111.50 1sxe s HIS 107 Ca 0.45 1.86 -0.09 0.00 0.47 0.00 0.00 55.06 57.75 1sxe s HIS 107 Cb 0.24 0.52 0.01 0.00 -0.13 0.00 0.00 32.58 33.21 1sxe s HIS 107 CO -0.03 -0.55 0.13 -1.64 -2.47 0.00 0.00 174.74 170.18 1sxe s MET 108 N 2.56 3.12 0.35 2.88 1.00 -1.26 -5.09 119.30 122.87 1sxe s MET 108 Ca -0.05 -0.86 -0.04 0.00 0.00 0.00 0.00 55.69 54.75 1sxe s MET 108 Cb -0.11 -3.52 -0.04 0.00 0.00 0.00 0.00 34.83 31.15 1sxe s MET 108 CO -0.16 -0.49 0.62 -1.21 0.00 0.00 0.00 175.02 173.78 1sxe s GLU 109 N 1.55 3.59 0.15 2.03 0.41 -1.26 -4.97 118.70 120.20 1sxe s GLU 109 Ca 0.03 0.00 0.16 0.00 -0.41 0.00 0.00 54.97 54.75 1sxe s GLU 109 Cb -0.18 -2.57 0.73 0.00 -1.78 0.00 0.00 34.13 30.33 1sxe s GLU 109 CO 0.05 0.09 1.49 0.39 -0.49 0.00 0.00 175.26 176.79 1sxe n GLU 110 N -1.45 0.09 0.13 1.61 1.02 -1.26 -1.87 120.64 118.91 1sxe n GLU 110 Ca -0.02 0.45 -0.00 0.00 -0.02 0.00 0.00 57.16 57.57 1sxe n GLU 110 Cb 0.55 -1.72 0.07 0.00 -0.02 0.00 0.00 31.44 30.32 1sxe n GLU 110 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 1sxe h LYS 111 N 0.00 0.00 -2.88 3.49 1.63 -2.03 -3.37 116.57 113.41 1sxe h LYS 111 Ca 0.00 0.00 -0.74 0.00 -0.85 0.00 0.00 60.65 59.06 1sxe h LYS 111 Cb 0.17 0.00 -0.33 0.00 -0.60 0.00 0.00 32.23 31.48 1sxe h LYS 111 CO 0.00 0.64 0.25 0.72 -3.45 0.00 0.00 179.45 177.60 1sxe n HIS 112 N -3.41 3.28 -0.04 1.91 8.25 -0.78 -4.71 115.22 119.72 1sxe n HIS 112 Ca 0.00 -3.40 -0.08 0.00 -0.26 0.00 0.00 57.72 53.98 1sxe n HIS 112 Cb 0.73 -1.11 -0.03 0.00 1.12 0.00 0.00 29.99 30.70 1sxe n HIS 112 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1sxe n MET 113 N 1.52 0.25 -0.20 -0.41 2.81 -1.26 -4.78 117.12 115.05 1sxe n MET 113 Ca 0.26 0.10 -0.03 0.00 -1.81 0.00 0.00 57.70 56.23 1sxe n MET 113 Cb 0.36 -0.93 0.08 0.00 -0.71 0.00 0.00 33.22 32.02 1sxe n MET 113 CO 0.00 0.00 0.00 -1.35 1.51 0.00 0.00 175.97 176.13 1sxe h PRO 114 N -0.45 0.60 -6.17 0.03 0.11 -1.93 -3.42 132.00 120.77 1sxe h PRO 114 Ca -0.14 -0.04 -0.73 0.00 0.11 0.00 0.00 66.00 65.20 1sxe h PRO 114 Cb 0.81 -0.14 0.03 0.00 0.11 0.00 0.00 31.00 31.81 1sxe h PRO 114 CO -0.09 0.40 0.77 -0.35 -0.21 0.00 0.00 178.00 178.52 1sxe n PRO 115 N -4.82 1.10 -1.66 1.05 -0.04 -1.26 -4.89 135.00 124.47 1sxe n PRO 115 Ca 0.07 0.40 -0.45 0.00 -0.04 0.00 0.00 63.50 63.48 1sxe n PRO 115 Cb 0.15 -2.06 -0.02 0.00 -0.04 0.00 0.00 33.50 31.52 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 4.54 1.95 -0.00 0.54 -0.02 -1.26 -4.96 135.00 135.78 1sxe n PRO 116 Ca 0.24 0.69 -0.01 0.00 -2.02 0.00 0.00 63.50 62.41 1sxe n PRO 116 Cb 0.14 -2.31 -0.00 0.00 -0.02 0.00 0.00 33.50 31.31 1sxe n PRO 116 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1sxe h ASN 117 N 3.73 -0.04 -4.43 2.55 -0.26 -1.88 -3.48 115.58 111.77 1sxe h ASN 117 Ca -0.45 0.00 -0.39 0.00 -0.56 0.00 0.00 56.30 54.91 1sxe h ASN 117 Cb 1.29 0.01 -0.20 0.00 -1.06 0.00 0.00 38.32 38.35 1sxe h ASN 117 CO 0.72 0.19 -0.77 -0.04 -1.06 0.00 0.00 177.43 176.48 1sxe s MET 118 N -1.50 0.83 -0.66 0.81 -1.94 -1.24 -4.90 119.30 110.69 1sxe s MET 118 Ca -0.01 -1.01 -0.04 0.00 -1.71 0.00 0.00 55.69 52.93 1sxe s MET 118 Cb 0.00 -0.75 0.11 0.00 2.01 