#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hgm h SER 104 N 0.00 0.16 -0.25 6.41 0.87 -1.88 -2.90 113.55 115.95 2hgm h SER 104 Ca 0.00 0.20 -0.22 0.00 -1.23 0.00 0.00 61.79 60.55 2hgm h SER 104 Cb 0.00 0.23 -0.39 0.00 -0.44 0.00 0.00 62.40 61.80 2hgm h SER 104 CO 0.00 -0.17 -1.08 0.00 -0.53 0.00 0.00 176.83 175.05 2hgm n ALA 105 N -2.58 2.49 -3.23 6.23 0.00 -1.26 -4.36 120.51 117.80 2hgm n ALA 105 Ca 0.25 -2.58 -0.00 0.00 0.00 0.00 0.00 53.44 51.11 2hgm n ALA 105 Cb 0.80 -0.82 0.01 0.00 0.00 0.00 0.00 19.45 19.44 2hgm n ALA 105 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2hgm n ASP 106 N -0.15 -0.66 -3.02 0.00 5.68 -1.10 -5.13 116.55 112.18 2hgm n ASP 106 Ca 0.06 -1.46 -0.41 0.00 -0.50 0.00 0.00 54.79 52.48 2hgm n ASP 106 Cb 0.94 1.10 -0.09 0.00 -1.14 0.00 0.00 41.12 41.94 2hgm n ASP 106 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 2hgm n SER 107 N -1.17 0.50 0.00 -1.12 3.41 -1.26 -4.04 113.62 109.93 2hgm n SER 107 Ca -0.03 0.44 0.00 0.00 -0.26 0.00 0.00 58.87 59.03 2hgm n SER 107 Cb 0.17 -0.64 0.00 0.00 -0.26 0.00 0.00 64.21 63.49 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 5.50 0.22 0.00 7.33 0.00 -1.26 -0.83 120.51 131.47 2hgm n ALA 108 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.84 2hgm n ALA 108 Cb -0.02 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.43 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 -0.88 3.19 -1.91 0.00 6.94 -1.26 -3.45 115.26 117.89 2hgm n ASN 109 Ca 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 54.58 54.53 2hgm n ASN 109 Cb 0.00 0.61 -0.04 0.00 -2.36 0.00 0.00 39.78 37.99 2hgm n ASN 109 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 2hgm n ASP 110 N -0.99 3.11 -4.55 0.53 5.75 -1.26 -3.28 116.55 115.85 2hgm n ASP 110 Ca 0.00 -1.93 -0.33 0.00 -0.01 0.00 0.00 54.79 52.53 2hgm n ASP 110 Cb 0.02 -0.73 -0.04 0.00 -1.03 0.00 0.00 41.12 39.34 2hgm n ASP 110 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 2hgm s GLY 111 N 2.17 0.14 0.28 6.12 0.00 -1.26 -4.42 107.32 110.35 2hgm s GLY 111 Ca 0.16 -1.01 0.07 0.00 0.00 0.00 0.00 44.72 43.94 2hgm s GLY 111 CO 0.00 3.49 0.24 -1.36 0.00 0.00 0.00 173.10 175.48 2hgm s PHE 112 N 9.77 3.07 -0.11 1.90 0.40 -0.82 -1.07 117.98 131.12 2hgm s PHE 112 Ca 0.70 -0.16 -0.04 0.00 -0.60 0.00 0.00 56.93 56.82 2hgm s PHE 112 Cb -0.10 -1.54 0.06 0.00 0.51 0.00 0.00 43.02 41.94 2hgm s PHE 112 CO 0.11 0.40 0.23 0.08 0.70 0.00 0.00 175.22 176.74 2hgm s VAL 113 N -2.18 -0.31 -0.10 -0.44 1.01 0.47 -1.77 120.40 117.09 2hgm s VAL 113 Ca 0.36 0.28 -0.15 0.00 0.00 0.00 0.00 61.98 62.47 2hgm s VAL 113 Cb -0.07 -0.38 -0.05 0.00 0.00 0.00 0.00 36.38 35.87 2hgm s VAL 113 CO 0.26 0.12 0.37 -0.60 0.00 0.00 0.00 175.10 175.24 2hgm s ARG 114 N 2.17 