#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hgm n SER 104 N 0.00 2.93 -4.02 6.41 7.64 -1.26 -5.01 113.62 120.32 2hgm n SER 104 Ca 0.00 1.12 -0.11 0.00 1.01 0.00 0.00 58.87 60.90 2hgm n SER 104 Cb 0.00 -1.44 -0.11 0.00 -1.01 0.00 0.00 64.21 61.65 2hgm n SER 104 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2hgm s ALA 105 N 0.26 0.32 -0.02 -0.43 0.00 -1.26 -4.92 121.76 115.70 2hgm s ALA 105 Ca 0.71 -0.68 -0.21 0.00 0.00 0.00 0.00 51.96 51.78 2hgm s ALA 105 Cb -0.65 0.11 0.04 0.00 0.00 0.00 0.00 23.12 22.62 2hgm s ALA 105 CO 0.46 -0.11 0.46 0.34 0.00 0.00 0.00 175.76 176.91 2hgm s ASP 106 N -1.56 -0.37 0.00 0.00 2.15 -1.26 -5.02 116.67 110.60 2hgm s ASP 106 Ca -0.13 0.30 0.00 0.00 0.43 0.00 0.00 52.55 53.15 2hgm s ASP 106 Cb -0.09 0.41 0.00 0.00 -0.30 0.00 0.00 42.92 42.94 2hgm s ASP 106 CO -0.01 -0.54 0.00 -1.54 -0.17 0.00 0.00 175.17 172.91 2hgm n SER 107 N 1.02 0.00 0.00 -0.34 3.41 -1.26 -3.63 113.62 112.82 2hgm n SER 107 Ca -0.20 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.41 2hgm n SER 107 Cb 0.57 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 2hgm n SER 107 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2hgm n ALA 108 N 0.00 0.00 0.00 7.33 0.00 -1.26 -4.96 120.51 121.62 2hgm n ALA 108 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2hgm n ALA 108 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 0.00 1.34 -2.70 0.00 6.94 -1.24 -4.04 115.26 115.56 2hgm n ASN 109 Ca 0.00 0.00 -0.22 0.00 -0.02 0.00 0.00 54.58 54.34 2hgm n ASN 109 Cb 0.00 0.19 -0.08 0.00 -2.36 0.00 0.00 39.78 37.53 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 -0.70 5.96 -4.55 0.53 8.00 -1.25 -2.84 116.55 121.68 2hgm n ASP 110 Ca 0.00 -2.40 -0.34 0.00 0.71 0.00 0.00 54.79 52.76 2hgm n ASP 110 Cb 0.08 -1.29 -0.04 0.00 -0.02 0.00 0.00 41.12 39.85 2hgm n ASP 110 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2hgm s GLY 111 N 2.41 0.31 0.32 0.44 0.00 -1.26 -4.60 107.32 104.94 2hgm s GLY 111 Ca 0.57 -1.17 0.06 0.00 0.00 0.00 0.00 44.72 44.18 2hgm s GLY 111 CO -0.03 3.34 0.46 -1.36 0.00 0.00 0.00 173.10 175.52 2hgm s PHE 112 N 8.97 3.17 -0.19 1.90 0.40 -0.82 -1.55 117.98 129.87 2hgm s PHE 112 Ca 0.65 -0.17 -0.04 0.00 -0.60 0.00 0.00 56.93 56.77 2hgm s PHE 112 Cb -0.09 -1.94 0.10 0.00 0.51 0.00 0.00 43.02 41.60 2hgm s PHE 112 CO 0.09 0.05 0.29 0.08 0.70 0.00 0.00 175.22 176.43 2hgm s VAL 113 N -2.16 -0.45 -0.35 -0.44 1.01 0.56 -1.86 120.40 116.71 2hgm s VAL 113 Ca 0.43 0.03 -0.21 0.00 0.00 0.00 0.00 61.98 62.23 2hgm s VAL 113 Cb -0.09 -0.65 0.00 0.00 0.00 0.00 0.00 36.38 35.64 2hgm s VAL 113 CO 0.31 -0.07 0.67 -0.60 0.00 0.00 0.00 175.10 175.41 2hgm s ARG 114 N 2.44 3.73 0.48 2.72 3.52 -0.13 -1.10 118.95 130.62 2hgm s ARG 114 Ca 0.06 0.16 -0.22 0.00 -0.13 0.00 0.00 55.73 55.60 2hgm s ARG 114 Cb -0.14 -3.80 -0.07 0.00 -1.56 0.00 0.00 34.95 29.38 2hgm s ARG 114 CO -0.12 -0.74 1.21 -0.51 -0.81 0.00 0.00 175.30 174.33 2hgm s LEU 115 N 2.79 3.96 