#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dgr s SER 100 N 0.00 6.24 -0.65 1.61 1.04 -1.26 -4.99 113.70 115.70 2dgr s SER 100 Ca 0.00 1.47 -0.28 0.00 0.48 0.00 0.00 55.95 57.63 2dgr s SER 100 Cb 0.00 -2.48 0.03 0.00 0.10 0.00 0.00 66.02 63.67 2dgr s SER 100 CO 0.00 -0.86 1.23 -0.44 0.98 0.00 0.00 173.24 174.15 2dgr s SER 101 N -3.90 6.32 0.00 7.02 0.01 -1.26 -4.91 113.70 116.98 2dgr s SER 101 Ca 0.56 -0.16 0.00 0.00 1.31 0.00 0.00 55.95 57.67 2dgr s SER 101 Cb -0.11 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.57 2dgr s SER 101 CO 0.49 -1.64 0.00 0.61 0.41 0.00 0.00 173.24 173.11 2dgr n GLY 102 N 5.21 0.17 3.27 3.44 0.00 -1.26 -5.05 105.19 110.97 2dgr n GLY 102 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 2dgr n GLY 102 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dgr s SER 103 N -1.00 3.31 -0.14 1.61 0.01 -1.26 -5.03 113.70 111.20 2dgr s SER 103 Ca 0.00 -0.49 -0.23 0.00 1.31 0.00 0.00 55.95 56.54 2dgr s SER 103 Cb 0.00 -1.30 -0.25 0.00 0.21 0.00 0.00 66.02 64.68 2dgr s SER 103 CO 0.00 0.19 0.57 0.77 0.41 0.00 0.00 173.24 175.18 2dgr h SER 104 N 6.51 0.14 -1.04 2.44 4.64 -2.02 -3.47 113.55 120.74 2dgr h SER 104 Ca -0.24 -0.82 -0.46 0.00 -0.47 0.00 0.00 61.79 59.80 2dgr h SER 104 Cb 1.22 -0.04 0.03 0.00 -0.31 0.00 0.00 62.40 63.29 2dgr h SER 104 CO 0.49 1.33 -0.15 -0.83 -0.87 0.00 0.00 176.83 176.80 2dgr s GLY 105 N -4.60 1.80 0.10 -0.77 0.00 -1.26 -5.07 107.32 97.53 2dgr s GLY 105 Ca -0.22 -1.98 0.00 0.00 0.00 0.00 0.00 44.72 42.53 2dgr s GLY 105 CO 0.69 -1.61 0.00 0.61 0.00 0.00 0.00 173.10 172.79 2dgr n GLY 106 N -2.12 -0.10 3.64 0.20 0.00 -1.26 -5.11 105.19 100.44 2dgr n GLY 106 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 2dgr n GLY 106 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2dgr s GLN 107 N -2.00 -0.60 0.18 1.61 1.03 -1.26 -4.85 119.66 113.76 2dgr s GLN 107 Ca 0.00 0.07 0.02 0.00 0.04 0.00 0.00 55.36 55.49 2dgr s GLN 107 Cb 0.00 -1.66 -0.05 0.00 0.03 0.00 0.00 33.01 31.34 2dgr s GLN 107 CO 0.00 -3.33 0.00 -0.08 -2.54 0.00 0.00 175.29 169.35 2dgr s THR 108 N -3.06 0.69 -0.09 3.63 -1.32 -0.51 -4.95 115.64 110.03 2dgr s THR 108 Ca 0.69 -1.98 -0.00 0.00 -1.21 0.00 0.00 61.69 59.19 2dgr s THR 108 Cb -0.12 -2.13 0.02 0.00 -1.51 0.00 0.00 72.50 68.76 2dgr s THR 108 CO 0.56 -0.47 -0.06 -0.89 -2.21 0.00 0.00 174.62 171.55 2dgr s THR 109 N -3.65 0.85 0.09 5.08 2.01 -1.26 -1.13 115.64 117.62 2dgr s THR 109 Ca 0.24 -0.21 0.08 0.00 0.31 0.00 0.00 61.69 62.11 2dgr s THR 109 Cb 0.06 -0.88 -0.04 0.00 0.01 0.00 0.00 72.50 71.65 2dgr s THR 109 CO 0.04 0.33 -0.14 0.27 -0.69 0.00 0.00 174.62 174.43 2dgr s ILE 110 N 1.53 3.11 -0.43 1.82 -4.36 -0.59 -4.99 121.20 117.29 2dgr s ILE 110 Ca 0.00 -1.31 -0.07 0.00 -0.26 0.00 0.00 