4.13 0.25 2.72 3.52 0.27 -0.64 118.95 131.36 2hgm s ARG 114 Ca -0.00 0.27 -0.06 0.00 -0.13 0.00 0.00 55.73 55.80 2hgm s ARG 114 Cb -0.12 -3.35 -0.06 0.00 -1.56 0.00 0.00 34.95 29.86 2hgm s ARG 114 CO -0.08 0.39 0.53 -0.51 -0.81 0.00 0.00 175.30 174.82 2hgm s LEU 115 N -0.05 4.13 -0.02 -0.88 2.01 0.77 -1.12 118.68 123.52 2hgm s LEU 115 Ca 0.21 0.76 0.01 0.00 0.01 0.00 0.00 54.13 55.13 2hgm s LEU 115 Cb -0.15 -3.55 0.01 0.00 0.01 0.00 0.00 46.19 42.52 2hgm s LEU 115 CO 0.08 -0.12 -0.04 -0.60 1.01 0.00 0.00 176.35 176.69 2hgm s ARG 116 N -3.17 0.47 0.00 1.70 3.00 -1.21 -2.64 118.95 117.10 2hgm s ARG 116 Ca 0.45 -0.10 0.00 0.00 -1.00 0.00 0.00 55.73 55.07 2hgm s ARG 116 Cb -0.11 -0.51 0.00 0.00 0.00 0.00 0.00 34.95 34.33 2hgm s ARG 116 CO 0.26 0.01 0.00 0.41 0.00 0.00 0.00 175.30 175.98 2hgm n GLY 117 N 3.47 0.00 3.63 8.12 0.00 0.14 -0.23 105.19 120.32 2hgm n GLY 117 Ca -0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.45 2hgm n GLY 117 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2hgm n LEU 118 N 0.00 3.86 -4.79 0.99 4.77 -1.16 -3.82 117.00 116.85 2hgm n LEU 118 Ca 0.00 0.85 -0.30 0.00 -0.03 0.00 0.00 56.01 56.53 2hgm n LEU 118 Cb 0.00 -1.41 0.18 0.00 -2.33 0.00 0.00 43.42 39.86 2hgm n LEU 118 CO 0.00 -1.65 0.76 -2.16 -1.33 0.00 0.00 177.39 173.01 2hgm s PRO 119 N -2.71 0.27 0.24 3.23 0.04 -1.26 -4.57 135.00 130.23 2hgm s PRO 119 Ca 0.74 -0.11 -0.30 0.00 0.04 0.00 0.00 61.00 61.37 2hgm s PRO 119 Cb -0.43 -1.77 -0.10 0.00 0.04 0.00 0.00 34.50 32.24 2hgm s PRO 119 CO 0.48 -2.71 1.39 0.12 0.04 0.00 0.00 177.00 176.32 2hgm s PHE 120 N -3.46 3.09 -2.12 0.56 5.36 -1.26 -1.95 117.98 118.21 2hgm s PHE 120 Ca 0.70 1.11 0.00 0.00 -0.96 0.00 0.00 56.93 57.78 2hgm s PHE 120 Cb -0.09 -3.74 0.00 0.00 -0.34 0.00 0.00 43.02 38.85 2hgm s PHE 120 CO 0.54 -2.38 0.00 0.41 -1.46 0.00 0.00 175.22 172.33 2hgm n GLY 121 N 2.18 1.42 3.65 13.12 0.00 -1.26 -4.99 105.19 119.31 2hgm n GLY 121 Ca 0.06 -0.01 -0.36 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.62 0.09 0.33 0.00 -1.32 -1.26 -4.84 115.64 107.02 2hgm s THR 123 Ca 0.77 -1.61 0.13 0.00 -1.21 0.00 0.00 61.69 59.77 2hgm s THR 123 Cb -0.37 -1.91 0.33 0.00 -1.51 0.00 0.00 72.50 69.03 2hgm s THR 123 CO 0.46 -0.39 1.66 0.50 -2.21 0.00 0.00 174.62 174.65 2hgm h LYS 124 N 2.69 0.31 0.00 7.08 3.64 -1.96 -0.61 116.57 127.72 2hgm h LYS 124 Ca -0.33 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 2hgm h LYS 124 Cb 1.21 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 2hgm h LYS 124 CO 0.53 0.21 0.00 0.93 -2.27 0.00 0.00 179.45 178.85 2hgm h GLU 125 N 0.32 0.00 0.01 1.90 3.07 -1.97 0.32 114.58 118.24 2hgm h GLU 125 Ca 0.71 0.00 -0.20 0.00 -0.50 0.00 0.00 59.36 59.37 2hgm h GLU 125 Cb 1.58 