0.00 0.00 34.83 36.20 1sxe s MET 118 CO 0.02 0.16 2.60 2.41 -0.01 0.00 0.00 175.02 180.20 1sxe n THR 119 N 1.09 3.76 0.04 2.05 -1.04 -1.26 -3.96 114.28 114.96 1sxe n THR 119 Ca -0.20 -3.45 0.00 0.00 -2.04 0.00 0.00 64.05 58.36 1sxe n THR 119 Cb 0.55 -1.64 0.00 0.00 -1.82 0.00 0.00 70.33 67.42 1sxe n THR 119 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1sxe n THR 120 N 0.84 1.00 -0.46 12.58 -1.04 -1.25 -4.73 114.28 121.21 1sxe n THR 120 Ca 0.52 0.33 -0.09 0.00 -2.04 0.00 0.00 64.05 62.77 1sxe n THR 120 Cb 0.46 -1.46 0.18 0.00 -1.82 0.00 0.00 70.33 67.69 1sxe n THR 120 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1sxe n ASN 121 N -3.32 3.81 -0.07 8.00 2.85 0.63 -4.30 115.26 122.86 1sxe n ASN 121 Ca 0.00 -2.94 0.09 0.00 -0.11 0.00 0.00 54.58 51.61 1sxe n ASN 121 Cb 0.00 -0.70 0.49 0.00 1.24 0.00 0.00 39.78 40.81 1sxe n ASN 121 CO 0.00 0.00 0.00 -1.84 -2.11 0.00 0.00 177.26 173.31 1sxe n GLU 122 N -0.25 1.10 -0.05 1.20 -0.00 -1.26 -0.11 120.64 121.27 1sxe n GLU 122 Ca 0.33 -0.15 0.10 0.00 -0.00 0.00 0.00 57.16 57.44 1sxe n GLU 122 Cb 1.17 -1.28 0.43 0.00 -0.00 0.00 0.00 31.44 31.75 1sxe n GLU 122 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1sxe n ARG 123 N -0.62 1.46 0.00 3.44 5.12 -1.26 -4.53 116.66 120.27 1sxe n ARG 123 Ca 0.13 -0.68 0.00 0.00 -1.93 0.00 0.00 57.85 55.37 1sxe n ARG 123 Cb 0.09 -1.35 0.00 0.00 -1.16 0.00 0.00 32.46 30.05 1sxe n ARG 123 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 1sxe n ARG 124 N -0.09 0.00 -0.13 5.56 0.63 -0.66 -4.99 116.66 116.98 1sxe n ARG 124 Ca 0.15 0.00 0.05 0.00 -0.92 0.00 0.00 57.85 57.13 1sxe n ARG 124 Cb 0.23 0.00 0.11 0.00 0.45 0.00 0.00 32.46 33.25 1sxe n ARG 124 CO 0.00 0.00 0.00 1.33 -2.51 0.00 0.00 177.63 176.45 1sxe n VAL 125 N -1.22 1.42 -2.67 5.15 0.24 -0.13 -4.98 118.33 116.14 1sxe n VAL 125 Ca 0.00 -1.44 -0.21 0.00 -2.04 0.00 0.00 64.34 60.64 1sxe n VAL 125 Cb 0.00 0.20 0.01 0.00 -1.47 0.00 0.00 33.84 32.58 1sxe n VAL 125 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1sxe n ILE 126 N -0.48 -1.40 -4.66 1.34 2.08 0.84 -4.89 119.36 112.19 1sxe n ILE 126 Ca 0.10 0.00 -0.30 0.00 0.56 0.00 0.00 62.75 63.11 1sxe n ILE 126 Cb 0.49 -3.15 -0.09 0.00 -0.75 0.00 0.00 39.64 36.14 1sxe n ILE 126 CO 0.00 0.00 0.00 0.68 0.56 0.00 0.00 176.55 177.79 1sxe s VAL 127 N -3.09 1.63 0.33 1.39 -7.23 -1.24 -3.01 120.40 109.18 1sxe s VAL 127 Ca 0.13 -1.98 -0.29 0.00 -1.81 0.00 0.00 61.98 58.03 1sxe s VAL 127 Cb -0.06 -2.61 -0.10 0.00 0.56 0.00 0.00 36.38 34.17 1sxe s VAL 127 CO 0.16 0.00 1.35 -2.16 -0.31 0.00 0.00 175.10 174.14 1sxe s PRO 128 N -3.80 4.30 0.00 4.82 0.04 -1.26 -0.27 135.00 138.84 1sxe s PRO 128 Ca 0.22 2.29 0.00 0.00 0.04 0.00 0.00 61.00 63.54 1sxe s PRO 128 Cb 0.06 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.54 1sxe s PRO 128 CO 0.11 -0.27 0.05 0.00 0.04 0.00 0.00 177.00 176.93 1sxe n ALA 129 N 0.89 1.15 -3.76 8.56 0.00 -1.26 -4.19 120.51 121.90 1sxe n ALA 129 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.16 1sxe n ALA 129 Cb 0.41 -1.00 -0.16 0.00 0.00 0.00 0.00 19.45 18.70 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 -0.95 3.35 