60.65 59.02 2dgr s ILE 110 Cb -0.13 -2.42 0.11 0.00 1.25 0.00 0.00 42.46 41.27 2dgr s ILE 110 CO -0.05 0.16 0.27 -1.10 0.24 0.00 0.00 174.94 174.45 2dgr s GLN 111 N -2.02 2.33 0.38 0.37 -1.52 -1.26 -1.19 119.66 116.75 2dgr s GLN 111 Ca 0.19 -1.71 -0.26 0.00 -1.95 0.00 0.00 55.36 51.63 2dgr s GLN 111 Cb -0.11 -3.75 -0.09 0.00 -0.22 0.00 0.00 33.01 28.85 2dgr s GLN 111 CO 0.11 -1.08 1.18 0.08 -0.25 0.00 0.00 175.29 175.33 2dgr s VAL 112 N 1.29 3.11 -0.20 1.09 1.01 0.79 -4.86 120.40 122.62 2dgr s VAL 112 Ca 0.06 0.97 -0.02 0.00 0.00 0.00 0.00 61.98 62.98 2dgr s VAL 112 Cb -0.24 -3.56 -0.00 0.00 0.00 0.00 0.00 36.38 32.58 2dgr s VAL 112 CO -0.01 0.12 -0.09 -0.60 0.00 0.00 0.00 175.10 174.52 2dgr s ARG 113 N -2.18 3.29 0.02 2.72 3.52 -1.26 -1.23 118.95 123.83 2dgr s ARG 113 Ca 0.55 -0.68 0.00 0.00 -0.13 0.00 0.00 55.73 55.47 2dgr s ARG 113 Cb -0.32 -2.87 -0.02 0.00 -1.56 0.00 0.00 34.95 30.18 2dgr s ARG 113 CO 0.41 -0.16 -0.03 0.14 -0.81 0.00 0.00 175.30 174.84 2dgr s VAL 114 N 1.33 0.15 0.02 7.11 -7.23 -1.23 -4.96 120.40 115.59 2dgr s VAL 114 Ca 0.04 -1.01 -0.30 0.00 -1.81 0.00 0.00 61.98 58.90 2dgr s VAL 114 Cb -0.14 -0.40 -0.06 0.00 0.56 0.00 0.00 36.38 36.34 2dgr s VAL 114 CO -0.05 -0.54 1.44 -2.16 -0.31 0.00 0.00 175.10 173.48 2dgr s PRO 115 N -1.70 4.27 0.33 4.82 0.04 -1.26 -4.62 135.00 136.89 2dgr s PRO 115 Ca -0.13 2.02 0.25 0.00 0.04 0.00 0.00 61.00 63.18 2dgr s PRO 115 Cb -0.08 -3.55 1.11 0.00 0.04 0.00 0.00 34.50 32.01 2dgr s PRO 115 CO -0.02 -0.59 1.14 0.98 0.04 0.00 0.00 177.00 178.56 2dgr n TYR 116 N 5.30 0.47 0.01 0.56 9.36 -1.26 0.20 117.16 131.80 2dgr n TYR 116 Ca 0.13 0.47 -0.11 0.00 3.32 0.00 0.00 57.90 61.72 2dgr n TYR 116 Cb 0.43 -0.87 -0.05 0.00 -0.63 0.00 0.00 39.34 38.21 2dgr n TYR 116 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2dgr h ARG 117 N 0.00 0.08 -0.21 2.98 3.08 -2.02 -2.74 114.38 115.55 2dgr h ARG 117 Ca 0.65 -0.00 -0.13 0.00 0.07 0.00 0.00 59.98 60.56 2dgr h ARG 117 Cb 2.14 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 32.16 2dgr h ARG 117 CO -0.31 0.05 -0.42 0.28 -1.07 0.00 0.00 179.97 178.50 2dgr h VAL 118 N 0.08 1.31 -0.65 2.04 2.07 0.19 -3.30 116.25 118.00 2dgr h VAL 118 Ca 0.03 -1.59 0.06 0.00 0.82 0.00 0.00 66.70 66.02 2dgr h VAL 118 Cb 0.01 1.60 -0.08 0.00 -1.52 0.00 0.00 31.29 31.30 2dgr h VAL 118 CO -0.03 0.50 -0.38 0.52 0.02 0.00 0.00 177.57 178.20 2dgr n VAL 119 N -4.02 -0.44 -0.31 2.57 0.31 -0.67 0.11 118.33 115.88 2dgr n VAL 119 Ca -0.02 2.06 0.11 0.00 -0.01 0.00 0.00 64.34 66.48 2dgr n VAL 119 Cb 0.52 -2.59 0.28 0.00 -0.91 0.00 0.00 33.84 31.14 2dgr n VAL 119 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2dgr h GLY 120 N 0.00 1.52 1.00 2.92 0.00 -1.63 0.16 103.07 107.05 2dgr h GLY 120 Ca 0.10 