0.10 -0.88 2.01 0.10 -1.26 118.68 125.51 2hgm s LEU 115 Ca 0.26 2.40 0.07 0.00 0.01 0.00 0.00 54.13 56.88 2hgm s LEU 115 Cb -0.14 -4.26 -0.03 0.00 0.01 0.00 0.00 46.19 41.76 2hgm s LEU 115 CO 0.15 -1.08 -0.18 -0.60 1.01 0.00 0.00 176.35 175.64 2hgm s ARG 116 N -2.77 1.06 0.00 1.70 3.00 -1.15 -2.12 118.95 118.67 2hgm s ARG 116 Ca 0.66 -1.15 0.00 0.00 -1.00 0.00 0.00 55.73 54.24 2hgm s ARG 116 Cb -0.31 -1.20 0.00 0.00 0.00 0.00 0.00 34.95 33.44 2hgm s ARG 116 CO 0.37 0.27 0.00 0.41 0.00 0.00 0.00 175.30 176.35 2hgm n GLY 117 N 0.98 0.28 3.76 8.12 0.00 0.73 -0.28 105.19 118.77 2hgm n GLY 117 Ca -0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.49 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 3.48 0.98 0.99 1.43 -1.10 -3.77 118.68 120.69 2hgm s LEU 118 Ca 0.00 2.15 -0.13 0.00 -1.03 0.00 0.00 54.13 55.11 2hgm s LEU 118 Cb 0.00 -4.57 0.17 0.00 0.03 0.00 0.00 46.19 41.82 2hgm s LEU 118 CO 0.00 -1.65 1.13 -2.16 0.23 0.00 0.00 176.35 173.90 2hgm s PRO 119 N -3.80 0.61 0.17 1.29 0.04 -1.26 -4.47 135.00 127.58 2hgm s PRO 119 Ca 0.71 0.28 -0.31 0.00 0.04 0.00 0.00 61.00 61.72 2hgm s PRO 119 Cb -0.24 -1.78 -0.09 0.00 0.04 0.00 0.00 34.50 32.44 2hgm s PRO 119 CO 0.38 -2.55 1.36 0.12 0.04 0.00 0.00 177.00 176.35 2hgm s PHE 120 N -3.19 3.22 -1.95 0.56 5.36 -1.26 -1.90 117.98 118.83 2hgm s PHE 120 Ca 0.66 1.08 0.00 0.00 -0.96 0.00 0.00 56.93 57.71 2hgm s PHE 120 Cb -0.15 -3.67 0.00 0.00 -0.34 0.00 0.00 43.02 38.86 2hgm s PHE 120 CO 0.55 -2.21 0.00 0.41 -1.46 0.00 0.00 175.22 172.51 2hgm n GLY 121 N 2.80 0.69 3.60 13.12 0.00 -1.26 -4.98 105.19 119.15 2hgm n GLY 121 Ca 0.08 -0.03 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.52 0.14 0.38 0.00 -1.32 -1.26 -4.85 115.64 107.20 2hgm s THR 123 Ca 0.74 -1.36 0.18 0.00 -1.21 0.00 0.00 61.69 60.04 2hgm s THR 123 Cb -0.43 -1.49 0.38 0.00 -1.51 0.00 0.00 72.50 69.45 2hgm s THR 123 CO 0.49 -0.64 1.71 0.50 -2.21 0.00 0.00 174.62 174.47 2hgm h LYS 124 N 2.79 0.34 0.00 7.08 3.64 -1.96 -0.51 116.57 127.94 2hgm h LYS 124 Ca -0.34 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.02 2hgm h LYS 124 Cb 1.19 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.94 2hgm h LYS 124 CO 0.57 0.23 0.00 0.93 -2.27 0.00 0.00 179.45 178.90 2hgm h GLU 125 N 0.35 0.00 0.01 1.90 3.07 -1.97 0.34 114.58 118.29 2hgm h GLU 125 Ca 0.68 0.00 -0.20 0.00 -0.50 0.00 0.00 59.36 59.34 2hgm h GLU 125 Cb 1.69 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.59 2hgm h GLU 125 CO -0.42 0.00 -0.90 0.93 -1.40 0.00 0.00 179.01 177.22 2hgm h GLU 126 N 0.00 0.13 -0.41 2.33 5.08 -1.40 -2.11 114.58 118.20 2hgm h GLU 126 Ca 0.00 -0.15 -0.14 0.00 -1.00 0.00 0.00 59.36 58.07 2hgm h GLU 126 Cb 0.57 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 2hgm h GLU 126 CO 0.00 0.94 -0.29 0.82 -1.00 0.00 0.00 179.01 179.49 2hgm h ILE 127 N 0.06 1.27 0.00 3.13 2.04 -1.19 0.64 117.51 123.46 2hgm h ILE 127 Ca -0.04 -1.45 0.00 0.00 1.00 0.00 0.00 64.86 64.37 2hgm h ILE 