#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 2.07 -4.22 1.61 3.41 -1.26 -4.65 113.62 110.57 1sxe n SER 106 Ca 0.00 0.09 -0.13 0.00 -0.26 0.00 0.00 58.87 58.57 1sxe n SER 106 Cb 0.00 -0.70 -0.10 0.00 -0.26 0.00 0.00 64.21 63.15 1sxe n SER 106 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1sxe s HIS 107 N -2.54 1.11 0.00 7.33 0.09 -1.26 -4.84 115.29 115.18 1sxe s HIS 107 Ca -0.27 -0.97 0.00 0.00 -0.00 0.00 0.00 55.06 53.81 1sxe s HIS 107 Cb 0.08 -0.63 0.00 0.00 -0.00 0.00 0.00 32.58 32.02 1sxe s HIS 107 CO 0.70 -0.18 0.00 -0.12 -0.00 0.00 0.00 174.74 175.14 1sxe n MET 108 N -0.18 0.00 -3.67 1.40 1.56 -1.26 -4.82 117.12 110.16 1sxe n MET 108 Ca -0.08 0.00 -0.31 0.00 -0.27 0.00 0.00 57.70 57.03 1sxe n MET 108 Cb 0.62 0.00 -0.05 0.00 2.15 0.00 0.00 33.22 35.95 1sxe n MET 108 CO 0.00 0.00 0.00 -1.21 -0.73 0.00 0.00 175.97 174.03 1sxe s GLU 109 N 0.00 3.62 -1.26 2.12 2.02 -1.26 -4.39 118.70 119.54 1sxe s GLU 109 Ca 0.00 -0.08 -0.01 0.00 0.02 0.00 0.00 54.97 54.90 1sxe s GLU 109 Cb 0.00 -2.84 0.00 0.00 0.10 0.00 0.00 34.13 31.39 1sxe s GLU 109 CO 0.00 0.46 0.86 0.39 0.02 0.00 0.00 175.26 176.99 1sxe n GLU 110 N 0.07 -5.81 -1.69 1.61 4.71 -1.26 -4.34 120.64 113.94 1sxe n GLU 110 Ca -0.02 0.73 -0.44 0.00 -0.01 0.00 0.00 57.16 57.41 1sxe n GLU 110 Cb 0.52 -5.52 -0.04 0.00 -1.01 0.00 0.00 31.44 25.39 1sxe n GLU 110 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1sxe n LYS 111 N -4.24 2.51 -1.52 3.49 5.02 -1.26 -4.74 118.16 117.42 1sxe n LYS 111 Ca -0.28 0.91 -0.13 0.00 -2.02 0.00 0.00 58.31 56.79 1sxe n LYS 111 Cb 0.67 -2.76 -0.10 0.00 -0.02 0.00 0.00 35.03 32.82 1sxe n LYS 111 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1sxe n HIS 112 N 5.05 0.88 -2.81 2.13 8.25 -1.26 -4.57 115.22 122.89 1sxe n HIS 112 Ca 0.18 -0.06 -0.11 0.00 -0.26 0.00 0.00 57.72 57.47 1sxe n HIS 112 Cb 0.33 -2.27 0.04 0.00 1.12 0.00 0.00 29.99 29.22 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 7.97 1.09 0.47 -0.41 2.81 -1.26 -4.54 117.12 123.26 1sxe n MET 113 Ca 0.44 -2.82 -0.19 0.00 -1.81 0.00 0.00 57.70 53.32 1sxe n MET 113 Cb 0.42 -1.09 -0.09 0.00 -0.71 0.00 0.00 33.22 31.75 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 2.79 -1.15 -5.98 0.03 0.11 -1.97 -3.44 132.00 122.40 1sxe h PRO 114 Ca -0.09 0.08 -0.59 0.00 0.11 0.00 0.00 66.00 65.51 1sxe h PRO 114 Cb 1.14 0.26 -0.08 0.00 0.11 0.00 0.00 31.00 32.43 1sxe h PRO 114 CO 0.34 -0.76 0.61 -1.25 -0.21 0.00 0.00 178.00 176.73 1sxe s PRO 115 N -5.75 4.10 -0.80 1.05 0.05 -1.26 -4.99 135.00 127.41 1sxe s PRO 115 Ca -0.18 0.95 -0.26 0.00 0.05 0.00 0.00 61.00 61.56 1sxe s PRO 115 Cb 0.02 -3.69 0.04 0.00 0.05 0.00 0.00 34.50 30.92 1sxe s PRO 115 CO 0.57 -0.69 1.29 -2.14 0.05 0.00 0.00 177.00 176.08 1sxe s PRO 116 N 3.16 3.28 0.00 0.56 0.02 -1.26 -4.83 135.00 135.92 1sxe s PRO 116 Ca 0.39 -0.49 0.00 0.00 0.02 0.00 0.00 61.00 60.92 1sxe s PRO 116 Cb -0.14 -4.44 0.00 0.00 0.02 0.00 0.00 34.50 29.94 1sxe s PRO 116 CO 0.11 -2.13 0.00 0.09 -0.33 0.00 0.00 177.00 174.73 1sxe n ASN 117 N 9.11 0.72 -2.93 2.53 3.02 -1.26 -4.99 115.26 121.46 1sxe n ASN 117 Ca 0.09 -0.64 -0.01 0.00 -0.03 0.00 0.00 54.58 53.99 1sxe n ASN 117 Cb 0.49 