#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 5.74 -0.11 1.61 2.88 -1.26 -4.69 113.62 117.79 1sxe n SER 106 Ca 0.00 -3.15 -0.12 0.00 -1.33 0.00 0.00 58.87 54.27 1sxe n SER 106 Cb 0.00 -1.34 -0.15 0.00 -0.75 0.00 0.00 64.21 61.98 1sxe n SER 106 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 1sxe n HIS 107 N 2.27 0.02 -3.58 0.66 -0.00 -1.26 -5.00 115.22 108.32 1sxe n HIS 107 Ca 0.25 0.01 -0.22 0.00 -0.00 0.00 0.00 57.72 57.75 1sxe n HIS 107 Cb 0.37 -1.00 0.08 0.00 -0.00 0.00 0.00 29.99 29.44 1sxe n HIS 107 CO 0.00 0.00 0.00 -0.12 -0.00 0.00 0.00 176.34 176.22 1sxe n MET 108 N -2.90 -7.28 -3.33 1.57 1.56 -1.26 -4.97 117.12 100.51 1sxe n MET 108 Ca -0.36 0.81 -0.25 0.00 -0.27 0.00 0.00 57.70 57.62 1sxe n MET 108 Cb 1.11 -5.82 -0.09 0.00 2.15 0.00 0.00 33.22 30.57 1sxe n MET 108 CO 0.00 0.00 0.00 -1.91 -0.73 0.00 0.00 175.97 173.33 1sxe n GLU 109 N -4.71 0.22 -1.03 2.12 4.07 -1.26 -4.94 120.64 115.10 1sxe n GLU 109 Ca -0.08 -3.07 -0.22 0.00 -0.06 0.00 0.00 57.16 53.72 1sxe n GLU 109 Cb 0.59 -1.65 0.11 0.00 -0.06 0.00 0.00 31.44 30.43 1sxe n GLU 109 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 1sxe n GLU 110 N 2.84 2.11 -1.29 5.31 4.71 -1.26 -4.42 120.64 128.64 1sxe n GLU 110 Ca 0.29 -2.41 -0.09 0.00 -0.01 0.00 0.00 57.16 54.93 1sxe n GLU 110 Cb 0.49 -1.95 0.12 0.00 -1.01 0.00 0.00 31.44 29.09 1sxe n GLU 110 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 177.13 178.39 1sxe n LYS 111 N -0.59 2.58 0.00 3.49 4.81 -1.26 -4.48 118.16 122.70 1sxe n LYS 111 Ca 0.47 -3.71 0.14 0.00 -0.87 0.00 0.00 58.31 54.34 1sxe n LYS 111 Cb 1.07 -1.95 0.50 0.00 0.02 0.00 0.00 35.03 34.67 1sxe n LYS 111 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1sxe n HIS 112 N -0.92 0.00 -3.51 5.64 8.25 -1.26 -4.50 115.22 118.92 1sxe n HIS 112 Ca 0.32 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.47 1sxe n HIS 112 Cb 0.84 -0.04 -0.07 0.00 1.12 0.00 0.00 29.99 31.84 1sxe n HIS 112 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1sxe n MET 113 N -0.09 2.67 -0.17 -0.41 -0.00 -1.26 -4.67 117.12 113.18 1sxe n MET 113 Ca 0.17 -4.59 -0.08 0.00 -0.00 0.00 0.00 57.70 53.20 1sxe n MET 113 Cb 0.35 -2.33 0.01 0.00 -0.00 0.00 0.00 33.22 31.25 1sxe n MET 113 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 175.97 174.62 1sxe h PRO 114 N 4.95 0.75 -5.38 3.17 0.11 -1.95 -3.44 132.00 130.21 1sxe h PRO 114 Ca 0.18 -0.15 -0.63 0.00 0.11 0.00 0.00 66.00 65.52 1sxe h PRO 114 Cb 0.70 -0.12 -0.13 0.00 0.11 0.00 0.00 31.00 31.56 1sxe h PRO 114 CO 0.88 0.68 0.04 -1.25 -0.21 0.00 0.00 178.00 178.15 1sxe s PRO 115 N -5.49 3.83 -1.24 1.05 0.04 -1.26 -4.97 135.00 126.96 1sxe s PRO 115 Ca -0.13 0.13 -0.17 0.00 0.04 0.00 0.00 61.00 60.87 1sxe s PRO 115 Cb 0.11 -3.74 -0.02 0.00 0.04 0.00 0.00 34.50 30.89 1sxe s PRO 115 CO 0.78 -0.56 2.08 -2.30 0.04 0.00 0.00 177.00 177.04 1sxe n PRO 116 N 5.77 2.47 -1.30 0.56 -0.02 -1.26 -4.86 135.00 136.36 1sxe n PRO 116 Ca -0.03 -2.47 -0.28 0.00 -2.02 0.00 0.00 63.50 58.70 1sxe n PRO 116 Cb 0.49 -3.24 -0.08 0.00 -0.02 0.00 0.00 33.50 30.65 1sxe n PRO 116 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1sxe n ASN 117 N 7.14 7.16 -3.75 2.55 5.15 -1.26 -4.81 115.26 127.43 1sxe n ASN 117 Ca 0.51 -2.67 0.03 0.00 -0.60 0.00 