#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wkz s GLN 102 N 0.00 3.24 -0.19 0.54 0.74 -1.26 -5.10 119.66 117.63 2wkz s GLN 102 Ca 0.00 -0.73 -0.01 0.00 0.05 0.00 0.00 55.36 54.67 2wkz s GLN 102 Cb 0.00 -2.70 -0.00 0.00 1.10 0.00 0.00 33.01 31.41 2wkz s GLN 102 CO 0.00 -0.04 -0.12 0.42 -0.55 0.00 0.00 175.29 175.01 2wkz s ILE 103 N 0.97 2.85 0.74 -2.34 1.01 -1.26 -5.11 121.20 118.06 2wkz s ILE 103 Ca -0.02 -0.68 -0.10 0.00 0.00 0.00 0.00 60.65 59.85 2wkz s ILE 103 Cb -0.15 -2.25 0.06 0.00 0.01 0.00 0.00 42.46 40.13 2wkz s ILE 103 CO -0.02 0.48 1.10 0.42 0.00 0.00 0.00 174.94 176.92 2wkz s THR 104 N 1.18 2.47 -0.22 2.92 -4.23 -1.26 -5.02 115.64 111.49 2wkz s THR 104 Ca 0.02 0.01 0.13 0.00 -1.18 0.00 0.00 61.69 60.66 2wkz s THR 104 Cb -0.14 -3.12 0.45 0.00 1.34 0.00 0.00 72.50 71.02 2wkz s THR 104 CO -0.04 -0.15 1.33 0.18 -0.54 0.00 0.00 174.62 175.40 2wkz n LEU 105 N -3.09 3.38 0.24 4.79 4.77 -1.26 -4.60 117.00 121.23 2wkz n LEU 105 Ca 0.08 -3.53 0.11 0.00 -0.03 0.00 0.00 56.01 52.64 2wkz n LEU 105 Cb 0.60 -0.55 0.57 0.00 -2.33 0.00 0.00 43.42 41.71 2wkz n LEU 105 CO 0.55 1.08 0.87 -0.50 -1.33 0.00 0.00 177.39 178.06 2wkz h TRP 106 N 0.94 0.00 -3.16 -1.77 4.06 -2.06 -3.43 115.95 110.53 2wkz h TRP 106 Ca 0.08 0.00 -0.42 0.00 2.06 0.00 0.00 58.89 60.61 2wkz h TRP 106 Cb 1.33 0.00 -0.14 0.00 -1.00 0.00 0.00 29.16 29.35 2wkz h TRP 106 CO 0.66 0.18 -0.63 1.14 -3.56 0.00 0.00 178.44 176.22 2wkz s GLN 107 N -3.83 1.48 0.31 0.49 -2.07 -1.26 -5.11 119.66 109.66 2wkz s GLN 107 Ca -0.01 -1.78 -0.29 0.00 -1.82 0.00 0.00 55.36 51.46 2wkz s GLN 107 Cb 0.11 -0.70 -0.11 0.00 -1.09 0.00 0.00 33.01 31.23 2wkz s GLN 107 CO 0.61 -0.15 1.48 1.03 -1.32 0.00 0.00 175.29 176.94 2wkz s ARG 108 N -3.89 4.19 -1.18 9.60 0.52 -1.26 -4.85 118.95 122.08 2wkz s ARG 108 Ca 0.33 2.45 -0.17 0.00 -0.52 0.00 0.00 55.73 57.81 2wkz s ARG 108 Cb 0.07 -3.04 -0.04 0.00 0.52 0.00 0.00 34.95 32.46 2wkz s ARG 108 CO 0.12 -0.48 2.11 -0.35 0.02 0.00 0.00 175.30 176.72 2wkz n PRO 109 N 1.56 2.30 -3.19 3.54 -0.04 -1.26 -4.92 135.00 132.99 2wkz n PRO 109 Ca 0.05 -2.28 -0.39 0.00 -0.04 0.00 0.00 63.50 60.84 2wkz n PRO 109 Cb 0.39 -3.13 -0.06 0.00 -0.04 0.00 0.00 33.50 30.67 2wkz n PRO 109 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2wkz s LEU 110 N 1.74 4.41 0.17 1.53 1.43 -1.26 -1.67 118.68 125.04 2wkz s LEU 110 Ca 0.51 1.17 0.01 0.00 -1.03 0.00 0.00 54.13 54.79 2wkz s LEU 110 Cb 0.14 -2.94 -0.04 0.00 0.03 0.00 0.00 46.19 43.38 2wkz s LEU 110 CO -0.00 0.09 0.03 0.68 0.23 0.00 0.00 176.35 177.38 2wkz s VAL 111 N -0.15 0.46 -0.08 -1.59 -7.23 -0.03 -4.95 120.40 106.83 2wkz s VAL 111 Ca 0.31 -1.96 -0.17 0.00 -1.81 0.00 0.00 61.98 58.36 2wkz s VAL 111 Cb -0.18 -2.16 -0.05 0.00 0.56 0.00 0.00 36.38 34.55 2wkz s VAL 111 CO 0.17 -0.41 0.44 -0.89 -0.31 0.00 0.00 175.10 174.10 2wkz s THR 112 N -3.81 5.13 0.29 5.32 2.01 -1.26 -0.93 115.64 122.39 2wkz s THR 112 Ca 0.26 0.88 0.11 0.00 0.31 0.00 0.00 61.69 63.24 2wkz s THR 112 Cb 0.07 -3.76 -0.05 0.00 0.01 0.00 0.00 72.50 68.76 2wkz s THR 112 CO 0.04 0.43 -0.16 0.27 -0.69 0.00 0.00 174.62 174.51 2wkz s ILE 113 N -0.02 2.33 -0.11 1.82 -4.36 0.25 -1.81 121.20 119.30 2wkz s ILE 113 Ca 0.24 -2.33 