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.65 1sxe n ASN 117 CO 0.00 0.00 0.00 1.15 -2.62 0.00 0.00 177.26 175.79 1sxe n MET 118 N -0.41 -2.21 0.17 3.52 0.00 -1.26 -4.90 117.12 112.02 1sxe n MET 118 Ca 0.00 1.94 0.03 0.00 0.00 0.00 0.00 57.70 59.67 1sxe n MET 118 Cb 0.00 -2.83 0.25 0.00 0.00 0.00 0.00 33.22 30.64 1sxe n MET 118 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 175.97 177.12 1sxe h THR 119 N 3.97 1.06 -3.33 3.17 2.02 -1.98 -3.41 112.91 114.42 1sxe h THR 119 Ca -0.12 -1.81 -0.67 0.00 0.77 0.00 0.00 66.41 64.58 1sxe h THR 119 Cb 0.57 2.06 -0.31 0.00 -1.74 0.00 0.00 68.15 68.73 1sxe h THR 119 CO 0.03 0.46 -0.77 -0.89 0.37 0.00 0.00 175.52 174.72 1sxe s THR 120 N -3.52 2.85 0.28 3.16 2.01 -1.26 -5.12 115.64 114.05 1sxe s THR 120 Ca 0.00 -0.77 0.11 0.00 0.31 0.00 0.00 61.69 61.34 1sxe s THR 120 Cb 0.11 -2.32 -0.05 0.00 0.01 0.00 0.00 72.50 70.26 1sxe s THR 120 CO 0.72 0.40 -0.10 0.54 -0.69 0.00 0.00 174.62 175.48 1sxe s ASN 121 N 1.38 4.03 0.72 3.53 6.03 -1.26 -4.17 114.94 125.20 1sxe s ASN 121 Ca 0.04 -0.88 -0.16 0.00 -1.03 0.00 0.00 52.86 50.83 1sxe s ASN 121 Cb -0.15 -0.54 0.03 0.00 -3.03 0.00 0.00 41.25 37.56 1sxe s ASN 121 CO -0.06 -0.01 1.26 1.21 -2.03 0.00 0.00 177.10 177.46 1sxe n GLU 122 N -0.77 0.73 0.07 3.55 4.07 0.32 -4.81 120.64 123.79 1sxe n GLU 122 Ca -0.05 0.31 0.12 0.00 -0.06 0.00 0.00 57.16 57.48 1sxe n GLU 122 Cb 0.60 -2.49 0.46 0.00 -0.06 0.00 0.00 31.44 29.94 1sxe n GLU 122 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1sxe n ARG 123 N -2.47 0.13 -0.01 5.31 5.12 -1.26 -4.14 116.66 119.34 1sxe n ARG 123 Ca 0.15 0.23 -0.01 0.00 -1.93 0.00 0.00 57.85 56.29 1sxe n ARG 123 Cb 0.49 -1.69 -0.00 0.00 -1.16 0.00 0.00 32.46 30.09 1sxe n ARG 123 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1sxe n ARG 124 N -1.93 0.09 -3.70 5.56 3.00 -1.26 -4.96 116.66 113.45 1sxe n ARG 124 Ca 0.05 0.03 -0.37 0.00 -0.01 0.00 0.00 57.85 57.55 1sxe n ARG 124 Cb 0.30 -0.51 -0.07 0.00 0.00 0.00 0.00 32.46 32.19 1sxe n ARG 124 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.63 177.77 1sxe s VAL 125 N -1.41 5.36 -0.84 1.55 -7.23 -1.26 -4.99 120.40 111.58 1sxe s VAL 125 Ca -0.05 0.39 -0.22 0.00 -1.81 0.00 0.00 61.98 60.29 1sxe s VAL 125 Cb 0.01 -3.53 -0.15 0.00 0.56 0.00 0.00 36.38 33.27 1sxe s VAL 125 CO 0.07 0.51 1.92 -0.38 -0.31 0.00 0.00 175.10 176.91 1sxe n ILE 126 N 2.72 1.83 -3.85 -0.62 -0.00 -1.26 -3.12 119.36 115.05 1sxe n ILE 126 Ca -0.16 -1.66 -0.12 0.00 -0.00 0.00 0.00 62.75 60.81 1sxe n ILE 126 Cb 0.53 -2.29 -0.13 0.00 -0.00 0.00 0.00 39.64 37.75 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 6.12 0.00 0.22 1.39 -7.23 -1.26 -4.87 120.40 114.78 1sxe s VAL 127 Ca 0.60 -0.02 -0.32 0.00 -1.81 0.00 0.00 61.98 60.43 1sxe s VAL 127 Cb 0.12 -0.10 -0.13 0.00 0.56 0.00 0.00 36.38 36.82 1sxe s VAL 127 CO 0.13 -0.01 1.46 -0.81 -0.31 0.00 0.00 175.10 175.56 1sxe n PRO 128 N 3.01 2.09 0.28 4.82 -0.04 -1.26 0.12 135.00 144.01 1sxe n PRO 128 Ca -0.12 0.75 0.17 0.00 -0.04 0.00 0.00 63.50 64.25 1sxe n PRO 128 Cb 0.59 -2.44 0.81 0.00 -0.04 0.00 0.00 33.50 32.43 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 4.70 1.52 -1.85 0.55 0.00 -1.82 -3.25 119.26 119.12 