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.48 2hgm h GLU 125 CO -0.61 0.00 -0.92 0.93 -1.40 0.00 0.00 179.01 177.01 2hgm h GLU 126 N 0.00 0.13 -0.37 2.33 5.08 -1.40 -2.06 114.58 118.30 2hgm h GLU 126 Ca 0.00 -0.16 -0.13 0.00 -1.00 0.00 0.00 59.36 58.07 2hgm h GLU 126 Cb 0.46 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 2hgm h GLU 126 CO 0.00 0.96 -0.30 0.82 -1.00 0.00 0.00 179.01 179.49 2hgm h ILE 127 N 0.07 1.28 0.00 3.13 2.04 -1.08 0.48 117.51 123.43 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 1.58 1.31 0.00 0.00 -0.74 0.00 0.00 36.82 38.97 2hgm h ILE 127 CO 0.13 0.48 0.00 -0.37 0.00 0.00 0.00 178.15 178.39 2hgm h VAL 128 N 0.68 0.00 0.00 1.67 -1.51 -0.35 -0.61 116.25 116.13 2hgm h VAL 128 Ca 0.08 -0.13 -0.13 0.00 -1.23 0.00 0.00 66.70 65.28 2hgm h VAL 128 Cb 0.84 0.90 -0.02 0.00 -2.13 0.00 0.00 31.29 30.87 2hgm h VAL 128 CO 0.07 0.00 -1.95 0.00 -1.23 0.00 0.00 177.57 174.46 2hgm n GLN 129 N -2.63 0.66 0.01 5.19 -0.00 -0.78 -2.70 117.38 117.14 2hgm n GLN 129 Ca -0.01 -0.06 -0.12 0.00 -0.00 0.00 0.00 57.00 56.82 2hgm n GLN 129 Cb 0.13 -1.59 -0.06 0.00 -0.00 0.00 0.00 30.24 28.72 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 0.08 -0.40 2.61 3.57 0.39 -3.11 116.94 120.08 2hgm h PHE 130 Ca -0.18 -0.00 -0.26 0.00 3.53 0.00 0.00 57.97 61.06 2hgm h PHE 130 Cb 1.44 -0.03 -0.17 0.00 2.79 0.00 0.00 35.95 39.98 2hgm h PHE 130 CO 0.00 0.11 -0.33 1.19 -2.23 0.00 0.00 178.31 177.05 2hgm n PHE 131 N -5.02 1.35 0.22 0.41 3.72 -0.36 -4.57 117.46 113.22 2hgm n PHE 131 Ca -0.06 -1.84 0.16 0.00 -0.05 0.00 0.00 57.45 55.66 2hgm n PHE 131 Cb 0.06 -0.45 0.65 0.00 -0.94 0.00 0.00 39.48 38.79 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 1.37 0.00 -1.02 4.37 4.64 -1.43 -1.43 113.55 120.05 2hgm h SER 132 Ca 0.23 0.00 0.24 0.00 -0.47 0.00 0.00 61.79 61.79 2hgm h SER 132 Cb 1.39 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.38 2hgm h SER 132 CO 0.46 0.00 0.64 1.23 -0.87 0.00 0.00 176.83 178.28 2hgm h GLY 133 N 0.00 1.45 -2.63 -0.77 0.00 -1.83 -3.47 103.07 95.82 2hgm h GLY 133 Ca 0.09 -0.26 -0.26 0.00 0.00 0.00 0.00 47.33 46.91 2hgm h GLY 133 CO -0.00 -0.14 -0.63 1.08 0.00 0.00 0.00 176.54 176.85 2hgm s LEU 134 N -9.90 1.55 -0.12 3.11 1.02 -0.54 -5.15 118.68 108.65 2hgm s LEU 134 Ca -0.10 -1.31 -0.20 0.00 0.02 0.00 0.00 54.13 52.54 2hgm s LEU 134 Cb 0.25 0.22 -0.04 0.00 0.02 0.00 0.00 46.19 46.65 2hgm s LEU 134 CO 0.80 -0.75 0.58 -0.70 0.02 0.00 0.00 176.35 176.30 2hgm s GLU 135 N -4.07 4.34 -0.04 1.70 2.12 -1.26 -5.02 118.70 116.48 2hgm s GLU 135 Ca 0.33 0.62 0.03 0.00 0.36 0.00 0.00 54.97 56.31 2hgm s GLU 135 Cb 0.07 -3.47 0.00 0.00 0.26 0.00 0.00 34.13 30.99 2hgm s GLU 135 CO 0.09 0.04 -0.13 0.42 -0.54 0.00 0.00 175.26 175.14 2hgm s ILE 136 