#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hgm s SER 104 N 0.00 -0.13 0.00 0.53 0.01 -1.26 -5.03 113.70 107.82 2hgm s SER 104 Ca 0.00 -0.33 0.00 0.00 1.31 0.00 0.00 55.95 56.93 2hgm s SER 104 Cb 0.00 0.41 0.00 0.00 0.21 0.00 0.00 66.02 66.64 2hgm s SER 104 CO 0.00 -0.75 0.94 0.00 0.41 0.00 0.00 173.24 173.84 2hgm n ALA 105 N 0.08 2.04 -0.77 1.44 0.00 -1.26 -4.93 120.51 117.11 2hgm n ALA 105 Ca -0.17 -0.94 -0.29 0.00 0.00 0.00 0.00 53.44 52.04 2hgm n ALA 105 Cb 0.62 0.00 0.20 0.00 0.00 0.00 0.00 19.45 20.27 2hgm n ALA 105 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2hgm s ASP 106 N -0.87 2.16 -0.11 0.00 1.11 -1.26 -5.10 116.67 112.59 2hgm s ASP 106 Ca 0.00 1.68 -0.05 0.00 0.18 0.00 0.00 52.55 54.36 2hgm s ASP 106 Cb 0.00 -2.33 0.05 0.00 1.07 0.00 0.00 42.92 41.71 2hgm s ASP 106 CO 0.00 -3.49 0.26 -0.44 1.18 0.00 0.00 175.17 172.68 2hgm s SER 107 N -2.81 -0.20 0.18 0.27 0.01 -1.26 -5.02 113.70 104.87 2hgm s SER 107 Ca 0.67 0.56 0.00 0.00 1.31 0.00 0.00 55.95 58.48 2hgm s SER 107 Cb -0.22 0.47 0.00 0.00 0.21 0.00 0.00 66.02 66.48 2hgm s SER 107 CO 0.61 -0.18 0.00 0.00 0.41 0.00 0.00 173.24 174.08 2hgm n ALA 108 N 4.38 0.80 0.00 1.44 0.00 -1.26 -5.06 120.51 120.81 2hgm n ALA 108 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.21 2hgm n ALA 108 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 2hgm n ALA 108 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2hgm n ASN 109 N -2.91 0.00 -2.52 0.00 6.94 -1.26 -4.65 115.26 110.85 2hgm n ASN 109 Ca 0.00 0.00 -0.17 0.00 -0.02 0.00 0.00 54.58 54.39 2hgm n ASN 109 Cb 0.00 0.05 -0.09 0.00 -2.36 0.00 0.00 39.78 37.38 2hgm n ASN 109 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 2hgm n ASP 110 N -1.62 4.95 -4.55 0.53 9.92 -1.26 -2.61 116.55 121.92 2hgm n ASP 110 Ca 0.00 -2.31 -0.35 0.00 -0.53 0.00 0.00 54.79 51.60 2hgm n ASP 110 Cb 0.00 -1.16 -0.04 0.00 -0.64 0.00 0.00 41.12 39.28 2hgm n ASP 110 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 2hgm s GLY 111 N 2.46 0.06 0.32 0.44 0.00 -1.26 -4.66 107.32 104.68 2hgm s GLY 111 Ca 0.52 -0.71 0.08 0.00 0.00 0.00 0.00 44.72 44.60 2hgm s GLY 111 CO -0.02 3.57 0.21 -1.36 0.00 0.00 0.00 173.10 175.50 2hgm s PHE 112 N 9.94 2.87 0.04 1.90 0.40 -1.12 -1.26 117.98 130.75 2hgm s PHE 112 Ca 0.73 -0.29 0.01 0.00 -0.60 0.00 0.00 56.93 56.79 2hgm s PHE 112 Cb -0.12 -1.64 -0.02 0.00 0.51 0.00 0.00 43.02 41.74 2hgm s PHE 112 CO 0.17 0.32 -0.06 0.08 0.70 0.00 0.00 175.22 176.43 2hgm s VAL 113 N -2.31 0.36 0.03 -0.44 1.01 0.51 -1.16 120.40 118.40 2hgm s VAL 113 Ca 0.38 -1.07 0.09 0.00 0.00 0.00 0.00 61.98 61.38 2hgm s VAL 113 Cb -0.05 -0.54 -0.03 0.00 0.00 0.00 0.00 36.38 35.77 2hgm s VAL 113 CO 0.25 -0.47 -0.25 -0.60 0.00 0.00 0.00 175.10 174.03 2hgm s ARG 114 N -1.69 1.75 0.15 2.72 3.52 -0.04 -0.30 118.95 125.06 2hgm s ARG 114 Ca -0.11 -1.04 0.08 0.00 -0.13 0.00 0.00 55.73 54.53 2hgm s ARG 114 Cb -0.09 -1.87 -0.04 0.00 -1.56 0.00 0.00 34.95 31.39 2hgm s ARG 114 CO -0.01 0.49 -0.06 -0.51 -0.81 0.00 0.00 175.30 174.40 2hgm s LEU 115 N -1.11 