1sxe h ALA 129 Ca -0.45 -0.00 -0.61 0.00 0.00 0.00 0.00 54.91 53.85 1sxe h ALA 129 Cb 1.27 0.01 -0.12 0.00 0.00 0.00 0.00 17.79 18.95 1sxe h ALA 129 CO 0.79 -0.40 0.57 0.34 0.00 0.00 0.00 179.25 180.56 1sxe s ASP 130 N -4.69 6.39 0.00 0.00 -1.08 -1.26 -2.21 116.67 113.82 1sxe s ASP 130 Ca -0.04 -0.19 0.00 0.00 -0.52 0.00 0.00 52.55 51.81 1sxe s ASP 130 Cb 0.11 -2.44 0.00 0.00 -1.46 0.00 0.00 42.92 39.12 1sxe s ASP 130 CO 0.35 -1.17 0.97 -2.65 0.52 0.00 0.00 175.17 173.20 1sxe n PRO 131 N 7.36 0.66 -0.11 4.34 -0.02 -1.23 -2.87 135.00 143.13 1sxe n PRO 131 Ca 0.03 0.00 -0.15 0.00 -2.02 0.00 0.00 63.50 61.37 1sxe n PRO 131 Cb 0.48 -1.17 -0.14 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 1.15 1.45 1.17 3.45 -2.24 -1.26 -3.84 114.28 114.17 1sxe n THR 132 Ca 0.00 -0.70 0.13 0.00 -2.27 0.00 0.00 64.05 61.21 1sxe n THR 132 Cb 0.33 -1.01 0.24 0.00 -2.10 0.00 0.00 70.33 67.79 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 -3.04 2.31 -4.60 3.22 4.77 -1.14 -0.56 117.00 117.97 1sxe n LEU 133 Ca -0.40 -0.77 -0.49 0.00 -0.03 0.00 0.00 56.01 54.31 1sxe n LEU 133 Cb 1.06 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 42.09 1sxe n LEU 133 CO 0.34 0.39 1.62 0.79 -1.33 0.00 0.00 177.39 179.20 1sxe n TRP 134 N 0.72 2.02 -1.07 -1.77 8.01 -1.26 -4.80 117.44 119.29 1sxe n TRP 134 Ca 0.15 0.12 -0.32 0.00 -1.31 0.00 0.00 57.50 56.14 1sxe n TRP 134 Cb 0.50 -2.61 0.12 0.00 -2.01 0.00 0.00 31.31 27.31 1sxe n TRP 134 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.69 175.56 1sxe s SER 135 N 5.64 3.76 0.21 -0.99 0.01 -1.26 0.13 113.70 121.21 1sxe s SER 135 Ca 1.00 2.11 0.02 0.00 1.31 0.00 0.00 55.95 60.39 1sxe s SER 135 Cb -0.73 -2.56 0.53 0.00 0.21 0.00 0.00 66.02 63.47 1sxe s SER 135 CO 0.50 -2.54 1.03 0.35 0.41 0.00 0.00 173.24 172.99 1sxe n THR 136 N -3.61 -0.28 0.08 1.44 -2.24 -1.26 0.34 114.28 108.75 1sxe n THR 136 Ca 0.11 1.44 -0.13 0.00 -2.27 0.00 0.00 64.05 63.20 1sxe n THR 136 Cb 0.52 -2.12 -0.13 0.00 -2.10 0.00 0.00 70.33 66.49 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 0.29 0.90 3.42 2.03 -1.80 -3.16 116.42 118.10 1sxe h ASP 137 Ca 0.41 -0.33 0.00 0.00 -0.73 0.00 0.00 57.03 56.38 1sxe h ASP 137 Cb 0.87 -0.10 0.00 0.00 -0.83 0.00 0.00 39.33 39.27 1sxe h ASP 137 CO -0.61 1.26 0.00 1.41 -1.03 0.00 0.00 179.24 180.27 1sxe n HIS 138 N -3.46 0.74 0.05 4.15 8.25 0.15 -1.42 115.22 123.67 1sxe n HIS 138 Ca -0.07 0.27 -0.17 0.00 -0.26 0.00 0.00 57.72 57.49 1sxe n HIS 138 Cb 1.00 -0.93 -0.14 0.00 1.12 0.00 0.00 29.99 31.04 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 1.04 0.00 1.59 2.07 -0.77 -2.97 116.25 117.21 1sxe h VAL 139 Ca 0.00 -2.71 -0.05 0.00 0.82 0.00 0.00 66.70 64.76 1sxe h VAL 139 Cb 0.45 2.69 -0.01 0.00 -1.52 0.00 0.00 31.29 32.90 1sxe h VAL 139 CO 0.00 0.80 -0.22 -0.09 0.02 0.00 0.00 177.57 178.08 1sxe h ARG 140 N 0.06 0.00 0.40 1.57 1.12 -1.51 -2.12 114.38 113.90 1sxe h ARG 140 Ca -0.27 0.00 -0.02 0.00 -1.11 0.00 0.00 59.98 58.58 1sxe h ARG 140 Cb 2.02 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.98 1sxe h ARG 140 CO 0.14 0.22 -0.19 0.37 -3.11 0.00 0.00 179.97 177.40 1sxe h GLN 141 N 0.00 -0.51 0.16 0.20 4.15 -1.09 -1.17 115.11 116.85 1sxe h