0.01 0.00 -0.26 0.00 0.00 60.65 58.31 2wkz s ILE 113 Cb -0.16 -2.37 0.02 0.00 1.25 0.00 0.00 42.46 41.20 2wkz s ILE 113 CO 0.11 -0.36 -0.11 -0.75 0.24 0.00 0.00 174.94 174.07 2wkz s LYS 114 N -3.55 1.77 -0.12 0.37 2.20 0.43 -1.48 119.74 119.36 2wkz s LYS 114 Ca 0.30 -0.38 -0.08 0.00 -0.36 0.00 0.00 55.97 55.45 2wkz s LYS 114 Cb -0.02 -1.66 0.04 0.00 -1.51 0.00 0.00 37.83 34.68 2wkz s LYS 114 CO 0.15 -0.16 0.30 -1.50 -0.36 0.00 0.00 175.35 173.77 2wkz s ILE 115 N 1.33 -0.02 -1.59 5.43 2.07 -0.40 -0.61 121.20 127.41 2wkz s ILE 115 Ca -0.01 0.09 -0.01 0.00 -1.41 0.00 0.00 60.65 59.31 2wkz s ILE 115 Cb -0.14 -0.44 0.00 0.00 0.13 0.00 0.00 42.46 42.01 2wkz s ILE 115 CO -0.05 0.04 0.12 0.61 -1.91 0.00 0.00 174.94 173.75 2wkz n GLY 116 N 3.81 -0.42 2.84 1.50 0.00 -1.26 -1.65 105.19 110.01 2wkz n GLY 116 Ca -0.21 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.76 2wkz n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wkz n GLY 117 N -1.12 0.57 3.46 -0.02 0.00 -1.26 -5.01 105.19 101.82 2wkz n GLY 117 Ca -0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.53 2wkz n GLY 117 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wkz s GLN 118 N -0.40 1.68 0.01 1.61 -0.21 -0.66 -5.12 119.66 116.57 2wkz s GLN 118 Ca 0.00 -1.24 -0.13 0.00 0.02 0.00 0.00 55.36 54.01 2wkz s GLN 118 Cb 0.00 -2.05 -0.06 0.00 1.00 0.00 0.00 33.01 31.90 2wkz s GLN 118 CO 0.00 0.47 0.39 -0.51 -2.12 0.00 0.00 175.29 173.52 2wkz s LEU 119 N -2.16 4.45 0.08 2.90 1.43 -1.26 -1.27 118.68 122.85 2wkz s LEU 119 Ca 0.17 0.90 -0.05 0.00 -1.03 0.00 0.00 54.13 54.12 2wkz s LEU 119 Cb -0.10 -2.62 -0.02 0.00 0.03 0.00 0.00 46.19 43.47 2wkz s LEU 119 CO 0.09 0.30 0.10 -0.54 0.23 0.00 0.00 176.35 176.53 2wkz s LYS 120 N -1.23 0.79 -0.17 1.70 1.02 -0.55 -4.98 119.74 116.31 2wkz s LYS 120 Ca 0.25 -1.12 -0.09 0.00 0.02 0.00 0.00 55.97 55.03 2wkz s LYS 120 Cb -0.16 0.28 -0.05 0.00 -0.52 0.00 0.00 37.83 37.39 2wkz s LYS 120 CO 0.14 -0.22 0.13 -1.21 -0.92 0.00 0.00 175.35 173.26 2wkz s GLU 121 N -3.91 3.94 0.05 1.68 0.41 -1.26 -0.59 118.70 119.02 2wkz s GLU 121 Ca 0.09 -0.20 -0.00 0.00 -0.41 0.00 0.00 54.97 54.44 2wkz s GLU 121 Cb 0.06 -3.33 -0.03 0.00 -1.78 0.00 0.00 34.13 29.05 2wkz s GLU 121 CO -0.09 0.44 -0.04 0.00 -0.49 0.00 0.00 175.26 175.09 2wkz s ALA 122 N -0.06 0.45 -0.22 5.21 0.00 -0.11 -4.50 121.76 122.53 2wkz s ALA 122 Ca 0.10 -1.03 -0.12 0.00 0.00 0.00 0.00 51.96 50.91 2wkz s ALA 122 Cb -0.11 0.21 -0.05 0.00 0.00 0.00 0.00 23.12 23.17 2wkz s ALA 122 CO -0.00 -0.28 0.22 -1.17 0.00 0.00 0.00 175.76 174.53 2wkz s LEU 123 N -2.45 4.14 -0.47 0.00 2.96 0.24 -0.85 118.68 122.24 2wkz s LEU 123 Ca 0.00 0.24 -0.29 0.00 -0.22 0.00 0.00 54.13 53.86 2wkz s LEU 123 Cb 0.02 -2.22 0.03 0.00 0.50 0.00 0.00 46.19 44.52 2wkz s LEU 123 CO -0.06 0.04 1.19 -0.76 -1.32 0.00 0.00 176.35 175.44 2wkz s LEU 124 N 1.04 3.61 -0.37 -0.68 1.43 -0.67 -0.40 118.68 122.64 2wkz s LEU 124 Ca 0.11 0.51 0.03 0.00 -1.03 0.00 0.00 54.13 53.74 2wkz s LEU 124 Cb -0.14 -3.53 0.10 0.00 0.03 0.00 0.00 46.19 42.66 2wkz s LEU 124 CO 0.05 -1.30 0.10 -0.62 0.23 0.00 0.00 176.35 174.80 2wkz s ASP 125 N 2.76 4.84 0.20 2.29 -1.08 -0.40 -4.79 116.67 120.48 2wkz s ASP 125 Ca 0.50 -2.20 0.20 0.00 -0.52 0.00 0.00 52.55 50.54 2wkz s ASP 125 Cb -0.08 -1.67 0.88 0.00 -1.46 0.00 0.00 42.92 40.59 2wkz s ASP 125 CO 0.32 -0.40 1.62 0.35 0.52 0.00 0.00 175.17 177.58 2wkz n THR 126 N 4.23 0.93 1.31 1.71 -2.24 -1.26 -1.92 114.28 117.05 2wkz n THR 126 Ca 0.03 0.30 0.13 0.00 -2.27 0.00 0.00 64.05 62.24 2wkz n THR 126 Cb 0.41 -1.20 0.40 0.00 -2.10 0.00 0.00 70.33 67.85 2wkz n THR 126 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wkz n GLY 127 N -0.19 -0.37 3.64 3.38 0.00 -1.26 -4.84 105.19 105.55 2wkz n GLY 127 Ca 0.02 -0.43 -0.36 0.00 0.00 0.00 0.00 46.02 45.25 2wkz n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wkz s ALA 128 N -2.34 3.54 0.17 4.61 0.00 -0.81 -4.98 121.76 121.96 2wkz s ALA 128 Ca 0.28 -0.87 -0.08 0.00 0.00 0.00 0.00 51.96 51.30 2wkz s ALA 128 Cb 0.20 -2.21 0.05 0.00 0.00 0.00 0.00 23.12 21.16 2wkz s ALA 128 CO 0.46 -0.12 1.53 -0.44 0.00 0.00 0.00 175.76 177.19 2wkz h ASP 129 N 7.35 0.88 -0.97 0.00 3.32 -1.88 0.49 116.42 125.60 2wkz h ASP 129 Ca -0.38 -0.39 -0.62 0.00 0.02 0.00 0.00 57.03 55.66 2wkz h ASP 129 Cb 1.17 -0.25 -0.10 0.00 0.22 0.00 0.00 39.33 40.37 2wkz h ASP 129 CO 0.67 1.15 -0.48 -1.81 -1.72 0.00 0.00 179.24 177.04 2wkz s ASP 130 N -6.83 4.27 -0.23 6.45 1.01 -1.26 -2.81 116.67 117.27 2wkz s ASP 130 Ca -0.10 -1.36 -0.05 0.00 0.71 0.00 0.00 52.55 51.75 2wkz s ASP 130 Cb 0.12 0.06 -0.02 0.00 1.01 0.00 0.00 42.92 44.09 2wkz s ASP 130 CO 0.86 -0.75 0.00 -0.89 0.21 0.00 0.00 175.17 174.61 2wkz s THR 131 N -2.75 3.77 -0.08 -1.27 2.01 -1.26 -2.68 115.64 113.38 2wkz s THR 131 Ca 0.26 -0.36 0.02 0.00 0.31 0.00 0.00 61.69 61.93 2wkz s THR 131 Cb 0.03 -2.73 0.01 0.00 0.01 0.00 0.00 72.50 69.82 2wkz s THR 131 CO 0.15 0.40 -0.14 0.54 -0.69 0.00 0.00 174.62 174.87 2wkz s VAL 132 N 1.44 1.34 0.20 3.82 0.11 -0.63 -0.51 120.40 126.17 2wkz s VAL 132 Ca 0.05 -0.58 0.09 0.00 -2.93 0.00 0.00 61.98 58.61 2wkz s VAL 132 Cb -0.15 -1.21 -0.04 0.00 -1.53 0.00 0.00 36.38 33.45 2wkz s VAL 132 CO -0.00 0.40 -0.08 -0.76 -3.33 0.00 0.00 175.10 171.34 2wkz s LEU 133 N 0.74 3.02 0.79 2.54 1.43 0.10 -1.06 118.68 126.25 2wkz s LEU 133 Ca -0.13 -0.60 -0.12 0.00 -1.03 0.00 0.00 54.13 52.25 2wkz s LEU 133 Cb -0.16 -1.67 0.08 0.00 0.03 0.00 0.00 46.19 44.47 2wkz s LEU 133 CO 0.03 0.08 1.16 -1.61 0.23 0.00 0.00 176.35 176.24 2wkz s GLU 134 N -3.02 1.83 -0.01 1.70 2.02 -1.26 -1.79 118.70 118.17 2wkz s GLU 134 Ca 0.26 1.55 -0.39 0.00 0.02 0.00 0.00 54.97 56.42 2wkz s GLU 134 Cb -0.08 -1.82 -0.19 0.00 0.10 0.00 0.00 34.13 32.14 2wkz s GLU 134 CO 0.16 -2.03 1.04 -1.91 0.02 0.00 0.00 175.26 172.54 2wkz n GLU 135 N -3.36 0.00 -3.81 1.61 4.07 -1.23 -4.66 120.64 113.26 2wkz n GLU 135 Ca 0.12 0.00 -0.04 0.00 -0.06 0.00 0.00 57.16 57.18 2wkz n GLU 135 Cb 0.51 -1.44 -0.00 0.00 -0.06 0.00 0.00 31.44 30.46 2wkz n GLU 135 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2wkz s MET 136 N 0.06 1.42 -0.15 5.31 0.23 -1.26 -5.05 119.30 119.86 2wkz s MET 136 Ca 0.88 -0.85 -0.06 0.00 -1.03 0.00 0.00 55.69 54.63 2wkz s MET 136 Cb -1.22 0.44 -0.04 0.00 -1.53 0.00 0.00 34.83 32.48 2wkz s MET 136 CO 0.55 -0.66 0.07 0.45 -2.03 0.00 0.00 175.02 173.40 2wkz s SER 137 N -3.09 5.75 0.06 -1.18 0.15 -1.26 -5.05 