N 0.95 1.14 0.69 -3.70 1.01 -1.26 -2.58 121.20 117.45 2hgm s ILE 136 Ca 0.30 -0.54 -0.15 0.00 0.00 0.00 0.00 60.65 60.25 2hgm s ILE 136 Cb -0.16 -1.00 0.02 0.00 0.01 0.00 0.00 42.46 41.33 2hgm s ILE 136 CO 0.13 0.34 1.17 0.68 0.00 0.00 0.00 174.94 177.26 2hgm s VAL 137 N 0.18 2.65 -1.04 2.92 -7.23 -1.15 -4.83 120.40 111.91 2hgm s VAL 137 Ca -0.05 0.32 0.00 0.00 -1.81 0.00 0.00 61.98 60.44 2hgm s VAL 137 Cb -0.11 -2.89 0.00 0.00 0.56 0.00 0.00 36.38 33.95 2hgm s VAL 137 CO 0.02 -0.17 0.78 -2.65 -0.31 0.00 0.00 175.10 172.76 2hgm n PRO 138 N -2.51 0.00 -0.07 4.82 -0.02 -1.26 -0.78 135.00 135.18 2hgm n PRO 138 Ca 0.12 0.30 0.02 0.00 -2.02 0.00 0.00 63.50 61.92 2hgm n PRO 138 Cb 0.51 -1.57 0.03 0.00 -0.02 0.00 0.00 33.50 32.45 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 -1.28 1.33 0.24 2.55 5.03 -1.26 -4.99 115.26 116.89 2hgm n ASN 139 Ca 0.00 -1.95 0.08 0.00 0.87 0.00 0.00 54.58 53.59 2hgm n ASN 139 Cb 0.07 -0.10 0.61 0.00 -1.02 0.00 0.00 39.78 39.33 2hgm n ASN 139 CO 0.00 0.00 0.00 1.23 -1.83 0.00 0.00 177.26 176.66 2hgm h GLY 140 N 0.00 0.00 -5.56 7.41 0.00 -1.19 -3.43 103.07 100.29 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 -0.23 -0.42 0.00 0.00 0.00 176.54 175.89 2hgm s ILE 141 N -4.63 5.21 -0.06 2.60 1.01 -1.26 -0.58 121.20 123.49 2hgm s ILE 141 Ca -0.04 0.76 0.04 0.00 0.00 0.00 0.00 60.65 61.41 2hgm s ILE 141 Cb 0.15 -3.72 -0.00 0.00 0.01 0.00 0.00 42.46 38.91 2hgm s ILE 141 CO 0.66 0.41 -0.19 -0.89 0.00 0.00 0.00 174.94 174.92 2hgm s THR 142 N 0.19 1.63 -0.45 2.92 2.01 0.69 -4.95 115.64 117.68 2hgm s THR 142 Ca 0.22 -0.80 0.03 0.00 0.31 0.00 0.00 61.69 61.45 2hgm s THR 142 Cb -0.15 -1.41 0.12 0.00 0.01 0.00 0.00 72.50 71.07 2hgm s THR 142 CO 0.08 0.46 0.19 -0.76 -0.69 0.00 0.00 174.62 173.91 2hgm s LEU 143 N 0.21 4.10 -0.05 4.42 2.01 -1.26 -0.89 118.68 127.21 2hgm s LEU 143 Ca -0.10 -2.67 -0.01 0.00 0.01 0.00 0.00 54.13 51.36 2hgm s LEU 143 Cb -0.14 -1.51 -0.00 0.00 0.01 0.00 0.00 46.19 44.54 2hgm s LEU 143 CO 0.04 -0.28 -0.02 1.55 1.01 0.00 0.00 176.35 178.65 2hgm h PRO 144 N 6.90 0.00 -2.23 1.29 0.13 -1.92 -3.51 132.00 132.66 2hgm h PRO 144 Ca -0.06 0.00 0.23 0.00 -0.87 0.00 0.00 66.00 65.29 2hgm h PRO 144 Cb 0.94 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.00 2hgm h PRO 144 CO 0.61 0.00 0.66 0.14 -0.23 0.00 0.00 178.00 179.18 2hgm s VAL 145 N -1.35 0.00 0.99 1.56 -7.23 -1.26 -4.86 120.40 108.24 2hgm s VAL 145 Ca -0.02 -0.46 -0.14 0.00 -1.81 0.00 0.00 61.98 59.55 2hgm s VAL 145 Cb 0.00 -2.56 0.18 0.00 0.56 0.00 0.00 36.38 34.56 2hgm s VAL 145 CO 0.02 0.00 1.13 1.51 -0.31 0.00 0.00 175.10 177.46 2hgm s ASP 146 N -3.31 2.80 0.00 4.85 -4.77 -1.25 -1.99 116.67 113.00 2hgm s ASP 146 Ca 0.20 0.93 0.00 0.00 -3.30 0.00 0.00 