GLN 141 Ca -0.00 0.04 0.02 0.00 0.77 0.00 0.00 58.65 59.47 1sxe h GLN 141 Cb 0.75 0.12 -0.04 0.00 0.21 0.00 0.00 27.48 28.52 1sxe h GLN 141 CO 0.03 -0.34 -0.35 2.35 -1.93 0.00 0.00 178.83 178.59 1sxe h TRP 142 N -0.70 -0.95 -1.18 3.99 7.01 -1.60 0.50 115.95 123.02 1sxe h TRP 142 Ca -0.05 0.02 0.40 0.00 2.11 0.00 0.00 58.89 61.37 1sxe h TRP 142 Cb 0.41 0.40 -0.14 0.00 -2.10 0.00 0.00 29.16 27.72 1sxe h TRP 142 CO 0.07 -0.46 0.72 1.25 -2.79 0.00 0.00 178.44 177.23 1sxe h LEU 143 N -0.60 0.32 0.04 0.65 5.85 -1.44 1.55 115.31 121.67 1sxe h LEU 143 Ca 0.02 0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 1sxe h LEU 143 Cb 0.62 0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.80 1sxe h LEU 143 CO -0.18 -0.22 -0.02 -0.33 -0.34 0.00 0.00 178.44 177.35 1sxe h GLU 144 N 0.12 -0.05 0.00 1.25 5.08 -0.67 -3.15 114.58 117.17 1sxe h GLU 144 Ca 0.80 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.17 1sxe h GLU 144 Cb 2.30 0.01 0.00 0.00 0.50 0.00 0.00 28.75 31.56 1sxe h GLU 144 CO -0.53 0.59 0.05 1.87 -1.00 0.00 0.00 179.01 179.99 1sxe n TRP 145 N -4.73 0.14 -0.01 4.33 -0.00 0.58 -1.40 117.44 116.35 1sxe n TRP 145 Ca -0.07 0.07 -0.14 0.00 -0.00 0.00 0.00 57.50 57.36 1sxe n TRP 145 Cb 0.32 -0.57 -0.14 0.00 -0.00 0.00 0.00 31.31 30.92 1sxe n TRP 145 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1sxe h ALA 146 N 1.81 0.63 0.00 5.87 0.00 0.21 0.06 119.26 127.84 1sxe h ALA 146 Ca 0.00 -1.43 -0.01 0.00 0.00 0.00 0.00 54.91 53.48 1sxe h ALA 146 Cb 0.10 0.56 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1sxe h ALA 146 CO 0.00 1.47 -0.04 0.28 0.00 0.00 0.00 179.25 180.96 1sxe h VAL 147 N 0.03 0.55 0.00 0.00 2.07 -1.19 0.35 116.25 118.05 1sxe h VAL 147 Ca -0.33 -0.18 -0.07 0.00 0.82 0.00 0.00 66.70 66.94 1sxe h VAL 147 Cb 2.02 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 32.89 1sxe h VAL 147 CO 0.09 0.04 -0.92 0.11 0.02 0.00 0.00 177.57 176.90 1sxe h LYS 148 N 0.00 0.00 0.03 1.57 1.79 -1.43 -2.74 116.57 115.79 1sxe h LYS 148 Ca -0.00 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1sxe h LYS 148 Cb 0.11 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.76 1sxe h LYS 148 CO 0.01 0.16 -0.01 1.49 -1.08 0.00 0.00 179.45 180.01 1sxe h GLU 149 N 0.00 -0.03 -0.14 3.15 4.81 0.45 -3.38 114.58 119.44 1sxe h GLU 149 Ca -0.05 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1sxe h GLU 149 Cb 1.24 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.62 1sxe h GLU 149 CO 0.02 0.61 0.00 0.66 -0.73 0.00 0.00 179.01 179.57 1sxe n TYR 150 N -4.71 0.18 -2.67 0.92 4.01 0.11 -5.00 117.16 109.98 1sxe n TYR 150 Ca -0.07 -0.28 -0.08 0.00 -0.16 0.00 0.00 57.90 57.31 1sxe n TYR 150 Cb 0.32 -0.02 0.04 0.00 -0.31 0.00 0.00 39.34 39.37 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 0.30 0.01 3.63 2.72 0.00 -1.05 -4.95 105.19 105.86 1sxe n GLY 151 Ca 0.06 -0.13 -0.43 0.00 0.00 0.00 0.00 46.02 45.52 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 -4.21 3.90 0.21 0.99 1.43 -1.13 -4.91 118.68 114.96 1sxe s LEU 152 Ca 0.03 1.34 -0.09 0.00 -1.03 0.00 0.00 54.13 54.38 1sxe s LEU 152 Cb -0.00 -3.54 0.20 0.00 0.03 0.00 0.00 46.19 42.88 1sxe s LEU 152 CO 0.37 -1.11 1.86 1.55 0.23 