0.00 54.58 51.85 1sxe n ASN 117 Cb 0.41 -1.45 0.01 0.00 -0.53 0.00 0.00 39.78 38.21 1sxe n ASN 117 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1sxe s MET 118 N 0.94 0.23 0.00 1.20 0.23 -1.26 -4.46 119.30 116.18 1sxe s MET 118 Ca 0.66 -0.14 0.00 0.00 -1.03 0.00 0.00 55.69 55.18 1sxe s MET 118 Cb 0.25 0.07 0.00 0.00 -1.53 0.00 0.00 34.83 33.62 1sxe s MET 118 CO -0.06 -0.11 0.54 -2.37 -2.03 0.00 0.00 175.02 170.99 1sxe n THR 119 N -0.73 0.00 0.00 3.16 5.66 -1.26 -5.00 114.28 116.11 1sxe n THR 119 Ca -0.02 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.98 1sxe n THR 119 Cb 0.61 0.13 0.00 0.00 -1.55 0.00 0.00 70.33 69.52 1sxe n THR 119 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1sxe n THR 120 N 0.00 0.00 -0.95 1.09 -1.04 -1.26 -4.49 114.28 107.63 1sxe n THR 120 Ca 0.00 0.23 -0.12 0.00 -2.04 0.00 0.00 64.05 62.12 1sxe n THR 120 Cb 0.54 -0.92 -0.11 0.00 -1.82 0.00 0.00 70.33 68.02 1sxe n THR 120 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1sxe n ASN 121 N -1.51 5.49 0.15 8.00 3.02 -0.25 -4.55 115.26 125.61 1sxe n ASN 121 Ca 0.00 -2.59 0.04 0.00 -0.03 0.00 0.00 54.58 52.00 1sxe n ASN 121 Cb 0.00 -1.31 0.47 0.00 -0.61 0.00 0.00 39.78 38.32 1sxe n ASN 121 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1sxe h GLU 122 N 2.49 0.20 -0.59 3.52 4.81 -1.81 0.52 114.58 123.71 1sxe h GLU 122 Ca 0.18 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.35 1sxe h GLU 122 Cb 1.27 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.60 1sxe h GLU 122 CO 0.30 0.26 0.04 2.89 -0.73 0.00 0.00 179.01 181.76 1sxe n ARG 123 N -4.37 4.70 0.12 1.92 1.85 -1.26 -4.39 116.66 115.22 1sxe n ARG 123 Ca -0.01 -3.16 0.00 0.00 -1.00 0.00 0.00 57.85 53.68 1sxe n ARG 123 Cb 0.19 -2.26 0.00 0.00 -1.05 0.00 0.00 32.46 29.34 1sxe n ARG 123 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 177.63 180.51 1sxe n ARG 124 N 0.48 0.00 0.00 2.89 1.85 -1.05 -4.98 116.66 115.84 1sxe n ARG 124 Ca 0.30 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.15 1sxe n ARG 124 Cb 1.22 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.63 1sxe n ARG 124 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 1sxe n VAL 125 N -3.10 0.00 -3.66 8.89 0.31 -1.00 -5.00 118.33 114.78 1sxe n VAL 125 Ca 0.00 -0.48 -0.22 0.00 -0.01 0.00 0.00 64.34 63.63 1sxe n VAL 125 Cb 0.00 1.02 0.05 0.00 -0.91 0.00 0.00 33.84 34.00 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 -0.52 -4.40 -4.24 2.52 -0.00 0.18 -4.90 119.36 108.00 1sxe n ILE 126 Ca 0.00 -0.39 -0.14 0.00 -0.00 0.00 0.00 62.75 62.22 1sxe n ILE 126 Cb 0.00 -3.97 -0.10 0.00 -0.00 0.00 0.00 39.64 35.58 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 -3.52 1.12 0.24 1.39 -7.23 -1.22 -4.91 120.40 106.27 1sxe s VAL 127 Ca 0.14 -2.05 -0.30 0.00 -1.81 0.00 0.00 61.98 57.96 1sxe s VAL 127 Cb -0.07 -1.84 -0.09 0.00 0.56 0.00 0.00 36.38 34.94 1sxe s VAL 127 CO 0.79 -0.75 1.31 -2.16 -0.31 0.00 0.00 175.10 173.98 1sxe s PRO 128 N -3.76 4.38 0.59 4.82 0.04 -1.26 -1.10 135.00 138.71 1sxe s PRO 128 Ca 0.16 2.11 0.32 0.00 0.04 0.00 0.00 61.00 63.63 1sxe s PRO 128 Cb 0.03 -3.15 1.32 0.00 0.04 0.00 0.00 34.50 32.74 1sxe s PRO 128 CO 0.00 -0.23 1.63 0.00 0.04 0.00 0.00 177.00 178.45 1sxe h ALA 129 N 4.74 2.81 -2.34 8.56 