3.13 -0.49 -0.88 2.01 0.49 -1.62 118.68 120.20 2hgm s LEU 115 Ca 0.10 -0.45 0.06 0.00 0.01 0.00 0.00 54.13 53.86 2hgm s LEU 115 Cb -0.10 -1.83 0.23 0.00 0.01 0.00 0.00 46.19 44.50 2hgm s LEU 115 CO 0.01 0.12 0.85 -1.14 1.01 0.00 0.00 176.35 177.21 2hgm n ARG 116 N 0.17 0.74 0.00 1.70 0.00 -1.25 -2.38 116.66 115.64 2hgm n ARG 116 Ca -0.11 -1.83 0.00 0.00 -0.00 0.00 0.00 57.85 55.91 2hgm n ARG 116 Cb 0.54 -1.46 0.00 0.00 0.00 0.00 0.00 32.46 31.54 2hgm n ARG 116 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2hgm n GLY 117 N 1.83 0.08 3.82 5.14 0.00 0.56 -3.88 105.19 112.74 2hgm n GLY 117 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 2hgm n GLY 117 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2hgm s LEU 118 N 0.00 3.66 0.79 0.99 1.43 -1.06 -3.11 118.68 121.39 2hgm s LEU 118 Ca 0.00 1.71 -0.10 0.00 -1.03 0.00 0.00 54.13 54.71 2hgm s LEU 118 Cb 0.00 -4.53 0.10 0.00 0.03 0.00 0.00 46.19 41.79 2hgm s LEU 118 CO 0.00 -0.75 1.13 -2.16 0.23 0.00 0.00 176.35 174.80 2hgm s PRO 119 N -3.84 1.81 0.07 1.29 0.04 -1.26 -4.49 135.00 128.61 2hgm s PRO 119 Ca 0.62 -0.20 -0.31 0.00 0.04 0.00 0.00 61.00 61.16 2hgm s PRO 119 Cb -0.12 -2.04 -0.09 0.00 0.04 0.00 0.00 34.50 32.28 2hgm s PRO 119 CO 0.29 -1.59 1.84 -0.06 0.04 0.00 0.00 177.00 177.52 2hgm s PHE 120 N -3.48 1.86 0.00 0.56 0.08 -1.26 -1.97 117.98 113.77 2hgm s PHE 120 Ca 0.64 -0.12 0.00 0.00 0.12 0.00 0.00 56.93 57.57 2hgm s PHE 120 Cb -0.09 -4.16 0.00 0.00 -0.57 0.00 0.00 43.02 38.20 2hgm s PHE 120 CO 0.48 -4.92 0.00 0.41 -0.10 0.00 0.00 175.22 171.08 2hgm n GLY 121 N 4.31 0.55 3.68 4.36 0.00 -1.26 -5.06 105.19 111.77 2hgm n GLY 121 Ca 0.18 -0.25 -0.36 0.00 0.00 0.00 0.00 46.02 45.59 2hgm n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hgm s THR 123 N -1.65 0.06 0.26 0.00 -1.32 -1.26 -4.85 115.64 106.89 2hgm s THR 123 Ca 0.78 -1.35 -0.09 0.00 -1.21 0.00 0.00 61.69 59.82 2hgm s THR 123 Cb -0.36 -1.82 0.40 0.00 -1.51 0.00 0.00 72.50 69.21 2hgm s THR 123 CO 0.45 -0.29 1.58 0.50 -2.21 0.00 0.00 174.62 174.65 2hgm h LYS 124 N 2.52 0.00 0.00 7.08 3.64 -1.97 0.75 116.57 128.60 2hgm h LYS 124 Ca -0.32 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.06 2hgm h LYS 124 Cb 1.23 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 2hgm h LYS 124 CO 0.48 0.00 0.00 0.39 -2.27 0.00 0.00 179.45 178.05 2hgm n GLU 125 N -5.57 0.14 0.06 1.90 4.71 -1.26 -0.48 120.64 120.14 2hgm n GLU 125 Ca 0.14 0.55 -0.02 0.00 -0.01 0.00 0.00 57.16 57.83 2hgm n GLU 125 Cb 0.46 -1.88 -0.07 0.00 -1.01 0.00 0.00 31.44 28.94 2hgm n GLU 125 CO 0.00 0.00 0.00 0.93 0.09 0.00 0.00 177.13 178.15 2hgm h GLU 126 N 0.00 0.00 -0.41 3.49 5.08 -1.26 -2.13 114.58 119.34 2hgm h GLU 126 Ca 0.00 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.21 2hgm h GLU 126 Cb 0.11 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 2hgm h GLU 126 CO 0.00 0.48 -0.33 0.82 -1.00 0.00 0.00 179.01 178.98 2hgm h ILE 127 N 0.00 1.27 0.00 3.13 5.03 -1.00 -0.38 117.51 125.56 2hgm h ILE 127 Ca -0.12 -1.50 0.00 0.00 -0.12 0.00 0.00 64.86 63.12 2hgm