#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zpk s GLN 102 N 0.00 0.04 -0.10 0.54 0.74 -1.26 -5.06 119.66 114.56 1zpk s GLN 102 Ca 0.00 0.41 0.02 0.00 0.05 0.00 0.00 55.36 55.84 1zpk s GLN 102 Cb 0.00 -0.25 0.01 0.00 1.10 0.00 0.00 33.01 33.87 1zpk s GLN 102 CO 0.00 -0.23 -0.14 0.42 -0.55 0.00 0.00 175.29 174.79 1zpk s ILE 103 N 1.63 1.39 0.73 -2.34 1.01 -1.26 -5.14 121.20 117.22 1zpk s ILE 103 Ca -0.04 -0.59 -0.06 0.00 0.00 0.00 0.00 60.65 59.96 1zpk s ILE 103 Cb -0.12 -1.27 0.09 0.00 0.01 0.00 0.00 42.46 41.17 1zpk s ILE 103 CO -0.05 0.42 1.03 0.42 0.00 0.00 0.00 174.94 176.76 1zpk s THR 104 N 0.92 2.24 -0.15 2.92 -4.23 -1.26 -5.02 115.64 111.06 1zpk s THR 104 Ca -0.09 -0.32 0.17 0.00 -1.18 0.00 0.00 61.69 60.27 1zpk s THR 104 Cb -0.15 -2.92 0.31 0.00 1.34 0.00 0.00 72.50 71.08 1zpk s THR 104 CO -0.00 0.00 1.19 0.18 -0.54 0.00 0.00 174.62 175.45 1zpk n LEU 105 N -2.97 2.64 0.25 4.79 4.77 -1.26 -4.57 117.00 120.64 1zpk n LEU 105 Ca 0.10 -2.94 0.08 0.00 -0.03 0.00 0.00 56.01 53.22 1zpk n LEU 105 Cb 0.60 -0.41 0.62 0.00 -2.33 0.00 0.00 43.42 41.91 1zpk n LEU 105 CO 0.49 0.68 0.97 -0.50 -1.33 0.00 0.00 177.39 177.71 1zpk h TRP 106 N 0.41 0.00 -2.31 -1.77 4.06 -2.07 -3.43 115.95 110.85 1zpk h TRP 106 Ca 0.00 0.00 -0.56 0.00 2.06 0.00 0.00 58.89 60.39 1zpk h TRP 106 Cb 1.03 0.00 -0.14 0.00 -1.00 0.00 0.00 29.16 29.06 1zpk h TRP 106 CO 0.10 0.11 -0.69 -0.65 -3.56 0.00 0.00 178.44 173.76 1zpk s GLN 107 N -4.64 1.66 0.26 0.49 -1.52 -1.26 -5.11 119.66 109.54 1zpk s GLN 107 Ca -0.04 -1.83 -0.31 0.00 -1.95 0.00 0.00 55.36 51.23 1zpk s GLN 107 Cb 0.15 -1.47 -0.12 0.00 -0.22 0.00 0.00 33.01 31.35 1zpk s GLN 107 CO 0.65 0.14 1.59 0.54 -0.25 0.00 0.00 175.29 177.96 1zpk n ARG 108 N -0.66 2.56 -2.22 2.91 1.74 -1.26 -4.85 116.66 114.88 1zpk n ARG 108 Ca -0.05 0.91 -0.43 0.00 -0.77 0.00 0.00 57.85 57.51 1zpk n ARG 108 Cb 0.63 -2.69 0.00 0.00 -1.02 0.00 0.00 32.46 29.38 1zpk n ARG 108 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1zpk n PRO 109 N 2.61 3.05 -3.11 5.56 -0.04 -1.26 -4.93 135.00 136.87 1zpk n PRO 109 Ca 0.11 -2.99 -0.39 0.00 -0.04 0.00 0.00 63.50 60.19 1zpk n PRO 109 Cb 0.35 -3.41 -0.05 0.00 -0.04 0.00 0.00 33.50 30.35 1zpk n PRO 109 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1zpk s LEU 110 N 3.36 4.37 0.17 1.53 1.43 -1.26 -0.77 118.68 127.51 1zpk s LEU 110 Ca 0.51 1.19 0.06 0.00 -1.03 0.00 0.00 54.13 54.86 1zpk s LEU 110 Cb 0.08 -3.02 -0.04 0.00 0.03 0.00 0.00 46.19 43.24 1zpk s LEU 110 CO 0.01 -0.01 -0.13 0.68 0.23 0.00 0.00 176.35 177.13 1zpk s VAL 111 N 0.29 1.44 -0.00 -1.59 -7.23 -0.17 -4.95 120.40 108.19 1zpk s VAL 111 Ca 0.34 -2.07 -0.22 0.00 -1.81 0.00 0.00 61.98 58.22 1zpk s VAL 111 Cb -0.18 -1.88 -0.05 0.00 0.56 0.00 0.00 36.38 34.83 1zpk s VAL 111 CO 0.18 -0.63 0.67 -0.89 -0.31 0.00 0.00 175.10 174.12 1zpk s THR 112 N -2.98 4.88 0.19 5.32 2.01 -1.26 -0.82 115.64 122.98 1zpk s THR 112 Ca 0.18 1.40 0.10 0.00 0.31 0.00 0.00 61.69 63.68 1zpk s THR 112 Cb -0.00 -4.01 -0.04 0.00 0.01 0.00 0.00 72.50 68.46 1zpk s THR 112 CO 0.04 0.37 -0.19 0.27 -0.69 0.00 0.00 174.62 174.41 1zpk s ILE 113 N 0.05 2.02 -0.11 1.82 -4.36 0.54 -4.59 121.20 116.57 1zpk s ILE 113 Ca 0.35 -2.04 0.01 0.00 -0.26 0.00 0.00 60.65 58.70 1zpk s ILE 113 Cb -0.19 -1.99 0.02 0.00 1.25 0.00 0.00 42.46 41.55 1zpk s ILE 113 CO 0.19 -0.31 -0.11 -0.75 0.24 0.00 0.00 174.94 174.19 1zpk s LYS 114 N -2.96 1.87 -0.07 0.37 2.20 -0.41 -1.09 119.74 119.66 1zpk s LYS 114 Ca 0.20 -0.41 -0.04 0.00 -0.36 0.00 0.00 55.97 55.36 1zpk s LYS 114 Cb -0.06 -1.74 0.03 0.00 -1.51 0.00 0.00 37.83 34.55 1zpk s LYS 114 CO 0.08 -0.18 0.16 -1.50 -0.36 0.00 0.00 175.35 173.56 1zpk s ILE 115 N 1.36 -0.03 -1.55 5.43 2.07 -0.09 -0.61 121.20 127.77 1zpk s ILE 115 Ca -0.00 0.11 0.00 0.00 -1.41 0.00 0.00 60.65 59.35 1zpk s ILE 115 Cb -0.14 -0.26 0.00 0.00 0.13 0.00 0.00 42.46 42.20 1zpk s ILE 115 CO -0.06 0.05 0.00 0.61 -1.91 0.00 0.00 174.94 173.63 1zpk n GLY 116 N 3.80 -0.49 2.26 1.50 0.00 -1.26 -1.01 105.19 109.99 1zpk n GLY 116 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1zpk n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1zpk n GLY 117 N -0.95 1.35 3.61 -0.02 0.00 -1.26 -5.01 105.19 102.91 1zpk n GLY 117 Ca -0.22 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.49 1zpk n GLY 117 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1zpk s GLN 118 N -0.25 2.55 -0.20 1.61 -0.21 -0.18 -5.12 119.66 117.87 1zpk s GLN 118 Ca 0.00 -0.73 -0.09 0.00 0.02 0.00 0.00 55.36 54.55 1zpk s GLN 118 Cb 0.00 -2.51 -0.05 0.00 1.00 0.00 0.00 33.01 31.45 1zpk s GLN 118 CO 0.00 0.60 0.11 -0.51 -2.12 0.00 0.00 175.29 173.37 1zpk s LEU 119 N -1.53 4.09 0.15 2.90 1.43 -1.26 -0.92 118.68 123.54 1zpk s LEU 119 Ca 0.18 0.18 -0.01 0.00 -1.03 0.00 0.00 54.13 53.46 1zpk s LEU 119 Cb -0.11 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 44.01 1zpk s LEU 119 CO 0.09 0.17 0.06 -0.54 0.23 0.00 0.00 176.35 176.36 1zpk s LYS 120 N 0.41 1.00 0.00 1.70 1.02 -0.25 -5.00 119.74 118.62 1zpk s LYS 120 Ca 0.07 -1.49 0.01 0.00 0.02 0.00 0.00 55.97 54.58 1zpk s LYS 120 Cb -0.12 0.17 -0.04 0.00 -0.52 0.00 0.00 37.83 37.33 1zpk s LYS 120 CO -0.01 -0.27 0.03 -1.21 -0.92 0.00 0.00 175.35 172.97 1zpk s GLU 121 N -4.05 2.87 0.01 1.68 2.02 -1.26 -0.34 118.70 119.63 1zpk s GLU 121 Ca 0.27 -0.58 -0.12 0.00 0.02 0.00 0.00 54.97 54.56 1zpk s GLU 121 Cb 0.07 -2.73 0.01 0.00 0.10 0.00 0.00 34.13 31.59 1zpk s GLU 121 CO 0.04 0.63 0.25 0.00 0.02 0.00 0.00 175.26 176.20 1zpk s ALA 122 N -1.14 -0.60 -0.15 5.21 0.00 -0.00 -4.47 121.76 120.61 1zpk s ALA 122 Ca 0.21 0.07 -0.18 0.00 0.00 0.00 0.00 51.96 52.06 1zpk s ALA 122 Cb -0.12 0.16 -0.04 0.00 0.00 0.00 0.00 23.12 23.12 1zpk s ALA 122 CO 0.12 -0.29 0.48 -1.17 0.00 0.00 0.00 175.76 174.90 1zpk s LEU 123 N -1.59 4.23 -0.35 0.00 2.96 0.26 -1.00 118.68 123.18 1zpk s LEU 123 Ca -0.11 0.74 -0.29 0.00 -0.22 0.00 0.00 54.13 54.25 1zpk s LEU 123 Cb -0.04 -2.68 0.02 0.00 0.50 0.00 0.00 46.19 43.99 1zpk s LEU 123 CO 0.01 -0.06 1.13 -0.76 -1.32 0.00 0.00 176.35 175.36 1zpk s LEU 124 N 0.98 3.86 -0.35 -0.68 1.43 0.05 -0.70 118.68 123.28 1zpk s LEU 124 Ca 0.25 0.96 0.02 0.00 -1.03 0.00 0.00 54.13 54.33 1zpk s LEU 124 Cb -0.15 -3.54 0.10 0.00 0.03 0.00 0.00 46.19 42.63 1zpk s LEU 124 CO 0.10 -1.00 0.10 -0.62 0.23 0.00 0.00 176.35 175.16 1zpk s ASP 125 N 2.04 4.36 0.25 2.29 -1.08 -0.14 -4.77 116.67 119.62 1zpk s ASP 125 Ca 0.48 -2.04 0.24 0.00 -0.52 0.00 0.00 52.55 50.71 1zpk s ASP 125 Cb -0.12 -1.28 0.94 0.00 -1.46 0.00 0.00 42.92 41.01 1zpk s ASP 125 CO 0.20 -0.38 1.73 0.35 0.52 0.00 0.00 175.17 177.60 1zpk n THR 126 N 4.36 0.77 1.35 1.71 -2.24 -1.26 -2.18 114.28 116.78 1zpk n THR 126 Ca 0.02 0.10 0.14 0.00 -2.27 0.00 0.00 64.05 62.05 1zpk n THR 126 Cb 0.41 -1.02 0.69 0.00 -2.10 0.00 0.00 70.33 68.31 1zpk n THR 126 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1zpk n GLY 127 N 0.32 -1.25 3.54 3.38 0.00 -1.26 -4.83 105.19 105.09 1zpk n GLY 127 Ca 0.03 -0.17 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 1zpk n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zpk s ALA 128 N -2.63 3.25 0.23 4.61 0.00 -0.93 -4.99 121.76 121.31 1zpk s ALA 128 Ca 0.26 -0.92 -0.01 0.00 0.00 0.00 0.00 51.96 51.29 1zpk s ALA 128 Cb 0.20 -1.96 0.23 0.00 0.00 0.00 0.00 23.12 21.59 1zpk s ALA 128 CO 0.48 -0.11 1.59 -0.44 0.00 0.00 0.00 175.76 177.28 1zpk h ASP 129 N 7.38 0.56 -2.05 0.00 3.32 -1.88 -0.56 116.42 123.20 1zpk h ASP 129 Ca -0.36 -0.25 -0.59 0.00 0.02 0.00 0.00 57.03 55.84 1zpk h ASP 129 Cb 1.18 -0.16 -0.12 0.00 0.22 0.00 0.00 39.33 40.45 1zpk h ASP 129 CO 0.63 0.91 -0.67 -1.81 -1.72 0.00 0.00 179.24 176.59 1zpk s ASP 130 N -6.86 4.01 -0.22 6.45 1.01 -1.26 -2.62 116.67 117.18 1zpk s ASP 130 Ca -0.07 -0.98 -0.11 0.00 0.71 0.00 0.00 52.55 52.10 1zpk s ASP 130 Cb 0.12 -0.49 -0.05 0.00 1.01 0.00 0.00 42.92 43.51 1zpk s ASP 130 CO 0.82 -0.12 0.17 -0.89 0.21 0.00 0.00 175.17 175.37 1zpk s THR 131 N -2.50 5.36 -0.10 -1.27 2.01 -1.26 -3.22 115.64 114.66 1zpk s THR 131 Ca 0.33 0.24 0.00 0.00 0.31 0.00 0.00 61.69 62.57 1zpk s THR 131 Cb -0.02 -3.51 0.02 0.00 0.01 0.00 0.00 72.50 69.00 1zpk s THR 131 CO 0.18 0.37 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.70 1zpk s VAL 132 N 0.82 1.09 0.14 3.82 1.01 -0.20 -0.55 120.40 126.53 1zpk s VAL 132 Ca 0.09 -0.36 0.11 0.00 0.00 0.00 0.00 61.98 61.81 1zpk s VAL 132 Cb -0.13 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 35.14 1zpk s VAL 132 CO 0.03 0.37 -0.24 -0.76 0.00 0.00 0.00 175.10 174.50 1zpk s LEU 133 N 1.42 2.45 0.89 3.92 1.43 0.40 -0.74 118.68 128.45 1zpk s LEU 133 Ca -0.00 -0.72 -0.12 0.00 -1.03 0.00 0.00 54.13 52.26 1zpk s LEU 133 Cb -0.13 -1.30 0.09 0.00 0.03 0.00 0.00 46.19 44.87 1zpk s LEU 133 CO -0.05 0.17 0.91 -0.62 0.23 0.00 0.00 176.35 176.99 1zpk n GLU 134 N 0.76 -0.21 -1.60 1.70 1.02 -1.26 -1.50 120.64 119.56 1zpk n GLU 134 Ca -0.16 0.00 -0.56 0.00 -0.02 0.00 0.00 57.16 56.42 1zpk n GLU 134 Cb 0.53 -2.21 -0.07 0.00 -0.02 0.00 0.00 31.44 29.67 1zpk n GLU 134 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1zpk n GLU 135 N -3.08 0.78 -3.57 3.49 4.07 -1.20 -4.53 120.64 116.61 1zpk n GLU 135 Ca 0.11 0.28 -0.09 0.00 -0.06 0.00 0.00 57.16 57.40 1zpk n GLU 135 Cb 0.52 -1.89 -0.02 0.00 -0.06 0.00 0.00 31.44 29.99 1zpk n GLU 135 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1zpk s MET 136 N 1.02 1.27 -0.48 5.31 0.23 -1.26 -5.01 119.30 120.38 1zpk s MET 136 Ca 0.90 -0.56 -0.25 0.00 -1.03 0.00 0.00 55.69 54.74 1zpk s MET 136 Cb -1.09 0.53 0.03 0.00 -1.53 0.00 0.00 34.83 32.77 1zpk s MET 136 CO 0.55 -0.57 0.92 0.45 -2.03 0.00 0.00 175.02 174.35 1zpk s SER 137 N -2.75 6.47 -0.10 -1.18 0.15 -1.26 -5.02 113.70 110.01 1zpk s SER 137 Ca 0.05 0.02 0.03 0.00 0.70 0.00 0.00 55.95 56.76 1zpk s SER 137 Cb -0.02 -2.45 0.00 0.00 -1.71 0.00 0.00 66.02 61.85 1zpk s SER 137 CO -0.06 -1.08 -0.21 -0.76 1.20 0.00 0.00 173.24 172.33 1zpk s LEU 138 N 3.78 1.99 0.61 3.45 1.43 -1.26 -4.94 118.68 123.74 1zpk s LEU 138 Ca 0.36 -0.51 -0.14 0.00 -1.03 0.00 0.00 54.13 52.80 1zpk s LEU 138 Cb -0.11 -1.29 -0.03 0.00 0.03 0.00 0.00 46.19 44.79 1zpk s LEU 138 CO 0.25 0.12 1.04 -2.16 0.23 0.00 0.00 176.35 175.83 1zpk s PRO 139 N 0.51 3.35 0.00 1.29 0.04 -1.26 -4.93 135.00 134.00 1zpk s PRO 139 Ca -0.16 1.08 0.00 0.00 0.04 0.00 0.00 61.00 61.96 1zpk s PRO 139 Cb -0.17 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.33 1zpk s PRO 139 CO 0.06 -0.77 0.00 0.41 0.04 0.00 0.00 177.00 176.74 1zpk n GLY 140 N -1.42 -0.60 3.58 0.56 0.00 -1.26 -5.00 105.19 101.05 1zpk n GLY 140 Ca 0.08 -2.27 -0.39 0.00 0.00 0.00 0.00 46.02 43.44 1zpk n GLY 140 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1zpk s ARG 141 N -0.88 3.81 0.47 1.61 0.52 -1.26 -5.08 118.95 118.14 1zpk s ARG 141 Ca 0.00 -0.24 0.07 0.00 -0.52 0.00 0.00 55.73 55.04 1zpk s ARG 141 Cb 0.00 -3.72 0.00 0.00 0.52 0.00 0.00 34.95 31.75 1zpk s ARG 141 CO 0.00 -0.35 0.38 1.67 0.02 0.00 0.00 175.30 177.02 1zpk s TRP 142 N 1.97 2.27 0.00 -0.53 1.48 -1.26 -4.53 118.94 118.34 1zpk s TRP 142 Ca 0.12 -0.63 0.02 0.00 -1.06 0.00 0.00 56.10 54.55 1zpk s TRP 142 Cb -0.16 -2.06 -0.01 0.00 -1.16 0.00 0.00 33.47 30.08 1zpk s TRP 142 CO 0.11 -0.25 -0.08 0.15 -4.06 0.00 0.00 176.95 172.82 1zpk s LYS 143 N -4.18 0.61 0.22 3.25 -0.14 -0.31 -4.91 119.74 114.28 1zpk s LYS 143 Ca 0.43 -0.34 -0.31 0.00 -1.36 0.00 0.00 55.97 54.39 1zpk s LYS 143 Cb -0.02 -0.57 -0.10 0.00 -1.68 0.00 0.00 37.83 35.45 1zpk s LYS 143 CO 0.26 0.15 1.52 -1.25 -0.76 0.00 0.00 175.35 175.27 1zpk s PRO 144 N -0.37 4.22 0.08 -1.68 0.04 -1.26 0.67 135.00 136.71 1zpk s PRO 144 Ca 0.02 2.36 0.00 0.00 0.04 0.00 0.00 61.00 63.42 1zpk s PRO 144 Cb -0.04 -3.12 -0.04 0.00 0.04 0.00 0.00 34.50 31.34 1zpk s PRO 144 CO -0.00 -0.53 -0.03 0.21 0.04 0.00 0.00 177.00 176.69 1zpk s LYS 145 N 0.30 0.76 -0.06 4.56 2.20 0.83 -4.85 119.74 123.48 1zpk s LYS 145 Ca 0.65 -1.31 0.04 0.00 -0.36 0.00 0.00 55.97 54.99 1zpk s LYS 145 Cb -0.43 0.04 0.00 0.00 -1.51 0.00 0.00 37.83 35.93 1zpk s LYS 145 CO 0.38 -0.10 -0.17 1.41 -0.36 0.00 0.00 175.35 176.51 1zpk s MET 146 N -3.91 1.95 0.15 4.03 -2.45 -1.26 0.11 119.30 117.92 1zpk s MET 146 Ca 0.12 -0.60 0.05 0.00 -1.25 0.00 0.00 55.69 54.01 1zpk s MET 146 Cb 0.07 -1.63 -0.04 0.00 1.25 0.00 0.00 34.83 34.48 1zpk s MET 146 CO -0.06 0.18 -0.11 0.96 1.05 0.00 0.00 175.02 177.04 1zpk s ILE 147 N 0.25 1.27 0.26 10.11 -4.36 0.30 -4.96 121.20 124.07 1zpk s ILE 147 Ca -0.09 -2.01 0.11 0.00 -0.26 0.00 0.00 60.65 58.40 1zpk s ILE 147 Cb -0.14 -1.80 -0.05 0.00 1.25 0.00 0.00 42.46 41.73 1zpk s ILE 147 CO 0.04 -0.66 -0.19 -0.83 0.24 0.00 0.00 174.94 173.53 1zpk s GLY 148 N -3.04 1.79 0.00 6.27 0.00 -1.26 -1.12 107.32 109.96 1zpk s GLY 148 Ca 0.16 -1.83 0.00 0.00 0.00 0.00 0.00 44.72 43.05 1zpk s GLY 148 CO 0.02 -1.92 0.00 0.61 0.00 0.00 0.00 173.10 171.81 1zpk n GLY 149 N -0.56 3.68 3.70 0.20 0.00 