0.00 -1.88 -3.35 119.26 127.81 1sxe h ALA 129 Ca -0.46 -0.03 -0.59 0.00 0.00 0.00 0.00 54.91 53.83 1sxe h ALA 129 Cb 1.22 0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.99 1sxe h ALA 129 CO 0.74 -1.40 0.41 0.16 0.00 0.00 0.00 179.25 179.16 1sxe s ASP 130 N -4.43 6.84 0.00 0.00 -4.77 -1.08 -2.80 116.67 110.44 1sxe s ASP 130 Ca -0.04 1.04 0.00 0.00 -3.30 0.00 0.00 52.55 50.25 1sxe s ASP 130 Cb 0.17 -2.43 0.00 0.00 -1.09 0.00 0.00 42.92 39.57 1sxe s ASP 130 CO 0.60 -0.46 0.73 -0.81 0.70 0.00 0.00 175.17 175.92 1sxe n PRO 131 N 5.72 0.79 -0.12 2.11 -0.05 -1.26 -3.11 135.00 139.09 1sxe n PRO 131 Ca 0.04 0.00 -0.16 0.00 -0.05 0.00 0.00 63.50 63.34 1sxe n PRO 131 Cb 0.48 -1.15 -0.13 0.00 -0.05 0.00 0.00 33.50 32.65 1sxe n PRO 131 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 175.50 175.70 1sxe n THR 132 N 0.52 1.46 0.90 0.52 -2.24 -1.26 -3.99 114.28 110.20 1sxe n THR 132 Ca 0.00 -0.66 0.12 0.00 -2.27 0.00 0.00 64.05 61.24 1sxe n THR 132 Cb 0.36 -1.12 0.23 0.00 -2.10 0.00 0.00 70.33 67.70 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 -3.10 2.75 -4.65 3.22 4.77 -1.18 -0.88 117.00 117.93 1sxe n LEU 133 Ca -0.42 -1.03 -0.47 0.00 -0.03 0.00 0.00 56.01 54.06 1sxe n LEU 133 Cb 1.04 -0.09 -0.04 0.00 -2.33 0.00 0.00 43.42 42.00 1sxe n LEU 133 CO 0.31 0.52 1.57 0.79 -1.33 0.00 0.00 177.39 179.25 1sxe n TRP 134 N 1.10 2.27 -1.33 -1.77 7.02 -1.26 -4.83 117.44 118.65 1sxe n TRP 134 Ca 0.17 -0.06 -0.30 0.00 -1.02 0.00 0.00 57.50 56.29 1sxe n TRP 134 Cb 0.53 -2.68 0.11 0.00 -2.42 0.00 0.00 31.31 26.85 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 4.79 4.12 0.19 -0.99 0.15 -1.26 0.11 113.70 120.80 1sxe s SER 135 Ca 0.94 1.54 0.03 0.00 0.70 0.00 0.00 55.95 59.16 1sxe s SER 135 Cb -0.63 -2.26 0.51 0.00 -1.71 0.00 0.00 66.02 61.93 1sxe s SER 135 CO 0.49 -2.24 0.95 0.35 1.20 0.00 0.00 173.24 173.99 1sxe n THR 136 N -3.63 -0.25 0.04 6.45 -2.24 -1.26 0.22 114.28 113.61 1sxe n THR 136 Ca 0.08 1.32 -0.13 0.00 -2.27 0.00 0.00 64.05 63.04 1sxe n THR 136 Cb 0.55 -1.95 -0.14 0.00 -2.10 0.00 0.00 70.33 66.69 1sxe n THR 136 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1sxe h ASP 137 N 0.00 0.23 0.80 3.42 5.19 -1.85 -3.14 116.42 121.06 1sxe h ASP 137 Ca 0.39 -0.34 0.00 0.00 -0.62 0.00 0.00 57.03 56.46 1sxe h ASP 137 Cb 0.84 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 40.28 1sxe h ASP 137 CO -0.56 1.28 0.00 0.45 -3.12 0.00 0.00 179.24 177.30 1sxe h HIS 138 N 0.04 0.00 0.10 4.55 3.86 -0.53 0.67 115.15 123.84 1sxe h HIS 138 Ca -0.21 0.00 -0.33 0.00 -1.16 0.00 0.00 60.37 58.67 1sxe h HIS 138 Cb 1.97 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 30.42 1sxe h HIS 138 CO 0.04 0.00 -1.75 0.28 0.86 0.00 0.00 177.93 177.35 1sxe h VAL 139 N 0.00 0.88 -0.04 2.45 2.07 -1.06 -2.88 116.25 117.68 1sxe h VAL 139 Ca 0.00 -2.59 -0.06 0.00 0.82 0.00 0.00 66.70 64.87 1sxe h VAL 139 Cb 0.40 2.60 -0.01 0.00 -1.52 0.00 0.00 31.29 32.76 1sxe h VAL 139 CO 0.00 0.79 -0.26 -0.09 0.02 0.00 0.00 177.57 178.02 1sxe h ARG 140 N 0.06 0.07 0.27 1.57 2.43 -1.44 -1.46 114.38 115.88 1sxe h ARG 140 Ca -0.33 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 58.81 1sxe h ARG 140 Cb 2.03 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 31.58 1sxe h ARG 140 