#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sxe s SER 106 N 0.00 4.40 -1.58 1.61 0.15 -1.26 -5.01 113.70 112.02 1sxe s SER 106 Ca 0.00 -2.39 -0.10 0.00 0.70 0.00 0.00 55.95 54.16 1sxe s SER 106 Cb 0.00 -1.45 -0.05 0.00 -1.71 0.00 0.00 66.02 62.80 1sxe s SER 106 CO 0.00 -0.33 2.83 1.57 1.20 0.00 0.00 173.24 178.51 1sxe n HIS 107 N 3.92 2.54 -1.64 3.44 -0.00 -1.26 -2.96 115.22 119.26 1sxe n HIS 107 Ca 0.04 -3.06 0.00 0.00 0.46 0.00 0.00 57.72 55.16 1sxe n HIS 107 Cb 0.38 -2.43 0.00 0.00 -0.12 0.00 0.00 29.99 27.82 1sxe n HIS 107 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1sxe n MET 108 N 3.61 0.00 0.00 1.57 -0.00 -1.26 -5.02 117.12 116.02 1sxe n MET 108 Ca 0.74 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 58.44 1sxe n MET 108 Cb 0.25 -0.13 0.00 0.00 -0.00 0.00 0.00 33.22 33.33 1sxe n MET 108 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1sxe n GLU 109 N 0.00 0.00 -1.07 3.17 1.02 -1.16 -5.05 120.64 117.56 1sxe n GLU 109 Ca 0.00 0.14 0.15 0.00 -0.02 0.00 0.00 57.16 57.43 1sxe n GLU 109 Cb 0.23 -0.70 -0.04 0.00 -0.02 0.00 0.00 31.44 30.92 1sxe n GLU 109 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1sxe n GLU 110 N -0.93 -2.15 0.00 3.49 2.13 -1.26 -4.82 120.64 117.10 1sxe n GLU 110 Ca 0.00 1.42 0.00 0.00 0.66 0.00 0.00 57.16 59.24 1sxe n GLU 110 Cb 0.00 -2.62 0.00 0.00 0.27 0.00 0.00 31.44 29.09 1sxe n GLU 110 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1sxe n LYS 111 N -3.67 0.00 0.12 5.31 5.02 -1.26 -4.67 118.16 119.00 1sxe n LYS 111 Ca 0.01 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.42 1sxe n LYS 111 Cb 0.49 -1.95 0.34 0.00 -0.02 0.00 0.00 35.03 33.89 1sxe n LYS 111 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1sxe h HIS 112 N 0.00 0.00 -3.54 2.13 3.86 -2.02 -3.39 115.15 112.19 1sxe h HIS 112 Ca 0.00 0.00 -0.69 0.00 -1.16 0.00 0.00 60.37 58.52 1sxe h HIS 112 Cb 0.00 0.00 -0.36 0.00 1.06 0.00 0.00 27.41 28.11 1sxe h HIS 112 CO 0.00 0.00 -0.37 -1.64 0.86 0.00 0.00 177.93 176.78 1sxe s MET 113 N -3.13 2.55 0.60 2.45 -1.94 -1.26 -3.98 119.30 114.59 1sxe s MET 113 Ca 0.10 -2.57 -0.06 0.00 -1.71 0.00 0.00 55.69 51.45 1sxe s MET 113 Cb 0.11 -3.71 0.01 0.00 2.01 0.00 0.00 34.83 33.25 1sxe s MET 113 CO 0.62 -1.17 0.90 -1.25 -0.01 0.00 0.00 175.02 174.11 1sxe s PRO 114 N -0.13 2.85 0.43 2.03 0.04 -1.26 -5.06 135.00 133.90 1sxe s PRO 114 Ca 0.17 -0.06 -0.26 0.00 0.04 0.00 0.00 61.00 60.89 1sxe s PRO 114 Cb -0.20 -2.28 -0.09 0.00 0.04 0.00 0.00 34.50 31.97 1sxe s PRO 114 CO -0.03 -0.74 1.39 -1.25 0.04 0.00 0.00 177.00 176.42 1sxe s PRO 115 N -4.99 3.81 -0.61 0.56 0.04 -1.26 -4.75 135.00 127.79 1sxe s PRO 115 Ca 0.54 2.35 -0.27 0.00 0.04 0.00 0.00 61.00 63.66 1sxe s PRO 115 Cb -0.11 -2.71 -0.16 0.00 0.04 0.00 0.00 34.50 31.56 1sxe s PRO 115 CO 0.45 -0.69 1.87 -2.30 0.04 0.00 0.00 177.00 176.36 1sxe n PRO 116 N -0.04 0.00 0.18 0.56 -0.02 -1.26 -4.80 135.00 129.63 1sxe n PRO 116 Ca 0.04 0.00 0.03 0.00 -2.02 0.00 0.00 63.50 61.55 1sxe n PRO 116 Cb 0.42 -1.13 0.40 0.00 -0.02 0.00 0.00 33.50 33.17 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 8.16 0.05 -1.74 2.55 4.21 -1.85 -3.45 115.58 123.50 1sxe h ASN 117 Ca -0.05 -0.01 -0.53 0.00 1.21 0.00 0.00 56.30 56.92 1sxe h