0.00 0.00 176.35 179.24 1sxe h PRO 153 N 9.62 0.88 -0.98 1.29 0.13 -1.92 -3.39 132.00 137.63 1sxe h PRO 153 Ca -0.28 -0.05 -0.08 0.00 -0.87 0.00 0.00 66.00 64.72 1sxe h PRO 153 Cb 1.11 -0.20 -0.18 0.00 0.13 0.00 0.00 31.00 31.86 1sxe h PRO 153 CO 1.02 0.58 -0.45 0.34 -0.23 0.00 0.00 178.00 179.26 1sxe s ASP 154 N -5.78 -1.49 -0.16 1.44 2.15 -1.26 -5.12 116.67 106.44 1sxe s ASP 154 Ca -0.13 -0.98 -0.07 0.00 0.43 0.00 0.00 52.55 51.80 1sxe s ASP 154 Cb 0.16 1.92 -0.04 0.00 -0.30 0.00 0.00 42.92 44.66 1sxe s ASP 154 CO 0.77 -0.14 0.07 -0.69 -0.17 0.00 0.00 175.17 175.02 1sxe s VAL 155 N 1.63 4.92 -0.53 1.11 1.01 -1.26 -5.00 120.40 122.28 1sxe s VAL 155 Ca 0.19 0.00 -0.18 0.00 0.00 0.00 0.00 61.98 61.99 1sxe s VAL 155 Cb -0.03 -3.19 0.08 0.00 0.00 0.00 0.00 36.38 33.24 1sxe s VAL 155 CO -0.07 0.50 0.61 0.21 0.00 0.00 0.00 175.10 176.36 1sxe s ASN 156 N -0.03 6.20 0.04 3.32 3.04 -1.26 -4.91 114.94 121.34 1sxe s ASN 156 Ca 0.07 -1.15 -0.02 0.00 0.04 0.00 0.00 52.86 51.80 1sxe s ASN 156 Cb -0.12 -2.27 -0.27 0.00 -1.54 0.00 0.00 41.25 37.05 1sxe s ASN 156 CO 0.01 -0.92 1.00 0.40 -3.04 0.00 0.00 177.10 174.55 1sxe h ILE 157 N 5.87 1.33 0.00 -5.21 1.08 -1.95 -3.27 117.51 115.35 1sxe h ILE 157 Ca -0.28 -2.96 0.00 0.00 -0.39 0.00 0.00 64.86 61.23 1sxe h ILE 157 Cb 1.10 2.83 0.00 0.00 -3.07 0.00 0.00 36.82 37.67 1sxe h ILE 157 CO 0.99 0.85 0.00 0.00 -0.69 0.00 0.00 178.15 179.30 1sxe n LEU 158 N -3.45 0.00 -0.00 1.44 -0.00 -1.26 -0.87 117.00 112.86 1sxe n LEU 158 Ca -0.12 0.00 0.08 0.00 -0.00 0.00 0.00 56.01 55.98 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 0.51 0.00 -0.67 0.18 -0.00 0.00 0.00 177.39 177.41 1sxe n LEU 159 N -0.61 0.16 0.00 1.47 4.32 -1.23 -4.29 117.00 116.81 1sxe n LEU 159 Ca 0.01 0.06 0.11 0.00 -0.02 0.00 0.00 56.01 56.17 1sxe n LEU 159 Cb 0.00 0.05 -0.02 0.00 -1.62 0.00 0.00 43.42 41.83 1sxe n LEU 159 CO 0.01 0.03 0.05 0.49 -1.22 0.00 0.00 177.39 176.75 1sxe n PHE 160 N -2.40 0.02 -0.48 -1.77 3.01 -0.05 -4.51 117.46 111.28 1sxe n PHE 160 Ca -0.07 0.00 0.41 0.00 1.01 0.00 0.00 57.45 58.80 1sxe n PHE 160 Cb 0.64 -0.10 0.73 0.00 -0.01 0.00 0.00 39.48 40.74 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 -0.27 -1.08 4.20 -1.74 0.54 115.11 116.82 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 0.53 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.30 1sxe h GLN 161 CO 0.00 0.04 0.00 0.09 -0.67 0.00 0.00 178.83 178.29 1sxe n ASN 162 N -4.27 3.18 -4.65 1.46 3.02 -1.26 -4.52 115.26 108.22 1sxe n ASN 162 Ca 0.35 -1.94 -0.38 0.00 -0.03 0.00 0.00 54.58 52.58 1sxe n ASN 162 Cb 1.52 -0.17 -0.09 0.00 -0.61 0.00 0.00 39.78 40.43 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 -1.50 5.25 0.67 2.41 1.01 0.19 -4.96 121.20 124.26 1sxe s ILE 163 Ca 0.33 0.50 0.02 0.00 0.00 0.00 0.00 60.65 61.50 1sxe s ILE 163 Cb 0.20 -3.64 0.11 0.00 0.01 0.00 0.00 42.46 39.13 1sxe s ILE 163 CO 0.28 0.26 0.92 1.51 0.00 0.00 0.00 174.94 177.92 1sxe s ASP 164 N 1.17 4.62 0.40 3.58 1.47 -1.26 -4.37 116.67 122.28 1sxe s ASP 164 Ca 0.14 -0.45 0.08 0.00 1.18 0.00 0.00 52.55 53.50 1sxe s ASP 164 Cb -0.15 -0.02 0.84 0.00 -0.34 0.00 0.00 42.92 43.25 1sxe s ASP 164 CO 0.07 -1.67 2.00 1.23 0.68 