h ILE 127 Cb 1.62 1.30 0.00 0.00 -3.03 0.00 0.00 36.82 36.71 2hgm h ILE 127 CO 0.07 0.51 0.12 -0.37 -0.68 0.00 0.00 178.15 177.79 2hgm h VAL 128 N 0.78 0.00 0.00 1.67 -1.51 -0.73 -0.27 116.25 116.19 2hgm h VAL 128 Ca 0.08 0.00 -0.22 0.00 -1.23 0.00 0.00 66.70 65.33 2hgm h VAL 128 Cb 0.92 0.74 -0.04 0.00 -2.13 0.00 0.00 31.29 30.78 2hgm h VAL 128 CO 0.09 0.00 -2.05 0.00 -1.23 0.00 0.00 177.57 174.37 2hgm n GLN 129 N -2.77 0.67 -0.26 5.19 -0.00 -0.81 -2.50 117.38 116.89 2hgm n GLN 129 Ca -0.02 -0.01 -0.06 0.00 -0.00 0.00 0.00 57.00 56.91 2hgm n GLN 129 Cb 0.17 -1.59 0.05 0.00 -0.00 0.00 0.00 30.24 28.87 2hgm n GLN 129 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.06 177.41 2hgm h PHE 130 N 0.00 1.05 -0.27 2.61 3.57 0.25 -3.11 116.94 121.04 2hgm h PHE 130 Ca -0.30 -0.06 -0.21 0.00 3.53 0.00 0.00 57.97 60.93 2hgm h PHE 130 Cb 1.74 -0.32 -0.18 0.00 2.79 0.00 0.00 35.95 39.97 2hgm h PHE 130 CO 0.00 0.79 -0.66 1.19 -2.23 0.00 0.00 178.31 177.40 2hgm n PHE 131 N -4.40 0.98 0.28 0.41 3.72 -0.24 -4.61 117.46 113.60 2hgm n PHE 131 Ca 0.06 -1.71 0.17 0.00 -0.05 0.00 0.00 57.45 55.92 2hgm n PHE 131 Cb 0.15 -0.27 0.83 0.00 -0.94 0.00 0.00 39.48 39.25 2hgm n PHE 131 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 2hgm h SER 132 N 1.46 0.00 -0.83 4.37 0.02 -1.41 -1.72 113.55 115.44 2hgm h SER 132 Ca 0.11 0.00 0.19 0.00 -0.84 0.00 0.00 61.79 61.25 2hgm h SER 132 Cb 1.25 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.73 2hgm h SER 132 CO 0.27 0.00 0.56 1.23 -1.14 0.00 0.00 176.83 177.75 2hgm h GLY 133 N 0.00 0.60 -2.56 -3.77 0.00 -1.81 -3.47 103.07 92.05 2hgm h GLY 133 Ca 0.05 -0.13 -0.29 0.00 0.00 0.00 0.00 47.33 46.95 2hgm h GLY 133 CO -0.00 0.01 -0.64 1.08 0.00 0.00 0.00 176.54 176.99 2hgm s LEU 134 N -9.19 1.75 0.09 3.11 1.02 -0.65 -5.16 118.68 109.66 2hgm s LEU 134 Ca -0.07 -1.29 -0.20 0.00 0.02 0.00 0.00 54.13 52.59 2hgm s LEU 134 Cb 0.22 0.08 -0.07 0.00 0.02 0.00 0.00 46.19 46.44 2hgm s LEU 134 CO 0.77 -0.69 0.60 -1.61 0.02 0.00 0.00 176.35 175.45 2hgm s GLU 135 N -4.01 4.26 -0.02 1.70 2.02 -1.26 -5.00 118.70 116.39 2hgm s GLU 135 Ca 0.31 0.80 0.01 0.00 0.02 0.00 0.00 54.97 56.12 2hgm s GLU 135 Cb 0.07 -3.23 0.00 0.00 0.10 0.00 0.00 34.13 31.07 2hgm s GLU 135 CO 0.09 0.62 -0.05 0.42 0.02 0.00 0.00 175.26 176.36 2hgm s ILE 136 N -1.13 0.45 0.67 -1.63 1.01 -1.26 -0.92 121.20 118.39 2hgm s ILE 136 Ca 0.30 -0.19 -0.17 0.00 0.00 0.00 0.00 60.65 60.60 2hgm s ILE 136 Cb -0.20 -0.42 0.01 0.00 0.01 0.00 0.00 42.46 41.86 2hgm s ILE 136 CO 0.20 0.15 1.22 0.68 0.00 0.00 0.00 174.94 177.20 2hgm s VAL 137 N 0.22 2.38 -0.11 2.92 -7.23 -1.20 -4.69 120.40 112.69 2hgm s VAL 137 Ca -0.02 0.21 0.17 0.00 -1.81 0.00 0.00 61.98 60.52 2hgm s VAL 137 Cb -0.06 -2.92 0.17 0.00 0.56 0.00 0.00 36.38 34.12 2hgm s VAL 137 CO -0.00 -0.08 1.45 -2.65 -0.31 0.00 0.00 175.10 173.51 2hgm n PRO 138 N -2.20 0.11 -0.25 4.82 -0.02 -1.26 -0.65 135.00 135.54 2hgm n PRO 138 Ca 0.14 0.59 0.06 0.00 -2.02 0.00 0.00 63.50 62.27 2hgm n PRO 138 Cb 0.50 -2.01 0.08 0.00 -0.02 0.00 0.00 33.50 