CO 0.12 0.33 -0.13 0.37 -1.51 0.00 0.00 179.97 179.15 1sxe h GLN 141 N 0.06 -0.35 -0.26 0.20 4.15 -0.81 -2.06 115.11 116.05 1sxe h GLN 141 Ca 0.01 0.02 0.05 0.00 0.77 0.00 0.00 58.65 59.50 1sxe h GLN 141 Cb 0.50 0.08 -0.08 0.00 0.21 0.00 0.00 27.48 28.19 1sxe h GLN 141 CO 0.04 -0.24 -0.47 2.35 -1.93 0.00 0.00 178.83 178.58 1sxe h TRP 142 N -0.48 -1.37 -1.51 3.99 7.01 -1.54 0.39 115.95 122.45 1sxe h TRP 142 Ca -0.04 0.06 0.46 0.00 2.11 0.00 0.00 58.89 61.48 1sxe h TRP 142 Cb 0.28 0.63 -0.10 0.00 -2.10 0.00 0.00 29.16 27.88 1sxe h TRP 142 CO 0.10 -0.48 1.04 1.25 -2.79 0.00 0.00 178.44 177.55 1sxe h LEU 143 N -0.45 0.13 0.00 0.65 5.85 -1.33 1.67 115.31 121.84 1sxe h LEU 143 Ca 0.09 0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.81 1sxe h LEU 143 Cb 0.62 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 1sxe h LEU 143 CO -0.49 -0.08 -0.41 -0.33 -0.34 0.00 0.00 178.44 176.79 1sxe h GLU 144 N 0.06 0.00 0.00 1.25 5.08 -0.25 -3.18 114.58 117.54 1sxe h GLU 144 Ca 0.81 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.17 1sxe h GLU 144 Cb 2.88 0.00 0.00 0.00 0.50 0.00 0.00 28.75 32.13 1sxe h GLU 144 CO -0.21 0.73 0.00 1.87 -1.00 0.00 0.00 179.01 180.40 1sxe n TRP 145 N -4.59 0.11 -0.02 4.33 -0.00 0.12 -1.32 117.44 116.06 1sxe n TRP 145 Ca -0.14 0.05 -0.15 0.00 -0.00 0.00 0.00 57.50 57.26 1sxe n TRP 145 Cb 0.44 -0.59 -0.14 0.00 -0.00 0.00 0.00 31.31 31.02 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 -1.54 1.22 0.19 5.87 0.00 0.55 -1.18 120.51 125.61 1sxe n ALA 146 Ca 0.00 -0.76 0.15 0.00 0.00 0.00 0.00 53.44 52.83 1sxe n ALA 146 Cb 0.03 -0.67 0.75 0.00 0.00 0.00 0.00 19.45 19.56 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 0.03 0.69 0.00 0.00 2.07 -1.18 0.47 116.25 118.34 1sxe h VAL 147 Ca -0.39 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.06 1sxe h VAL 147 Cb 2.03 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 32.67 1sxe h VAL 147 CO 0.07 0.00 -1.46 2.29 0.02 0.00 0.00 177.57 178.48 1sxe n LYS 148 N -4.15 0.63 0.01 1.57 2.85 -1.17 -2.08 118.16 115.82 1sxe n LYS 148 Ca 0.02 0.05 -0.11 0.00 -1.05 0.00 0.00 58.31 57.22 1sxe n LYS 148 Cb 0.29 -1.72 -0.09 0.00 -0.65 0.00 0.00 35.03 32.86 1sxe n LYS 148 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 177.40 178.84 1sxe h GLU 149 N 0.00 -0.12 -0.13 -1.58 4.81 0.06 -3.37 114.58 114.25 1sxe h GLU 149 Ca -0.08 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 1sxe h GLU 149 Cb 1.23 0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.64 1sxe h GLU 149 CO 0.01 0.42 0.00 0.66 -0.73 0.00 0.00 179.01 179.37 1sxe n TYR 150 N -4.84 0.17 -2.66 0.92 4.01 0.16 -5.01 117.16 109.91 1sxe n TYR 150 Ca -0.08 -0.27 -0.08 0.00 -0.16 0.00 0.00 57.90 57.31 1sxe n TYR 150 Cb 0.29 -0.02 0.04 0.00 -0.31 0.00 0.00 39.34 39.34 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 0.29 0.14 3.59 2.72 0.00 -1.00 -4.95 105.19 105.98 1sxe n GLY 151 Ca 0.06 -0.24 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 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 -3.82 3.51 0.20 0.99 1.43 -0.89 -4.91 118.68 115.19 1sxe s LEU 152 Ca 0.04 0.86 -0.11 0.00 -1.03 0.00 0.00 54.13 53.89 1sxe s LEU 152 Cb -0.02 -3.37 0.17 0.00 0.03 0.00 0.00 46.19 43.00 1sxe s LEU 152 CO 0.31 -1.65 