ASN 117 Cb 1.02 -0.01 -0.06 0.00 -1.12 0.00 0.00 38.32 38.15 1sxe h ASN 117 CO 0.96 0.33 -0.48 0.00 -1.29 0.00 0.00 177.43 176.95 1sxe s MET 118 N -4.41 2.44 0.02 0.81 0.23 -1.26 -5.02 119.30 112.11 1sxe s MET 118 Ca -0.04 -1.56 0.22 0.00 -1.03 0.00 0.00 55.69 53.29 1sxe s MET 118 Cb 0.15 -2.24 -0.08 0.00 -1.53 0.00 0.00 34.83 31.13 1sxe s MET 118 CO 0.72 -0.00 0.92 0.25 -2.03 0.00 0.00 175.02 174.88 1sxe n THR 119 N -1.29 0.07 -3.73 3.16 -2.24 -1.26 -4.87 114.28 104.12 1sxe n THR 119 Ca -0.01 -0.18 -0.38 0.00 -2.27 0.00 0.00 64.05 61.21 1sxe n THR 119 Cb 0.62 0.45 -0.12 0.00 -2.10 0.00 0.00 70.33 69.18 1sxe n THR 119 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1sxe s THR 120 N -3.17 3.92 -0.30 4.28 2.01 -1.26 -5.00 115.64 116.12 1sxe s THR 120 Ca 0.04 -1.07 -0.19 0.00 0.31 0.00 0.00 61.69 60.78 1sxe s THR 120 Cb 0.15 -3.21 0.18 0.00 0.01 0.00 0.00 72.50 69.64 1sxe s THR 120 CO 0.84 -0.18 1.28 0.21 -0.69 0.00 0.00 174.62 176.08 1sxe s ASN 121 N 1.43 -0.04 -0.13 3.53 2.47 -0.71 -2.55 114.94 118.94 1sxe s ASN 121 Ca -0.01 0.04 -0.34 0.00 0.42 0.00 0.00 52.86 52.97 1sxe s ASN 121 Cb -0.19 1.04 0.14 0.00 -1.45 0.00 0.00 41.25 40.78 1sxe s ASN 121 CO 0.03 -0.01 1.32 -0.70 -3.72 0.00 0.00 177.10 174.02 1sxe s GLU 122 N 2.50 0.23 5.99 0.43 2.12 -0.13 -4.96 118.70 124.87 1sxe s GLU 122 Ca -0.05 -0.11 0.00 0.00 0.36 0.00 0.00 54.97 55.17 1sxe s GLU 122 Cb -0.04 0.09 0.00 0.00 0.26 0.00 0.00 34.13 34.44 1sxe s GLU 122 CO -0.11 -0.10 0.00 0.54 -0.54 0.00 0.00 175.26 175.04 1sxe n ARG 123 N -0.30 0.00 0.00 4.30 5.12 -1.26 -2.98 116.66 121.54 1sxe n ARG 123 Ca -0.04 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.88 1sxe n ARG 123 Cb 0.61 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.91 1sxe n ARG 123 CO 0.00 0.00 0.00 2.89 -1.93 0.00 0.00 177.63 178.59 1sxe n ARG 124 N 0.00 0.00 0.00 5.56 1.85 -1.26 -4.91 116.66 117.90 1sxe n ARG 124 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1sxe n ARG 124 Cb 0.00 -0.68 0.00 0.00 -1.05 0.00 0.00 32.46 30.73 1sxe n ARG 124 CO 0.00 0.00 0.00 1.33 -0.01 0.00 0.00 177.63 178.95 1sxe n VAL 125 N -0.23 0.00 -3.26 8.89 0.24 -1.16 -4.97 118.33 117.84 1sxe n VAL 125 Ca 0.00 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.17 1sxe n VAL 125 Cb 0.00 -0.14 -0.03 0.00 -1.47 0.00 0.00 33.84 32.20 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 -1.52 -0.44 -1.72 1.34 5.41 -1.16 -0.96 119.36 120.30 1sxe n ILE 126 Ca 0.00 -0.20 -0.30 0.00 1.00 0.00 0.00 62.75 63.26 1sxe n ILE 126 Cb 0.11 -0.43 0.17 0.00 -0.71 0.00 0.00 39.64 38.79 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 -3.62 1.93 0.09 1.39 -7.23 -1.26 -1.74 120.40 109.96 1sxe s VAL 127 Ca 0.02 0.00 -0.34 0.00 -1.81 0.00 0.00 61.98 59.85 1sxe s VAL 127 Cb -0.01 -2.88 -0.14 0.00 0.56 0.00 0.00 36.38 33.92 1sxe s VAL 127 CO 0.38 0.00 1.63 -0.81 -0.31 0.00 0.00 175.10 175.99 1sxe n PRO 128 N -3.88 2.06 -0.04 4.82 -0.04 -1.06 -4.79 135.00 132.08 1sxe n PRO 128 Ca 0.13 0.75 0.24 0.00 -0.04 0.00 0.00 63.50 64.58 1sxe n PRO 128 Cb 0.60 -2.52 0.67 0.00 -0.04 0.00 0.00 33.50 32.20 1sxe n PRO 128 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1sxe h ALA 129 N 6.58 2.46 -1.78 0.55 0.00 -1.82 -3.24 119.26 122.01 1sxe