32.04 2hgm n PRO 138 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2hgm n ASN 139 N -2.12 1.35 0.23 2.55 3.02 -1.26 -4.96 115.26 114.06 2hgm n ASN 139 Ca -0.01 -2.62 0.14 0.00 -0.03 0.00 0.00 54.58 52.06 2hgm n ASN 139 Cb 0.18 -0.33 0.78 0.00 -0.61 0.00 0.00 39.78 39.80 2hgm n ASN 139 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 2hgm h GLY 140 N 0.00 0.00 -5.04 7.41 0.00 -1.12 -3.44 103.07 100.88 2hgm h GLY 140 Ca 0.00 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 46.74 2hgm h GLY 140 CO 0.00 0.00 -0.15 -0.42 0.00 0.00 0.00 176.54 175.97 2hgm s ILE 141 N -4.82 5.00 -0.02 2.60 1.01 -1.26 -0.74 121.20 122.97 2hgm s ILE 141 Ca -0.05 0.95 0.03 0.00 0.00 0.00 0.00 60.65 61.58 2hgm s ILE 141 Cb 0.16 -3.78 -0.00 0.00 0.01 0.00 0.00 42.46 38.85 2hgm s ILE 141 CO 0.61 0.51 -0.09 -0.89 0.00 0.00 0.00 174.94 175.08 2hgm s THR 142 N -0.69 0.76 -0.47 2.92 2.01 0.58 -4.94 115.64 115.82 2hgm s THR 142 Ca 0.25 -0.38 0.03 0.00 0.31 0.00 0.00 61.69 61.90 2hgm s THR 142 Cb -0.17 -0.66 0.13 0.00 0.01 0.00 0.00 72.50 71.81 2hgm s THR 142 CO 0.14 0.23 0.24 -0.76 -0.69 0.00 0.00 174.62 173.78 2hgm s LEU 143 N 0.01 3.26 -0.06 4.42 2.01 -1.26 -0.81 118.68 126.25 2hgm s LEU 143 Ca -0.00 -2.75 -0.01 0.00 0.01 0.00 0.00 54.13 51.38 2hgm s LEU 143 Cb -0.06 -1.25 -0.01 0.00 0.01 0.00 0.00 46.19 44.88 2hgm s LEU 143 CO 0.00 -0.26 0.06 1.55 1.01 0.00 0.00 176.35 178.72 2hgm h PRO 144 N 6.66 -0.04 -2.42 1.29 0.13 -1.88 -3.50 132.00 132.25 2hgm h PRO 144 Ca -0.04 0.00 0.23 0.00 -0.87 0.00 0.00 66.00 65.32 2hgm h PRO 144 Cb 0.92 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.01 2hgm h PRO 144 CO 0.55 -0.03 0.71 0.14 -0.23 0.00 0.00 178.00 179.14 2hgm s VAL 145 N -1.55 0.00 0.93 1.56 -7.23 -1.26 -4.89 120.40 107.96 2hgm s VAL 145 Ca -0.01 -0.43 -0.13 0.00 -1.81 0.00 0.00 61.98 59.61 2hgm s VAL 145 Cb 0.00 -2.99 0.15 0.00 0.56 0.00 0.00 36.38 34.11 2hgm s VAL 145 CO 0.02 0.00 1.14 1.51 -0.31 0.00 0.00 175.10 177.46 2hgm s ASP 146 N -3.60 3.29 0.00 4.85 -4.77 -1.25 -1.23 116.67 113.96 2hgm s ASP 146 Ca 0.26 0.94 0.00 0.00 -3.30 0.00 0.00 52.55 50.44 2hgm s ASP 146 Cb -0.02 -1.48 0.00 0.00 -1.09 0.00 0.00 42.92 40.33 2hgm s ASP 146 CO 0.03 -2.69 0.48 -2.65 0.70 0.00 0.00 175.17 171.04 2hgm n PRO 147 N -3.85 0.00 0.00 2.11 -0.02 -1.26 -2.09 135.00 129.88 2hgm n PRO 147 Ca 0.07 0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 2hgm n PRO 147 Cb 0.59 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.57 2hgm n PRO 147 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2hgm n GLU 148 N -0.98 -0.31 -2.58 -0.52 2.13 -1.26 -5.07 120.64 112.06 2hgm n GLU 148 Ca 0.00 -0.31 -0.02 0.00 0.66 0.00 0.00 57.16 57.48 2hgm n GLU 148 Cb 0.00 -0.75 0.01 0.00 0.27 0.00 0.00 31.44 30.98 2hgm n GLU 148 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2hgm n GLY 149 N -0.02 0.78 0.00 8.31 0.00 -0.89 -4.96 105.19 108.40 2hgm n GLY 149 Ca 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.42 2hgm n GLY 149 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2hgm