1.84 1.55 0.23 0.00 0.00 176.35 178.64 1sxe h PRO 153 N 11.84 0.81 -1.29 1.29 0.13 -1.92 -3.38 132.00 139.48 1sxe h PRO 153 Ca -0.29 -0.05 -0.34 0.00 -0.87 0.00 0.00 66.00 64.45 1sxe h PRO 153 Cb 1.13 -0.18 -0.25 0.00 0.13 0.00 0.00 31.00 31.83 1sxe h PRO 153 CO 1.09 0.53 -0.70 -3.47 -0.23 0.00 0.00 178.00 175.22 1sxe n ASP 154 N -4.68 -2.08 -4.73 1.44 2.03 -1.26 -5.11 116.55 102.16 1sxe n ASP 154 Ca 0.07 -2.82 -0.36 0.00 0.52 0.00 0.00 54.79 52.19 1sxe n ASP 154 Cb 0.08 0.84 -0.07 0.00 -0.72 0.00 0.00 41.12 41.25 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 0.35 5.32 -0.57 5.18 1.01 -1.26 -5.03 120.40 125.40 1sxe s VAL 155 Ca 0.32 0.49 -0.20 0.00 0.00 0.00 0.00 61.98 62.60 1sxe s VAL 155 Cb 0.08 -3.60 0.08 0.00 0.00 0.00 0.00 36.38 32.93 1sxe s VAL 155 CO -0.14 0.41 0.73 0.21 0.00 0.00 0.00 175.10 176.30 1sxe s ASN 156 N 0.38 6.21 -0.02 3.32 3.04 -1.26 -4.90 114.94 121.71 1sxe s ASN 156 Ca 0.15 -1.11 0.07 0.00 0.04 0.00 0.00 52.86 52.01 1sxe s ASN 156 Cb -0.13 -2.32 -0.24 0.00 -1.54 0.00 0.00 41.25 37.02 1sxe s ASN 156 CO 0.03 -1.09 0.77 0.40 -3.04 0.00 0.00 177.10 174.17 1sxe h ILE 157 N 5.92 1.02 0.00 -5.21 2.04 -1.95 -3.30 117.51 116.02 1sxe h ILE 157 Ca -0.28 -2.80 0.00 0.00 1.00 0.00 0.00 64.86 62.78 1sxe h ILE 157 Cb 1.09 2.56 0.00 0.00 -0.74 0.00 0.00 36.82 39.73 1sxe h ILE 157 CO 1.06 0.67 0.00 0.00 0.00 0.00 0.00 178.15 179.89 1sxe n LEU 158 N -3.22 0.00 -0.01 1.44 -0.00 -1.26 -0.83 117.00 113.12 1sxe n LEU 158 Ca -0.16 0.00 0.06 0.00 -0.00 0.00 0.00 56.01 55.92 1sxe n LEU 158 Cb 1.03 0.00 -0.14 0.00 -0.00 0.00 0.00 43.42 44.31 1sxe n LEU 158 CO 0.46 0.00 -0.68 0.18 -0.00 0.00 0.00 177.39 177.35 1sxe n LEU 159 N -0.65 0.20 0.01 1.47 4.32 -1.24 -4.26 117.00 116.85 1sxe n LEU 159 Ca 0.02 0.08 0.11 0.00 -0.02 0.00 0.00 56.01 56.20 1sxe n LEU 159 Cb 0.01 0.09 0.04 0.00 -1.62 0.00 0.00 43.42 41.94 1sxe n LEU 159 CO 0.01 0.08 0.08 0.49 -1.22 0.00 0.00 177.39 176.83 1sxe n PHE 160 N -2.46 0.15 -0.48 -1.77 3.01 -0.01 -4.42 117.46 111.47 1sxe n PHE 160 Ca -0.09 0.04 0.40 0.00 1.01 0.00 0.00 57.45 58.81 1sxe n PHE 160 Cb 0.70 -0.31 0.71 0.00 -0.01 0.00 0.00 39.48 40.56 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 0.00 0.07 -0.20 -1.08 4.20 -1.73 0.41 115.11 116.79 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 0.64 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.40 1sxe h GLN 161 CO 0.00 0.05 0.00 0.09 -0.67 0.00 0.00 178.83 178.30 1sxe n ASN 162 N -4.37 3.01 -4.66 1.46 3.02 -1.26 -4.47 115.26 107.99 1sxe n ASN 162 Ca 0.35 -1.90 -0.38 0.00 -0.03 0.00 0.00 54.58 52.62 1sxe n ASN 162 Cb 1.50 -0.12 -0.08 0.00 -0.61 0.00 0.00 39.78 40.47 1sxe n ASN 162 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1sxe s ILE 163 N -1.53 5.21 0.86 2.41 1.01 0.14 -4.94 121.20 124.36 1sxe s ILE 163 Ca 0.30 0.65 -0.12 0.00 0.00 0.00 0.00 60.65 61.48 1sxe s ILE 163 Cb 0.19 -3.71 0.14 0.00 0.01 0.00 0.00 42.46 39.09 1sxe s ILE 163 CO 0.27 0.25 1.20 -1.81 0.00 0.00 0.00 174.94 174.85 1sxe s ASP 164 N 1.11 3.86 0.40 3.58 1.11 -1.26 -4.34 116.67 121.14 1sxe s ASP 164 Ca 0.18 0.34 0.10 0.00 0.18 0.00 0.00 52.55 53.35 1sxe s ASP 164 Cb -0.15 -0.63 0.83 0.00 1.07 0.00 0.00 42.92 44.05 1sxe s ASP 164 CO 0.08 -2.25 1.95 1.23 1.18 0.00 0.00 