h ALA 129 Ca -0.46 -0.02 -0.60 0.00 0.00 0.00 0.00 54.91 53.83 1sxe h ALA 129 Cb 1.27 0.05 -0.11 0.00 0.00 0.00 0.00 17.79 18.99 1sxe h ALA 129 CO 0.89 -1.04 0.65 -0.51 0.00 0.00 0.00 179.25 179.24 1sxe s ASP 130 N -4.76 6.38 0.00 0.00 1.01 -1.25 -1.92 116.67 116.13 1sxe s ASP 130 Ca -0.04 -0.21 0.00 0.00 0.71 0.00 0.00 52.55 53.01 1sxe s ASP 130 Cb 0.16 -2.46 0.00 0.00 1.01 0.00 0.00 42.92 41.63 1sxe s ASP 130 CO 0.55 -1.26 0.80 -2.65 0.21 0.00 0.00 175.17 172.82 1sxe n PRO 131 N 7.62 0.68 -0.11 8.23 -0.02 -1.23 -3.21 135.00 146.97 1sxe n PRO 131 Ca 0.04 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.39 1sxe n PRO 131 Cb 0.48 -1.16 -0.15 0.00 -0.02 0.00 0.00 33.50 32.65 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 0.83 1.42 1.00 3.45 -2.24 -1.26 -4.04 114.28 113.44 1sxe n THR 132 Ca 0.00 -0.78 0.12 0.00 -2.27 0.00 0.00 64.05 61.12 1sxe n THR 132 Cb 0.34 -0.74 0.09 0.00 -2.10 0.00 0.00 70.33 67.93 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 -2.90 2.95 -4.60 3.22 4.77 -1.20 -0.51 117.00 118.74 1sxe n LEU 133 Ca -0.37 -0.99 -0.49 0.00 -0.03 0.00 0.00 56.01 54.13 1sxe n LEU 133 Cb 1.11 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 42.15 1sxe n LEU 133 CO 0.38 0.49 1.62 0.79 -1.33 0.00 0.00 177.39 179.35 1sxe n TRP 134 N 1.28 2.03 -1.35 -1.77 8.01 -1.26 -4.71 117.44 119.67 1sxe n TRP 134 Ca 0.14 0.11 -0.32 0.00 -1.31 0.00 0.00 57.50 56.11 1sxe n TRP 134 Cb 0.59 -2.62 0.09 0.00 -2.01 0.00 0.00 31.31 27.37 1sxe n TRP 134 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.69 177.13 1sxe s SER 135 N 5.62 4.33 0.29 -0.99 0.15 -1.26 0.10 113.70 121.94 1sxe s SER 135 Ca 1.00 2.08 0.11 0.00 0.70 0.00 0.00 55.95 59.83 1sxe s SER 135 Cb -0.73 -2.56 0.94 0.00 -1.71 0.00 0.00 66.02 61.96 1sxe s SER 135 CO 0.50 -2.16 1.34 0.35 1.20 0.00 0.00 173.24 174.47 1sxe n THR 136 N -3.11 -0.36 0.13 6.45 -2.24 -1.26 0.18 114.28 114.07 1sxe n THR 136 Ca 0.11 1.78 -0.20 0.00 -2.27 0.00 0.00 64.05 63.47 1sxe n THR 136 Cb 0.52 -2.77 -0.15 0.00 -2.10 0.00 0.00 70.33 65.83 1sxe n THR 136 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 1sxe h ASP 137 N 0.00 0.64 0.86 3.42 2.03 -1.87 -3.16 116.42 118.33 1sxe h ASP 137 Ca 0.64 -0.68 0.00 0.00 -0.73 0.00 0.00 57.03 56.25 1sxe h ASP 137 Cb 1.56 -0.21 0.00 0.00 -0.83 0.00 0.00 39.33 39.85 1sxe h ASP 137 CO -0.71 1.53 0.00 1.41 -1.03 0.00 0.00 179.24 180.44 1sxe n HIS 138 N -3.62 0.69 0.05 4.15 8.25 0.13 -1.70 115.22 123.17 1sxe n HIS 138 Ca -0.13 0.25 -0.17 0.00 -0.26 0.00 0.00 57.72 57.41 1sxe n HIS 138 Cb 1.07 -0.91 -0.14 0.00 1.12 0.00 0.00 29.99 31.12 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 1.06 0.00 1.59 2.07 -0.46 -2.87 116.25 117.63 1sxe h VAL 139 Ca 0.00 -2.71 -0.06 0.00 0.82 0.00 0.00 66.70 64.75 1sxe h VAL 139 Cb 0.43 2.71 -0.01 0.00 -1.52 0.00 0.00 31.29 32.90 1sxe h VAL 139 CO 0.00 0.81 -0.27 -0.09 0.02 0.00 0.00 177.57 178.03 1sxe h ARG 140 N 0.07 0.00 0.32 1.57 2.43 -1.49 -1.96 114.38 115.32 1sxe h ARG 140 Ca -0.27 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 58.88 1sxe h ARG 140 Cb 2.03 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.58 1sxe h ARG 140 CO 0.15 0.27 -0.15 0.37 -1.51 0.00 0.00 179.97 179.10 1sxe h GLN 141 N 0.00 -0.42 -0.05 0.20 4.15 -1.17 -1.66 115.11 116.16 1sxe h GLN 141 Ca -0.00 0.03 0.03 0.00 0.77 0.00 0.00 58.65 59.48 1sxe h GLN 141 Cb 0.67 0.09 -0.06 0.00 0.21 0.00 0.00 27.48 28.39 1sxe h GLN 141 CO 0.04 -0.28 -0.45 2.35 -1.93 0.00 0.00 178.83 178.56 1sxe h TRP 142 N -0.63 -1.29 -1.49 3.99 7.01 -1.58 -0.24 115.95 121.72 1sxe h TRP 142 Ca -0.04 0.05 0.47 0.00 2.11 0.00 0.00 58.89 61.47 1sxe h TRP 142 Cb 0.33 0.57 -0.11 0.00 -2.10 0.00 0.00 29.16 27.86 1sxe h TRP 142 CO 0.07 -0.51 1.01 1.25 -2.79 0.00 0.00 178.44 177.47 1sxe h LEU 143 N -0.57 0.16 0.00 0.65 5.85 -1.41 1.44 115.31 121.43 1sxe h LEU 143 Ca 0.05 0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.86 1sxe h LEU 143 Cb 0.66 0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.77 1sxe h LEU 143 CO -0.36 -0.12 -0.01 -0.33 -0.34 0.00 0.00 178.44 177.28 1sxe h GLU 144 N 0.05 0.00 0.00 1.25 5.08 -0.52 -3.15 114.58 117.29 1sxe h GLU 144 Ca 0.83 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.19 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 -0.27 0.76 0.00 1.87 -1.00 0.00 0.00 179.01 180.37 1sxe n TRP 145 N -4.65 0.08 -0.01 4.33 -0.00 0.78 -1.69 117.44 116.27 1sxe n TRP 145 Ca -0.08 0.04 -0.15 0.00 -0.00 0.00 0.00 57.50 57.31 1sxe n TRP 145 Cb 0.37 -0.56 -0.14 0.00 -0.00 0.00 0.00 31.31 30.97 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 -1.53 1.20 0.30 5.87 0.00 0.46 -1.57 120.51 125.24 1sxe n ALA 146 Ca -0.00 -0.70 0.18 0.00 0.00 0.00 0.00 53.44 52.92 1sxe n ALA 146 Cb 0.01 -0.74 0.93 0.00 0.00 0.00 0.00 19.45 19.65 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 0.04 0.25 0.00 0.00 2.07 -1.28 0.38 116.25 117.70 1sxe h VAL 147 Ca -0.37 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 66.89 1sxe h VAL 147 Cb 2.03 1.20 0.00 0.00 -1.52 0.00 0.00 31.29 33.00 1sxe h VAL 147 CO 0.08 0.04 -1.17 2.29 0.02 0.00 0.00 177.57 178.82 1sxe n LYS 148 N -3.36 0.53 -0.01 1.57 2.85 -1.20 -2.46 118.16 116.09 1sxe n LYS 148 Ca -0.02 0.03 -0.08 0.00 -1.05 0.00 0.00 58.31 57.19 1sxe n LYS 148 Cb 0.17 -1.71 -0.06 0.00 -0.65 0.00 0.00 35.03 32.78 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 -0.10 -0.03 -1.58 4.57 -0.14 -3.39 114.58 113.91 1sxe h GLU 149 Ca 0.00 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 1sxe h GLU 149 Cb 0.92 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.54 1sxe h GLU 149 CO 0.00 0.32 0.00 0.66 -1.18 0.00 0.00 179.01 178.81 1sxe n TYR 150 N -4.81 0.03 -2.73 0.92 4.01 0.12 -5.01 117.16 109.70 1sxe n TYR 150 Ca -0.06 -0.06 -0.09 0.00 -0.16 0.00 0.00 57.90 57.53 1sxe n TYR 150 Cb 0.23 -0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.30 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 0.35 -0.06 3.57 2.72 0.00 -1.03 -4.92 105.19 105.82 1sxe n GLY 151 Ca 0.04 -0.08 -0.40 0.00 0.00 0.00 0.00 46.02 45.58 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 -4.43 3.36 -0.47 0.99 1.43 -1.20 -4.90 118.68 113.46 1sxe s LEU 152 Ca 0.06 0.41 -0.03 0.00 -1.03 0.00 0.00 54.13 53.54 1sxe s LEU 152 Cb -0.01 -2.88 0.16 0.00 0.03 0.00 0.00 46.19 43.49 1sxe s LEU 152 CO 0.41 -1.98 2.45 -0.81 0.23 0.00 0.00 176.35 176.65 1sxe n PRO 153 N 8.88 2.30 0.00 1.29 -0.04 -1.26 -3.66 135.00 142.52 1sxe n PRO 153 Ca 0.16 -2.33 0.00 