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.21 2dgr h GLY 120 CO -0.61 -0.16 0.41 1.41 0.00 0.00 0.00 176.54 177.59 2dgr h LEU 121 N 0.53 0.75 0.49 3.11 3.38 -0.45 -2.60 115.31 120.52 2dgr h LEU 121 Ca 0.53 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.43 2dgr h LEU 121 Cb 0.90 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.47 2dgr h LEU 121 CO -0.45 0.57 -0.24 0.58 0.09 0.00 0.00 178.44 178.99 2dgr h VAL 122 N 0.87 0.00 -0.85 1.22 2.07 0.98 -3.29 116.25 117.25 2dgr h VAL 122 Ca 0.23 -0.48 0.16 0.00 0.82 0.00 0.00 66.70 67.43 2dgr h VAL 122 Cb -0.06 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 29.55 2dgr h VAL 122 CO -0.05 0.00 -0.25 0.52 0.02 0.00 0.00 177.57 177.81 2dgr n VAL 123 N -5.11 -0.39 0.00 2.57 0.31 0.37 -3.05 118.33 113.03 2dgr n VAL 123 Ca -0.08 1.97 0.00 0.00 -0.01 0.00 0.00 64.34 66.22 2dgr n VAL 123 Cb 0.26 -2.69 0.00 0.00 -0.91 0.00 0.00 33.84 30.50 2dgr n VAL 123 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2dgr n GLY 124 N -1.50 -1.13 3.52 2.92 0.00 -0.98 -2.50 105.19 105.52 2dgr n GLY 124 Ca 0.12 -1.62 -0.24 0.00 0.00 0.00 0.00 46.02 44.29 2dgr n GLY 124 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2dgr n PRO 125 N -1.16 0.28 -3.64 1.61 -0.02 -1.26 -0.93 135.00 129.87 2dgr n PRO 125 Ca 0.00 -0.25 -0.24 0.00 -2.02 0.00 0.00 63.50 60.99 2dgr n PRO 125 Cb 0.00 -2.14 0.07 0.00 -0.02 0.00 0.00 33.50 31.41 2dgr n PRO 125 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2dgr n LYS 126 N 7.36 -7.26 -2.35 -0.52 4.76 -1.26 -3.49 118.16 115.39 2dgr n LYS 126 Ca 0.58 0.78 -0.03 0.00 -2.87 0.00 0.00 58.31 56.77 2dgr n LYS 126 Cb 0.25 -5.79 0.01 0.00 -1.84 0.00 0.00 35.03 27.67 2dgr n LYS 126 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dgr n GLY 127 N -1.83 -0.56 0.08 0.72 0.00 -0.11 -5.01 105.19 98.47 2dgr n GLY 127 Ca -0.03 0.16 -0.08 0.00 0.00 0.00 0.00 46.02 46.07 2dgr n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dgr n ALA 128 N -1.77 1.79 0.02 4.61 0.00 -1.04 -4.47 120.51 119.63 2dgr n ALA 128 Ca -0.01 -0.46 -0.21 0.00 0.00 0.00 0.00 53.44 52.76 2dgr n ALA 128 Cb 0.52 0.26 -0.14 0.00 0.00 0.00 0.00 19.45 20.09 2dgr n ALA 128 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2dgr h THR 129 N -0.01 1.13 -0.12 0.00 2.02 -1.75 -3.29 112.91 110.88 2dgr h THR 129 Ca -0.24 -2.43 0.04 0.00 0.77 0.00 0.00 66.41 64.55 2dgr h THR 129 Cb 1.37 2.81 -0.00 0.00 -1.74 0.00 0.00 68.15 70.58 2dgr h THR 129 CO -0.04 0.70 0.10 -0.29 0.37 0.00 0.00 175.52 176.36 2dgr h ILE 130 N -0.33 0.76 -0.19 3.11 6.09 -1.43 -1.74 117.51 123.78 2dgr h ILE 130 Ca -0.27 0.00 -0.12 0.00 -1.37 0.00 0.00 64.86 63.09 2dgr h ILE 130 Cb 1.73 0.93 0.00 0.00 0.47 0.00 0.00 36.82 39.95 2dgr h ILE 130 CO 0.07 0.00 -0.36 0.50 -3.07 0.00 