n LYS 150 N -0.97 2.29 0.00 1.61 5.02 -1.26 -4.98 118.16 119.87 2hgm n LYS 150 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2hgm n LYS 150 Cb 0.51 -0.93 0.00 0.00 -0.02 0.00 0.00 35.03 34.59 2hgm n LYS 150 CO 0.00 0.00 0.00 1.51 -0.52 0.00 0.00 177.40 178.39 2hgm n ILE 151 N -1.56 0.00 -2.66 -0.18 0.00 -1.26 -4.98 119.36 108.72 2hgm n ILE 151 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 62.75 62.72 2hgm n ILE 151 Cb 0.24 0.00 0.04 0.00 0.00 0.00 0.00 39.64 39.92 2hgm n ILE 151 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2hgm n THR 152 N 0.00 0.00 -0.53 9.51 -2.24 -1.26 -3.88 114.28 115.88 2hgm n THR 152 Ca 0.00 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 2hgm n THR 152 Cb 0.00 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 2hgm n THR 152 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2hgm n GLY 153 N 2.37 -0.19 3.16 3.38 0.00 -1.10 -4.19 105.19 108.63 2hgm n GLY 153 Ca 0.09 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.01 2hgm n GLY 153 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2hgm s GLU 154 N -0.35 0.82 0.11 1.61 -1.05 -0.36 -0.32 118.70 119.15 2hgm s GLU 154 Ca 0.00 -1.33 -0.25 0.00 -0.15 0.00 0.00 54.97 53.24 2hgm s GLU 154 Cb 0.00 -0.14 0.09 0.00 -0.44 0.00 0.00 34.13 33.64 2hgm s GLU 154 CO 0.00 -0.04 1.12 0.00 0.95 0.00 0.00 175.26 177.29 2hgm s ALA 155 N -3.68 -1.89 0.09 -0.84 0.00 -1.00 -4.14 121.76 110.30 2hgm s ALA 155 Ca 0.12 -0.06 -0.10 0.00 0.00 0.00 0.00 51.96 51.92 2hgm s ALA 155 Cb 0.06 0.73 0.01 0.00 0.00 0.00 0.00 23.12 23.91 2hgm s ALA 155 CO -0.05 -1.08 0.24 -0.06 0.00 0.00 0.00 175.76 174.81 2hgm s PHE 156 N -2.30 0.07 -0.29 0.00 0.08 0.01 -0.38 117.98 115.16 2hgm s PHE 156 Ca 0.21 -0.46 -0.14 0.00 0.12 0.00 0.00 56.93 56.67 2hgm s PHE 156 Cb -0.01 0.01 0.12 0.00 -0.57 0.00 0.00 43.02 42.57 2hgm s PHE 156 CO 0.02 -0.57 0.78 0.54 -0.10 0.00 0.00 175.22 175.90 2hgm s VAL 157 N -3.74 -0.43 -0.11 -0.44 0.11 0.59 -0.31 120.40 116.07 2hgm s VAL 157 Ca 0.04 0.00 -0.15 0.00 -2.93 0.00 0.00 61.98 58.93 2hgm s VAL 157 Cb 0.04 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.84 2hgm s VAL 157 CO -0.11 0.00 0.38 -1.58 -3.33 0.00 0.00 175.10 170.46 2hgm s GLN 158 N 2.16 4.19 0.21 1.54 2.00 0.08 -0.37 119.66 129.47 2hgm s GLN 158 Ca -0.07 0.28 0.00 0.00 -2.00 0.00 0.00 55.36 53.57 2hgm s GLN 158 Cb -0.07 -3.38 0.04 0.00 0.80 0.00 0.00 33.01 30.40 2hgm s GLN 158 CO -0.18 0.32 0.28 1.19 -0.50 0.00 0.00 175.29 176.40 2hgm n PHE 159 N 3.19 -3.23 0.65 1.67 3.01 -0.39 -3.22 117.46 119.13 2hgm n PHE 159 Ca -0.11 -0.51 0.12 0.00 1.01 0.00 0.00 57.45 57.96 2hgm n PHE 159 Cb 0.52 -0.21 0.46 0.00 -0.01 0.00 0.00 39.48 40.25 2hgm n PHE 159 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2hgm n ALA 160 N -2.97 2.01 -3.48 4.37 0.00 -0.10 -3.67 120.51 116.67 2hgm n ALA 160 Ca -0.05 -0.03 -0.11 0.00 0.00 0.00 0.00 53.44 53.26 2hgm n ALA 160 Cb 0.17 -1.40 -0.02 0.00 0.00 0.00 0.00 19.45 18.20 2hgm n ALA 160 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2hgm s SER 161 N -3.69 -0.47 0.42 0.00 0.01 -1.25 -4.97 113.70 103.74 2hgm s SER 161 Ca 0.09 -0.17 0.10 0.00 1.31 0.00 0.00 55.95 57.28 2hgm s SER 161 Cb 0.13 0.62 0.92 0.00 0.21 0.00 0.00 66.02 67.90 2hgm s SER 161 CO 0.45 -1.05 2.02 -0.61 0.41 0.00 0.00 173.24 174.47 2hgm h GLN 162 N 2.03 0.49 -0.08 12.44 5.75 -1.77 -2.83 115.11 131.15 2hgm h GLN 162 Ca -0.31 -0.03 -0.05 0.00 -0.15 0.00 0.00 58.65 58.11 2hgm h GLN 162 Cb 1.29 -0.11 0.00 0.00 1.07 0.00 0.00 27.48 29.73 2hgm h GLN 162 CO 0.35 0.33 -0.16 1.49 -2.65 0.00 0.00 178.83 178.19 2hgm h GLU 163 N 0.51 0.25 -0.46 1.69 4.57 -1.96 -2.70 114.58 116.48 2hgm h GLU 163 Ca 0.21 -0.16 0.00 0.00 -1.18 0.00 0.00 59.36 58.23 2hgm h GLU 163 Cb 0.19 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.78 2hgm h GLU 163 CO -0.05 0.75 0.29 -0.07 -1.18 0.00 0.00 179.01 178.75 2hgm h LEU 164 N -0.22 0.54 -0.44 1.64 3.38 -1.92 0.34 115.31 118.63 2hgm h LEU 164 Ca 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2hgm h LEU 164 Cb 0.75 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2hgm h LEU 164 CO 0.04 0.40 0.00 0.00 0.09 0.00 0.00 178.44 178.97 2hgm h ALA 165 N 1.69 1.00 0.06 1.53 0.00 -1.44 -2.48 119.26 119.62 2hgm h ALA 165 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.79 2hgm h ALA 165 Cb -0.05 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 2hgm h ALA 165 CO -0.03 0.00 -1.51 1.49 0.00 0.00 0.00 179.25 179.19 2hgm h GLU 166 N 0.00 0.12 -0.45 0.00 4.57 -0.64 -3.10 114.58 115.08 2hgm h GLU 166 Ca 0.00 -0.21 -0.08 0.00 -1.18 0.00 0.00 59.36 57.89 2hgm h GLU 166 Cb 0.67 0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 29.32 2hgm h GLU 166 CO 0.00 0.90 -0.03 0.87 -1.18 0.00 0.00 179.01 179.58 2hgm h LYS 167 N 0.03 0.76 -0.27 1.92 1.79 -1.18 -3.28 116.57 116.34 2hgm h LYS 167 Ca -0.22 -0.21 -0.01 0.00 -2.18 0.00 0.00 60.65 58.03 2hgm h LYS 167 Cb 1.97 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 32.52 2hgm h LYS 167 CO 0.12 0.79 0.15 0.00 -1.08 0.00 0.00 179.45 179.43 2hgm h ALA 168 N 1.26 0.35 -0.84 3.86 0.00 -1.41 -1.84 119.26 120.64 2hgm h ALA 168 Ca 0.13 -0.07 0.24 0.00 0.00 0.00 0.00 54.91 55.22 2hgm h ALA 168 Cb 0.48 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 2hgm h ALA 168 CO 0.02 -0.12 0.74 -0.07 0.00 0.00 0.00 179.25 179.82 2hgm h LEU 169 N 0.33 0.00 -0.87 0.00 4.07 -1.60 -0.42 115.31 116.82 2hgm h LEU 169 Ca 0.10 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.06 2hgm h LEU 169 Cb 0.06 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.80 2hgm h LEU 169 CO -0.02 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 177.95 2hgm n GLY 170 N -1.65 -0.93 0.28 0.83 0.00 -0.69 -2.13 105.19 100.91 2hgm n GLY 170 Ca 0.18 0.11 0.16 0.00 0.00 0.00 0.00 46.02 46.47 2hgm n GLY 170 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2hgm h LYS 171 N 0.00 0.00 0.00 1.61 1.79 -1.21 -3.46 116.57 115.30 2hgm h LYS 171 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2hgm h LYS 171 Cb 0.12 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.77 2hgm h LYS 171 CO 0.00 0.07 0.00 