52.55 50.38 2hgm s ASP 146 Cb -0.01 -1.45 0.00 0.00 -1.09 0.00 0.00 42.92 40.37 2hgm s ASP 146 CO 0.02 -2.99 0.32 -2.65 0.70 0.00 0.00 175.17 170.58 2hgm n PRO 147 N -4.05 0.00 0.00 2.11 -0.02 -1.26 -1.78 135.00 130.00 2hgm n PRO 147 Ca 0.07 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 2hgm n PRO 147 Cb 0.59 -1.38 0.00 0.00 -0.02 0.00 0.00 33.50 32.69 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 -0.81 0.03 -2.33 -0.52 2.13 -1.26 -5.07 120.64 112.81 2hgm n GLU 148 Ca 0.00 -0.25 -0.01 0.00 0.66 0.00 0.00 57.16 57.56 2hgm n GLU 148 Cb 0.00 -0.72 0.00 0.00 0.27 0.00 0.00 31.44 30.99 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 0.08 0.68 0.00 8.31 0.00 -0.74 -4.96 105.19 108.57 2hgm n GLY 149 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.29 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 -0.83 3.32 0.00 1.61 2.85 -1.26 -4.97 118.16 118.88 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 0.50 -0.50 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 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 -0.50 0.00 -2.66 0.58 3.06 -1.26 -4.98 119.36 113.60 2hgm n ILE 151 Ca 0.00 0.00 -0.03 0.00 -2.50 0.00 0.00 62.75 60.22 2hgm n ILE 151 Cb 0.00 0.00 0.04 0.00 0.54 0.00 0.00 39.64 40.22 2hgm n ILE 151 CO 0.00 0.00 0.00 0.42 -2.50 0.00 0.00 176.55 174.47 2hgm s THR 152 N 2.20 -0.11 0.00 9.51 -4.23 -1.26 -3.90 115.64 117.85 2hgm s THR 152 Ca 0.00 -0.11 0.00 0.00 -1.18 0.00 0.00 61.69 60.40 2hgm s THR 152 Cb 0.00 0.00 0.00 0.00 1.34 0.00 0.00 72.50 73.84 2hgm s THR 152 CO 0.00 0.00 0.57 0.61 -0.54 0.00 0.00 174.62 175.26 2hgm n GLY 153 N 2.55 0.05 3.13 3.99 0.00 -1.20 -4.21 105.19 109.51 2hgm n GLY 153 Ca 0.11 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.32 0.76 0.04 1.61 -1.05 -0.84 -0.68 118.70 118.21 2hgm s GLU 154 Ca 0.00 -1.32 -0.25 0.00 -0.15 0.00 0.00 54.97 53.25 2hgm s GLU 154 Cb 0.00 0.14 0.08 0.00 -0.44 0.00 0.00 34.13 33.91 2hgm s GLU 154 CO 0.00 -0.14 1.16 0.00 0.95 0.00 0.00 175.26 177.23 2hgm n ALA 155 N 0.01 -3.22 -3.03 -0.84 0.00 -1.08 -4.21 120.51 108.15 2hgm n ALA 155 Ca -0.11 -0.84 -0.11 0.00 0.00 0.00 0.00 53.44 52.39 2hgm n ALA 155 Cb 0.62 0.26 -0.05 0.00 0.00 0.00 0.00 19.45 20.28 2hgm n ALA 155 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2hgm s PHE 156 N -2.11 -0.21 -0.27 0.00 0.08 -0.07 -0.17 117.98 115.22 2hgm s PHE 156 Ca 0.27 -0.04 -0.11 0.00 0.12 0.00 0.00 56.93 57.16 2hgm s PHE 156 Cb -0.01 0.24 0.11 0.00 -0.57 0.00 0.00 43.02 42.79 2hgm s PHE 156 CO 0.01 -0.67 0.62 0.54 -0.10 0.00 0.00 175.22 175.62 2hgm s VAL 157 N -3.49 -0.61 -0.13 -0.44 0.11 0.19 -0.22 120.40 115.81 2hgm s VAL 157 Ca 0.01 0.03 -0.18 0.00 -2.93 0.00 0.00 61.98 58.91 2hgm s VAL 157 Cb 0.01 -0.94 -0.04 