0.00 -0.04 0.00 0.00 63.50 61.29 1sxe n PRO 153 Cb 0.50 -2.03 0.00 0.00 -0.04 0.00 0.00 33.50 31.93 1sxe n PRO 153 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1sxe n ASP 154 N 0.46 0.00 -4.67 3.54 2.03 -1.26 -5.14 116.55 111.51 1sxe n ASP 154 Ca 0.46 0.00 -0.40 0.00 0.52 0.00 0.00 54.79 55.37 1sxe n ASP 154 Cb 0.54 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.88 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 0.00 5.02 -0.29 5.18 1.01 -1.24 -4.86 120.40 125.22 1sxe s VAL 155 Ca 0.00 1.24 -0.08 0.00 0.00 0.00 0.00 61.98 63.14 1sxe s VAL 155 Cb 0.00 -3.97 -0.01 0.00 0.00 0.00 0.00 36.38 32.40 1sxe s VAL 155 CO 0.00 0.13 0.11 0.21 0.00 0.00 0.00 175.10 175.55 1sxe s ASN 156 N 1.13 5.35 -0.05 3.32 2.47 -1.26 -4.99 114.94 120.91 1sxe s ASN 156 Ca 0.30 -0.44 0.07 0.00 0.42 0.00 0.00 52.86 53.21 1sxe s ASN 156 Cb -0.16 -1.96 -0.24 0.00 -1.45 0.00 0.00 41.25 37.44 1sxe s ASN 156 CO 0.11 -0.14 0.64 0.40 -3.72 0.00 0.00 177.10 174.39 1sxe h ILE 157 N 5.65 0.86 0.00 -5.21 2.04 -1.95 -3.30 117.51 115.59 1sxe h ILE 157 Ca -0.34 -2.66 0.00 0.00 1.00 0.00 0.00 64.86 62.86 1sxe h ILE 157 Cb 1.15 2.49 0.00 0.00 -0.74 0.00 0.00 36.82 39.72 1sxe h ILE 157 CO 0.60 0.63 0.00 0.00 0.00 0.00 0.00 178.15 179.38 1sxe n LEU 158 N -3.19 0.00 -0.01 1.44 -0.00 -1.26 -0.85 117.00 113.13 1sxe n LEU 158 Ca -0.20 0.00 -0.00 0.00 -0.00 0.00 0.00 56.01 55.81 1sxe n LEU 158 Cb 1.05 0.00 -0.12 0.00 -0.00 0.00 0.00 43.42 44.35 1sxe n LEU 158 CO 0.45 0.00 -0.57 0.18 -0.00 0.00 0.00 177.39 177.45 1sxe n LEU 159 N -0.68 0.51 0.01 1.47 4.32 -1.24 -4.18 117.00 117.22 1sxe n LEU 159 Ca 0.02 0.23 0.11 0.00 -0.02 0.00 0.00 56.01 56.35 1sxe n LEU 159 Cb 0.01 0.16 0.09 0.00 -1.62 0.00 0.00 43.42 42.06 1sxe n LEU 159 CO 0.01 0.20 0.18 0.49 -1.22 0.00 0.00 177.39 177.05 1sxe n PHE 160 N -2.75 0.13 -0.41 -1.77 3.01 -0.03 -4.26 117.46 111.38 1sxe n PHE 160 Ca -0.14 0.04 0.37 0.00 1.01 0.00 0.00 57.45 58.73 1sxe n PHE 160 Cb 0.87 -0.29 0.73 0.00 -0.01 0.00 0.00 39.48 40.77 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 0.06 -0.02 -1.08 4.20 -1.71 0.41 115.11 116.97 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 0.60 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.37 1sxe h GLN 161 CO 0.00 0.04 -0.26 0.09 -0.67 0.00 0.00 178.83 178.02 1sxe n ASN 162 N -4.24 1.88 -4.69 1.46 5.03 -1.26 -4.66 115.26 108.78 1sxe n ASN 162 Ca 0.30 -1.44 -0.36 0.00 0.87 0.00 0.00 54.58 53.95 1sxe n ASN 162 Cb 1.36 0.23 -0.09 0.00 -1.02 0.00 0.00 39.78 40.27 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 -2.33 5.35 0.33 2.41 1.01 0.14 -4.99 121.20 123.12 1sxe s ILE 163 Ca 0.24 0.29 0.05 0.00 0.00 0.00 0.00 60.65 61.24 1sxe s ILE 163 Cb 0.19 -3.54 0.06 0.00 0.01 0.00 0.00 42.46 39.18 1sxe s ILE 163 CO 0.48 0.36 0.45 -0.90 0.00 0.00 0.00 174.94 175.33 1sxe n ASP 164 N 4.01 1.13 -0.12 3.58 5.75 -1.26 -4.45 116.55 125.19 1sxe n ASP 164 Ca -0.14 -1.83 -0.01 0.00 -0.01 0.00 0.00 54.79 52.80 1sxe n ASP 164 Cb 0.52 -0.25 0.25 0.00 -1.03 0.00 0.00 41.12 40.61 1sxe n ASP 164 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1sxe h GLY 165 N 0.02 0.86 2.00 6.12 0.00 0.62 0.55 103.07 113.23 1sxe h GLY 165 Ca -0.15 -0.42 -0.08 0.00 0.00 0.00 0.00 47.33 46.68 1sxe