0.00 0.00 -1.08 -1.26 -3.55 116.67 113.18 1sxe s ASP 130 Ca 0.00 -1.09 0.00 0.00 -0.52 0.00 0.00 52.55 50.94 1sxe s ASP 130 Cb 0.00 -0.74 0.00 0.00 -1.46 0.00 0.00 42.92 40.72 1sxe s ASP 130 CO 0.00 -0.33 0.33 -2.65 0.52 0.00 0.00 175.17 173.04 1sxe n PRO 131 N 4.95 0.37 -0.12 4.34 -0.02 -1.26 -2.78 135.00 140.48 1sxe n PRO 131 Ca -0.08 0.00 -0.15 0.00 -2.02 0.00 0.00 63.50 61.25 1sxe n PRO 131 Cb 0.45 -1.28 -0.13 0.00 -0.02 0.00 0.00 33.50 32.52 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 0.70 1.43 0.23 3.45 -2.24 -1.26 -3.78 114.28 112.81 1sxe n THR 132 Ca 0.00 -0.65 0.12 0.00 -2.27 0.00 0.00 64.05 61.24 1sxe n THR 132 Cb 0.16 -1.10 0.25 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 -3.08 3.42 -4.68 3.22 4.77 -1.12 0.00 117.00 119.54 1sxe n LEU 133 Ca -0.41 -1.54 -0.49 0.00 -0.03 0.00 0.00 56.01 53.54 1sxe n LEU 133 Cb 1.04 -0.30 -0.05 0.00 -2.33 0.00 0.00 43.42 41.78 1sxe n LEU 133 CO 0.31 0.77 1.38 0.79 -1.33 0.00 0.00 177.39 179.31 1sxe n TRP 134 N 1.43 2.26 -1.66 -1.77 7.02 -1.26 -4.81 117.44 118.66 1sxe n TRP 134 Ca 0.20 0.13 -0.34 0.00 -1.02 0.00 0.00 57.50 56.47 1sxe n TRP 134 Cb 0.58 -2.60 0.07 0.00 -2.42 0.00 0.00 31.31 26.94 1sxe n TRP 134 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 1sxe s SER 135 N 3.05 4.69 0.25 -0.99 0.15 -1.26 0.66 113.70 120.25 1sxe s SER 135 Ca 0.89 2.25 -0.04 0.00 0.70 0.00 0.00 55.95 59.76 1sxe s SER 135 Cb -0.73 -2.58 0.48 0.00 -1.71 0.00 0.00 66.02 61.48 1sxe s SER 135 CO 0.49 -1.92 1.32 0.35 1.20 0.00 0.00 173.24 174.67 1sxe n THR 136 N -2.37 -0.35 -0.01 6.45 -2.24 -1.26 0.22 114.28 114.71 1sxe n THR 136 Ca 0.13 1.90 -0.18 0.00 -2.27 0.00 0.00 64.05 63.63 1sxe n THR 136 Cb 0.51 -2.69 -0.08 0.00 -2.10 0.00 0.00 70.33 65.97 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 0.87 0.48 3.42 1.82 -1.85 -2.85 116.42 118.31 1sxe h ASP 137 Ca 0.44 -0.65 0.00 0.00 -0.39 0.00 0.00 57.03 56.43 1sxe h ASP 137 Cb 0.77 -0.26 0.00 0.00 0.68 0.00 0.00 39.33 40.52 1sxe h ASP 137 CO -0.84 1.39 0.00 1.41 -1.61 0.00 0.00 179.24 179.59 1sxe n HIS 138 N -3.99 0.47 0.07 0.28 8.25 0.53 -1.88 115.22 118.95 1sxe n HIS 138 Ca -0.08 0.20 -0.19 0.00 -0.26 0.00 0.00 57.72 57.38 1sxe n HIS 138 Cb 0.74 -0.82 -0.15 0.00 1.12 0.00 0.00 29.99 30.89 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 1.08 0.00 1.59 2.07 0.02 -2.83 116.25 118.18 1sxe h VAL 139 Ca 0.00 -2.69 -0.05 0.00 0.82 0.00 0.00 66.70 64.78 1sxe h VAL 139 Cb 0.24 2.77 -0.01 0.00 -1.52 0.00 0.00 31.29 32.77 1sxe h VAL 139 CO 0.00 0.83 -0.25 0.03 0.02 0.00 0.00 177.57 178.20 1sxe h ARG 140 N 0.08 0.00 0.85 1.57 -0.00 -1.46 -1.69 114.38 113.75 1sxe h ARG 140 Ca -0.28 0.00 -0.04 0.00 -0.50 0.00 0.00 59.98 59.16 1sxe h ARG 140 Cb 2.05 0.00 0.01 0.00 0.00 0.00 0.00 29.97 32.03 1sxe h ARG 140 CO 0.17 0.25 -0.41 0.37 0.00 0.00 0.00 179.97 180.35 1sxe h GLN 141 N 0.00 -1.11 0.48 0.04 4.15 -1.13 0.65 115.11 118.20 1sxe h GLN 141 Ca -0.00 0.08 -0.02 0.00 0.77 0.00 0.00 58.65 59.47 1sxe h GLN 141 Cb 0.55 0.25 0.00 0.00 0.21 0.00 0.00 27.48 28.50 1sxe h GLN 141 CO 0.03 -0.74 -0.23 2.35 -1.93 0.00 0.00 178.83 178.31 1sxe h TRP 142 N -1.31 -0.60 -1.28 3.99 7.01 -1.59 0.41 115.95 122.59 1sxe h TRP 142 Ca -0.12 -0.01 0.37 0.00 2.11 0.00 0.00 58.89 61.24 1sxe h TRP 142 Cb 0.88 0.20 -0.09 0.00 -2.10 0.00 0.00 29.16 28.05 1sxe h TRP 142 CO 0.00 -0.35 0.87 1.25 -2.79 0.00 0.00 178.44 177.42 1sxe h LEU 143 N -0.69 0.20 0.00 0.65 5.85 -1.20 1.35 115.31 121.47 1sxe h LEU 143 Ca -0.07 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 1sxe h LEU 143 Cb 0.52 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.59 1sxe h LEU 143 CO 0.11 -0.03 -0.15 -0.33 -0.34 0.00 0.00 178.44 177.70 1sxe h GLU 144 N 0.14 0.00 0.00 1.25 5.08 0.45 -3.10 114.58 118.40 1sxe h GLU 144 Ca 0.69 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.05 1sxe h GLU 144 Cb 2.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.56 1sxe h GLU 144 CO -0.21 0.63 0.07 1.87 -1.00 0.00 0.00 179.01 180.37 1sxe n TRP 145 N -4.65 0.00 -0.10 4.33 -0.00 0.20 -1.10 117.44 116.11 1sxe n TRP 145 Ca -0.09 0.00 -0.23 0.00 -0.00 0.00 0.00 57.50 57.18 1sxe n TRP 145 Cb 0.34 -0.38 -0.11 0.00 -0.00 0.00 0.00 31.31 31.15 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 -1.37 0.85 -0.24 5.87 0.00 0.44 -1.75 120.51 124.31 1sxe n ALA 146 Ca 0.00 -0.58 0.16 0.00 0.00 0.00 0.00 53.44 53.02 1sxe n ALA 146 Cb 0.07 -0.47 0.47 0.00 0.00 0.00 0.00 19.45 19.52 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 -0.94 0.74 -0.11 0.00 2.07 -1.25 0.10 116.25 116.86 1sxe h VAL 147 Ca -0.41 -0.17 -0.02 0.00 0.82 0.00 0.00 66.70 66.92 1sxe h VAL 147 Cb 1.39 0.19 -0.00 0.00 -1.52 0.00 0.00 31.29 31.35 1sxe h VAL 147 CO -0.23 0.09 -0.03 0.11 0.02 0.00 0.00 177.57 177.54 1sxe h LYS 148 N 0.50 0.21 0.06 1.57 1.57 -1.13 -2.72 116.57 116.63 1sxe h LYS 148 Ca 0.45 -0.08 -0.24 0.00 -1.87 0.00 0.00 60.65 58.91 1sxe h LYS 148 Cb 0.98 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.27 1sxe h LYS 148 CO -0.19 0.52 -1.12 1.49 -0.57 0.00 0.00 179.45 179.58 1sxe h GLU 149 N -0.11 0.13 -0.02 3.15 4.57 -0.77 -3.37 114.58 118.16 1sxe h GLU 149 Ca 0.03 -0.22 0.00 0.00 -1.18 0.00 0.00 59.36 57.99 1sxe h GLU 149 Cb 0.44 0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.12 1sxe h GLU 149 CO 0.01 1.10 -0.25 0.66 -1.18 0.00 0.00 179.01 179.35 1sxe n TYR 150 N -3.43 0.00 -2.43 0.92 4.01 0.30 -4.97 117.16 111.56 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 0.98 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 40.04 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 1.16 0.15 3.50 2.72 0.00 -1.05 -4.97 105.19 106.70 1sxe n GLY 151 Ca 0.08 -0.20 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 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 -3.66 4.51 0.13 0.99 1.43 -1.09 -4.95 118.68 116.04 1sxe s LEU 152 Ca 0.04 -0.52 -0.18 0.00 -1.03 0.00 0.00 54.13 52.44 1sxe s LEU 152 Cb -0.01 -2.69 -0.03 0.00 0.03 0.00 0.00 46.19 43.50 1sxe s LEU 152 CO 0.27 -0.99 1.77 1.55 0.23 0.00 0.00 176.35 179.18 1sxe h PRO 153 N 9.08 0.41 -1.89 1.29 0.13 -1.93 -3.36 132.00 135.72 1sxe h PRO 153 Ca -0.26 -0.03 -0.52 0.00 -0.87 0.00 0.00 66.00 64.31 1sxe h PRO 153 Cb 1.09 -0.09 -0.38 0.00 0.13 0.00 0.00 31.00 31.75 1sxe h PRO 153 CO 0.99 0.31 -1.10 -3.47 -0.23 0.00 0.00 178.00 174.50 1sxe n ASP 154 N -4.85 0.19 -4.66 1.44 2.03 -1.26 -5.07 116.55 104.37 1sxe n ASP 154 Ca -0.01 -2.82 -0.40 0.00 0.52 0.00 0.00 54.79 52.08 1sxe n ASP 154 Cb 0.05 -0.49 -0.06 0.00 -0.72 0.00 0.00 41.12 39.89 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 -1.43 5.06 -0.62 5.18 1.01 -1.26 -4.94 120.40 123.40 1sxe s VAL 155 Ca 0.36 1.09 -0.19 0.00 0.00 0.00 0.00 61.98 63.24 1sxe s VAL 155 Cb 0.22 -3.90 0.11 0.00 0.00 0.00 0.00 36.38 32.81 1sxe s VAL 155 CO -0.11 0.14 0.75 0.21 0.00 0.00 0.00 175.10 176.10 1sxe s ASN 156 N 1.16 6.22 0.03 3.32 3.04 -1.26 -4.89 114.94 122.57 1sxe s ASN 156 Ca 0.27 -1.47 0.03 0.00 0.04 0.00 0.00 52.86 51.74 1sxe s ASN 156 Cb -0.16 -2.31 -0.25 0.00 -1.54 0.00 0.00 41.25 36.99 1sxe s ASN 156 CO 0.10 -1.13 0.94 0.40 -3.04 0.00 0.00 177.10 174.38 1sxe h ILE 157 N 5.89 1.26 0.00 -5.21 2.04 -1.95 -3.19 117.51 116.35 1sxe h ILE 157 Ca -0.26 -2.96 0.00 0.00 1.00 0.00 0.00 64.86 62.64 1sxe h ILE 157 Cb 1.08 2.72 0.00 0.00 -0.74 0.00 0.00 36.82 39.88 1sxe h ILE 157 CO 1.10 0.80 0.00 0.00 0.00 0.00 0.00 178.15 180.04 1sxe n LEU 158 N -3.34 0.00 -0.01 1.44 -0.00 -1.26 -0.87 117.00 112.96 1sxe n LEU 158 Ca -0.12 0.00 0.04 0.00 -0.00 0.00 0.00 56.01 55.93 1sxe n LEU 158 Cb 1.01 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 44.30 1sxe n LEU 158 CO 0.48 0.00 -0.69 0.18 -0.00 0.00 0.00 177.39 177.36 1sxe n LEU 159 N -0.63 0.24 -0.19 1.47 4.32 -1.20 -4.17 117.00 116.84 1sxe n LEU 159 Ca 0.01 0.10 0.11 0.00 -0.02 0.00 0.00 56.01 56.22 1sxe n LEU 159 Cb 0.01 0.13 0.11 0.00 -1.62 0.00 0.00 43.42 42.05 1sxe n LEU 159 CO 0.01 0.13 0.33 0.49 -1.22 0.00 0.00 177.39 177.12 1sxe n PHE 160 N -2.53 0.00 -0.28 -1.77 3.01 -0.05 -4.46 117.46 111.38 1sxe n PHE 160 Ca -0.12 0.00 0.30 0.00 1.01 0.00 0.00 57.45 58.65 1sxe n PHE 160 Cb 0.76 -0.09 0.68 0.00 -0.01 0.00 0.00 39.48 40.82 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 0.92 0.09 -0.55 -1.08 4.20 -1.70 0.68 115.11 117.67 1sxe h GLN 161 Ca 0.00 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.70 1sxe h GLN 161 Cb 0.57 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.33 1sxe h GLN 161 CO 0.00 0.06 0.00 0.09 -0.67 0.00 0.00 178.83 178.31 1sxe n ASN 162 N -4.31 3.56 -4.60 1.46 5.03 -1.26 -4.75 115.26 110.39 1sxe n ASN 162 Ca 0.23 -1.99 -0.37 0.00 0.87 0.00 0.00 54.58 53.33 1sxe n ASN 162 Cb 1.07 -0.36 -0.11 0.00 -1.02 0.00 0.00 39.78 39.36 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 -1.28 5.08 0.64 2.41 1.01 0.24 -5.04 121.20 124.25 1sxe s ILE 163 Ca 0.43 0.08 0.04 0.00 0.00 0.00 0.00 60.65 61.20 1sxe s ILE 163 Cb 0.24 -3.37 0.10 0.00 0.01 0.00 0.00 42.46 39.43 1sxe s ILE 163 CO 0.32 0.33 0.88 1.51 0.00 0.00 0.00 174.94 177.98 1sxe s ASP 164 N 1.26 4.76 0.47 3.58 1.47 -1.26 -4.47 116.67 122.49 1sxe s ASP 164 Ca 0.06 -0.54 0.13 0.00 1.18 0.00 0.00 52.55 53.38 1sxe s ASP 164 Cb -0.14 0.02 1.10 0.00 -0.34 0.00 0.00 42.92 43.56 1sxe s ASP 164 CO 0.06 -1.56 2.11 1.23 0.68 0.00 0.00 175.17 177.68 1sxe h GLY 165 N -0.15 0.25 2.00 2.12 0.00 0.15 0.87 103.07 108.30 1sxe h GLY 165 Ca -0.34 -0.09 -0.03 0.00 0.00 0.00 0.00 47.33 46.87 