0.00 0.00 175.17 177.49 1sxe h GLY 165 N -0.30 0.44 2.00 2.12 0.00 0.11 0.12 103.07 107.56 1sxe h GLY 165 Ca -0.35 -0.20 -0.03 0.00 0.00 0.00 0.00 47.33 46.74 1sxe h GLY 165 CO 0.41 0.19 -0.15 0.07 0.00 0.00 0.00 176.54 177.06 1sxe h LYS 166 N 0.41 0.00 0.00 4.80 2.10 -1.00 0.73 116.57 123.60 1sxe h LYS 166 Ca 0.10 0.00 -0.12 0.00 -2.00 0.00 0.00 60.65 58.63 1sxe h LYS 166 Cb 0.12 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.43 1sxe h LYS 166 CO -0.01 0.15 -1.65 -1.91 -2.00 0.00 0.00 179.45 174.03 1sxe n GLU 167 N -3.38 0.64 0.06 0.07 4.07 -0.06 -3.57 120.64 118.47 1sxe n GLU 167 Ca -0.00 0.04 0.03 0.00 -0.06 0.00 0.00 57.16 57.17 1sxe n GLU 167 Cb 0.35 -1.68 -0.05 0.00 -0.06 0.00 0.00 31.44 30.00 1sxe n GLU 167 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 1sxe h LEU 168 N 0.00 0.00 -1.53 4.31 5.85 -0.11 -3.22 115.31 120.61 1sxe h LEU 168 Ca -0.15 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.53 1sxe h LEU 168 Cb 1.40 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.43 1sxe h LEU 168 CO 0.02 0.42 -0.16 0.00 -0.34 0.00 0.00 178.44 178.38 1sxe n LYS 170 N -4.30 2.58 -3.44 0.00 5.02 -1.22 -4.95 118.16 111.86 1sxe n LYS 170 Ca -0.02 -3.07 -0.38 0.00 -2.02 0.00 0.00 58.31 52.83 1sxe n LYS 170 Cb 0.26 -2.00 -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 -3.13 4.08 0.41 1.97 -1.94 -1.07 -5.03 119.30 114.59 1sxe s MET 171 Ca 0.50 0.41 0.05 0.00 -1.71 0.00 0.00 55.69 54.94 1sxe s MET 171 Cb 0.42 -3.30 0.00 0.00 2.01 0.00 0.00 34.83 33.96 1sxe s MET 171 CO 0.07 0.50 0.57 0.95 -0.01 0.00 0.00 175.02 177.10 1sxe s THR 172 N -0.46 3.51 0.41 2.05 -4.23 -1.26 -4.99 115.64 110.66 1sxe s THR 172 Ca 0.24 -0.88 0.12 0.00 -1.18 0.00 0.00 61.69 59.99 1sxe s THR 172 Cb -0.16 -3.23 0.33 0.00 1.34 0.00 0.00 72.50 70.78 1sxe s THR 172 CO 0.12 -0.11 1.94 0.50 -0.54 0.00 0.00 174.62 176.53 1sxe h LYS 173 N 0.63 0.50 0.00 3.99 3.11 -1.99 -1.28 116.57 121.53 1sxe h LYS 173 Ca -0.43 -0.03 -0.09 0.00 -2.81 0.00 0.00 60.65 57.28 1sxe h LYS 173 Cb 1.27 -0.11 -0.01 0.00 -1.00 0.00 0.00 32.23 32.37 1sxe h LYS 173 CO 0.51 0.33 -0.44 0.22 -2.81 0.00 0.00 179.45 177.26 1sxe h ASP 174 N 0.52 0.00 1.50 4.20 3.58 -1.98 -2.93 116.42 121.31 1sxe h ASP 174 Ca 0.34 0.00 -0.09 0.00 0.42 0.00 0.00 57.03 57.71 1sxe h ASP 174 Cb 0.63 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.67 1sxe h ASP 174 CO -0.12 0.44 -0.41 -0.78 -2.88 0.00 0.00 179.24 175.50 1sxe h ASP 175 N 0.00 0.00 1.42 2.28 3.58 -1.62 -2.62 116.42 119.46 1sxe h ASP 175 Ca -0.00 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 57.32 1sxe h ASP 175 Cb 1.07 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.10 1sxe h ASP 175 CO 0.06 0.41 -0.58 -0.26 -2.88 0.00 0.00 179.24 175.98 1sxe h PHE 176 N 0.00 0.00 0.00 0.28 -1.00 -1.44 -3.25 116.94 111.52 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 1.27 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.83 1sxe h PHE 176 CO 0.00 0.57 0.00 1.04 -1.61 0.00 0.00 178.31 178.31 1sxe n GLN 177 N -3.24 0.51 0.00 1.51 6.02 -1.00 0.71 117.38 121.89 1sxe n GLN 177 Ca 0.02 0.03 0.11 0.00 -0.01 0.00 0.00 57.00 57.15 1sxe n GLN 177 Cb 0.77 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.53 