127 Cb 1.55 1.26 0.00 0.00 -0.74 0.00 0.00 36.82 38.89 2hgm h ILE 127 CO 0.13 0.49 0.00 -0.37 0.00 0.00 0.00 178.15 178.40 2hgm h VAL 128 N 0.76 0.00 0.00 1.67 -1.51 -0.31 0.33 116.25 117.19 2hgm h VAL 128 Ca 0.09 -0.16 -0.29 0.00 -1.23 0.00 0.00 66.70 65.10 2hgm h VAL 128 Cb 0.85 0.88 -0.05 0.00 -2.13 0.00 0.00 31.29 30.84 2hgm h VAL 128 CO 0.08 0.00 -2.02 0.00 -1.23 0.00 0.00 177.57 174.39 2hgm n GLN 129 N -2.46 0.66 -0.16 5.19 -0.00 -0.80 -2.44 117.38 117.37 2hgm n GLN 129 Ca 0.00 0.10 -0.08 0.00 -0.00 0.00 0.00 57.00 57.03 2hgm n GLN 129 Cb 0.15 -1.64 0.01 0.00 -0.00 0.00 0.00 30.24 28.76 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 0.64 -0.42 2.61 3.57 0.22 -2.99 116.94 120.58 2hgm h PHE 130 Ca -0.38 -0.01 -0.30 0.00 3.53 0.00 0.00 57.97 60.81 2hgm h PHE 130 Cb 2.01 -0.21 -0.22 0.00 2.79 0.00 0.00 35.95 40.32 2hgm h PHE 130 CO 0.00 0.48 -0.55 1.19 -2.23 0.00 0.00 178.31 177.19 2hgm n PHE 131 N -4.68 1.50 0.11 0.41 3.72 0.00 -4.60 117.46 113.93 2hgm n PHE 131 Ca 0.02 -1.90 0.19 0.00 -0.05 0.00 0.00 57.45 55.71 2hgm n PHE 131 Cb 0.08 -0.36 0.67 0.00 -0.94 0.00 0.00 39.48 38.92 2hgm n PHE 131 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2hgm h SER 132 N 1.58 0.00 -0.69 4.37 4.64 -1.32 -2.06 113.55 120.08 2hgm h SER 132 Ca 0.22 0.00 0.14 0.00 -0.47 0.00 0.00 61.79 61.68 2hgm h SER 132 Cb 1.31 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.36 2hgm h SER 132 CO 0.45 0.00 0.47 1.23 -0.87 0.00 0.00 176.83 178.11 2hgm h GLY 133 N 0.00 0.53 -3.04 -0.77 0.00 -1.82 -3.47 103.07 94.51 2hgm h GLY 133 Ca 0.19 -0.14 -0.18 0.00 0.00 0.00 0.00 47.33 47.20 2hgm h GLY 133 CO -0.00 0.05 -0.67 1.08 0.00 0.00 0.00 176.54 177.00 2hgm s LEU 134 N -9.22 2.29 -0.02 3.11 1.02 -0.77 -5.15 118.68 109.93 2hgm s LEU 134 Ca -0.07 -1.07 -0.23 0.00 0.02 0.00 0.00 54.13 52.78 2hgm s LEU 134 Cb 0.21 0.12 -0.05 0.00 0.02 0.00 0.00 46.19 46.49 2hgm s LEU 134 CO 0.76 -0.59 0.68 -0.70 0.02 0.00 0.00 176.35 176.51 2hgm s GLU 135 N -3.93 4.41 -0.01 1.70 2.12 -1.26 -5.01 118.70 116.72 2hgm s GLU 135 Ca 0.14 0.87 0.02 0.00 0.36 0.00 0.00 54.97 56.36 2hgm s GLU 135 Cb 0.07 -3.39 -0.00 0.00 0.26 0.00 0.00 34.13 31.07 2hgm s GLU 135 CO -0.04 0.22 -0.08 0.42 -0.54 0.00 0.00 175.26 175.23 2hgm s ILE 136 N 0.26 0.68 0.66 -3.70 1.01 -1.26 -2.01 121.20 116.84 2hgm s ILE 136 Ca 0.35 -0.34 -0.17 0.00 0.00 0.00 0.00 60.65 60.49 2hgm s ILE 136 Cb -0.18 -0.59 -0.00 0.00 0.01 0.00 0.00 42.46 41.69 2hgm s ILE 136 CO 0.19 0.20 1.21 0.68 0.00 0.00 0.00 174.94 177.22 2hgm s VAL 137 N -0.02 2.47 -0.10 2.92 -7.23 -1.20 -4.75 120.40 112.48 2hgm s VAL 137 Ca 0.01 0.26 0.17 0.00 -1.81 0.00 0.00 61.98 60.60 2hgm s VAL 137 Cb -0.05 -2.96 0.17 0.00 0.56 0.00 0.00 36.38 34.09 2hgm s VAL 137 CO -0.00 -0.09 1.45 -2.65 -0.31 0.00 0.00 175.10 173.49 2hgm n PRO 138 N -2.14 0.11 -0.44 4.82 -0.02 -1.26 -0.60 135.00 135.47 2hgm n PRO 138 Ca 0.14 0.59 0.05 0.00 -2.02 0.00 0.00 63.50 62.26 2hgm n PRO 138 Cb 0.50 -2.02 