1sxe h GLY 165 CO 0.41 0.09 -0.14 0.07 0.00 0.00 0.00 176.54 176.97 1sxe h LYS 166 N 0.23 0.00 0.00 4.80 5.09 -0.61 0.23 116.57 126.32 1sxe h LYS 166 Ca 0.07 0.00 -0.18 0.00 0.09 0.00 0.00 60.65 60.63 1sxe h LYS 166 Cb 0.01 0.00 -0.03 0.00 0.10 0.00 0.00 32.23 32.31 1sxe h LYS 166 CO -0.02 0.14 -1.85 -1.91 -2.09 0.00 0.00 179.45 173.73 1sxe n GLU 167 N -3.34 0.65 -0.02 0.07 4.07 0.12 -3.92 120.64 118.27 1sxe n GLU 167 Ca -0.00 0.04 -0.11 0.00 -0.06 0.00 0.00 57.16 57.03 1sxe n GLU 167 Cb 0.36 -1.65 -0.14 0.00 -0.06 0.00 0.00 31.44 29.95 1sxe n GLU 167 CO 0.00 0.00 0.00 -0.11 -0.06 0.00 0.00 177.13 176.96 1sxe n LEU 168 N -2.68 1.17 -0.00 4.31 7.94 -0.14 -3.65 117.00 123.94 1sxe n LEU 168 Ca -0.15 0.35 0.15 0.00 -1.11 0.00 0.00 56.01 55.25 1sxe n LEU 168 Cb 0.86 -0.05 0.73 0.00 0.53 0.00 0.00 43.42 45.49 1sxe n LEU 168 CO 0.44 0.48 1.01 0.00 -1.11 0.00 0.00 177.39 178.21 1sxe n LYS 170 N -1.31 3.22 -3.43 0.00 5.02 -1.24 -4.95 118.16 115.47 1sxe n LYS 170 Ca 0.13 -3.04 -0.38 0.00 -2.02 0.00 0.00 58.31 53.00 1sxe n LYS 170 Cb 0.26 -2.05 -0.06 0.00 -0.02 0.00 0.00 35.03 33.16 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 -2.99 4.07 0.57 1.97 -1.94 -0.74 -5.01 119.30 115.23 1sxe s MET 171 Ca 0.50 0.45 0.02 0.00 -1.71 0.00 0.00 55.69 54.94 1sxe s MET 171 Cb 0.41 -3.29 0.05 0.00 2.01 0.00 0.00 34.83 34.01 1sxe s MET 171 CO 0.10 0.53 0.80 0.95 -0.01 0.00 0.00 175.02 177.39 1sxe s THR 172 N -0.59 2.58 0.47 2.05 -4.23 -1.26 -4.93 115.64 109.72 1sxe s THR 172 Ca 0.25 -0.70 0.21 0.00 -1.18 0.00 0.00 61.69 60.26 1sxe s THR 172 Cb -0.16 -2.88 0.39 0.00 1.34 0.00 0.00 72.50 71.19 1sxe s THR 172 CO 0.13 0.00 1.92 0.11 -0.54 0.00 0.00 174.62 176.24 1sxe h LYS 173 N 0.02 0.24 0.00 3.99 1.57 -1.98 -0.17 116.57 120.25 1sxe h LYS 173 Ca -0.40 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.28 1sxe h LYS 173 Cb 1.29 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.53 1sxe h LYS 173 CO 0.49 0.16 -0.45 0.22 -0.57 0.00 0.00 179.45 179.30 1sxe h ASP 174 N 0.25 0.00 0.62 0.86 1.82 -1.98 -3.21 116.42 114.78 1sxe h ASP 174 Ca 0.37 0.00 -0.14 0.00 -0.39 0.00 0.00 57.03 56.88 1sxe h ASP 174 Cb 1.08 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 41.08 1sxe h ASP 174 CO -0.09 0.39 -0.64 0.44 -1.61 0.00 0.00 179.24 177.73 1sxe h ASP 175 N 0.00 0.02 1.33 2.28 3.32 -1.38 -2.13 116.42 119.86 1sxe h ASP 175 Ca -0.01 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 56.90 1sxe h ASP 175 Cb 1.31 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.83 1sxe h ASP 175 CO 0.05 0.65 -0.58 -0.26 -1.72 0.00 0.00 179.24 177.38 1sxe h PHE 176 N 0.01 0.00 0.00 4.55 -1.00 -1.57 -3.27 116.94 115.66 1sxe h PHE 176 Ca -0.01 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.77 1sxe h PHE 176 Cb 1.13 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.69 1sxe h PHE 176 CO 0.00 0.58 0.00 1.04 -1.61 0.00 0.00 178.31 178.32 1sxe n GLN 177 N -3.28 0.48 0.00 1.51 6.02 -0.82 0.74 117.38 122.04 1sxe n GLN 177 Ca 0.01 0.03 0.09 0.00 -0.01 0.00 0.00 57.00 57.12 1sxe n GLN 177 Cb 0.75 -1.50 -0.04 0.00 1.02 0.00 0.00 30.24 30.47 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 -1.22 1.45 0.00 -1.09 1.85 -1.12 -3.84 116.66 112.69 1sxe n ARG 178 Ca 0.14 -0.54 0.00 0.00 -1.00 0.00 0.00 57.85 56.45 1sxe n ARG 178 Cb 0.18 -1.33 0.00 0.00 -1.05 0.00 0.00 32.46 30.26 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 -0.58 0.00 -3.12 2.89 4.77 -0.75 -4.95 117.00 115.26 1sxe n LEU 179 Ca 0.06 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 56.06 1sxe n LEU 179 Cb 0.34 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.43 1sxe n LEU 179 CO 0.27 0.00 0.20 -0.89 -1.33 0.00 0.00 177.39 175.64 1sxe s THR 180 N -1.97 -0.80 1.22 -5.08 2.01 0.23 -4.42 115.64 106.83 1sxe s THR 180 Ca 0.00 0.00 -0.20 0.00 0.31 0.00 0.00 61.69 61.80 1sxe s THR 180 Cb 0.00 -0.31 0.32 0.00 0.01 0.00 0.00 72.50 72.52 1sxe s THR 180 CO 0.00 0.00 0.73 -2.65 -0.69 0.00 0.00 174.62 172.01 1sxe n PRO 181 N 4.66 -4.37 -1.50 4.92 -0.02 -1.25 -3.32 135.00 134.13 1sxe n PRO 181 Ca 0.08 -1.22 -0.46 0.00 -2.02 0.00 0.00 63.50 59.89 1sxe n PRO 181 Cb 0.57 -1.57 -0.06 0.00 -0.02 0.00 0.00 33.50 32.42 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 -5.33 2.19 0.00 2.55 7.64 -1.26 -2.69 113.62 116.71 1sxe n SER 182 Ca 0.11 0.18 0.00 0.00 1.01 0.00 0.00 58.87 60.17 1sxe n SER 182 Cb 0.50 -1.34 0.00 0.00 -1.01 0.00 0.00 64.21 62.35 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 11.39 0.00 -0.04 1.43 9.36 -1.26 -4.91 117.16 133.12 1sxe n TYR 183 Ca 0.41 0.00 -0.09 0.00 3.32 0.00 0.00 57.90 61.54 1sxe n TYR 183 Cb 0.31 0.00 -0.14 0.00 -0.63 0.00 0.00 39.34 38.87 1sxe n TYR 183 CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37 1sxe n ASN 184 N 0.00 0.64 -0.12 2.98 2.85 -1.10 -3.86 115.26 116.65 1sxe n ASN 184 Ca 0.00 0.30 -0.05 0.00 -0.11 0.00 0.00 54.58 54.72 1sxe n ASN 184 Cb 0.00 0.23 0.01 0.00 1.24 0.00 0.00 39.78 41.27 1sxe n ASN 184 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1sxe h ALA 185 N 1.01 0.14 0.00 5.20 0.00 -1.54 0.93 119.26 125.00 1sxe h ALA 185 Ca -0.35 0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1sxe h ALA 185 Cb 2.06 0.45 0.00 0.00 0.00 0.00 0.00 17.79 20.30 1sxe h ALA 185 CO 0.06 -0.54 0.00 -0.25 0.00 0.00 0.00 179.25 178.53 1sxe n ASP 186 N -5.37 0.00 -0.07 0.00 9.92 -1.25 -0.73 116.55 119.05 1sxe n ASP 186 Ca 0.02 0.47 -0.06 0.00 -0.53 0.00 0.00 54.79 54.69 1sxe n ASP 186 Cb 0.28 -0.47 -0.02 0.00 -0.64 0.00 0.00 41.12 40.26 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 -1.47 1.37 -0.11 0.53 5.41 0.22 -3.89 119.36 121.42 1sxe n ILE 187 Ca 0.01 0.21 -0.05 0.00 1.00 0.00 0.00 62.75 63.92 1sxe n ILE 187 Cb 0.05 -2.34 0.02 0.00 -0.71 0.00 0.00 39.64 36.67 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 -0.95 0.00 -1.24 1.39 3.38 -1.15 -0.88 115.31 115.86 1sxe h LEU 188 Ca 0.00 0.06 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1sxe h LEU 188 Cb 0.64 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 1sxe h LEU 188 CO 0.00 0.04 -0.33 0.25 0.09 0.00 0.00 178.44 178.48 1sxe h LEU 189 N 0.19 0.00 0.00 1.67 5.85 -1.16 0.26 115.31 122.12 1sxe h LEU 189 Ca 0.18 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.90 1sxe h LEU 189 Cb 0.