113.70 109.07 2wkz s SER 137 Ca 0.15 0.19 0.03 0.00 0.70 0.00 0.00 55.95 57.02 2wkz s SER 137 Cb -0.03 -1.89 -0.03 0.00 -1.71 0.00 0.00 66.02 62.37 2wkz s SER 137 CO 0.05 0.27 -0.09 -0.76 1.20 0.00 0.00 173.24 173.92 2wkz s LEU 138 N -0.22 2.32 0.63 3.45 1.43 -1.26 -4.99 118.68 120.03 2wkz s LEU 138 Ca 0.08 -0.66 -0.13 0.00 -1.03 0.00 0.00 54.13 52.39 2wkz s LEU 138 Cb -0.12 -0.20 -0.03 0.00 0.03 0.00 0.00 46.19 45.87 2wkz s LEU 138 CO 0.01 -0.24 1.04 -2.84 0.23 0.00 0.00 176.35 174.55 2wkz s PRO 139 N -2.10 3.32 0.85 1.29 0.02 -1.26 -4.96 135.00 132.15 2wkz s PRO 139 Ca -0.04 0.96 0.00 0.00 0.02 0.00 0.00 61.00 61.94 2wkz s PRO 139 Cb -0.07 -2.04 0.00 0.00 0.02 0.00 0.00 34.50 32.41 2wkz s PRO 139 CO -0.00 -0.79 0.00 0.41 -0.33 0.00 0.00 177.00 176.28 2wkz n GLY 140 N -1.90 -2.01 3.91 0.52 0.00 -1.26 -4.93 105.19 99.52 2wkz n GLY 140 Ca 0.07 -1.54 -0.29 0.00 0.00 0.00 0.00 46.02 44.26 2wkz n GLY 140 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wkz s ARG 141 N 0.00 3.62 0.26 1.61 0.52 -1.26 -5.10 118.95 118.59 2wkz s ARG 141 Ca 0.00 -0.07 0.09 0.00 -0.52 0.00 0.00 55.73 55.23 2wkz s ARG 141 Cb 0.00 -2.73 -0.05 0.00 0.52 0.00 0.00 34.95 32.69 2wkz s ARG 141 CO 0.00 0.32 -0.15 1.67 0.02 0.00 0.00 175.30 177.15 2wkz s TRP 142 N -1.93 2.04 0.23 -0.53 1.48 -1.26 -4.69 118.94 114.28 2wkz s TRP 142 Ca 0.42 -0.48 0.11 0.00 -1.06 0.00 0.00 56.10 55.09 2wkz s TRP 142 Cb -0.11 -0.97 -0.05 0.00 -1.16 0.00 0.00 33.47 31.18 2wkz s TRP 142 CO 0.28 0.52 -0.21 0.15 -4.06 0.00 0.00 176.95 173.62 2wkz s LYS 143 N -3.60 1.56 0.38 3.25 1.02 -0.61 -4.89 119.74 116.85 2wkz s LYS 143 Ca 0.27 -1.62 -0.20 0.00 0.02 0.00 0.00 55.97 54.44 2wkz s LYS 143 Cb -0.02 -1.74 -0.10 0.00 -0.52 0.00 0.00 37.83 35.45 2wkz s LYS 143 CO 0.12 0.35 0.88 -1.25 -0.92 0.00 0.00 175.35 174.53 2wkz s PRO 144 N -3.06 4.22 -0.17 -1.68 0.04 -1.26 -0.42 135.00 132.67 2wkz s PRO 144 Ca 0.24 1.02 -0.20 0.00 0.04 0.00 0.00 61.00 62.10 2wkz s PRO 144 Cb -0.06 -2.37 0.05 0.00 0.04 0.00 0.00 34.50 32.16 2wkz s PRO 144 CO 0.12 0.08 0.54 0.21 0.04 0.00 0.00 177.00 177.98 2wkz s LYS 145 N -2.91 0.69 -0.17 4.56 2.20 -1.11 -4.87 119.74 118.13 2wkz s LYS 145 Ca 0.57 0.60 -0.02 0.00 -0.36 0.00 0.00 55.97 56.76 2wkz s LYS 145 Cb -0.11 0.33 -0.01 0.00 -1.51 0.00 0.00 37.83 36.53 2wkz s LYS 145 CO 0.16 -0.12 -0.09 -1.64 -0.36 0.00 0.00 175.35 173.30 2wkz s MET 146 N -0.06 3.37 -0.01 4.03 -1.94 -1.26 -1.15 119.30 122.28 2wkz s MET 146 Ca -0.03 -0.66 0.08 0.00 -1.71 0.00 0.00 55.69 53.37 2wkz s MET 146 Cb -0.03 -2.80 -0.02 0.00 2.01 0.00 0.00 34.83 33.99 2wkz s MET 146 CO 0.02 0.02 -0.26 0.96 -0.01 0.00 0.00 175.02 175.75 2wkz s ILE 147 N 0.88 2.08 -0.08 2.53 -4.36 -0.77 -4.96 121.20 116.52 2wkz s ILE 147 Ca -0.02 -1.14 0.00 0.00 -0.26 0.00 0.00 60.65 59.23 2wkz s ILE 147 Cb -0.15 -1.72 -0.03 0.00 1.25 0.00 0.00 42.46 41.81 2wkz s ILE 147 CO 0.00 0.56 -0.07 -0.83 0.24 0.00 0.00 174.94 174.84 2wkz s GLY 148 N -0.68 1.70 0.00 6.27 0.00 -1.26 -1.51 107.32 111.83 2wkz s GLY 148 Ca 0.10 -0.88 0.00 0.00 0.00 0.00 0.00 44.72 43.94 2wkz s GLY 148 CO -0.01 -0.61 0.00 0.61 0.00 0.00 0.00 173.10 173.09 2wkz n GLY 149 N 2.33 5.30 0.26 0.20 0.00 0.79 -4.98 105.19 109.09 