175.17 177.36 1sxe h GLY 165 N -1.20 0.26 2.00 0.21 0.00 0.62 -0.36 103.07 104.60 1sxe h GLY 165 Ca -0.44 -0.15 -0.02 0.00 0.00 0.00 0.00 47.33 46.73 1sxe h GLY 165 CO 0.48 0.14 -0.08 0.07 0.00 0.00 0.00 176.54 177.15 1sxe h LYS 166 N 0.24 0.00 0.00 4.80 2.10 -1.15 0.46 116.57 123.02 1sxe h LYS 166 Ca 0.05 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.57 1sxe h LYS 166 Cb 0.30 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.61 1sxe h LYS 166 CO 0.01 0.08 -1.78 -1.91 -2.00 0.00 0.00 179.45 173.86 1sxe n GLU 167 N -3.30 0.65 0.02 0.07 4.07 -0.57 -3.78 120.64 117.79 1sxe n GLU 167 Ca -0.01 0.01 -0.01 0.00 -0.06 0.00 0.00 57.16 57.10 1sxe n GLU 167 Cb 0.29 -1.65 -0.09 0.00 -0.06 0.00 0.00 31.44 29.93 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 -2.61 0.77 0.19 4.31 7.94 -0.25 -3.68 117.00 123.67 1sxe n LEU 168 Ca -0.12 0.34 0.03 0.00 -1.11 0.00 0.00 56.01 55.16 1sxe n LEU 168 Cb 0.78 0.10 0.40 0.00 0.53 0.00 0.00 43.42 45.24 1sxe n LEU 168 CO 0.44 0.17 0.80 0.00 -1.11 0.00 0.00 177.39 177.69 1sxe n LYS 170 N -4.19 2.19 -3.77 0.00 5.02 -1.24 -4.92 118.16 111.25 1sxe n LYS 170 Ca -0.02 -3.10 -0.37 0.00 -2.02 0.00 0.00 58.31 52.80 1sxe n LYS 170 Cb 0.34 -2.09 -0.06 0.00 -0.02 0.00 0.00 35.03 33.20 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 -3.33 3.58 0.55 1.97 -1.94 -1.09 -5.03 119.30 114.01 1sxe s MET 171 Ca 0.54 0.02 0.06 0.00 -1.71 0.00 0.00 55.69 54.60 1sxe s MET 171 Cb 0.46 -3.18 0.06 0.00 2.01 0.00 0.00 34.83 34.18 1sxe s MET 171 CO 0.07 0.74 0.76 0.95 -0.01 0.00 0.00 175.02 177.53 1sxe s THR 172 N -1.08 2.49 0.55 2.05 -4.23 -1.26 -4.96 115.64 109.20 1sxe s THR 172 Ca 0.19 -0.87 0.24 0.00 -1.18 0.00 0.00 61.69 60.07 1sxe s THR 172 Cb -0.13 -2.62 0.36 0.00 1.34 0.00 0.00 72.50 71.44 1sxe s THR 172 CO 0.08 0.00 2.06 0.07 -0.54 0.00 0.00 174.62 176.29 1sxe h LYS 173 N 0.17 0.00 0.00 3.99 2.10 -1.99 -1.64 116.57 119.20 1sxe h LYS 173 Ca -0.36 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 58.18 1sxe h LYS 173 Cb 1.28 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.60 1sxe h LYS 173 CO 0.44 0.00 -0.79 0.22 -2.00 0.00 0.00 179.45 177.32 1sxe h ASP 174 N 0.00 0.00 0.45 7.07 1.82 -1.99 -3.12 116.42 120.66 1sxe h ASP 174 Ca 0.15 0.00 -0.13 0.00 -0.39 0.00 0.00 57.03 56.66 1sxe h ASP 174 Cb 0.65 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.64 1sxe h ASP 174 CO -0.00 0.46 -0.58 0.44 -1.61 0.00 0.00 179.24 177.95 1sxe h ASP 175 N 0.00 0.15 1.40 2.28 3.32 -1.67 -2.02 116.42 119.88 1sxe h ASP 175 Ca -0.05 -0.08 -0.07 0.00 0.02 0.00 0.00 57.03 56.85 1sxe h ASP 175 Cb 1.40 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.89 1sxe h ASP 175 CO 0.05 0.70 -0.32 -0.26 -1.72 0.00 0.00 179.24 177.69 1sxe h PHE 176 N 0.10 0.00 0.00 4.55 -1.00 -1.55 -3.13 116.94 115.91 1sxe h PHE 176 Ca -0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1sxe h PHE 176 Cb 1.05 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.61 1sxe h PHE 176 CO 0.01 0.32 0.00 1.04 -1.61 0.00 0.00 178.31 178.07 1sxe n GLN 177 N -3.25 0.19 0.00 1.51 6.02 -0.77 0.76 117.38 121.84 1sxe n GLN 177 Ca 0.02 0.12 0.12 0.00 -0.01 0.00 0.00 57.00 57.24 1sxe n GLN 177 Cb 0.60 -1.50 0.13 0.00 1.02 0.00 0.00 30.24 30.48 