0.07 0.00 -0.02 0.00 0.00 33.50 32.03 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 1.15 0.28 2.55 3.02 -1.26 -4.96 115.26 113.91 2hgm n ASN 139 Ca -0.01 -2.58 0.17 0.00 -0.03 0.00 0.00 54.58 52.12 2hgm n ASN 139 Cb 0.19 -0.33 0.93 0.00 -0.61 0.00 0.00 39.78 39.95 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 0.18 0.00 -5.71 7.41 0.00 -1.09 -3.43 103.07 100.43 2hgm h GLY 140 Ca -0.02 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 46.72 2hgm h GLY 140 CO 0.01 0.00 -0.25 -0.42 0.00 0.00 0.00 176.54 175.88 2hgm s ILE 141 N -4.56 5.25 -0.07 2.60 1.01 -1.26 -0.56 121.20 123.61 2hgm s ILE 141 Ca -0.05 0.71 0.04 0.00 0.00 0.00 0.00 60.65 61.34 2hgm s ILE 141 Cb 0.15 -3.70 0.00 0.00 0.01 0.00 0.00 42.46 38.92 2hgm s ILE 141 CO 0.52 0.38 -0.18 -0.89 0.00 0.00 0.00 174.94 174.77 2hgm s THR 142 N 0.42 1.57 -0.55 2.92 2.01 0.59 -4.96 115.64 117.64 2hgm s THR 142 Ca 0.20 -0.76 0.04 0.00 0.31 0.00 0.00 61.69 61.48 2hgm s THR 142 Cb -0.14 -1.37 0.14 0.00 0.01 0.00 0.00 72.50 71.14 2hgm s THR 142 CO 0.07 0.45 0.31 -0.76 -0.69 0.00 0.00 174.62 174.00 2hgm s LEU 143 N 0.32 4.13 0.00 4.42 2.01 -1.26 -0.53 118.68 127.77 2hgm s LEU 143 Ca -0.12 -3.16 0.00 0.00 0.01 0.00 0.00 54.13 50.86 2hgm s LEU 143 Cb -0.15 -1.53 0.00 0.00 0.01 0.00 0.00 46.19 44.52 2hgm s LEU 143 CO 0.05 -0.20 0.00 -0.81 1.01 0.00 0.00 176.35 176.40 2hgm n PRO 144 N 2.89 0.00 -3.50 1.29 -0.04 -1.26 -5.07 135.00 129.31 2hgm n PRO 144 Ca 0.10 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.45 2hgm n PRO 144 Cb 0.33 -0.15 -0.03 0.00 -0.04 0.00 0.00 33.50 33.61 2hgm n PRO 144 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2hgm s VAL 145 N 0.00 0.00 1.35 0.52 -7.23 -1.26 -4.82 120.40 108.96 2hgm s VAL 145 Ca 0.00 0.00 -0.21 0.00 -1.81 0.00 0.00 61.98 59.96 2hgm s VAL 145 Cb 0.00 -1.00 0.34 0.00 0.56 0.00 0.00 36.38 36.28 2hgm s VAL 145 CO 0.00 0.00 0.99 1.51 -0.31 0.00 0.00 175.10 177.29 2hgm s ASP 146 N -2.13 -0.38 0.00 4.85 -4.77 0.14 -4.13 116.67 110.25 2hgm s ASP 146 Ca 0.01 0.79 0.00 0.00 -3.30 0.00 0.00 52.55 50.05 2hgm s ASP 146 Cb -0.01 -1.11 0.00 0.00 -1.09 0.00 0.00 42.92 40.71 2hgm s ASP 146 CO -0.06 -4.94 0.38 -2.65 0.70 0.00 0.00 175.17 168.61 2hgm n PRO 147 N -5.33 0.00 0.00 2.11 -0.02 -1.26 -3.35 135.00 127.14 2hgm n PRO 147 Ca 0.13 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 2hgm n PRO 147 Cb 0.60 -1.44 0.00 0.00 -0.02 0.00 0.00 33.50 32.63 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 -0.87 0.90 0.00 -0.52 2.13 -1.26 -5.09 120.64 115.92 2hgm n GLU 148 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 2hgm n GLU 148 Cb 0.00 -0.66 0.00 0.00 0.27 0.00 0.00 31.44 31.05 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 1.52 1.00 0.00 8.31 0.00 -1.21 -5.05 105.19 109.76 2hgm n GLY 149 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2hgm n GLY 149 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2hgm n LYS 150 N 0.00 3.21 -0.33 1.61 2.85 -1.26 -4.97 118.16 119.26 2hgm n LYS 150 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 2hgm n LYS 150 Cb 0.00 -0.45 0.00 0.00 -0.65 0.00 0.00 35.03 33.93 2hgm n LYS 150 CO 0.00 0.00 0.00 1.51 -0.05 0.00 0.00 177.40 178.86 2hgm n ILE 151 N -0.48 0.00 -1.73 0.58 0.00 -1.26 -5.03 119.36 111.44 2hgm n ILE 151 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 62.75 62.80 2hgm n ILE 151 Cb 0.00 0.00 0.18 0.00 0.00 0.00 0.00 39.64 39.82 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 1.93 0.00 9.51 -2.24 -1.26 0.24 114.28 122.47 2hgm n THR 152 Ca 0.00 -2.99 0.00 0.00 -2.27 0.00 0.00 64.05 58.79 2hgm n THR 152 Cb 0.00 -0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.13 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 -0.90 0.00 3.18 3.38 0.00 -1.26 -4.33 105.19 105.26 2hgm n GLY 153 Ca 0.18 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.09 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 -1.63 0.65 0.20 1.61 -1.05 -1.26 -0.20 118.70 117.03 2hgm s GLU 154 Ca 0.00 -0.46 -0.22 0.00 -0.15 0.00 0.00 54.97 54.13 2hgm s GLU 154 Cb 0.00 0.28 0.07 0.00 -0.44 0.00 0.00 34.13 34.04 2hgm s GLU 154 CO 0.00 -0.18 0.99 0.00 0.95 0.00 0.00 175.26 177.01 2hgm s ALA 155 N -2.01 -1.51 0.15 -0.84 0.00 -0.90 -4.06 121.76 112.59 2hgm s ALA 155 Ca -0.09 -0.26 -0.11 0.00 0.00 0.00 0.00 51.96 51.50 2hgm s ALA 155 Cb -0.03 0.72 0.00 0.00 0.00 0.00 0.00 23.12 23.80 2hgm s ALA 155 CO -0.01 -1.05 0.31 -0.06 0.00 0.00 0.00 175.76 174.96 2hgm s PHE 156 N -2.50 0.19 -0.28 0.00 0.40 0.31 0.01 117.98 116.11 2hgm s PHE 156 Ca 0.18 -0.56 -0.14 0.00 -0.60 0.00 0.00 56.93 55.81 2hgm s PHE 156 Cb -0.03 0.05 0.09 0.00 0.51 0.00 0.00 43.02 43.65 2hgm s PHE 156 CO 0.05 -0.71 0.67 0.54 0.70 0.00 0.00 175.22 176.47 2hgm s VAL 157 N -3.91 -0.26 -0.15 -0.44 0.11 -0.26 -0.30 120.40 115.19 2hgm s VAL 157 Ca 0.12 0.00 -0.14 0.00 -2.93 0.00 0.00 61.98 59.03 2hgm s VAL 157 Cb 0.03 -0.99 -0.05 0.00 -1.53 0.00 0.00 36.38 33.84 2hgm s VAL 157 CO -0.04 0.00 0.29 -1.58 -3.33 0.00 0.00 175.10 170.44 2hgm s GLN 158 N 1.97 4.20 0.00 1.54 2.00 0.27 -0.32 119.66 129.32 2hgm s GLN 158 Ca -0.09 0.10 0.00 0.00 -2.00 0.00 0.00 55.36 53.37 2hgm s GLN 158 Cb -0.07 -3.40 0.00 0.00 0.80 0.00 0.00 33.01 30.34 2hgm s GLN 158 CO -0.19 0.29 0.00 1.19 -0.50 0.00 0.00 175.29 176.07 2hgm n PHE 159 N 3.41 -2.75 0.88 1.67 3.01 -0.59 -3.25 117.46 119.84 2hgm n PHE 159 Ca -0.12 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.46 2hgm n PHE 159 Cb 0.52 0.00 0.55 0.00 -0.01 0.00 0.00 39.48 40.54 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 -3.00 2.21 -3.39 4.37 0.00 -0.85 -3.79 120.51 116.06 2hgm n ALA 160 Ca 0.00 -0.08 -0.13 0.00 0.00 0.00 0.00 53.44 53.23 2hgm n ALA 160 Cb 0.00 -1.43 -0.03 0.00 0.00 0.00 0.00 19.45 17.99 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 -3.13 -0.55 0.58 0.00 0.01 -1.23 -4.92 113.70 104.46 2hgm s SER 161 Ca 0.12 0.10 0.27 0.00 1.31 0.00 0.00 55.95 57.75 2hgm