2wkz n GLY 149 Ca -0.18 -1.85 0.11 0.00 0.00 0.00 0.00 46.02 44.10 2wkz n GLY 149 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 2wkz h ILE 150 N 0.52 0.77 -0.02 -0.61 3.07 -2.03 -2.81 117.51 116.40 2wkz h ILE 150 Ca 0.00 -0.39 0.00 0.00 1.55 0.00 0.00 64.86 66.02 2wkz h ILE 150 Cb 0.00 1.23 0.00 0.00 -0.27 0.00 0.00 36.82 37.78 2wkz h ILE 150 CO 0.00 0.10 -0.38 0.61 -1.05 0.00 0.00 178.15 177.43 2wkz n GLY 151 N -1.01 0.02 0.00 0.16 0.00 -1.26 -5.07 105.19 98.02 2wkz n GLY 151 Ca -0.02 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.39 2wkz n GLY 151 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wkz n GLY 152 N 1.39 0.81 3.68 -0.02 0.00 -1.06 -5.11 105.19 104.87 2wkz n GLY 152 Ca 0.10 -1.87 -0.24 0.00 0.00 0.00 0.00 46.02 44.02 2wkz n GLY 152 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wkz s PHE 153 N -2.68 2.79 0.01 1.61 0.40 -1.26 -0.15 117.98 118.71 2wkz s PHE 153 Ca 0.00 -0.19 -0.01 0.00 -0.60 0.00 0.00 56.93 56.14 2wkz s PHE 153 Cb 0.00 -1.27 -0.01 0.00 0.51 0.00 0.00 43.02 42.25 2wkz s PHE 153 CO 0.00 0.58 -0.00 0.96 0.70 0.00 0.00 175.22 177.46 2wkz s ILE 154 N -2.15 0.08 0.07 0.64 -4.36 -0.57 -4.98 121.20 109.93 2wkz s ILE 154 Ca 0.31 -0.65 -0.20 0.00 -0.26 0.00 0.00 60.65 59.84 2wkz s ILE 154 Cb -0.07 -0.22 -0.07 0.00 1.25 0.00 0.00 42.46 43.35 2wkz s ILE 154 CO 0.20 -0.36 0.61 -1.59 0.24 0.00 0.00 174.94 174.04 2wkz s LYS 155 N -1.07 4.28 0.16 0.37 -2.85 -1.26 -1.84 119.74 117.53 2wkz s LYS 155 Ca -0.12 0.80 0.00 0.00 -1.00 0.00 0.00 55.97 55.66 2wkz s LYS 155 Cb -0.07 -3.26 -0.04 0.00 -2.06 0.00 0.00 37.83 32.40 2wkz s LYS 155 CO -0.00 0.58 0.05 0.14 0.10 0.00 0.00 175.35 176.22 2wkz s VAL 156 N -0.96 0.33 -0.21 1.79 -7.23 -0.30 -4.56 120.40 109.26 2wkz s VAL 156 Ca 0.30 -1.95 -0.10 0.00 -1.81 0.00 0.00 61.98 58.42 2wkz s VAL 156 Cb -0.20 -2.17 -0.05 0.00 0.56 0.00 0.00 36.38 34.52 2wkz s VAL 156 CO 0.20 -0.38 0.15 -0.13 -0.31 0.00 0.00 175.10 174.62 2wkz s ARG 157 N -4.01 4.15 -0.30 4.82 0.52 0.35 -2.76 118.95 121.72 2wkz s ARG 157 Ca 0.27 -0.22 -0.11 0.00 -0.52 0.00 0.00 55.73 55.15 2wkz s ARG 157 Cb 0.07 -3.46 -0.03 0.00 0.52 0.00 0.00 34.95 32.05 2wkz s ARG 157 CO 0.05 0.21 0.18 -1.14 0.02 0.00 0.00 175.30 174.61 2wkz s GLN 158 N 0.63 3.64 -0.11 3.54 0.74 0.44 -0.47 119.66 128.07 2wkz s GLN 158 Ca 0.08 -0.52 -0.01 0.00 0.05 0.00 0.00 55.36 54.97 2wkz s GLN 158 Cb -0.12 -3.63 -0.02 0.00 1.10 0.00 0.00 33.01 30.33 2wkz s GLN 158 CO 0.01 -0.31 -0.08 0.71 -0.55 0.00 0.00 175.29 175.07 2wkz s TYR 159 N 1.70 2.90 0.22 1.67 1.51 -0.55 -1.57 117.35 123.23 2wkz s TYR 159 Ca 0.06 -0.28 0.06 0.00 -1.01 0.00 0.00 57.07 55.91 2wkz s TYR 159 Cb -0.16 -1.81 -0.04 0.00 -0.11 0.00 0.00 41.96 39.84 2wkz s TYR 159 CO 0.09 0.06 0.18 -0.51 -1.11 0.00 0.00 175.55 174.26 2wkz s ASP 160 N -0.13 5.55 -1.44 2.29 1.01 -1.26 -1.09 116.67 121.60 2wkz s ASP 160 Ca 0.01 -0.20 -0.07 0.00 0.71 0.00 0.00 52.55 53.00 2wkz s ASP 160 Cb -0.13 -1.43 0.05 0.00 1.01 0.00 0.00 42.92 42.41 2wkz s ASP 160 CO 0.03 -0.00 0.80 1.67 0.21 0.00 0.00 175.17 177.88 2wkz n GLN 161 N -0.90 -4.90 -3.42 8.23 7.27 -1.17 -4.90 117.38 117.58 2wkz n GLN 161 Ca -0.08 0.57 -0.38 0.00 0.07 0.00 0.00 57.00 57.18 