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 -1.36 1.11 0.00 -1.09 1.85 -1.18 -3.66 116.66 112.33 1sxe n ARG 178 Ca 0.08 -0.84 0.00 0.00 -1.00 0.00 0.00 57.85 56.08 1sxe n ARG 178 Cb 0.19 -1.48 0.00 0.00 -1.05 0.00 0.00 32.46 30.12 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 -0.21 0.00 -3.15 2.89 4.77 -0.70 -4.98 117.00 115.62 1sxe n LEU 179 Ca 0.10 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.11 1sxe n LEU 179 Cb 0.43 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.52 1sxe n LEU 179 CO 0.27 0.00 0.15 -0.89 -1.33 0.00 0.00 177.39 175.59 1sxe s THR 180 N -1.56 -0.90 -0.51 -5.08 2.01 0.23 -4.52 115.64 105.32 1sxe s THR 180 Ca 0.00 0.00 -0.27 0.00 0.31 0.00 0.00 61.69 61.73 1sxe s THR 180 Cb 0.00 -0.49 -0.03 0.00 0.01 0.00 0.00 72.50 71.99 1sxe s THR 180 CO 0.00 0.00 1.95 -2.16 -0.69 0.00 0.00 174.62 173.72 1sxe s PRO 181 N 2.40 2.73 0.57 4.92 0.04 -1.24 -3.71 135.00 140.72 1sxe s PRO 181 Ca 0.14 1.00 0.00 0.00 0.04 0.00 0.00 61.00 62.18 1sxe s PRO 181 Cb -0.06 -4.37 0.00 0.00 0.04 0.00 0.00 34.50 30.10 1sxe s PRO 181 CO -0.18 -2.59 0.00 0.43 0.04 0.00 0.00 177.00 174.70 1sxe n SER 182 N 12.66 -7.62 0.00 6.66 7.64 -1.26 -4.72 113.62 126.98 1sxe n SER 182 Ca 0.24 1.22 0.00 0.00 1.01 0.00 0.00 58.87 61.34 1sxe n SER 182 Cb 0.51 -3.42 0.00 0.00 -1.01 0.00 0.00 64.21 60.29 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 -3.68 0.00 0.04 1.43 4.19 -1.26 -2.78 117.16 115.10 1sxe n TYR 183 Ca 0.01 0.00 -0.10 0.00 3.31 0.00 0.00 57.90 61.11 1sxe n TYR 183 Cb 0.52 0.00 -0.13 0.00 0.49 0.00 0.00 39.34 40.21 1sxe n TYR 183 CO 0.00 0.00 0.00 -0.91 0.91 0.00 0.00 176.86 176.86 1sxe h ASN 184 N 0.00 0.12 0.37 2.98 4.21 -1.84 -2.29 115.58 119.13 1sxe h ASN 184 Ca 0.00 -0.16 -0.01 0.00 1.21 0.00 0.00 56.30 57.34 1sxe h ASN 184 Cb 0.00 -0.04 -0.01 0.00 -1.12 0.00 0.00 38.32 37.15 1sxe h ASN 184 CO 0.00 1.14 -0.26 0.00 -1.29 0.00 0.00 177.43 177.02 1sxe h ALA 185 N 0.85 -0.61 -0.24 -0.83 0.00 -1.67 0.17 119.26 116.93 1sxe h ALA 185 Ca -0.15 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 54.69 1sxe h ALA 185 Cb 1.91 0.33 -0.04 0.00 0.00 0.00 0.00 17.79 19.99 1sxe h ALA 185 CO 0.13 -0.86 -0.03 -0.44 0.00 0.00 0.00 179.25 178.04 1sxe h ASP 186 N -0.62 -0.17 -0.01 0.00 5.19 -1.82 0.14 116.42 119.14 1sxe h ASP 186 Ca -0.03 0.07 0.01 0.00 -0.62 0.00 0.00 57.03 56.45 1sxe h ASP 186 Cb 0.52 0.13 -0.04 0.00 0.18 0.00 0.00 39.33 40.12 1sxe h ASP 186 CO 0.01 -0.05 -0.34 0.40 -3.12 0.00 0.00 179.24 176.14 1sxe h ILE 187 N 0.03 0.00 -0.05 0.35 2.04 -1.16 -2.30 117.51 116.42 1sxe h ILE 187 Ca 0.12 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.00 1sxe h ILE 187 Cb 0.17 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.22 1sxe h ILE 187 CO -0.23 0.00 -0.11 -0.07 0.00 0.00 0.00 178.15 177.75 1sxe h LEU 188 N -0.42 -0.32 0.11 1.44 3.38 -0.43 -2.19 115.31 116.87 1sxe h LEU 188 Ca 0.01 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1sxe h LEU 188 Cb 0.45 0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.35 1sxe h LEU 188 CO -0.23 -0.15 -0.05 0.25 0.09 0.00 0.00 178.44 178.35 1sxe h LEU 189 N -0.16 -0.12 -2.02 1.67 5.85 -0.74 0.31 115.31 120.10 1sxe h LEU 189 Ca 0.06 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.59 1sxe h LEU 189 Cb 