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 -1.20 1.30 0.00 -1.09 1.85 -1.18 -3.51 116.66 112.84 1sxe n ARG 178 Ca 0.14 -1.05 0.00 0.00 -1.00 0.00 0.00 57.85 55.95 1sxe n ARG 178 Cb 0.17 -1.47 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 0.06 0.00 -3.10 2.89 4.77 -0.62 -4.92 117.00 116.07 1sxe n LEU 179 Ca 0.09 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 56.07 1sxe n LEU 179 Cb 0.47 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.55 1sxe n LEU 179 CO 0.27 0.00 0.10 -0.89 -1.33 0.00 0.00 177.39 175.54 1sxe s THR 180 N -1.88 -0.99 0.75 -5.08 2.01 0.22 -4.45 115.64 106.22 1sxe s THR 180 Ca 0.00 -0.23 -0.11 0.00 0.31 0.00 0.00 61.69 61.66 1sxe s THR 180 Cb 0.00 0.00 0.04 0.00 0.01 0.00 0.00 72.50 72.55 1sxe s THR 180 CO 0.00 0.00 1.08 -2.84 -0.69 0.00 0.00 174.62 172.17 1sxe s PRO 181 N 1.62 2.45 3.81 4.92 0.02 -1.23 -3.93 135.00 142.66 1sxe s PRO 181 Ca 0.19 0.98 0.00 0.00 0.02 0.00 0.00 61.00 62.19 1sxe s PRO 181 Cb -0.03 -1.93 0.00 0.00 0.02 0.00 0.00 34.50 32.56 1sxe s PRO 181 CO -0.07 -1.45 0.00 0.43 -0.33 0.00 0.00 177.00 175.59 1sxe n SER 182 N -3.37 0.00 -4.95 2.53 7.64 -1.26 -4.71 113.62 109.50 1sxe n SER 182 Ca 0.08 0.00 -0.23 0.00 1.01 0.00 0.00 58.87 59.72 1sxe n SER 182 Cb 0.54 0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.78 1sxe n SER 182 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 1sxe s TYR 183 N 0.00 2.98 0.00 1.43 1.13 -1.26 -4.21 117.35 117.41 1sxe s TYR 183 Ca 0.00 0.25 0.00 0.00 -1.41 0.00 0.00 57.07 55.91 1sxe s TYR 183 Cb 0.00 -2.83 0.00 0.00 -1.10 0.00 0.00 41.96 38.03 1sxe s TYR 183 CO 0.00 -0.97 0.00 0.09 -2.51 0.00 0.00 175.55 172.16 1sxe n ASN 184 N -2.52 0.00 -0.10 -0.18 3.02 -1.26 -4.66 115.26 109.56 1sxe n ASN 184 Ca 0.07 0.00 -0.06 0.00 -0.03 0.00 0.00 54.58 54.56 1sxe n ASN 184 Cb 0.59 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.78 1sxe n ASN 184 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1sxe h ALA 185 N 0.00 0.33 -0.22 5.41 0.00 -1.73 0.78 119.26 123.83 1sxe h ALA 185 Ca 0.00 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1sxe h ALA 185 Cb 0.00 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1sxe h ALA 185 CO 0.00 -0.39 0.07 0.38 0.00 0.00 0.00 179.25 179.31 1sxe h ASP 186 N 0.12 0.32 -0.23 0.00 2.03 -1.83 -0.77 116.42 116.06 1sxe h ASP 186 Ca 0.17 -0.20 0.05 0.00 -0.73 0.00 0.00 57.03 56.32 1sxe h ASP 186 Cb 0.23 -0.08 -0.05 0.00 -0.83 0.00 0.00 39.33 38.59 1sxe h ASP 186 CO -0.27 0.44 -0.12 0.40 -1.03 0.00 0.00 179.24 178.66 1sxe h ILE 187 N 0.19 0.63 0.18 4.15 2.04 -1.81 0.21 117.51 123.10 1sxe h ILE 187 Ca 0.07 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.92 1sxe h ILE 187 Cb 0.23 0.63 0.00 0.00 -0.74 0.00 0.00 36.82 36.94 1sxe h ILE 187 CO -0.00 0.00 -0.09 -0.07 0.00 0.00 0.00 178.15 177.99 1sxe h LEU 188 N -0.10 -0.21 -0.28 1.44 3.38 -0.84 -3.12 115.31 115.59 1sxe h LEU 188 Ca 0.12 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1sxe h LEU 188 Cb 0.28 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1sxe h LEU 188 CO -0.29 -0.06 0.09 0.25 0.09 0.00 0.00 178.44 178.52 1sxe h LEU 189 N -0.35 0.40 -0.80 1.67 5.85 -0.90 -1.75 115.31 