h GLY 165 CO 0.21 0.40 -0.38 0.07 0.00 0.00 0.00 176.54 176.84 1sxe h LYS 166 N 0.79 0.00 0.00 4.80 2.10 -0.96 0.65 116.57 123.95 1sxe h LYS 166 Ca 0.19 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.68 1sxe h LYS 166 Cb 0.13 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.43 1sxe h LYS 166 CO -0.02 0.38 -1.12 1.49 -2.00 0.00 0.00 179.45 178.18 1sxe h GLU 167 N 0.00 0.00 0.00 0.07 4.57 -1.63 -3.06 114.58 114.53 1sxe h GLU 167 Ca -0.00 0.00 -0.19 0.00 -1.18 0.00 0.00 59.36 57.98 1sxe h GLU 167 Cb 0.76 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.32 1sxe h GLU 167 CO 0.05 0.43 -1.41 1.25 -1.18 0.00 0.00 179.01 178.15 1sxe h LEU 168 N 0.00 0.00 -1.13 1.64 5.85 -0.17 -3.24 115.31 118.26 1sxe h LEU 168 Ca -0.11 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.54 1sxe h LEU 168 Cb 1.57 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.59 1sxe h LEU 168 CO 0.06 0.68 -0.35 0.00 -0.34 0.00 0.00 178.44 178.49 1sxe n LYS 170 N -3.67 3.82 -3.65 0.00 4.01 -1.16 -4.90 118.16 112.62 1sxe n LYS 170 Ca -0.01 -2.85 -0.38 0.00 -0.51 0.00 0.00 58.31 54.57 1sxe n LYS 170 Cb 0.46 -2.17 -0.06 0.00 -0.51 0.00 0.00 35.03 32.75 1sxe n LYS 170 CO 0.00 0.00 0.00 -1.64 -1.11 0.00 0.00 177.40 174.65 1sxe s MET 171 N -2.74 3.75 0.52 1.97 -1.94 -1.02 -5.03 119.30 114.81 1sxe s MET 171 Ca 0.51 0.19 0.07 0.00 -1.71 0.00 0.00 55.69 54.75 1sxe s MET 171 Cb 0.40 -3.22 0.05 0.00 2.01 0.00 0.00 34.83 34.07 1sxe s MET 171 CO 0.13 0.70 0.71 0.95 -0.01 0.00 0.00 175.02 177.50 1sxe s THR 172 N -0.99 2.56 0.55 2.05 -4.23 -1.26 -4.95 115.64 109.38 1sxe s THR 172 Ca 0.20 -0.94 0.24 0.00 -1.18 0.00 0.00 61.69 60.01 1sxe s THR 172 Cb -0.15 -2.62 0.34 0.00 1.34 0.00 0.00 72.50 71.41 1sxe s THR 172 CO 0.09 0.00 2.10 0.50 -0.54 0.00 0.00 174.62 176.77 1sxe h LYS 173 N 0.32 0.00 0.00 3.99 3.64 -1.99 0.18 116.57 122.71 1sxe h LYS 173 Ca -0.36 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 58.94 1sxe h LYS 173 Cb 1.28 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.09 1sxe h LYS 173 CO 0.44 0.00 -0.40 0.22 -2.27 0.00 0.00 179.45 177.44 1sxe h ASP 174 N 0.00 0.00 0.43 4.20 3.58 -1.98 -2.95 116.42 119.70 1sxe h ASP 174 Ca 0.10 0.00 -0.16 0.00 0.42 0.00 0.00 57.03 57.39 1sxe h ASP 174 Cb 0.45 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.49 1sxe h ASP 174 CO -0.00 0.40 -0.67 0.44 -2.88 0.00 0.00 179.24 176.53 1sxe h ASP 175 N 0.00 0.25 1.24 2.28 3.32 -1.33 -2.50 116.42 119.69 1sxe h ASP 175 Ca -0.00 -0.16 -0.13 0.00 0.02 0.00 0.00 57.03 56.76 1sxe h ASP 175 Cb 1.24 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.69 1sxe h ASP 175 CO 0.05 0.85 -0.63 -0.26 -1.72 0.00 0.00 179.24 177.53 1sxe h PHE 176 N 0.15 0.00 -0.00 4.55 -1.00 -1.50 -3.15 116.94 115.99 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 1.20 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.76 1sxe h PHE 176 CO 0.02 0.63 -0.01 1.04 -1.61 0.00 0.00 178.31 178.39 1sxe n GLN 177 N -3.32 0.53 0.00 1.51 6.02 -1.03 0.74 117.38 121.83 1sxe n GLN 177 Ca 0.01 -0.01 0.11 0.00 -0.01 0.00 0.00 57.00 57.10 1sxe n GLN 177 Cb 0.76 -1.50 0.09 0.00 1.02 0.00 0.00 30.24 30.61 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 2.05 0.00 -1.09 1.85 -0.97 -3.66 116.66 