s SER 161 Cb 0.17 0.57 1.60 0.00 0.21 0.00 0.00 66.02 68.57 2hgm s SER 161 CO 0.49 -0.89 2.11 1.56 0.41 0.00 0.00 173.24 176.92 2hgm h GLN 162 N 2.24 0.00 0.12 12.44 1.08 -1.66 -1.91 115.11 127.41 2hgm h GLN 162 Ca -0.33 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 56.87 2hgm h GLN 162 Cb 1.27 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.70 2hgm h GLN 162 CO 0.39 0.00 -0.06 1.49 -0.95 0.00 0.00 178.83 179.71 2hgm h GLU 163 N 0.00 -0.15 -0.90 1.46 4.81 -1.91 -3.17 114.58 114.71 2hgm h GLU 163 Ca 0.09 0.01 0.13 0.00 -0.13 0.00 0.00 59.36 59.46 2hgm h GLU 163 Cb 0.46 0.03 -0.07 0.00 0.63 0.00 0.00 28.75 29.80 2hgm h GLU 163 CO -0.00 0.30 0.58 -0.07 -0.73 0.00 0.00 179.01 179.09 2hgm h LEU 164 N -0.92 0.73 -1.31 1.64 3.38 -1.92 0.34 115.31 117.24 2hgm h LEU 164 Ca -0.02 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2hgm h LEU 164 Cb 0.52 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.16 2hgm h LEU 164 CO 0.03 0.39 0.00 0.00 0.09 0.00 0.00 178.44 178.95 2hgm h ALA 165 N 1.58 1.00 0.00 1.53 0.00 -1.40 -2.64 119.26 119.33 2hgm h ALA 165 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.35 2hgm h ALA 165 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2hgm h ALA 165 CO -0.21 0.00 -1.13 -1.91 0.00 0.00 0.00 179.25 176.00 2hgm n GLU 166 N -2.64 1.49 -0.28 0.00 2.13 -0.00 -2.98 120.64 118.35 2hgm n GLU 166 Ca 0.01 -0.06 -0.02 0.00 0.66 0.00 0.00 57.16 57.75 2hgm n GLU 166 Cb 0.22 -1.16 0.17 0.00 0.27 0.00 0.00 31.44 30.94 2hgm n GLU 166 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 2hgm h LYS 167 N 0.00 1.13 -0.32 5.31 1.57 -1.20 -3.17 116.57 119.89 2hgm h LYS 167 Ca 0.00 -0.10 -0.07 0.00 -1.87 0.00 0.00 60.65 58.61 2hgm h LYS 167 Cb 0.40 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 2hgm h LYS 167 CO 0.00 0.79 -0.07 0.00 -0.57 0.00 0.00 179.45 179.60 2hgm h ALA 168 N 1.41 0.44 -0.70 3.86 0.00 -1.52 -2.16 119.26 120.60 2hgm h ALA 168 Ca 0.30 -0.29 0.20 0.00 0.00 0.00 0.00 54.91 55.12 2hgm h ALA 168 Cb -0.05 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 2hgm h ALA 168 CO -0.06 0.28 0.60 -0.07 0.00 0.00 0.00 179.25 180.00 2hgm h LEU 169 N 0.40 0.00 -1.45 0.00 4.07 -1.56 0.07 115.31 116.83 2hgm h LEU 169 Ca 0.08 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.04 2hgm h LEU 169 Cb 0.57 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.31 2hgm h LEU 169 CO 0.03 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 178.00 2hgm n GLY 170 N -1.62 -0.87 0.24 0.83 0.00 -0.81 -1.22 105.19 101.74 2hgm n GLY 170 Ca 0.14 0.20 0.16 0.00 0.00 0.00 0.00 46.02 46.53 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 -1.09 -3.46 116.57 115.42 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 0.01 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.66 2hgm h LYS 171 CO 0.00 0.00 0.00 -2.39 -1.08 0.00 0.00 179.45 175.98 2hgm n HIS 172 N -2.71 0.00 -1.97 -1.35 1.44 -0.36 -2.01 115.22 108.26 2hgm n HIS 172 Ca -0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2hgm n HIS 172 Cb 0.17 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.28 2hgm n HIS 172 CO 0.00 0.00 0.00 1.17 -2.81 0.00 0.00 176.34 174.70 2hgm n LYS 173 N 0.00 0.00 -0.23 -1.40 3.00 -1.25 -4.41 118.16 113.86 2hgm n LYS 173 Ca 0.00 -0.58 -0.31 0.00 -0.00 0.00 0.00 58.31 57.42 2hgm n LYS 173 Cb 0.00 -0.30 0.30 0.00 0.00 0.00 0.00 35.03 35.03 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 -4.84 -4.45 1.64 1.02 -0.85 -4.43 120.64 108.73 2hgm n GLU 174 Ca 0.00 -1.43 -0.29 0.00 -0.02 0.00 0.00 57.16 55.41 2hgm n GLU 174 Cb 0.61 -1.94 -0.13 0.00 -0.02 0.00 0.00 31.44 29.97 2hgm n GLU 174 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 2hgm s ARG 175 N -5.05 1.53 -0.04 3.49 3.52 -1.26 -0.92 118.95 120.21 2hgm s ARG 175 Ca 0.68 -1.28 0.04 0.00 -0.13 0.00 0.00 55.73 55.03 2hgm s ARG 175 Cb -0.13 -1.95 -0.05 0.00 -1.56 0.00 0.00 34.95 31.26 2hgm s ARG 175 CO 0.57 0.46 0.02 1.51 -0.81 0.00 0.00 175.30 177.06 2hgm n ILE 176 N 1.02 0.26 0.00 4.11 3.06 -0.40 -4.88 119.36 122.53 2hgm n ILE 176 Ca -0.17 -0.17 0.00 0.00 -2.50 0.00 0.00 62.75 59.90 2hgm n ILE 176 Cb 0.53 -0.79 0.00 0.00 0.54 0.00 0.00 39.64 39.92 2hgm n ILE 176 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 2hgm n GLY 177 N 2.70 -0.04 0.29 4.50 0.00 -1.26 -4.81 105.19 106.57 2hgm n GLY 177 Ca -0.06 0.54 -0.10 0.00 0.00 0.00 0.00 46.02 46.40 2hgm n GLY 177 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 2hgm h HIS 178 N 0.00 1.11 -5.32 1.61 3.86 -1.98 -3.48 115.15 110.95 2hgm h HIS 178 Ca 0.00 -0.25 -0.49 0.00 -1.16 0.00 0.00 60.37 58.48 2hgm h HIS 178 Cb 0.00 -0.27 -0.06 0.00 1.06 0.00 0.00 27.41 28.15 2hgm h HIS 178 CO 0.00 1.06 -0.27 0.54 0.86 0.00 0.00 177.93 180.12 2hgm n ARG 179 N -4.13 0.88 -3.75 2.45 3.00 -1.26 -5.03 116.66 108.82 2hgm n ARG 179 Ca 0.01 -2.86 -0.13 0.00 -0.01 0.00 0.00 57.85 54.87 2hgm n ARG 179 Cb 0.43 0.44 -0.13 0.00 0.00 0.00 0.00 32.46 33.20 2hgm n ARG 179 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 2hgm s TYR 180 N -2.29 -0.25 -0.03 -1.55 2.02 -1.25 -1.28 117.35 112.72 2hgm s TYR 180 Ca 0.18 0.63 0.04 0.00 -0.37 0.00 0.00 57.07 57.55 2hgm s TYR 180 Cb -0.01 0.01 -0.00 0.00 -0.40 0.00 0.00 41.96 41.55 2hgm s TYR 180 CO 0.11 -0.18 -0.14 0.42 -1.57 0.00 0.00 175.55 174.19 2hgm s ILE 181 N 0.98 1.18 0.49 2.71 1.01 -0.10 -4.44 121.20 123.04 2hgm s ILE 181 Ca -0.07 -0.59 -0.12 0.00 0.00 0.00 0.00 60.65 59.87 2hgm s ILE 181 Cb -0.09 -1.02 -0.06 0.00 0.01 0.00 0.00 42.46 41.31 2hgm s ILE 181 CO -0.06 0.35 0.89 -1.61 0.00 0.00 0.00 174.94 174.51 2hgm s GLU 182 N -0.00 3.77 -0.05 2.79 8.01 0.61 -3.89 118.70 129.94 2hgm s GLU 182 Ca -0.01 0.64 -0.02 0.00 0.01 0.00 0.00 54.97 55.58 2hgm s GLU 182 Cb -0.09 -2.25 0.03 0.00 -4.31 0.00 0.00 34.13 27.51 2hgm s GLU 182 CO 0.01 -0.24 0.11 0.14 0.01 0.00 0.00 175.26 175.29 2hgm s VAL 183 N -2.66 -0.04 0.02 2.63 -7.23 -1.26 -2.93 120.40 108.93 2hgm s VAL 183 Ca 0.54 