1.58 -1.08 0.00 0.00 179.45 180.02 2hgm n HIS 172 N -3.42 0.00 -1.95 -1.35 -0.00 -0.90 -1.58 115.22 106.02 2hgm n HIS 172 Ca -0.02 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.16 2hgm n HIS 172 Cb 0.22 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.09 2hgm n HIS 172 CO 0.00 0.00 0.00 1.17 0.46 0.00 0.00 176.34 177.97 2hgm n LYS 173 N 0.00 0.00 -0.45 1.57 3.00 -1.25 -4.26 118.16 116.77 2hgm n LYS 173 Ca 0.00 -0.70 -0.30 0.00 -0.00 0.00 0.00 58.31 57.31 2hgm n LYS 173 Cb 0.00 -0.36 0.28 0.00 0.00 0.00 0.00 35.03 34.94 2hgm n LYS 173 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2hgm n GLU 174 N 0.00 -4.38 -4.43 1.64 -0.58 -0.61 -4.19 120.64 108.09 2hgm n GLU 174 Ca 0.00 -1.52 -0.26 0.00 -0.42 0.00 0.00 57.16 54.96 2hgm n GLU 174 Cb 0.64 -1.79 -0.11 0.00 -0.57 0.00 0.00 31.44 29.60 2hgm n GLU 174 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2hgm s ARG 175 N -5.16 1.60 -0.02 3.49 0.52 -1.26 -1.26 118.95 116.86 2hgm s ARG 175 Ca 0.67 -1.57 0.00 0.00 -0.52 0.00 0.00 55.73 54.31 2hgm s ARG 175 Cb -0.10 -1.85 0.03 0.00 0.52 0.00 0.00 34.95 33.55 2hgm s ARG 175 CO 0.55 0.38 0.02 0.42 0.02 0.00 0.00 175.30 176.69 2hgm s ILE 176 N -1.89 -0.02 0.00 1.52 1.01 0.01 -4.77 121.20 117.06 2hgm s ILE 176 Ca 0.23 0.17 0.00 0.00 0.00 0.00 0.00 60.65 61.06 2hgm s ILE 176 Cb -0.07 -0.09 0.00 0.00 0.01 0.00 0.00 42.46 42.31 2hgm s ILE 176 CO 0.12 0.08 0.00 0.61 0.00 0.00 0.00 174.94 175.75 2hgm n GLY 177 N 4.03 0.24 0.20 6.18 0.00 -1.26 -0.67 105.19 113.91 2hgm n GLY 177 Ca -0.26 0.66 0.00 0.00 0.00 0.00 0.00 46.02 46.43 2hgm n GLY 177 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2hgm n HIS 178 N 0.00 0.00 -4.66 1.61 -0.00 -1.26 -5.14 115.22 105.77 2hgm n HIS 178 Ca 0.00 0.00 -0.30 0.00 0.46 0.00 0.00 57.72 57.88 2hgm n HIS 178 Cb 0.00 0.05 -0.08 0.00 -0.12 0.00 0.00 29.99 29.85 2hgm n HIS 178 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 2hgm s ARG 179 N 0.00 2.10 -0.37 1.57 3.00 0.16 -5.10 118.95 120.31 2hgm s ARG 179 Ca 0.00 -2.32 0.04 0.00 0.00 0.00 0.00 55.73 53.44 2hgm s ARG 179 Cb 0.00 -1.13 0.16 0.00 0.00 0.00 0.00 34.95 33.98 2hgm s ARG 179 CO 0.00 -0.43 0.41 0.71 0.00 0.00 0.00 175.30 175.99 2hgm s TYR 180 N -3.01 -0.54 -0.11 -0.53 2.02 -1.18 -0.81 117.35 113.18 2hgm s TYR 180 Ca 0.12 -0.58 -0.05 0.00 -0.37 0.00 0.00 57.07 56.19 2hgm s TYR 180 Cb 0.02 -0.29 -0.04 0.00 -0.40 0.00 0.00 41.96 41.24 2hgm s TYR 180 CO 0.08 -1.00 0.09 0.42 -1.57 0.00 0.00 175.55 173.57 2hgm s ILE 181 N 1.59 5.06 0.56 2.71 1.01 -0.39 -4.77 121.20 126.97 2hgm s ILE 181 Ca 0.16 0.04 -0.18 0.00 0.00 0.00 0.00 60.65 60.67 2hgm s ILE 181 Cb -0.14 -3.19 -0.05 0.00 0.01 0.00 0.00 42.46 39.10 2hgm s ILE 181 CO -0.07 0.61 1.11 -1.61 0.00 0.00 0.00 174.94 174.98 2hgm s GLU 182 N -0.91 3.30 -0.01 2.79 8.01 -1.25 -3.86 118.70 126.77 2hgm s GLU 182 Ca 0.14 1.51 0.00 0.00 0.01 0.00 0.00 54.97 56.63 2hgm s GLU 182 Cb -0.12 -2.01 0.01 0.00 -4.31 0.00 0.00 34.13 27.70 2hgm s GLU 182 CO 0.03 -0.87 0.01 0.14 0.01 0.00 0.00 175.26 174.58 2hgm s VAL 183 N -1.95 