119.42 1sxe h LEU 189 Ca -0.03 -0.20 0.19 0.00 0.84 0.00 0.00 57.88 58.68 1sxe h LEU 189 Cb 0.27 -0.10 -0.12 0.00 0.37 0.00 0.00 40.66 41.07 1sxe h LEU 189 CO 0.04 0.49 0.23 -1.28 -0.34 0.00 0.00 178.44 177.59 1sxe h SER 190 N 0.29 0.08 1.08 1.25 0.87 -0.62 0.14 113.55 116.63 1sxe h SER 190 Ca 0.09 0.16 -0.13 0.00 -1.23 0.00 0.00 61.79 60.68 1sxe h SER 190 Cb 0.23 0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 62.37 1sxe h SER 190 CO -0.00 -0.05 -0.63 -0.74 -0.53 0.00 0.00 176.83 174.88 1sxe h HIS 191 N 0.29 0.00 -0.10 2.24 -0.00 -1.43 -0.97 115.15 115.18 1sxe h HIS 191 Ca 0.47 0.00 -0.06 0.00 -0.00 0.00 0.00 60.37 60.78 1sxe h HIS 191 Cb 0.86 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.26 1sxe h HIS 191 CO -0.24 0.63 -0.22 1.25 -0.00 0.00 0.00 177.93 179.35 1sxe h LEU 192 N 0.00 0.15 0.00 0.26 7.12 0.06 0.47 115.31 123.38 1sxe h LEU 192 Ca -0.01 -0.04 0.00 0.00 0.13 0.00 0.00 57.88 57.96 1sxe h LEU 192 Cb 1.33 -0.04 0.00 0.00 -0.53 0.00 0.00 40.66 41.42 1sxe h LEU 192 CO 0.08 0.39 -0.59 1.41 -0.13 0.00 0.00 178.44 179.59 1sxe n HIS 193 N -4.21 0.34 -0.10 1.25 8.25 0.11 -4.02 115.22 116.84 1sxe n HIS 193 Ca -0.01 0.10 -0.23 0.00 -0.26 0.00 0.00 57.72 57.32 1sxe n HIS 193 Cb 0.32 -0.51 -0.12 0.00 1.12 0.00 0.00 29.99 30.80 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 -1.89 0.45 -0.30 4.41 9.36 -0.25 -4.11 117.16 124.83 1sxe n TYR 194 Ca 0.04 0.14 0.06 0.00 3.32 0.00 0.00 57.90 61.46 1sxe n TYR 194 Cb 0.40 -1.05 0.26 0.00 -0.63 0.00 0.00 39.34 38.32 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 -0.50 0.87 0.00 2.98 3.38 -0.33 -0.93 115.31 120.78 1sxe h LEU 195 Ca -0.55 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.44 1sxe h LEU 195 Cb 1.72 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 42.31 1sxe h LEU 195 CO -0.19 0.53 0.00 -1.14 0.09 0.00 0.00 178.44 177.73 1sxe n ARG 196 N -4.52 0.56 0.12 1.13 0.63 -0.94 -2.81 116.66 110.84 1sxe n ARG 196 Ca 0.15 0.02 0.12 0.00 -0.92 0.00 0.00 57.85 57.22 1sxe n ARG 196 Cb 0.26 -1.50 0.47 0.00 0.45 0.00 0.00 32.46 32.14 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 -1.06 0.21 -3.26 -0.14 -0.58 -0.35 -3.53 120.64 111.94 1sxe n GLU 197 Ca 0.14 0.37 -0.25 0.00 -0.42 0.00 0.00 57.16 57.00 1sxe n GLU 197 Cb 0.09 -1.86 -0.07 0.00 -0.57 0.00 0.00 31.44 29.03 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 -2.25 0.60 -0.84 2.62 5.66 -1.12 -5.13 114.28 113.82 1sxe n THR 198 Ca 0.03 -4.56 -0.30 0.00 -3.05 0.00 0.00 64.05 56.17 1sxe n THR 198 Cb 0.28 -1.84 0.26 0.00 -1.55 0.00 0.00 70.33 67.49 1sxe n THR 198 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 1sxe s PRO 199 N -1.85 -1.91 -0.09 1.09 0.04 -1.23 -4.53 135.00 126.52 1sxe s PRO 199 Ca 0.38 -0.04 -0.21 0.00 0.04 0.00 0.00 61.00 61.17 1sxe s PRO 199 Cb 0.18 -1.51 -0.18 0.00 0.04 0.00 0.00 34.50 33.04 1sxe s PRO 199 CO -0.07 -4.17 0.72 1.25 0.04 0.00 0.00 177.00 174.77 1sxe h LEU 200 N -2.91 -0.06 0.00 -3.56 7.12 -1.87 -3.43 115.31 110.59 1sxe h LEU 200 Ca -0.44 -0.56 0.00 0.00 0.13 0.00 0.00 57.88 57.02 1sxe h LEU 200 Cb 1.31 0.02 0.00 0.00 -0.53 0.00 0.00 40.66 41.45 1sxe h LEU 200 CO 0.31 0.65 0.00 -2.65 -0.13 0.00 0.00 178.44 176.61