0.25 -4.99 105.19 107.47 1zpk n GLY 149 Ca -0.06 -0.89 -0.42 0.00 0.00 0.00 0.00 46.02 44.65 1zpk n GLY 149 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1zpk s ILE 150 N -2.09 2.49 0.00 -0.61 -1.09 -1.26 -2.28 121.20 116.35 1zpk s ILE 150 Ca 0.00 0.14 0.00 0.00 -2.23 0.00 0.00 60.65 58.56 1zpk s ILE 150 Cb 0.00 -3.09 0.00 0.00 -1.58 0.00 0.00 42.46 37.79 1zpk s ILE 150 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 174.94 174.32 1zpk n GLY 151 N 4.09 3.10 0.00 6.18 0.00 -1.26 -4.98 105.19 112.32 1zpk n GLY 151 Ca 0.17 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.28 1zpk n GLY 151 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1zpk n GLY 152 N 0.00 0.25 3.31 -0.02 0.00 -0.97 -5.13 105.19 102.63 1zpk n GLY 152 Ca 0.00 -1.27 -0.26 0.00 0.00 0.00 0.00 46.02 44.49 1zpk n GLY 152 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1zpk s PHE 153 N -4.00 1.94 0.11 1.61 0.40 -1.26 -0.58 117.98 116.20 1zpk s PHE 153 Ca 0.00 -0.40 0.03 0.00 -0.60 0.00 0.00 56.93 55.95 1zpk s PHE 153 Cb 0.00 -1.09 -0.04 0.00 0.51 0.00 0.00 43.02 42.40 1zpk s PHE 153 CO 0.00 0.21 -0.08 0.96 0.70 0.00 0.00 175.22 177.01 1zpk s ILE 154 N -1.04 0.82 -0.05 0.64 -4.36 -0.27 -4.97 121.20 111.96 1zpk s ILE 154 Ca 0.09 -1.92 -0.14 0.00 -0.26 0.00 0.00 60.65 58.42 1zpk s ILE 154 Cb -0.10 -1.66 -0.05 0.00 1.25 0.00 0.00 42.46 41.90 1zpk s ILE 154 CO 0.04 -0.81 0.35 -0.54 0.24 0.00 0.00 174.94 174.23 1zpk s LYS 155 N -3.67 3.93 0.16 0.37 -0.14 -1.26 -0.54 119.74 118.59 1zpk s LYS 155 Ca 0.12 0.28 0.02 0.00 -1.36 0.00 0.00 55.97 55.04 1zpk s LYS 155 Cb 0.04 -3.26 -0.05 0.00 -1.68 0.00 0.00 37.83 32.88 1zpk s LYS 155 CO -0.03 0.59 -0.03 0.14 -0.76 0.00 0.00 175.35 175.27 1zpk s VAL 156 N -0.70 0.81 -0.23 3.17 -7.23 0.31 -4.45 120.40 112.08 1zpk s VAL 156 Ca 0.21 -1.99 -0.13 0.00 -1.81 0.00 0.00 61.98 58.26 1zpk s VAL 156 Cb -0.15 -2.04 -0.04 0.00 0.56 0.00 0.00 36.38 34.71 1zpk s VAL 156 CO 0.10 -0.56 0.29 -0.13 -0.31 0.00 0.00 175.10 174.49 1zpk s ARG 157 N -3.87 4.10 -0.38 4.82 0.52 -0.17 -0.12 118.95 123.85 1zpk s ARG 157 Ca 0.21 -0.03 -0.23 0.00 -0.52 0.00 0.00 55.73 55.16 1zpk s ARG 157 Cb 0.05 -3.56 0.01 0.00 0.52 0.00 0.00 34.95 31.98 1zpk s ARG 157 CO 0.03 -0.04 0.76 -1.14 0.02 0.00 0.00 175.30 174.93 1zpk s GLN 158 N 1.33 3.67 -0.28 3.54 0.74 0.21 -1.35 119.66 127.52 1zpk s GLN 158 Ca 0.13 0.19 -0.10 0.00 0.05 0.00 0.00 55.36 55.62 1zpk s GLN 158 Cb -0.14 -3.84 -0.04 0.00 1.10 0.00 0.00 33.01 30.09 1zpk s GLN 158 CO 0.07 -0.89 0.17 0.71 -0.55 0.00 0.00 175.29 174.80 1zpk s TYR 159 N 3.09 3.19 0.31 1.67 1.51 -0.60 -1.16 117.35 125.36 1zpk s TYR 159 Ca 0.30 -0.06 0.02 0.00 -1.01 0.00 0.00 57.07 56.33 1zpk s TYR 159 Cb -0.13 -2.37 -0.03 0.00 -0.11 0.00 0.00 41.96 39.32 1zpk s TYR 159 CO 0.18 -0.24 0.48 -0.51 -1.11 0.00 0.00 175.55 174.35 1zpk s ASP 160 N 1.72 6.29 -1.21 2.29 1.01 -1.26 -0.64 116.67 124.88 1zpk s ASP 160 Ca 0.07 0.30 -0.13 0.00 0.71 0.00 0.00 52.55 53.49 1zpk s ASP 160 Cb -0.16 -1.95 -0.01 0.00 1.01 0.00 0.00 42.92 41.81 1zpk s ASP 160 CO 0.09 -0.22 0.72 0.00 0.21 0.00 0.00 175.17 175.97 1zpk n GLN 161 N -1.65 -2.23 -4.20 8.23 6.02 -1.16 -4.90 117.38 117.49 1zpk n GLN 161 Ca -0.06 0.50 -0.34 