2wkz n GLN 161 Cb 0.57 -5.24 -0.06 0.00 2.41 0.00 0.00 30.24 27.92 2wkz n GLN 161 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 2wkz s ILE 162 N -3.52 5.11 0.03 1.69 -1.09 -0.08 -4.71 121.20 118.63 2wkz s ILE 162 Ca 0.34 0.87 -0.30 0.00 -2.23 0.00 0.00 60.65 59.33 2wkz s ILE 162 Cb -0.17 -3.75 -0.04 0.00 -1.58 0.00 0.00 42.46 36.91 2wkz s ILE 162 CO 0.84 0.46 1.09 -0.22 -1.23 0.00 0.00 174.94 175.87 2wkz s LEU 163 N -0.23 4.37 -0.18 2.97 2.96 -1.26 -1.60 118.68 125.71 2wkz s LEU 163 Ca 0.24 1.84 -0.10 0.00 -0.22 0.00 0.00 54.13 55.89 2wkz s LEU 163 Cb -0.16 -3.58 0.06 0.00 0.50 0.00 0.00 46.19 43.02 2wkz s LEU 163 CO 0.11 -0.36 0.44 -0.51 -1.32 0.00 0.00 176.35 174.72 2wkz s ILE 164 N 0.99 -0.02 -0.16 6.68 2.07 -0.25 -4.49 121.20 126.01 2wkz s ILE 164 Ca 0.55 0.08 -0.08 0.00 -1.41 0.00 0.00 60.65 59.79 2wkz s ILE 164 Cb -0.25 -0.65 -0.04 0.00 0.13 0.00 0.00 42.46 41.64 2wkz s ILE 164 CO 0.29 0.03 0.10 -0.70 -1.91 0.00 0.00 174.94 172.74 2wkz s GLU 165 N 1.34 3.81 -0.24 3.50 2.12 0.22 -1.10 118.70 128.34 2wkz s GLU 165 Ca -0.09 -0.26 0.01 0.00 0.36 0.00 0.00 54.97 54.99 2wkz s GLU 165 Cb -0.08 -3.23 0.06 0.00 0.26 0.00 0.00 34.13 31.15 2wkz s GLU 165 CO -0.12 0.45 -0.05 0.42 -0.54 0.00 0.00 175.26 175.41 2wkz s ILE 166 N -0.11 1.58 -1.46 -3.70 1.01 0.31 -0.43 121.20 118.39 2wkz s ILE 166 Ca 0.08 -1.28 -0.09 0.00 0.00 0.00 0.00 60.65 59.36 2wkz s ILE 166 Cb -0.12 -1.85 0.04 0.00 0.01 0.00 0.00 42.46 40.55 2wkz s ILE 166 CO 0.01 -0.12 0.88 0.00 0.00 0.00 0.00 174.94 175.71 2wkz n GLY 168 N -1.68 2.47 3.63 0.00 0.00 -1.26 -5.00 105.19 103.35 2wkz n GLY 168 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 2wkz n GLY 168 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2wkz s HIS 169 N -2.79 3.31 0.18 1.61 4.02 -0.01 -5.04 115.29 116.57 2wkz s HIS 169 Ca 0.00 0.82 -0.30 0.00 1.02 0.00 0.00 55.06 56.60 2wkz s HIS 169 Cb 0.00 -2.81 -0.08 0.00 -1.02 0.00 0.00 32.58 28.68 2wkz s HIS 169 CO 0.00 -0.27 1.05 0.15 1.02 0.00 0.00 174.74 176.69 2wkz s LYS 170 N 2.30 4.65 0.05 1.40 1.02 -1.26 -0.53 119.74 127.37 2wkz s LYS 170 Ca 0.26 1.64 -0.04 0.00 0.02 0.00 0.00 55.97 57.86 2wkz s LYS 170 Cb -0.16 -3.29 -0.02 0.00 -0.52 0.00 0.00 37.83 33.84 2wkz s LYS 170 CO 0.09 0.17 0.05 0.00 -0.92 0.00 0.00 175.35 174.74 2wkz s ALA 171 N -0.39 0.17 -0.18 5.17 0.00 -0.26 -4.87 121.76 121.40 2wkz s ALA 171 Ca 0.47 -0.85 -0.05 0.00 0.00 0.00 0.00 51.96 51.54 2wkz s ALA 171 Cb -0.28 0.29 0.07 0.00 0.00 0.00 0.00 23.12 23.20 2wkz s ALA 171 CO 0.34 -0.36 0.13 0.42 0.00 0.00 0.00 175.76 176.29 2wkz s ILE 172 N -3.30 -0.17 0.00 0.00 1.01 -1.26 -1.09 121.20 116.39 2wkz s ILE 172 Ca 0.01 -0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.51 2wkz s ILE 172 Cb 0.03 -0.61 0.00 0.00 0.01 0.00 0.00 42.46 41.89 2wkz s ILE 172 CO -0.08 -0.26 0.00 0.61 0.00 0.00 0.00 174.94 175.22 2wkz n GLY 173 N 5.29 2.18 3.70 6.18 0.00 -0.63 -4.77 105.19 117.14 2wkz n GLY 173 Ca -0.06 -0.78 -0.42 0.00 0.00 0.00 0.00 46.02 44.75 2wkz n GLY 173 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wkz s THR 174 N -2.73 4.62 -0.10 2.61 2.01 -1.26 -0.90 115.64 119.88 2wkz s THR 174 Ca 0.00 1.89 0.02 0.00 0.31 0.00 0.00 61.69 63.91 2wkz s