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.24 1sxe h LEU 189 CO -0.24 0.33 -1.06 -0.24 -0.34 0.00 0.00 178.44 176.89 1sxe n SER 190 N -3.76 0.78 0.05 1.25 2.88 -0.97 -2.33 113.62 111.52 1sxe n SER 190 Ca -0.01 0.28 -0.16 0.00 -1.33 0.00 0.00 58.87 57.65 1sxe n SER 190 Cb 0.42 0.56 -0.14 0.00 -0.75 0.00 0.00 64.21 64.30 1sxe n SER 190 CO 0.00 0.00 0.00 0.45 -1.23 0.00 0.00 175.04 174.26 1sxe h HIS 191 N 0.00 0.41 -0.61 0.66 3.86 -0.57 -3.00 115.15 115.90 1sxe h HIS 191 Ca 0.00 -0.30 -0.08 0.00 -1.16 0.00 0.00 60.37 58.83 1sxe h HIS 191 Cb 0.98 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 29.41 1sxe h HIS 191 CO 0.00 1.38 0.06 1.25 0.86 0.00 0.00 177.93 181.48 1sxe h LEU 192 N 0.06 1.01 -0.25 2.43 5.85 -0.55 -2.20 115.31 121.66 1sxe h LEU 192 Ca -0.26 -0.28 0.00 0.00 0.84 0.00 0.00 57.88 58.18 1sxe h LEU 192 Cb 2.01 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 42.78 1sxe h LEU 192 CO 0.15 1.04 0.00 1.41 -0.34 0.00 0.00 178.44 180.69 1sxe n HIS 193 N -4.24 0.34 0.01 1.25 8.25 -0.98 -1.90 115.22 117.94 1sxe n HIS 193 Ca 0.03 0.13 -0.20 0.00 -0.26 0.00 0.00 57.72 57.42 1sxe n HIS 193 Cb 0.31 -0.71 -0.14 0.00 1.12 0.00 0.00 29.99 30.57 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 -1.80 1.26 -0.22 4.41 9.36 -0.91 -3.74 117.16 125.51 1sxe n TYR 194 Ca 0.03 0.28 -0.03 0.00 3.32 0.00 0.00 57.90 61.51 1sxe n TYR 194 Cb 0.22 -1.17 0.15 0.00 -0.63 0.00 0.00 39.34 37.91 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 0.07 0.94 0.00 2.98 3.38 -1.16 -2.34 115.31 119.18 1sxe h LEU 195 Ca -0.41 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.45 1sxe h LEU 195 Cb 2.04 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 42.54 1sxe h LEU 195 CO 0.09 0.81 0.00 -1.14 0.09 0.00 0.00 178.44 178.30 1sxe n ARG 196 N -4.31 0.57 0.30 1.13 0.63 -0.80 -2.53 116.66 111.65 1sxe n ARG 196 Ca 0.07 0.02 0.16 0.00 -0.92 0.00 0.00 57.85 57.18 1sxe n ARG 196 Cb 0.15 -1.50 0.92 0.00 0.45 0.00 0.00 32.46 32.49 1sxe n ARG 196 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 1sxe h GLU 197 N 0.00 0.00 -3.13 -0.14 4.22 -1.50 -3.23 114.58 110.80 1sxe h GLU 197 Ca 0.00 0.00 -0.67 0.00 0.08 0.00 0.00 59.36 58.77 1sxe h GLU 197 Cb 0.04 0.00 -0.38 0.00 0.50 0.00 0.00 28.75 28.91 1sxe h GLU 197 CO 0.00 0.03 -0.28 0.25 -2.18 0.00 0.00 179.01 176.83 1sxe n THR 198 N -3.57 2.52 -1.85 0.32 -2.24 -1.05 -5.09 114.28 103.31 1sxe n THR 198 Ca -0.02 -5.06 -0.39 0.00 -2.27 0.00 0.00 64.05 56.30 1sxe n THR 198 Cb 0.13 -2.28 0.02 0.00 -2.10 0.00 0.00 70.33 66.10 1sxe n THR 198 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 1sxe s PRO 199 N -1.55 3.64 -0.18 -0.78 0.02 -1.22 -4.17 135.00 130.76 1sxe s PRO 199 Ca 0.28 2.33 -0.14 0.00 0.02 0.00 0.00 61.00 63.48 1sxe s PRO 199 Cb -0.04 -2.60 -0.08 0.00 0.02 0.00 0.00 34.50 31.80 1sxe s PRO 199 CO -0.13 -0.82 -0.12 -0.11 -0.33 0.00 0.00 177.00 175.49 1sxe n LEU 200 N -0.29 1.85 0.00 -5.54 -0.00 -1.26 -4.91 117.00 106.85 1sxe n LEU 200 Ca 0.06 0.51 0.09 0.00 -0.00 0.00 0.00 56.01 56.66 1sxe n LEU 200 Cb 0.43 -0.87 0.51 0.00 -0.00 0.00 0.00 43.42 43.48 1sxe n LEU 200 CO 0.57 -0.16 0.71 -2.65 -0.00 0.00 0.00 177.39 175.86