0.24 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.30 1sxe h LEU 189 CO -0.15 0.11 -0.03 0.28 -0.34 0.00 0.00 178.44 178.31 1sxe h SER 190 N -0.35 0.00 0.41 1.25 0.02 -1.40 0.76 113.55 114.24 1sxe h SER 190 Ca -0.01 0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 60.67 1sxe h SER 190 Cb 0.29 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.84 1sxe h SER 190 CO 0.02 0.03 -1.14 0.45 -1.14 0.00 0.00 176.83 175.05 1sxe h HIS 191 N 0.00 0.66 -0.47 3.45 3.86 -0.72 -2.95 115.15 118.97 1sxe h HIS 191 Ca -0.00 -0.42 -0.09 0.00 -1.16 0.00 0.00 60.37 58.70 1sxe h HIS 191 Cb 0.06 -0.05 -0.02 0.00 1.06 0.00 0.00 27.41 28.46 1sxe h HIS 191 CO 0.00 1.28 -0.05 1.25 0.86 0.00 0.00 177.93 181.27 1sxe h LEU 192 N 0.17 0.86 -0.90 2.43 5.85 0.64 -2.76 115.31 121.61 1sxe h LEU 192 Ca -0.13 -0.33 0.10 0.00 0.84 0.00 0.00 57.88 58.36 1sxe h LEU 192 Cb 1.82 -0.23 -0.08 0.00 0.37 0.00 0.00 40.66 42.54 1sxe h LEU 192 CO 0.20 0.99 0.54 0.45 -0.34 0.00 0.00 178.44 180.28 1sxe h HIS 193 N 0.72 0.98 -0.01 1.25 3.86 -0.90 -0.97 115.15 120.08 1sxe h HIS 193 Ca 0.13 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.37 1sxe h HIS 193 Cb 0.58 -0.31 -0.00 0.00 1.06 0.00 0.00 27.41 28.74 1sxe h HIS 193 CO 0.04 0.40 0.00 -0.92 0.86 0.00 0.00 177.93 178.31 1sxe h TYR 194 N 0.89 0.03 -0.59 2.45 3.20 -1.35 -3.07 116.97 118.53 1sxe h TYR 194 Ca 0.44 -0.00 0.11 0.00 3.14 0.00 0.00 58.73 62.41 1sxe h TYR 194 Cb 0.41 -0.01 -0.08 0.00 1.54 0.00 0.00 36.73 38.59 1sxe h TYR 194 CO -0.04 0.30 0.12 -0.07 -1.64 0.00 0.00 178.16 176.84 1sxe h LEU 195 N -0.26 0.00 -0.60 2.82 3.38 -1.16 -2.27 115.31 117.22 1sxe h LEU 195 Ca 0.00 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1sxe h LEU 195 Cb 0.29 0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1sxe h LEU 195 CO 0.00 0.01 0.00 -1.14 0.09 0.00 0.00 178.44 177.40 1sxe n ARG 196 N -5.13 0.12 0.28 1.13 0.63 -0.41 -2.20 116.66 111.09 1sxe n ARG 196 Ca 0.08 0.42 0.14 0.00 -0.92 0.00 0.00 57.85 57.57 1sxe n ARG 196 Cb 0.31 -1.77 0.83 0.00 0.45 0.00 0.00 32.46 32.28 1sxe n ARG 196 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1sxe h GLU 197 N 0.00 0.00 -4.77 -0.14 5.08 -1.32 -3.36 114.58 110.06 1sxe h GLU 197 Ca 0.00 0.00 -0.68 0.00 -1.00 0.00 0.00 59.36 57.68 1sxe h GLU 197 Cb 0.25 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 29.25 1sxe h GLU 197 CO 0.00 0.04 -0.60 0.95 -1.00 0.00 0.00 179.01 178.41 1sxe s THR 198 N -4.52 4.16 -0.05 1.13 -4.23 -0.93 -5.10 115.64 106.10 1sxe s THR 198 Ca -0.04 -0.66 -0.10 0.00 -1.18 0.00 0.00 61.69 59.71 1sxe s THR 198 Cb 0.15 -3.16 -0.05 0.00 1.34 0.00 0.00 72.50 70.77 1sxe s THR 198 CO 0.57 0.04 0.26 -2.16 -0.54 0.00 0.00 174.62 172.79 1sxe s PRO 199 N 1.53 3.64 -0.00 3.99 0.04 -1.26 -2.62 135.00 140.31 1sxe s PRO 199 Ca 0.03 0.07 -0.24 0.00 0.04 0.00 0.00 61.00 60.90 1sxe s PRO 199 Cb -0.17 -3.17 -0.17 0.00 0.04 0.00 0.00 34.50 31.03 1sxe s PRO 199 CO 0.04 0.72 1.19 1.25 0.04 0.00 0.00 177.00 180.24 1sxe h LEU 200 N 4.65 -0.29 -1.42 -3.56 7.12 -1.92 -3.47 115.31 116.42 1sxe h LEU 200 Ca -0.53 -0.22 0.00 0.00 0.13 0.00 0.00 57.88 57.26 1sxe h LEU 200 Cb 1.22 0.08 0.00 0.00 -0.53 0.00 0.00 40.66 41.42 1sxe h LEU 200 CO 0.61 0.10 0.00 -0.81 -0.13 0.00 0.00 178.44 178.21