0.00 -0.01 0.00 0.00 57.00 57.09 1zpk n GLN 161 Cb 0.57 -4.47 -0.11 0.00 1.02 0.00 0.00 30.24 27.25 1zpk n GLN 161 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1zpk s ILE 162 N -3.58 4.38 0.01 5.09 -1.09 -0.52 -4.82 121.20 120.66 1zpk s ILE 162 Ca 0.32 -0.19 -0.29 0.00 -2.23 0.00 0.00 60.65 58.27 1zpk s ILE 162 Cb -0.11 -2.94 -0.04 0.00 -1.58 0.00 0.00 42.46 37.79 1zpk s ILE 162 CO 0.85 0.48 0.92 -0.22 -1.23 0.00 0.00 174.94 175.75 1zpk s LEU 163 N 0.29 4.38 0.01 2.97 2.96 -1.26 -2.13 118.68 125.90 1zpk s LEU 163 Ca 0.00 1.59 0.01 0.00 -0.22 0.00 0.00 54.13 55.51 1zpk s LEU 163 Cb -0.13 -3.48 -0.01 0.00 0.50 0.00 0.00 46.19 43.07 1zpk s LEU 163 CO 0.01 -0.19 -0.03 -0.51 -1.32 0.00 0.00 176.35 174.31 1zpk s ILE 164 N 0.77 0.20 -0.22 6.68 2.07 0.59 -4.30 121.20 126.99 1zpk s ILE 164 Ca 0.48 -0.55 -0.03 0.00 -1.41 0.00 0.00 60.65 59.13 1zpk s ILE 164 Cb -0.21 -0.26 -0.00 0.00 0.13 0.00 0.00 42.46 42.12 1zpk s ILE 164 CO 0.26 -0.23 -0.06 -0.70 -1.91 0.00 0.00 174.94 172.31 1zpk s GLU 165 N -0.83 3.31 -0.43 3.50 2.12 0.21 -1.36 118.70 125.23 1zpk s GLU 165 Ca -0.07 -0.66 0.04 0.00 0.36 0.00 0.00 54.97 54.64 1zpk s GLU 165 Cb -0.06 -2.98 0.45 0.00 0.26 0.00 0.00 34.13 31.81 1zpk s GLU 165 CO -0.00 -0.21 1.45 -0.89 -0.54 0.00 0.00 175.26 175.06 1zpk n ILE 166 N 4.78 2.86 0.00 -3.70 5.41 -1.26 -1.28 119.36 126.17 1zpk n ILE 166 Ca -0.18 -3.92 0.00 0.00 1.00 0.00 0.00 62.75 59.65 1zpk n ILE 166 Cb 0.51 -1.16 0.00 0.00 -0.71 0.00 0.00 39.64 38.28 1zpk n ILE 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1zpk n GLY 168 N -0.75 0.00 3.12 7.39 0.00 -1.26 -4.72 105.19 108.98 1zpk n GLY 168 Ca 0.49 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.18 1zpk n GLY 168 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1zpk s HIS 169 N 0.00 3.31 0.02 1.61 4.02 -1.26 -5.10 115.29 117.89 1zpk s HIS 169 Ca 0.00 -2.13 -0.30 0.00 1.02 0.00 0.00 55.06 53.65 1zpk s HIS 169 Cb 0.00 -2.14 -0.04 0.00 -1.02 0.00 0.00 32.58 29.38 1zpk s HIS 169 CO 0.00 -0.85 1.08 0.15 1.02 0.00 0.00 174.74 176.15 1zpk s LYS 170 N 1.17 4.50 0.03 1.40 1.02 -1.26 -4.29 119.74 122.31 1zpk s LYS 170 Ca -0.05 1.58 -0.04 0.00 0.02 0.00 0.00 55.97 57.48 1zpk s LYS 170 Cb -0.20 -3.41 -0.02 0.00 -0.52 0.00 0.00 37.83 33.68 1zpk s LYS 170 CO -0.03 -0.16 0.05 0.14 -0.92 0.00 0.00 175.35 174.43 1zpk s VAL 171 N 1.08 0.14 -0.11 3.17 -7.23 -0.46 -4.99 120.40 111.99 1zpk s VAL 171 Ca 0.55 -1.12 -0.01 0.00 -1.81 0.00 0.00 61.98 59.60 1zpk s VAL 171 Cb -0.25 -0.79 0.03 0.00 0.56 0.00 0.00 36.38 35.93 1zpk s VAL 171 CO 0.28 -0.62 -0.05 -0.63 -0.31 0.00 0.00 175.10 173.77 1zpk s ILE 172 N -2.41 0.86 0.07 -0.62 1.01 -1.26 -0.30 121.20 118.55 1zpk s ILE 172 Ca -0.07 -0.20 -0.07 0.00 0.00 0.00 0.00 60.65 60.31 1zpk s ILE 172 Cb -0.03 -0.93 0.02 0.00 0.01 0.00 0.00 42.46 41.54 1zpk s ILE 172 CO -0.04 0.32 0.34 0.61 0.00 0.00 0.00 174.94 176.17 1zpk n GLY 173 N 4.99 1.13 3.74 6.18 0.00 -0.91 -4.84 105.19 115.48 1zpk n GLY 173 Ca -0.11 -1.01 -0.41 0.00 0.00 0.00 0.00 46.02 44.50 1zpk n GLY 173 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1zpk s THR 174 N -2.43 3.97 -0.09 2.61 2.01 -1.26 -1.44 115.64 119.02 1zpk s THR 174 Ca 0.07 1.79 0.01 0.00 0.31 