0.01 0.01 2.63 -7.23 -1.26 -3.75 120.40 108.87 2hgm s VAL 183 Ca 0.70 0.06 -0.04 0.00 -1.81 0.00 0.00 61.98 60.89 2hgm s VAL 183 Cb -0.22 -0.06 -0.01 0.00 0.56 0.00 0.00 36.38 36.66 2hgm s VAL 183 CO 0.29 0.04 0.07 -0.36 -0.31 0.00 0.00 175.10 174.83 2hgm s PHE 184 N 0.35 0.15 0.70 2.82 0.08 -0.64 -4.99 117.98 116.44 2hgm s PHE 184 Ca -0.03 -0.33 -0.16 0.00 0.12 0.00 0.00 56.93 56.53 2hgm s PHE 184 Cb -0.04 -0.12 0.02 0.00 -0.57 0.00 0.00 43.02 42.31 2hgm s PHE 184 CO -0.01 -0.26 1.24 0.21 -0.10 0.00 0.00 175.22 176.31 2hgm s LYS 185 N -1.55 2.27 0.27 0.44 2.47 -1.26 -0.86 119.74 121.52 2hgm s LYS 185 Ca -0.14 1.89 -0.12 0.00 -1.56 0.00 0.00 55.97 56.04 2hgm s LYS 185 Cb -0.08 -1.83 0.00 0.00 -1.46 0.00 0.00 37.83 34.46 2hgm s LYS 185 CO -0.00 -1.76 0.52 -1.12 0.16 0.00 0.00 175.35 173.14 2hgm s SER 186 N -1.76 0.02 0.06 1.43 0.01 -0.31 -4.55 113.70 108.61 2hgm s SER 186 Ca 0.78 -0.99 -0.18 0.00 1.31 0.00 0.00 55.95 56.87 2hgm s SER 186 Cb -0.33 0.63 0.04 0.00 0.21 0.00 0.00 66.02 66.57 2hgm s SER 186 CO 0.43 -1.22 0.41 -0.44 0.41 0.00 0.00 173.24 172.84 2hgm s SER 187 N -3.04 -0.28 0.00 2.44 0.01 -1.26 -2.78 113.70 108.79 2hgm s SER 187 Ca 0.22 -0.05 0.00 0.00 1.31 0.00 0.00 55.95 57.43 2hgm s SER 187 Cb -0.01 0.44 0.00 0.00 0.21 0.00 0.00 66.02 66.65 2hgm s SER 187 CO 0.10 -0.70 0.05 1.67 0.41 0.00 0.00 173.24 174.78 2hgm n GLN 188 N 0.37 0.00 -0.01 12.44 -0.06 -1.26 -1.34 117.38 127.52 2hgm n GLN 188 Ca -0.18 0.00 -0.01 0.00 -2.00 0.00 0.00 57.00 54.81 2hgm n GLN 188 Cb 0.60 -1.20 -0.02 0.00 -4.06 0.00 0.00 30.24 25.57 2hgm n GLN 188 CO 0.00 0.00 0.00 -1.91 -0.20 0.00 0.00 177.06 174.95 2hgm n GLU 189 N -0.43 3.07 0.17 3.69 4.07 -1.26 -4.47 120.64 125.47 2hgm n GLU 189 Ca 0.00 -0.00 0.12 0.00 -0.06 0.00 0.00 57.16 57.21 2hgm n GLU 189 Cb 0.05 -1.06 0.10 0.00 -0.06 0.00 0.00 31.44 30.48 2hgm n GLU 189 CO 0.00 0.00 0.00 0.93 -0.06 0.00 0.00 177.13 178.00 2hgm h GLU 190 N 0.00 0.00 0.02 5.31 5.08 -1.64 -3.37 114.58 119.97 2hgm h GLU 190 Ca -0.05 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.03 2hgm h GLU 190 Cb 0.97 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.18 2hgm h GLU 190 CO 0.00 0.00 -1.59 -0.39 -1.00 0.00 0.00 179.01 176.03 2hgm h VAL 191 N 0.00 1.01 -0.29 3.13 -1.51 -1.81 -3.33 116.25 113.45 2hgm h VAL 191 Ca 0.00 -2.81 -0.19 0.00 -1.23 0.00 0.00 66.70 62.47 2hgm h VAL 191 Cb 1.00 2.52 -0.08 0.00 -2.13 0.00 0.00 31.29 32.60 2hgm h VAL 191 CO 0.00 0.62 0.24 -2.11 -1.23 0.00 0.00 177.57 175.10 2hgm n ARG 192 N -3.16 1.47 -0.01 5.19 0.00 -1.26 -4.63 116.66 114.27 2hgm n ARG 192 Ca -0.15 -0.93 0.00 0.00 -0.00 0.00 0.00 57.85 56.77 2hgm n ARG 192 Cb 1.03 -1.36 0.00 0.00 -0.00 0.00 0.00 32.46 32.13 2hgm n ARG 192 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2hgm n SER 193 N 0.71 1.47 0.00 2.89 7.64 -1.25 -5.09 113.62 119.99 2hgm n SER 193 Ca 0.18 -0.98 0.00 0.00 1.01 0.00 0.00 58.87 59.08 2hgm n SER 193 Cb 0.58 -0.25 0.00 0.00 -1.01 0.00 0.00 64.21 63.53 2hgm n SER 193 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03