0.00 -1.53 0.00 0.00 36.38 33.88 2hgm s VAL 157 CO -0.10 0.01 0.45 -1.58 -3.33 0.00 0.00 175.10 170.55 2hgm s GLN 158 N 2.41 4.33 0.00 1.54 2.00 0.26 -0.40 119.66 129.79 2hgm s GLN 158 Ca -0.07 0.40 0.00 0.00 -2.00 0.00 0.00 55.36 53.69 2hgm s GLN 158 Cb -0.10 -3.44 0.00 0.00 0.80 0.00 0.00 33.01 30.28 2hgm s GLN 158 CO -0.18 0.16 0.00 1.19 -0.50 0.00 0.00 175.29 175.96 2hgm n PHE 159 N 3.68 -2.64 0.89 1.67 3.01 -0.23 -2.95 117.46 120.88 2hgm n PHE 159 Ca -0.08 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.51 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 2.20 -3.46 4.37 0.00 -1.06 -4.05 120.51 115.50 2hgm n ALA 160 Ca 0.00 -0.09 -0.12 0.00 0.00 0.00 0.00 53.44 53.24 2hgm n ALA 160 Cb 0.00 -1.42 -0.03 0.00 0.00 0.00 0.00 19.45 18.00 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 -3.07 -0.51 0.00 0.00 0.01 -1.21 -4.86 113.70 104.06 2hgm s SER 161 Ca 0.12 0.10 -0.01 0.00 1.31 0.00 0.00 55.95 57.48 2hgm s SER 161 Cb 0.17 0.51 -0.05 0.00 0.21 0.00 0.00 66.02 66.86 2hgm s SER 161 CO 0.48 -0.79 1.40 0.00 0.41 0.00 0.00 173.24 174.74 2hgm n GLN 162 N -0.13 0.69 0.13 12.44 1.13 -1.22 -1.79 117.38 128.62 2hgm n GLN 162 Ca -0.14 -0.19 0.00 0.00 -1.94 0.00 0.00 57.00 54.73 2hgm n GLN 162 Cb 0.63 -1.44 0.00 0.00 0.11 0.00 0.00 30.24 29.54 2hgm n GLN 162 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 2hgm n GLU 163 N 2.13 0.00 -0.31 -1.09 4.07 -1.26 -4.71 120.64 119.46 2hgm n GLU 163 Ca 0.08 0.00 0.05 0.00 -0.06 0.00 0.00 57.16 57.24 2hgm n GLU 163 Cb 0.33 0.00 0.21 0.00 -0.06 0.00 0.00 31.44 31.92 2hgm n GLU 163 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 2hgm h LEU 164 N 0.00 0.72 -0.36 4.31 3.38 -1.94 0.12 115.31 121.54 2hgm h LEU 164 Ca 0.00 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2hgm h LEU 164 Cb 0.00 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.67 2hgm h LEU 164 CO 0.00 0.37 0.00 0.00 0.09 0.00 0.00 178.44 178.90 2hgm n ALA 165 N -2.38 1.68 -0.08 1.53 0.00 -0.74 -1.93 120.51 118.59 2hgm n ALA 165 Ca 0.16 0.02 -0.11 0.00 0.00 0.00 0.00 53.44 53.52 2hgm n ALA 165 Cb 0.35 -1.32 -0.15 0.00 0.00 0.00 0.00 19.45 18.32 2hgm n ALA 165 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2hgm n GLU 166 N -1.89 0.68 -0.05 0.00 4.71 -0.03 -3.04 120.64 121.01 2hgm n GLU 166 Ca 0.03 0.08 -0.01 0.00 -0.01 0.00 0.00 57.16 57.25 2hgm n GLU 166 Cb 0.21 -1.59 0.27 0.00 -1.01 0.00 0.00 31.44 29.31 2hgm n GLU 166 CO 0.00 0.00 0.00 0.87 0.09 0.00 0.00 177.13 178.09 2hgm h LYS 167 N 0.00 0.64 -0.19 3.49 1.79 -0.68 -2.77 116.57 118.84 2hgm h LYS 167 Ca -0.49 -0.13 -0.04 0.00 -2.18 0.00 0.00 60.65 57.81 2hgm h LYS 167 Cb 2.16 -0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 32.71 2hgm h LYS 167 CO 0.03 0.61 -0.03 0.00 -1.08 0.00 0.00 179.45 178.98 2hgm h ALA 168 N 1.46 0.27 -0.81 3.86 0.00 -1.48 -2.35 119.26 120.21 2hgm h ALA 168 Ca 0.14 -0.24 0.20 0.00 0.00 0.00 0.00 54.91 55.01 2hgm h ALA 168 Cb 0.29 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 2hgm h ALA 168 CO 0.00 0.03 0.56 -0.07 0.00 0.00 0.00 179.25 179.77 2hgm h LEU 169 N 0.10 0.22 -0.52 0.00 4.07 -1.50 -1.62 115.31 116.06 2hgm h LEU 169 Ca 0.05 0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.03 2hgm h LEU 169 Cb 0.47 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 42.19 2hgm h LEU 169 CO 0.02 0.10 0.04 0.61 -1.08 0.00 0.00 178.44 178.13 2hgm n GLY 170 N -1.59 -0.60 0.36 0.83 0.00 -0.89 -1.43 105.19 101.87 2hgm n GLY 170 Ca 0.17 0.07 0.01 0.00 0.00 0.00 0.00 46.02 46.27 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 1.06 0.00 1.61 1.79 -1.34 -3.46 116.57 116.22 2hgm h LYS 171 Ca 0.00 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.41 2hgm h LYS 171 Cb 0.08 -0.24 0.00 0.00 -1.58 0.00 0.00 32.23 30.50 2hgm h LYS 171 CO 0.00 0.70 0.00 0.72 -1.08 0.00 0.00 179.45 179.79 2hgm n HIS 172 N -4.43 0.00 -3.53 -1.35 8.25 -0.51 -4.43 115.22 109.22 2hgm n HIS 172 Ca 0.11 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.33 2hgm n HIS 172 Cb 0.08 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.05 2hgm n HIS 172 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 2hgm s LYS 173 N 0.00 0.17 0.00 -0.41 -0.14 -1.26 -4.28 119.74 113.82 2hgm s LYS 173 Ca 0.00 -0.17 0.00 0.00 -1.36 0.00 0.00 55.97 54.44 2hgm s LYS 173 Cb 0.00 -1.29 0.00 0.00 -1.68 0.00 0.00 37.83 34.86 2hgm s LYS 173 CO 0.00 -0.84 0.00 0.39 -0.76 0.00 0.00 175.35 174.14 2hgm n GLU 174 N 5.28 0.00 -3.96 1.68 1.02 -1.23 -5.03 120.64 118.42 2hgm n GLU 174 Ca -0.06 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.00 2hgm n GLU 174 Cb 0.46 0.00 -0.09 0.00 -0.02 0.00 0.00 31.44 31.79 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 0.02 0.61 0.00 3.49 3.52 -1.26 -0.51 118.95 124.82 2hgm s ARG 175 Ca 0.00 -0.87 0.00 0.00 -0.13 0.00 0.00 55.73 54.73 2hgm s ARG 175 Cb 0.00 0.23 0.00 0.00 -1.56 0.00 0.00 34.95 33.62 2hgm s ARG 175 CO 0.00 -0.15 0.00 1.51 -0.81 0.00 0.00 175.30 175.85 2hgm n ILE 176 N 0.58 0.00 0.00 4.11 3.06 -0.91 -4.83 119.36 121.37 2hgm n ILE 176 Ca -0.18 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.07 2hgm n ILE 176 Cb 0.59 -0.41 0.00 0.00 0.54 0.00 0.00 39.64 40.36 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 3.12 1.67 0.10 4.50 0.00 -1.26 -4.73 105.19 108.60 2hgm n GLY 177 Ca 0.00 -0.24 -0.19 0.00 0.00 0.00 0.00 46.02 45.59 2hgm n GLY 177 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2hgm h HIS 178 N 0.00 0.34 -5.55 1.61 -0.00 -1.97 -3.50 115.15 106.09 2hgm h HIS 178 Ca 