0.00 178.15 175.29 2dgr h LYS 131 N 0.00 0.58 -0.99 2.19 3.64 -1.78 -3.02 116.57 117.19 2dgr h LYS 131 Ca 0.06 -0.37 0.01 0.00 -1.27 0.00 0.00 60.65 59.07 2dgr h LYS 131 Cb 0.26 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.07 2dgr h LYS 131 CO -0.00 0.98 0.65 -0.09 -2.27 0.00 0.00 179.45 178.72 2dgr h ARG 132 N 0.25 1.32 -0.03 1.90 2.43 -1.39 -2.77 114.38 116.09 2dgr h ARG 132 Ca 0.01 -0.09 0.01 0.00 -0.81 0.00 0.00 59.98 59.10 2dgr h ARG 132 Cb 0.96 -0.29 -0.01 0.00 -0.42 0.00 0.00 29.97 30.21 2dgr h ARG 132 CO 0.08 0.88 -0.01 0.82 -1.51 0.00 0.00 179.97 180.23 2dgr h ILE 133 N 1.35 0.95 -1.04 1.20 2.04 -1.46 0.11 117.51 120.67 2dgr h ILE 133 Ca 0.36 0.00 0.27 0.00 1.00 0.00 0.00 64.86 66.49 2dgr h ILE 133 Cb -0.14 0.95 -0.10 0.00 -0.74 0.00 0.00 36.82 36.79 2dgr h ILE 133 CO -0.08 0.00 0.66 1.56 0.00 0.00 0.00 178.15 180.30 2dgr h GLN 134 N -0.01 0.40 0.00 2.37 4.20 -1.36 0.31 115.11 121.01 2dgr h GLN 134 Ca 0.02 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.70 2dgr h GLN 134 Cb 0.04 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 27.73 2dgr h GLN 134 CO -0.04 0.26 -0.02 1.96 -0.67 0.00 0.00 178.83 180.32 2dgr h GLN 135 N 0.41 0.00 -0.74 1.46 4.20 -1.32 1.00 115.11 120.13 2dgr h GLN 135 Ca 0.61 0.00 0.15 0.00 0.06 0.00 0.00 58.65 59.47 2dgr h GLN 135 Cb 1.50 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 29.23 2dgr h GLN 135 CO -0.32 0.89 0.50 0.00 -0.67 0.00 0.00 178.83 179.23 2dgr h ARG 136 N -1.00 0.34 0.00 1.46 2.47 0.15 -1.24 114.38 116.56 2dgr h ARG 136 Ca -0.01 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.69 2dgr h ARG 136 Cb 0.90 -0.08 0.00 0.00 -1.65 0.00 0.00 29.97 29.14 2dgr h ARG 136 CO -0.00 0.23 -1.27 0.25 0.56 0.00 0.00 179.97 179.73 2dgr n THR 137 N -4.46 0.00 -3.36 2.04 -2.24 0.10 -5.02 114.28 101.34 2dgr n THR 137 Ca 0.14 -0.24 -0.16 0.00 -2.27 0.00 0.00 64.05 61.51 2dgr n THR 137 Cb 0.56 0.57 0.08 0.00 -2.10 0.00 0.00 70.33 69.44 2dgr n THR 137 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2dgr n HIS 138 N -1.74 -2.24 -3.98 4.78 8.25 0.31 -4.80 115.22 115.81 2dgr n HIS 138 Ca 0.00 0.91 -0.12 0.00 -0.26 0.00 0.00 57.72 58.25 2dgr n HIS 138 Cb 0.35 -4.79 -0.13 0.00 1.12 0.00 0.00 29.99 26.55 2dgr n HIS 138 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2dgr s THR 139 N -3.36 0.18 -0.71 1.59 -4.23 0.64 -4.93 115.64 104.81 2dgr s THR 139 Ca 0.13 -0.53 -0.27 0.00 -1.18 0.00 0.00 61.69 59.83 2dgr s THR 139 Cb -0.02 -0.24 0.02 0.00 1.34 0.00 0.00 72.50 73.60 2dgr s THR 139 CO 0.72 -0.23 1.37 -0.47 -0.54 0.00 0.00 174.62 175.47 2dgr s TYR 140 N -0.77 2.19 -0.25 3.99 5.04 -0.72 -4.45 117.35 122.39 2dgr s TYR 140 Ca -0.07 0.09 -0.14 0.00 -2.44 0.00 0.00 57.07 54.51 2dgr s TYR 140 Cb -0.06 -4.54 -0.04 0.00 