113.61 1sxe n ARG 178 Ca 0.16 -1.76 0.00 0.00 -1.00 0.00 0.00 57.85 55.25 1sxe n ARG 178 Cb 0.22 -1.43 0.00 0.00 -1.05 0.00 0.00 32.46 30.20 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 1.15 0.00 -3.08 2.89 4.77 -0.95 -4.98 117.00 116.79 1sxe n LEU 179 Ca 0.13 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 56.13 1sxe n LEU 179 Cb 0.55 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.64 1sxe n LEU 179 CO 0.15 0.00 0.22 -0.89 -1.33 0.00 0.00 177.39 175.54 1sxe s THR 180 N -1.76 -0.74 0.00 -5.08 2.01 0.23 -4.67 115.64 105.62 1sxe s THR 180 Ca 0.00 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.00 1sxe s THR 180 Cb 0.00 -0.13 0.00 0.00 0.01 0.00 0.00 72.50 72.38 1sxe s THR 180 CO 0.00 0.00 0.00 -0.81 -0.69 0.00 0.00 174.62 173.12 1sxe n PRO 181 N 4.39 -0.46 0.00 4.92 -0.04 -1.24 -3.49 135.00 139.07 1sxe n PRO 181 Ca 0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 1sxe n PRO 181 Cb 0.58 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.04 1sxe n PRO 181 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1sxe n SER 182 N -2.73 -1.88 0.00 3.54 7.64 -1.26 -3.54 113.62 115.39 1sxe n SER 182 Ca 0.00 0.00 0.06 0.00 1.01 0.00 0.00 58.87 59.94 1sxe n SER 182 Cb 0.00 0.00 0.29 0.00 -1.01 0.00 0.00 64.21 63.49 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 0.00 0.00 -0.10 1.43 0.18 -1.26 -2.95 117.16 114.46 1sxe n TYR 183 Ca 0.00 0.00 -0.12 0.00 1.88 0.00 0.00 57.90 59.66 1sxe n TYR 183 Cb 0.00 -0.32 -0.04 0.00 -0.38 0.00 0.00 39.34 38.61 1sxe n TYR 183 CO 0.00 0.00 0.00 -0.91 -2.08 0.00 0.00 176.86 173.87 1sxe h ASN 184 N 0.00 0.61 -0.35 9.48 4.21 -1.82 0.42 115.58 128.13 1sxe h ASN 184 Ca 0.00 -0.39 0.07 0.00 1.21 0.00 0.00 56.30 57.19 1sxe h ASN 184 Cb 0.12 -0.17 -0.07 0.00 -1.12 0.00 0.00 38.32 37.08 1sxe h ASN 184 CO 0.00 0.86 -0.14 0.00 -1.29 0.00 0.00 177.43 176.87 1sxe h ALA 185 N 0.76 0.15 -0.07 -0.83 0.00 -1.57 -1.16 119.26 116.55 1sxe h ALA 185 Ca 0.07 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1sxe h ALA 185 Cb 0.62 0.35 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 1sxe h ALA 185 CO 0.04 -0.51 0.05 -0.44 0.00 0.00 0.00 179.25 178.38 1sxe h ASP 186 N -0.07 0.08 -0.27 0.00 5.19 -1.66 0.15 116.42 119.84 1sxe h ASP 186 Ca 0.17 -0.01 0.06 0.00 -0.62 0.00 0.00 57.03 56.64 1sxe h ASP 186 Cb 0.33 -0.02 -0.06 0.00 0.18 0.00 0.00 39.33 39.76 1sxe h ASP 186 CO -0.39 0.07 -0.15 0.40 -3.12 0.00 0.00 179.24 176.04 1sxe h ILE 187 N 0.09 0.54 0.88 0.35 2.04 -0.56 -1.61 117.51 119.24 1sxe h ILE 187 Ca 0.03 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.84 1sxe h ILE 187 Cb -0.00 0.54 0.01 0.00 -0.74 0.00 0.00 36.82 36.63 1sxe h ILE 187 CO -0.01 0.00 -0.42 -0.07 0.00 0.00 0.00 178.15 177.65 1sxe h LEU 188 N -0.13 -1.00 -0.58 1.44 3.38 -1.02 -3.12 115.31 114.28 1sxe h LEU 188 Ca 0.14 0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.19 1sxe h LEU 188 Cb 0.35 0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.31 1sxe h LEU 188 CO -0.35 -0.67 0.33 0.25 0.09 0.00 0.00 178.44 178.10 1sxe h LEU 189 N -1.28 0.52 -2.26 1.67 5.85 -0.67 -1.05 115.31 118.09 1sxe h LEU 189 Ca -0.12 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 1sxe h LEU 189 Cb 0.90 