0.13 0.02 0.00 -1.81 0.00 0.00 61.98 60.86 2hgm s VAL 183 Cb -0.10 -0.18 -0.01 0.00 0.56 0.00 0.00 36.38 36.64 2hgm s VAL 183 CO 0.38 0.05 -0.07 -0.36 -0.31 0.00 0.00 175.10 174.79 2hgm s PHE 184 N 0.81 0.65 0.25 2.82 0.08 -0.39 -4.99 117.98 117.21 2hgm s PHE 184 Ca -0.06 -0.29 -0.30 0.00 0.12 0.00 0.00 56.93 56.40 2hgm s PHE 184 Cb -0.08 -0.40 -0.09 0.00 -0.57 0.00 0.00 43.02 41.88 2hgm s PHE 184 CO -0.04 -0.04 1.07 0.21 -0.10 0.00 0.00 175.22 176.33 2hgm s LYS 185 N -0.84 4.67 0.19 0.44 2.47 -1.26 -0.95 119.74 124.46 2hgm s LYS 185 Ca -0.03 1.74 -0.11 0.00 -1.56 0.00 0.00 55.97 56.01 2hgm s LYS 185 Cb -0.06 -3.22 -0.00 0.00 -1.46 0.00 0.00 37.83 33.08 2hgm s LYS 185 CO 0.00 0.24 0.36 -1.12 0.16 0.00 0.00 175.35 174.99 2hgm s SER 186 N -0.78 -0.03 -0.00 1.43 0.01 -0.78 -4.83 113.70 108.71 2hgm s SER 186 Ca 0.45 -0.86 -0.05 0.00 1.31 0.00 0.00 55.95 56.79 2hgm s SER 186 Cb -0.30 0.49 -0.00 0.00 0.21 0.00 0.00 66.02 66.42 2hgm s SER 186 CO 0.38 -0.98 0.10 -0.44 0.41 0.00 0.00 173.24 172.72 2hgm s SER 187 N -2.98 0.04 0.00 2.44 0.01 -1.26 -1.94 113.70 110.01 2hgm s SER 187 Ca 0.19 -0.17 0.00 0.00 1.31 0.00 0.00 55.95 57.27 2hgm s SER 187 Cb 0.02 0.20 0.00 0.00 0.21 0.00 0.00 66.02 66.44 2hgm s SER 187 CO 0.03 -0.29 0.00 1.67 0.41 0.00 0.00 173.24 175.05 2hgm n GLN 188 N 1.78 0.00 0.00 12.44 -0.06 -1.26 -1.19 117.38 129.09 2hgm n GLN 188 Ca -0.21 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.79 2hgm n GLN 188 Cb 0.56 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.74 2hgm n GLN 188 CO 0.00 0.00 0.00 0.39 -0.20 0.00 0.00 177.06 177.25 2hgm n GLU 189 N -0.30 3.47 0.22 3.69 -0.58 -1.26 -3.69 120.64 122.19 2hgm n GLU 189 Ca 0.00 -0.17 0.11 0.00 -0.42 0.00 0.00 57.16 56.68 2hgm n GLU 189 Cb 0.00 -0.63 0.30 0.00 -0.57 0.00 0.00 31.44 30.54 2hgm n GLU 189 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 2hgm h GLU 190 N 0.00 0.00 0.03 3.49 4.81 -1.59 -3.43 114.58 117.89 2hgm h GLU 190 Ca 0.00 0.00 -0.36 0.00 -0.13 0.00 0.00 59.36 58.87 2hgm h GLU 190 Cb 0.02 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.35 2hgm h GLU 190 CO 0.00 0.14 -2.20 1.33 -0.73 0.00 0.00 179.01 177.54 2hgm n VAL 191 N -3.17 1.55 0.73 0.32 0.24 -1.24 -4.23 118.33 112.52 2hgm n VAL 191 Ca 0.02 -0.72 0.11 0.00 -2.04 0.00 0.00 64.34 61.71 2hgm n VAL 191 Cb 0.51 -1.13 0.28 0.00 -1.47 0.00 0.00 33.84 32.03 2hgm n VAL 191 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 2hgm n ARG 192 N -3.12 2.13 -0.60 7.34 0.00 -1.25 -4.73 116.66 116.43 2hgm n ARG 192 Ca -0.34 -1.71 -0.04 0.00 -0.00 0.00 0.00 57.85 55.77 2hgm n ARG 192 Cb 1.06 -1.45 -0.00 0.00 -0.00 0.00 0.00 32.46 32.07 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 0.92 5.54 0.00 2.89 7.64 -1.26 -5.10 113.62 124.25 2hgm n SER 193 Ca 0.18 -2.53 0.00 0.00 1.01 0.00 0.00 58.87 57.52 2hgm n SER 193 Cb 0.46 -1.13 0.00 0.00 -1.01 0.00 0.00 64.21 62.53 2hgm n SER 193 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03