0.35 0.00 0.00 41.96 37.67 2dgr s TYR 140 CO -0.00 -2.10 0.34 0.42 -1.34 0.00 0.00 175.55 172.86 2dgr s ILE 141 N 6.23 5.22 -0.12 3.14 1.01 -1.26 -1.05 121.20 134.37 2dgr s ILE 141 Ca 0.40 0.52 -0.00 0.00 0.00 0.00 0.00 60.65 61.58 2dgr s ILE 141 Cb -0.09 -3.67 -0.02 0.00 0.01 0.00 0.00 42.46 38.70 2dgr s ILE 141 CO 0.16 0.21 -0.11 -0.69 0.00 0.00 0.00 174.94 174.51 2dgr s VAL 142 N 1.71 3.24 0.38 2.92 1.01 0.49 -4.96 120.40 125.20 2dgr s VAL 142 Ca 0.14 -0.61 -0.13 0.00 0.00 0.00 0.00 61.98 61.38 2dgr s VAL 142 Cb -0.15 -2.36 -0.08 0.00 0.00 0.00 0.00 36.38 33.79 2dgr s VAL 142 CO 0.09 0.54 0.78 0.42 0.00 0.00 0.00 175.10 176.93 2dgr s THR 143 N 0.10 4.70 1.24 3.92 -4.23 -1.26 -1.22 115.64 118.89 2dgr s THR 143 Ca -0.05 0.85 -0.21 0.00 -1.18 0.00 0.00 61.69 61.11 2dgr s THR 143 Cb -0.14 -3.67 0.31 0.00 1.34 0.00 0.00 72.50 70.33 2dgr s THR 143 CO 0.04 -0.39 1.11 -2.16 -0.54 0.00 0.00 174.62 172.69 2dgr s PRO 144 N -3.48 -1.55 0.81 3.99 0.04 -1.24 -4.93 135.00 128.63 2dgr s PRO 144 Ca 0.54 -0.19 -0.12 0.00 0.04 0.00 0.00 61.00 61.27 2dgr s PRO 144 Cb -0.10 -1.57 0.08 0.00 0.04 0.00 0.00 34.50 32.95 2dgr s PRO 144 CO 0.25 -3.91 1.18 0.20 0.04 0.00 0.00 177.00 174.75 2dgr s GLY 145 N -3.99 1.59 0.02 0.56 0.00 -1.26 -5.00 107.32 99.23 2dgr s GLY 145 Ca 0.72 -0.63 -0.22 0.00 0.00 0.00 0.00 44.72 44.58 2dgr s GLY 145 CO 0.56 -0.15 1.30 0.07 0.00 0.00 0.00 173.10 174.88 2dgr h ARG 146 N -1.05 0.24 -1.04 2.90 0.11 -1.97 -3.24 114.38 110.32 2dgr h ARG 146 Ca -0.46 -0.13 -0.66 0.00 0.10 0.00 0.00 59.98 58.83 2dgr h ARG 146 Cb 1.33 0.01 -0.31 0.00 1.11 0.00 0.00 29.97 32.10 2dgr h ARG 146 CO 0.66 0.67 0.57 -3.47 0.10 0.00 0.00 179.97 178.51 2dgr n ASP 147 N -4.64 7.17 -4.28 0.08 2.03 -1.26 -4.96 116.55 110.69 2dgr n ASP 147 Ca -0.07 -3.79 -0.20 0.00 0.52 0.00 0.00 54.79 51.25 2dgr n ASP 147 Cb 0.34 -0.87 -0.10 0.00 -0.72 0.00 0.00 41.12 39.77 2dgr n ASP 147 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2dgr s LYS 148 N -3.80 1.62 0.42 -0.67 -0.14 -1.22 -5.14 119.74 110.80 2dgr s LYS 148 Ca 0.61 -1.91 -0.25 0.00 -1.36 0.00 0.00 55.97 53.06 2dgr s LYS 148 Cb 0.49 -0.51 -0.08 0.00 -1.68 0.00 0.00 37.83 36.05 2dgr s LYS 148 CO -0.04 -0.32 1.21 -1.83 -0.76 0.00 0.00 175.35 173.62 2dgr s GLU 149 N -3.89 3.94 -0.63 1.68 -1.05 -1.26 -4.76 118.70 112.72 2dgr s GLU 149 Ca 0.34 1.92 -0.26 0.00 -0.15 0.00 0.00 54.97 56.82 2dgr s GLU 149 Cb 0.07 -2.63 -0.02 0.00 -0.44 0.00 0.00 34.13 31.10 2dgr s GLU 149 CO 0.15 -0.44 1.87 -1.25 0.95 0.00 0.00 175.26 176.54 2dgr s PRO 150 N -2.38 2.62 -0.17 -4.83 0.04 -1.26 -4.64 135.00 124.38 2dgr s PRO 150 Ca 0.59 0.54 -0.05 0.00 0.04 0.00 0.00 61.00 62.11 2dgr s PRO 150 Cb -0.33 -4.44 0.08 0.00 0.04 0.00 0.00 34.50 29.86 2dgr s PRO 150 CO 0.41 -2.79 0.32 0.08 0.04 0.00 0.00 177.00 175.07 2dgr s VAL 151 N 9.16 -0.51 0.30 -0.36 1.01 -1.26 -3.54 120.40 125.21 2dgr s VAL 151 Ca 0.67 0.19 -0.14 0.00 0.00 0.00 0.00 61.98 62.71 2dgr s VAL 151 Cb -0.12 -0.56 -0.09 0.00 0.00 0.00 0.00 36.38 35.61 2dgr s VAL 151 CO 0.19 0.07 0.69 -0.36 0.00 0.00 0.00 175.10 175.69 2dgr s PHE 152 N 2.49 3.39 -0.25 5.22 0.40 -0.37 -3.70 117.98 125.16 2dgr s PHE 152 Ca 0.01 1.14 0.02 0.00 -0.60 0.00 0.00 56.93 57.51 2dgr s PHE 152 Cb -0.12 -2.47 0.06 0.00 0.51 0.00 0.00 43.02 40.99 2dgr s PHE 152 CO -0.11 0.14 -0.08 0.00 0.70 0.00 0.00 175.22 175.87 2dgr s ALA 153 N -1.94 2.35 -0.16 5.36 0.00 -0.36 -0.15 121.76 126.87 2dgr s ALA 153 Ca 0.52 -1.65 -0.07 0.00 0.00 0.00 0.00 51.96 50.76 2dgr s ALA 153 Cb -0.11 -1.55 -0.04 0.00 0.00 0.00 0.00 23.12 21.43 2dgr s ALA 153 CO 0.18 -1.22 0.09 0.08 0.00 0.00 0.00 175.76 174.89 2dgr s VAL 154 N 1.20 5.04 -0.06 0.00 1.01 -0.33 -0.38 120.40 126.88 2dgr s VAL 154 Ca -0.07 0.05 0.05 0.00 0.00 0.00 0.00 61.98 62.01 2dgr s VAL 154 Cb -0.20 -3.24 -0.01 0.00 0.00 0.00 0.00 36.38 32.93 2dgr s VAL 154 CO -0.06 0.51 -0.23 -0.89 0.00 0.00 0.00 175.10 174.44 2dgr s THR 155 N -0.14 2.26 -5.00 3.92 2.01 -0.21 -1.55 115.64 116.93 2dgr s THR 155 Ca 0.08 -0.99 0.00 0.00 0.31 0.00 0.00 61.69 61.09 2dgr s THR 155 Cb -0.12 -1.84 0.00 0.00 0.01 0.00 0.00 72.50 70.55 2dgr s THR 155 CO 0.01 0.57 0.00 0.61 -0.69 0.00 0.00 174.62 175.12 2dgr n GLY 156 N 2.92 -1.08 3.13 4.40 0.00 -0.29 -1.75 105.19 112.52 2dgr n GLY 156 Ca -0.17 -1.61 -0.35 0.00 0.00 0.00 0.00 46.02 43.88 2dgr n GLY 156 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2dgr n MET 157 N -1.36 -0.07 0.00 1.61 2.81 -1.26 -1.42 117.12 117.43 2dgr n MET 157 Ca 0.00 -0.01 0.08 0.00 -1.81 0.00 0.00 57.70 55.96 2dgr n MET 157 Cb 0.00 -1.24 0.46 0.00 -0.71 0.00 0.00 33.22 31.73 2dgr n MET 157 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 2dgr n PRO 158 N 1.30 0.48 -0.00 0.03 -0.04 -1.26 -2.00 135.00 133.50 2dgr n PRO 158 Ca 0.01 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.47 2dgr n PRO 158 Cb 0.55 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.50 2dgr n PRO 158 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2dgr n GLU 159 N -1.01 0.32 -0.15 0.54 0.28 -1.26 -4.38 120.64 114.99 2dgr n GLU 159 Ca 0.12 0.00 -0.12 0.00 -0.16 0.00 0.00 57.16 57.00 2dgr n GLU 159 Cb 0.06 -1.02 -0.01 0.00 1.43 0.00 0.00 31.44 31.90 2dgr n GLU 159 CO 0.00 0.00 0.00 -0.91 -0.16 0.00 0.00 177.13 176.06 2dgr h ASN 160 N 0.00 0.99 0.21 -1.84 4.21 -1.87 -2.87 115.58 114.41 2dgr h ASN 160 Ca -0.02 -0.41 -0.17 0.00 1.21 0.00 0.00 56.30 56.91 2dgr h ASN 160 Cb 1.03 -0.27 -0.01 0.00 -1.12 0.00 0.00 38.32 37.95 2dgr h ASN 160 CO -0.00 1.19 -0.65 -0.37 -1.29 0.00 0.00 