THR 174 Cb 0.00 -4.21 0.01 0.00 0.01 0.00 0.00 72.50 68.31 2wkz s THR 174 CO 0.00 0.09 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.16 2wkz s VAL 175 N 1.45 1.61 -0.04 3.82 1.01 -0.25 -4.51 120.40 123.50 2wkz s VAL 175 Ca 0.53 -0.73 -0.04 0.00 0.00 0.00 0.00 61.98 61.73 2wkz s VAL 175 Cb -0.22 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 2wkz s VAL 175 CO 0.25 0.46 0.18 -0.76 0.00 0.00 0.00 175.10 175.23 2wkz s LEU 176 N 0.80 4.38 -0.08 3.92 1.43 0.33 -1.48 118.68 127.97 2wkz s LEU 176 Ca -0.10 0.41 0.02 0.00 -1.03 0.00 0.00 54.13 53.43 2wkz s LEU 176 Cb -0.16 -2.47 0.01 0.00 0.03 0.00 0.00 46.19 43.60 2wkz s LEU 176 CO 0.01 0.30 -0.14 -0.69 0.23 0.00 0.00 176.35 176.06 2wkz s VAL 177 N -1.24 1.34 -0.01 -1.59 1.01 0.38 0.03 120.40 120.32 2wkz s VAL 177 Ca 0.24 -0.57 -0.06 0.00 0.00 0.00 0.00 61.98 61.59 2wkz s VAL 177 Cb -0.13 -1.22 0.02 0.00 0.00 0.00 0.00 36.38 35.06 2wkz s VAL 177 CO 0.14 0.40 0.26 0.61 0.00 0.00 0.00 175.10 176.52 2wkz n GLY 178 N 3.96 0.45 2.50 4.51 0.00 -0.74 -0.49 105.19 115.39 2wkz n GLY 178 Ca -0.21 -0.86 -0.22 0.00 0.00 0.00 0.00 46.02 44.73 2wkz n GLY 178 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2wkz n PRO 179 N -0.19 2.22 -3.21 1.61 -0.04 -1.26 -3.52 135.00 130.60 2wkz n PRO 179 Ca 0.01 -1.45 -0.36 0.00 -0.04 0.00 0.00 63.50 61.66 2wkz n PRO 179 Cb 0.12 -2.41 -0.06 0.00 -0.04 0.00 0.00 33.50 31.11 2wkz n PRO 179 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 2wkz s THR 180 N 2.97 4.69 0.47 0.52 -1.32 -1.26 -4.98 115.64 116.73 2wkz s THR 180 Ca 0.45 1.08 0.16 0.00 -1.21 0.00 0.00 61.69 62.16 2wkz s THR 180 Cb 0.13 -3.80 0.21 0.00 -1.51 0.00 0.00 72.50 67.53 2wkz s THR 180 CO -0.03 0.21 2.04 -0.65 -2.21 0.00 0.00 174.62 173.97 2wkz h PRO 181 N 3.43 0.00 -3.53 7.08 0.11 -1.98 -3.44 132.00 133.67 2wkz h PRO 181 Ca -0.48 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.56 2wkz h PRO 181 Cb 1.19 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.16 2wkz h PRO 181 CO 0.65 0.13 -0.21 0.14 -0.21 0.00 0.00 178.00 178.51 2wkz s VAL 182 N -4.71 0.10 0.02 3.15 -7.23 -1.26 -5.09 120.40 105.37 2wkz s VAL 182 Ca -0.04 -0.81 -0.30 0.00 -1.81 0.00 0.00 61.98 59.01 2wkz s VAL 182 Cb 0.16 -1.20 -0.06 0.00 0.56 0.00 0.00 36.38 35.85 2wkz s VAL 182 CO 0.68 -0.45 1.35 0.20 -0.31 0.00 0.00 175.10 176.57 2wkz s ASN 183 N -2.71 6.90 -0.11 4.85 0.01 -1.26 -4.71 114.94 117.91 2wkz s ASN 183 Ca 0.02 2.09 0.03 0.00 -0.71 0.00 0.00 52.86 54.29 2wkz s ASN 183 Cb 0.03 -2.57 0.01 0.00 0.41 0.00 0.00 41.25 39.13 2wkz s ASN 183 CO -0.10 -0.66 -0.21 -0.63 -1.51 0.00 0.00 177.10 173.98 2wkz s ILE 184 N 2.03 1.91 -0.38 0.60 1.01 -0.22 -0.60 121.20 125.55 2wkz s ILE 184 Ca 0.62 -0.92 -0.13 0.00 0.00 0.00 0.00 60.65 60.23 2wkz s ILE 184 Cb -0.31 -1.68 0.01 0.00 0.01 0.00 0.00 42.46 40.50 2wkz s ILE 184 CO 0.27 0.53 0.25 -0.63 0.00 0.00 0.00 174.94 175.35 2wkz s ILE 185 N 0.58 4.99 0.74 2.92 -1.09 0.46 -1.61 121.20 128.19 2wkz s ILE 185 Ca -0.14 -0.62 -0.01 0.00 -2.23 0.00 0.00 60.65 57.65 2wkz s ILE 185 Cb -0.17 -3.72 0.15 0.00 -1.58 0.00 0.00 42.46 37.14 2wkz s ILE 185 CO 0.04 -0.20 1.02 0.61 -1.23 0.00 0.00 174.94 175.18 2wkz n GLY 186 N 5.08 0.55 0.33 6.18 0.00 -1.09 -1.27 105.19 114.97 2wkz n GLY 186 Ca -0.12 -2.02 0.13 0.00 0.00 0.00 0.00 46.02 44.02 2wkz n GLY 186 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2wkz h ARG 187 N 0.00 0.10 -0.51 1.61 3.08 -0.92 -1.15 114.38 116.59 2wkz h ARG 187 Ca -0.34 -0.01 0.07 0.00 0.07 0.00 0.00 59.98 59.78 2wkz h ARG 187 Cb 1.22 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 31.22 2wkz h ARG 187 CO 0.35 0.07 0.34 -2.95 -1.07 0.00 0.00 179.97 176.71 2wkz h ASN 188 N 0.10 0.34 0.00 7.04 -1.07 -1.79 -1.57 115.58 118.64 2wkz h ASN 188 Ca 0.16 0.00 -0.28 0.00 0.07 0.00 0.00 56.30 56.25 2wkz h ASN 188 Cb 0.50 -0.07 -0.05 0.00 -2.07 0.00 0.00 38.32 36.62 2wkz h ASN 188 CO -0.02 0.22 -2.26 0.18 0.07 0.00 0.00 177.43 175.62 2wkz n LEU 189 N -4.47 0.00 0.01 6.14 4.77 -0.78 -4.02 117.00 118.66 2wkz n LEU 189 Ca 0.07 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 56.07 2wkz n LEU 189 Cb 0.30 0.37 0.34 0.00 -2.33 0.00 0.00 43.42 42.10 2wkz n LEU 189 CO 0.34 0.37 0.99 -0.07 -1.33 0.00 0.00 177.39 177.70 2wkz h LEU 190 N 0.00 0.47 -0.58 2.23 3.38 -0.96 -1.79 115.31 118.06 2wkz h LEU 190 Ca -0.41 -0.07 -0.14 0.00 0.09 0.00 0.00 57.88 57.35 2wkz h LEU 190 Cb 1.92 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 42.54 2wkz h LEU 190 CO 0.02 0.49 -0.41 0.71 0.09 0.00 0.00 178.44 179.35 2wkz h THR 191 N 0.50 1.29 -0.08 0.22 1.35 -1.48 -1.00 112.91 113.71 2wkz h THR 191 Ca 0.12 -1.58 -0.03 0.00 -0.55 0.00 0.00 66.41 64.36 2wkz h THR 191 Cb 0.23 1.52 -0.01 0.00 -1.73 0.00 0.00 68.15 68.16 2wkz h THR 191 CO -0.00 0.51 -0.07 1.56 -0.25 0.00 0.00 175.52 177.27 2wkz h GLN 192 N 0.55 0.12 -0.34 4.72 4.20 -1.47 -2.14 115.11 120.75 2wkz h GLN 192 Ca 0.04 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.74 2wkz h GLN 192 Cb 0.94 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.70 2wkz h GLN 192 CO 0.09 0.20 0.00 0.44 -0.67 0.00 0.00 178.83 178.89 2wkz n ILE 193 N -4.39 0.44 -2.03 2.54 -5.35 -0.95 -4.94 119.36 104.68 2wkz n ILE 193 Ca -0.02 -0.58 -0.04 0.00 -0.27 0.00 0.00 62.75 61.84 2wkz n ILE 193 Cb 0.19 0.59 -0.00 0.00 -1.74 0.00 0.00 39.64 38.67 2wkz n ILE 193 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wkz n GLY 194 N 1.32 0.22 3.75 3.28 0.00 -0.81 -5.03 105.19 107.93 2wkz n GLY 194 Ca 0.18 -0.71 -0.40 0.00 0.00 0.00 0.00 46.02 45.08 2wkz n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wkz s THR 196 N -0.81 0.15 -0.10 0.00 -4.23 -1.26 -4.69 115.64 104.70 2wkz s THR 196 Ca 0.41 -1.86 -0.06 0.00 -1.18 0.00 0.00 61.69 59.00 2wkz s THR 196 Cb -0.24 -1.82 -0.04 0.00 1.34 0.00 0.00 72.50 71.73 2wkz s THR 196 CO 0.29 -0.68 0.12 -0.76 -0.54 0.00 0.00 174.62 173.05 2wkz s LEU 197 N -2.99 4.27 -0.02 4.79 1.43 -1.26 -5.10 118.68 119.80 2wkz s LEU 197 Ca 0.17 0.41 -0.01 0.00 -1.03 0.00 0.00 54.13 53.67 2wkz s LEU 197 Cb 0.08 -2.09 0.01 0.00 0.03 0.00 0.00 46.19 44.21 2wkz s LEU 197 CO -0.03 0.39 0.05 0.20 0.23 0.00 0.00 176.35 177.18 2wkz s ASN 198 N -1.11 -0.03 0.00 2.29 0.01 -1.26 -5.29 114.94 109.54 2wkz s ASN 198 Ca 0.16 0.09 0.00 0.00 -0.71 0.00 0.00 52.86 52.40 2wkz s ASN 198 Cb -0.12 0.07 0.00 0.00 0.41 0.00 0.00 41.25 41.61 2wkz s ASN 198 CO 0.05 -0.04 0.00 2.22 -1.51 0.00 0.00 177.10 177.83