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.84 1sxe h LEU 189 CO 0.20 0.35 -0.05 0.77 -0.34 0.00 0.00 178.44 179.37 1sxe h SER 190 N 0.65 0.00 0.50 1.25 4.64 -1.37 0.06 113.55 119.28 1sxe h SER 190 Ca 0.25 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.34 1sxe h SER 190 Cb 0.09 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1sxe h SER 190 CO -0.13 0.05 -0.98 -0.74 -0.87 0.00 0.00 176.83 174.16 1sxe h HIS 191 N 0.00 0.46 -0.37 4.77 -0.00 -1.14 -2.25 115.15 116.63 1sxe h HIS 191 Ca -0.00 -0.27 -0.03 0.00 -0.00 0.00 0.00 60.37 60.07 1sxe h HIS 191 Cb 0.17 -0.04 -0.02 0.00 -0.00 0.00 0.00 27.41 27.52 1sxe h HIS 191 CO 0.00 1.11 0.11 1.25 -0.00 0.00 0.00 177.93 180.40 1sxe h LEU 192 N 0.15 0.54 -0.51 0.26 5.85 -0.65 0.56 115.31 121.51 1sxe h LEU 192 Ca -0.08 -0.21 -0.17 0.00 0.84 0.00 0.00 57.88 58.27 1sxe h LEU 192 Cb 1.64 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 42.52 1sxe h LEU 192 CO 0.16 0.60 -0.63 1.12 -0.34 0.00 0.00 178.44 179.35 1sxe h HIS 193 N 0.44 0.54 0.14 1.25 2.07 -1.44 0.55 115.15 118.70 1sxe h HIS 193 Ca 0.12 -0.21 -0.01 0.00 -2.85 0.00 0.00 60.37 57.42 1sxe h HIS 193 Cb 0.26 -0.09 -0.00 0.00 2.57 0.00 0.00 27.41 30.15 1sxe h HIS 193 CO 0.01 0.94 -0.07 -0.92 -3.07 0.00 0.00 177.93 174.81 1sxe h TYR 194 N 0.30 -0.19 -0.72 6.12 3.20 -1.02 -2.05 116.97 122.61 1sxe h TYR 194 Ca -0.01 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 61.93 1sxe h TYR 194 Cb 1.18 0.07 -0.06 0.00 1.54 0.00 0.00 36.73 39.45 1sxe h TYR 194 CO 0.04 -0.12 0.39 -0.07 -1.64 0.00 0.00 178.16 176.76 1sxe h LEU 195 N -0.20 0.55 0.00 2.82 3.38 0.23 -2.11 115.31 119.99 1sxe h LEU 195 Ca -0.02 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1sxe h LEU 195 Cb 0.16 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1sxe h LEU 195 CO 0.02 0.33 0.00 -1.14 0.09 0.00 0.00 178.44 177.75 1sxe n ARG 196 N -4.80 0.70 0.00 1.13 0.63 0.18 -3.10 116.66 111.40 1sxe n ARG 196 Ca 0.11 0.01 0.07 0.00 -0.92 0.00 0.00 57.85 57.12 1sxe n ARG 196 Cb 0.23 -1.50 0.39 0.00 0.45 0.00 0.00 32.46 32.03 1sxe n ARG 196 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1sxe n GLU 197 N -1.07 0.26 -3.86 -0.14 -0.58 -0.79 -4.59 120.64 109.87 1sxe n GLU 197 Ca 0.18 0.12 -0.12 0.00 -0.42 0.00 0.00 57.16 56.92 1sxe n GLU 197 Cb 0.11 -1.50 -0.12 0.00 -0.57 0.00 0.00 31.44 29.36 1sxe n GLU 197 CO 0.00 0.00 0.00 -0.08 -0.48 0.00 0.00 177.13 176.57 1sxe s THR 198 N -2.49 0.03 0.40 2.62 -1.32 -1.18 -5.13 115.64 108.57 1sxe s THR 198 Ca 0.16 -0.22 -0.14 0.00 -1.21 0.00 0.00 61.69 60.28 1sxe s THR 198 Cb 0.10 -0.20 -0.08 0.00 -1.51 0.00 0.00 72.50 70.82 1sxe s THR 198 CO 0.22 -0.12 0.81 -2.16 -2.21 0.00 0.00 174.62 171.16 1sxe s PRO 199 N -0.36 3.90 0.53 7.08 0.05 -1.26 -3.77 135.00 141.17 1sxe s PRO 199 Ca -0.04 0.66 -0.16 0.00 0.05 0.00 0.00 61.00 61.51 1sxe s PRO 199 Cb -0.03 -2.34 -0.07 0.00 0.05 0.00 0.00 34.50 32.11 1sxe s PRO 199 CO 0.00 -0.02 0.99 -0.48 0.05 0.00 0.00 177.00 177.54 1sxe s LEU 200 N -3.59 3.58 0.00 -3.56 -0.00 -1.26 -4.78 118.68 109.06 1sxe s LEU 200 Ca 0.54 1.56 0.21 0.00 -0.00 0.00 0.00 54.13 56.44 1sxe s LEU 200 Cb -0.10 -4.50 1.25 0.00 -0.00 0.00 0.00 46.19 42.83 1sxe s LEU 200 CO 0.26 -0.62 1.63 -2.65 -0.00 0.00 0.00 176.35 174.96