177.43 176.31 2dgr h VAL 161 N 0.79 1.36 -1.00 2.81 -1.51 -1.63 -3.15 116.25 113.92 2dgr h VAL 161 Ca 0.09 -2.00 0.01 0.00 -1.23 0.00 0.00 66.70 63.58 2dgr h VAL 161 Cb 0.83 1.98 -0.05 0.00 -2.13 0.00 0.00 31.29 31.93 2dgr h VAL 161 CO 0.07 0.60 0.67 -0.78 -1.23 0.00 0.00 177.57 176.90 2dgr h ASP 162 N 0.30 1.15 0.54 4.19 1.82 -1.74 -2.95 116.42 119.73 2dgr h ASP 162 Ca -0.01 -0.03 -0.03 0.00 -0.39 0.00 0.00 57.03 56.57 2dgr h ASP 162 Cb 1.19 -0.29 0.01 0.00 0.68 0.00 0.00 39.33 40.92 2dgr h ASP 162 CO 0.11 0.83 -0.26 -0.09 -1.61 0.00 0.00 179.24 178.22 2dgr h ARG 163 N 1.36 -0.70 -0.97 0.28 2.43 -1.47 -2.85 114.38 112.46 2dgr h ARG 163 Ca 0.37 0.05 0.31 0.00 -0.81 0.00 0.00 59.98 59.90 2dgr h ARG 163 Cb -0.15 0.16 -0.17 0.00 -0.42 0.00 0.00 29.97 29.39 2dgr h ARG 163 CO -0.08 -0.44 0.32 0.00 -1.51 0.00 0.00 179.97 178.25 2dgr h ALA 164 N -0.36 1.61 -0.96 2.80 0.00 -1.51 0.87 119.26 121.72 2dgr h ALA 164 Ca -0.07 0.27 0.08 0.00 0.00 0.00 0.00 54.91 55.19 2dgr h ALA 164 Cb 0.59 0.38 -0.07 0.00 0.00 0.00 0.00 17.79 18.68 2dgr h ALA 164 CO 0.12 -0.66 0.60 -0.09 0.00 0.00 0.00 179.25 179.22 2dgr h ARG 165 N 0.11 1.01 -0.61 0.00 2.43 -1.39 -1.69 114.38 114.25 2dgr h ARG 165 Ca 0.68 -0.06 0.08 0.00 -0.81 0.00 0.00 59.98 59.88 2dgr h ARG 165 Cb 1.57 -0.23 -0.07 0.00 -0.42 0.00 0.00 29.97 30.82 2dgr h ARG 165 CO -0.76 0.67 0.25 0.93 -1.51 0.00 0.00 179.97 179.55 2dgr h GLU 166 N 1.04 0.44 0.49 0.20 5.08 0.81 0.77 114.58 123.42 2dgr h GLU 166 Ca 0.43 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.74 2dgr h GLU 166 Cb 0.28 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2dgr h GLU 166 CO -0.21 0.29 -0.24 0.93 -1.00 0.00 0.00 179.01 178.79 2dgr h GLU 167 N 0.45 -0.63 -0.74 2.33 4.39 -1.25 0.27 114.58 119.41 2dgr h GLU 167 Ca 0.30 0.04 0.16 0.00 0.34 0.00 0.00 59.36 60.20 2dgr h GLU 167 Cb 0.33 0.14 -0.11 0.00 -0.10 0.00 0.00 28.75 29.02 2dgr h GLU 167 CO -0.27 -0.33 0.17 0.82 -1.16 0.00 0.00 179.01 178.24 2dgr h ILE 168 N -0.99 0.50 -0.18 3.13 2.04 -1.14 -1.15 117.51 119.73 2dgr h ILE 168 Ca -0.07 -0.09 -0.11 0.00 1.00 0.00 0.00 64.86 65.60 2dgr h ILE 168 Cb 0.60 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 36.90 2dgr h ILE 168 CO 0.11 0.05 -0.31 -0.33 0.00 0.00 0.00 178.15 177.67 2dgr h GLU 169 N 0.26 0.52 -0.93 2.37 5.08 -0.85 -3.30 114.58 117.74 2dgr h GLU 169 Ca 0.42 -0.32 0.10 0.00 -1.00 0.00 0.00 59.36 58.56 2dgr h GLU 169 Cb 0.72 0.04 -0.12 0.00 0.50 0.00 0.00 28.75 29.88 2dgr h GLU 169 CO -0.52 0.93 -0.48 0.00 -1.00 0.00 0.00 179.01 177.93 2dgr n ALA 170 N -2.49 -0.43 -0.26 3.43 0.00 0.96 0.85 120.51 122.57 2dgr n ALA 170 Ca -0.06 0.83 0.26 0.00 0.00 0.00 0.00 53.44 54.47 2dgr n ALA 170 Cb 0.48 -0.23 0.47 0.00 0.00 0.00 0.00 19.45 20.17 2dgr n ALA 