0.00 0.00 61.69 63.88 1zpk s THR 174 Cb -0.01 -4.14 0.02 0.00 0.01 0.00 0.00 72.50 68.37 1zpk s THR 174 CO 0.02 0.35 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.50 1zpk s VAL 175 N -0.57 1.15 -0.02 3.82 1.01 0.19 -4.50 120.40 121.48 1zpk s VAL 175 Ca 0.46 -0.44 -0.14 0.00 0.00 0.00 0.00 61.98 61.86 1zpk s VAL 175 Cb -0.28 -1.08 -0.05 0.00 0.00 0.00 0.00 36.38 34.97 1zpk s VAL 175 CO 0.34 0.37 0.39 -0.76 0.00 0.00 0.00 175.10 175.44 1zpk s LEU 176 N 1.02 4.45 -0.07 3.92 1.43 0.29 -1.56 118.68 128.16 1zpk s LEU 176 Ca -0.08 0.90 0.04 0.00 -1.03 0.00 0.00 54.13 53.97 1zpk s LEU 176 Cb -0.15 -2.54 -0.00 0.00 0.03 0.00 0.00 46.19 43.53 1zpk s LEU 176 CO -0.01 0.31 -0.20 -0.69 0.23 0.00 0.00 176.35 176.00 1zpk s VAL 177 N -0.95 1.69 -1.24 -1.59 1.01 -0.46 -0.45 120.40 118.41 1zpk s VAL 177 Ca 0.23 -0.83 0.00 0.00 0.00 0.00 0.00 61.98 61.37 1zpk s VAL 177 Cb -0.16 -1.46 0.00 0.00 0.00 0.00 0.00 36.38 34.76 1zpk s VAL 177 CO 0.12 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.31 1zpk n GLY 178 N 3.34 -1.28 2.13 4.51 0.00 -0.56 -1.00 105.19 112.34 1zpk n GLY 178 Ca -0.19 -0.91 -0.23 0.00 0.00 0.00 0.00 46.02 44.69 1zpk n GLY 178 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1zpk n PRO 179 N -0.00 2.71 -3.17 1.61 -0.04 -1.26 -3.28 135.00 131.57 1zpk n PRO 179 Ca 0.00 -1.52 -0.37 0.00 -0.04 0.00 0.00 63.50 61.58 1zpk n PRO 179 Cb 0.00 -2.33 -0.06 0.00 -0.04 0.00 0.00 33.50 31.07 1zpk n PRO 179 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1zpk s THR 180 N 1.41 4.64 0.16 0.52 -1.32 -1.26 -4.98 115.64 114.80 1zpk s THR 180 Ca 0.68 1.21 0.25 0.00 -1.21 0.00 0.00 61.69 62.62 1zpk s THR 180 Cb 0.26 -3.86 0.25 0.00 -1.51 0.00 0.00 72.50 67.64 1zpk s THR 180 CO -0.03 0.29 1.85 1.55 -2.21 0.00 0.00 174.62 176.08 1zpk h PRO 181 N 3.69 0.00 -4.11 7.08 0.14 -1.98 -3.42 132.00 133.39 1zpk h PRO 181 Ca -0.48 0.00 -0.13 0.00 0.14 0.00 0.00 66.00 65.53 1zpk h PRO 181 Cb 1.20 0.00 -0.16 0.00 0.14 0.00 0.00 31.00 32.18 1zpk h PRO 181 CO 0.65 0.21 -0.64 0.95 0.14 0.00 0.00 178.00 179.31 1zpk s THR 182 N -3.70 0.19 -0.07 1.56 -4.23 -1.26 -5.04 115.64 103.09 1zpk s THR 182 Ca 0.00 -1.53 -0.30 0.00 -1.18 0.00 0.00 61.69 58.68 1zpk s THR 182 Cb 0.10 -1.24 -0.03 0.00 1.34 0.00 0.00 72.50 72.68 1zpk s THR 182 CO 0.63 -0.85 1.15 0.20 -0.54 0.00 0.00 174.62 175.21 1zpk s ASN 183 N -2.60 7.10 -0.12 3.99 0.01 -1.26 -4.62 114.94 117.44 1zpk s ASN 183 Ca 0.02 1.74 0.03 0.00 -0.71 0.00 0.00 52.86 53.93 1zpk s ASN 183 Cb 0.04 -2.56 0.01 0.00 0.41 0.00 0.00 41.25 39.15 1zpk s ASN 183 CO -0.08 -0.55 -0.20 -0.69 -1.51 0.00 0.00 177.10 174.07 1zpk s VAL 184 N 2.16 1.85 -0.36 1.60 1.01 0.08 -0.58 120.40 126.17 1zpk s VAL 184 Ca 0.54 -0.86 -0.17 0.00 0.00 0.00 0.00 61.98 61.49 1zpk s VAL 184 Cb -0.23 -1.64 -0.00 0.00 0.00 0.00 0.00 36.38 34.51 1zpk s VAL 184 CO 0.21 0.51 0.43 -0.63 0.00 0.00 0.00 175.10 175.61 1zpk s ILE 185 N 0.76 5.10 0.47 2.22 -1.09 0.12 -1.03 121.20 127.76 1zpk s ILE 185 Ca -0.10 0.07 0.06 0.00 -2.23 0.00 0.00 60.65 58.45 1zpk s ILE 185 Cb -0.16 -3.91 0.08 0.00 -1.58 0.00 0.00 42.46 36.89 1zpk s ILE 185 CO 0.01 -0.20 0.65 0.61 -1.23 0.00 0.00 174.94 174.78 1zpk n GLY 186 N 4.94 1.68 0.24 6.18 0.00 -1.20 -0.97 105.19 116.06 1zpk n GLY 186 Ca -0.07 -2.16 0.09 0.00 0.00 0.00 0.00 46.02 43.88 1zpk n GLY 186 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1zpk h ARG 187 N 0.00 0.00 -0.03 1.61 3.08 -1.09 -0.34 114.38 117.61 1zpk h ARG 187 Ca -0.22 0.00 0.01 0.00 0.07 0.00 0.00 59.98 59.84 1zpk h ARG 187 Cb 0.96 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.01 1zpk h ARG 187 CO 0.29 0.19 0.02 -2.95 -1.07 0.00 0.00 179.97 176.45 1zpk h ASN 188 N 0.00 0.00 0.00 7.04 -1.07 -1.76 -1.19 115.58 118.60 1zpk h ASN 188 Ca -0.00 0.00 -0.22 0.00 0.07 0.00 0.00 56.30 56.15 1zpk h ASN 188 Cb 0.43 0.00 -0.04 0.00 -2.07 0.00 0.00 38.32 36.64 1zpk h ASN 188 CO 0.02 0.00 -2.00 0.18 0.07 0.00 0.00 177.43 175.71 1zpk n LEU 189 N -4.39 0.00 -0.04 6.14 4.77 -0.69 -4.40 117.00 118.38 1zpk n LEU 189 Ca -0.02 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 55.97 1zpk n LEU 189 Cb 0.11 0.29 0.32 0.00 -2.33 0.00 0.00 43.42 41.82 1zpk n LEU 189 CO 0.33 0.29 1.05 -0.07 -1.33 0.00 0.00 177.39 177.66 1zpk h LEU 190 N 0.00 0.55 -1.70 2.23 3.38 -0.70 -0.79 115.31 118.29 1zpk h LEU 190 Ca -0.32 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.55 1zpk h LEU 190 Cb 1.67 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 42.28 1zpk h LEU 190 CO 0.02 0.52 -0.16 0.71 0.09 0.00 0.00 178.44 179.61 1zpk h THR 191 N 0.61 1.08 0.00 0.22 1.35 -1.44 -1.90 112.91 112.82 1zpk h THR 191 Ca 0.15 -0.56 0.00 0.00 -0.55 0.00 0.00 66.41 65.45 1zpk h THR 191 Cb 0.15 1.30 0.00 0.00 -1.73 0.00 0.00 68.15 67.87 1zpk h THR 191 CO -0.01 0.16 -0.01 1.56 -0.25 0.00 0.00 175.52 176.96 1zpk h GLN 192 N 0.00 0.00 -0.72 4.72 1.08 -1.35 -2.61 115.11 116.23 1zpk h GLN 192 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1zpk h GLN 192 Cb 0.29 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.72 1zpk h GLN 192 CO 0.02 0.00 0.00 0.44 -0.95 0.00 0.00 178.83 178.34 1zpk n ILE 193 N -2.85 0.99 -2.27 2.54 -5.35 -1.06 -4.94 119.36 106.41 1zpk n ILE 193 Ca 0.04 -0.99 -0.11 0.00 -0.27 0.00 0.00 62.75 61.42 1zpk n ILE 193 Cb 0.50 0.51 -0.00 0.00 -1.74 0.00 0.00 39.64 38.91 1zpk n ILE 193 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1zpk n GLY 194 N 1.63 -0.04 3.73 3.28 0.00 -0.98 -5.00 105.19 107.81 1zpk n GLY 194 Ca 0.24 -0.42 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 1zpk n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zpk s THR 196 N -0.24 1.46 0.07 0.00 -4.23 -1.26 -4.75 115.64 106.70 1zpk s THR 196 Ca 0.47 -2.13 -0.08 0.00 -1.18 0.00 0.00 61.69 58.76 1zpk s THR 196 Cb -0.25 -1.94 -0.06 0.00 1.34 0.00 0.00 72.50 71.60 1zpk s THR 196 CO 0.31 -0.66 0.37 -0.76 -0.54 0.00 0.00 174.62 173.34 1zpk s LEU 197 N -3.22 4.34 -0.01 4.79 1.43 -1.26 -5.07 118.68 119.68 1zpk s LEU 197 Ca 0.19 0.72 -0.00 0.00 -1.03 0.00 0.00 54.13 54.01 1zpk s LEU 197 Cb 0.01 -2.97 0.01 0.00 0.03 0.00 0.00 46.19 43.27 1zpk s LEU 197 CO 0.04 0.17 0.02 0.20 0.23 0.00 0.00 176.35 177.01 1zpk s ASN 198 N -1.84 0.02 0.00 2.29 -0.87 -1.26 -5.28 114.94 108.00 1zpk s ASN 198 Ca 0.33 0.03 0.00 0.00 -1.57 0.00 0.00 52.86 51.65 1zpk s ASN 198 Cb -0.14 -0.02 0.00 0.00 -0.02 0.00 0.00 41.25 41.08 1zpk s ASN 198 CO 0.19 -0.06 0.00 2.22 -2.57 0.00 0.00 177.10 176.88