170 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2dgr n HIS 171 N -5.23 0.94 0.00 0.00 8.25 -1.08 0.24 115.22 118.34 2dgr n HIS 171 Ca 0.04 0.96 -0.14 0.00 -0.26 0.00 0.00 57.72 58.32 2dgr n HIS 171 Cb 0.29 -1.37 -0.08 0.00 1.12 0.00 0.00 29.99 29.95 2dgr n HIS 171 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 2dgr h ILE 172 N 0.00 0.06 -0.10 1.59 2.04 0.27 -2.76 117.51 118.61 2dgr h ILE 172 Ca 0.68 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.52 2dgr h ILE 172 Cb 1.80 0.06 -0.00 0.00 -0.74 0.00 0.00 36.82 37.93 2dgr h ILE 172 CO -0.63 0.00 -0.01 0.74 0.00 0.00 0.00 178.15 178.25 2dgr h THR 173 N -0.56 1.27 -3.52 -0.27 2.02 -0.31 -3.45 112.91 108.09 2dgr h THR 173 Ca 0.05 -0.87 -0.43 0.00 0.77 0.00 0.00 66.41 65.93 2dgr h THR 173 Cb 0.67 1.66 0.19 0.00 -1.74 0.00 0.00 68.15 68.93 2dgr h THR 173 CO -0.42 0.25 0.09 -0.76 0.37 0.00 0.00 175.52 175.05 2dgr s LEU 174 N -9.47 0.82 -0.19 2.58 1.02 -0.64 -5.08 118.68 107.72 2dgr s LEU 174 Ca -0.14 1.07 -0.15 0.00 0.02 0.00 0.00 54.13 54.93 2dgr s LEU 174 Cb 0.05 -2.98 0.05 0.00 0.02 0.00 0.00 46.19 43.34 2dgr s LEU 174 CO 0.70 -3.94 0.49 0.00 0.02 0.00 0.00 176.35 173.62 2dgr s ARG 175 N -4.96 0.53 -1.01 1.70 1.04 -1.26 -4.83 118.95 110.17 2dgr s ARG 175 Ca 0.68 0.77 -0.05 0.00 -1.04 0.00 0.00 55.73 56.09 2dgr s ARG 175 Cb -0.17 0.17 0.01 0.00 -2.04 0.00 0.00 34.95 32.91 2dgr s ARG 175 CO 0.59 -0.10 0.87 0.45 -0.04 0.00 0.00 175.30 177.07 2dgr n SER 176 N 3.41 -4.61 0.00 -2.89 2.88 -1.26 -4.77 113.62 106.38 2dgr n SER 176 Ca -0.17 -0.42 0.00 0.00 -1.33 0.00 0.00 58.87 56.94 2dgr n SER 176 Cb 0.56 -3.97 0.00 0.00 -0.75 0.00 0.00 64.21 60.06 2dgr n SER 176 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dgr n GLY 177 N -1.53 -2.06 3.77 0.46 0.00 -1.26 -4.93 105.19 99.64 2dgr n GLY 177 Ca -0.04 -1.51 -0.33 0.00 0.00 0.00 0.00 46.02 44.13 2dgr n GLY 177 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dgr s PRO 178 N -0.01 2.90 0.09 1.61 0.04 -1.26 -4.94 135.00 133.43 2dgr s PRO 178 Ca 0.00 1.43 -0.31 0.00 0.04 0.00 0.00 61.00 62.16 2dgr s PRO 178 Cb 0.00 -1.96 -0.11 0.00 0.04 0.00 0.00 34.50 32.47 2dgr s PRO 178 CO 0.00 -1.18 1.86 0.43 0.04 0.00 0.00 177.00 178.15 2dgr n SER 179 N -2.22 4.00 -3.93 6.66 7.64 -1.26 -4.98 113.62 119.53 2dgr n SER 179 Ca 0.11 0.97 -0.22 0.00 1.01 0.00 0.00 58.87 60.73 2dgr n SER 179 Cb 0.52 -1.52 -0.17 0.00 -1.01 0.00 0.00 64.21 62.03 2dgr n SER 179 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2dgr s SER 180 N 3.14 1.37 0.00 6.43 1.04 -1.26 -5.24 113.70 119.18 2dgr s SER 180 Ca 0.84 -0.20 0.00 0.00 0.48 0.00 0.00 55.95 57.08 2dgr s SER 180 Cb -0.49 -0.61 0.00 0.00 0.10 0.00 0.00 66.02 65.02 2dgr s SER 180 CO 0.39 -0.04 0.00 0.61 0.98 0.00 0.00 173.24 175.18