0.00 -0.25 -0.39 0.00 -0.00 0.00 0.00 60.37 59.73 2hgm h HIS 178 Cb 0.00 -0.01 0.05 0.00 -0.00 0.00 0.00 27.41 27.45 2hgm h HIS 178 CO 0.00 1.27 0.04 0.54 -0.00 0.00 0.00 177.93 179.78 2hgm n ARG 179 N -4.25 0.26 -4.09 5.26 3.00 -1.26 -5.04 116.66 110.53 2hgm n ARG 179 Ca -0.16 -2.40 -0.23 0.00 -0.01 0.00 0.00 57.85 55.06 2hgm n ARG 179 Cb 0.73 -0.42 -0.17 0.00 0.00 0.00 0.00 32.46 32.60 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 -2.34 0.99 -0.05 -1.55 2.02 -1.25 -2.13 117.35 113.03 2hgm s TYR 180 Ca 0.54 -0.35 0.04 0.00 -0.37 0.00 0.00 57.07 56.93 2hgm s TYR 180 Cb -0.03 -0.87 -0.00 0.00 -0.40 0.00 0.00 41.96 40.65 2hgm s TYR 180 CO 0.35 -0.30 -0.18 0.42 -1.57 0.00 0.00 175.55 174.27 2hgm s ILE 181 N 1.26 1.53 0.64 2.71 1.09 0.33 -4.46 121.20 124.29 2hgm s ILE 181 Ca -0.05 -0.76 -0.13 0.00 -1.10 0.00 0.00 60.65 58.61 2hgm s ILE 181 Cb -0.14 -1.32 -0.02 0.00 -1.06 0.00 0.00 42.46 39.93 2hgm s ILE 181 CO -0.02 0.44 1.05 -1.61 -0.10 0.00 0.00 174.94 174.70 2hgm s GLU 182 N 0.09 3.19 -0.01 2.79 8.01 0.68 -3.46 118.70 129.98 2hgm s GLU 182 Ca -0.06 1.06 0.01 0.00 0.01 0.00 0.00 54.97 55.99 2hgm s GLU 182 Cb -0.13 -2.02 0.01 0.00 -4.31 0.00 0.00 34.13 27.68 2hgm s GLU 182 CO 0.03 -0.91 -0.03 0.14 0.01 0.00 0.00 175.26 174.50 2hgm s VAL 183 N -2.75 0.31 0.03 2.63 -7.23 -1.26 -3.30 120.40 108.83 2hgm s VAL 183 Ca 0.60 -0.11 0.00 0.00 -1.81 0.00 0.00 61.98 60.67 2hgm s VAL 183 Cb -0.15 -0.30 -0.02 0.00 0.56 0.00 0.00 36.38 36.47 2hgm s VAL 183 CO 0.45 0.12 -0.04 -0.36 -0.31 0.00 0.00 175.10 174.96 2hgm s PHE 184 N 0.27 0.41 0.12 2.82 0.08 -0.27 -4.98 117.98 116.42 2hgm s PHE 184 Ca -0.03 -0.61 -0.15 0.00 0.12 0.00 0.00 56.93 56.27 2hgm s PHE 184 Cb -0.06 -0.28 -0.07 0.00 -0.57 0.00 0.00 43.02 42.05 2hgm s PHE 184 CO -0.00 -0.19 0.53 0.21 -0.10 0.00 0.00 175.22 175.67 2hgm s LYS 185 N -1.89 4.00 0.19 0.44 2.47 -1.26 -0.57 119.74 123.12 2hgm s LYS 185 Ca -0.11 0.51 -0.11 0.00 -1.56 0.00 0.00 55.97 54.70 2hgm s LYS 185 Cb -0.07 -3.01 -0.00 0.00 -1.46 0.00 0.00 37.83 33.29 2hgm s LYS 185 CO -0.02 0.53 0.37 -1.12 0.16 0.00 0.00 175.35 175.26 2hgm s SER 186 N -1.57 -0.05 0.09 1.43 0.01 -0.73 -4.82 113.70 108.06 2hgm s SER 186 Ca 0.35 -0.80 -0.09 0.00 1.31 0.00 0.00 55.95 56.72 2hgm s SER 186 Cb -0.16 0.49 -0.00 0.00 0.21 0.00 0.00 66.02 66.56 2hgm s SER 186 CO 0.19 -0.97 0.20 -0.44 0.41 0.00 0.00 173.24 172.63 2hgm s SER 187 N -2.96 0.11 0.00 2.44 0.01 -1.26 -1.94 113.70 110.10 2hgm s SER 187 Ca 0.17 -0.66 0.00 0.00 1.31 0.00 0.00 55.95 56.77 2hgm s SER 187 Cb 0.02 0.35 0.00 0.00 0.21 0.00 0.00 66.02 66.59 2hgm s SER 187 CO 0.01 -0.74 0.01 1.67 0.41 0.00 0.00 173.24 174.60 2hgm n GLN 188 N -0.07 0.00 0.00 12.44 -0.06 -1.26 -1.47 117.38 126.96 2hgm n GLN 188 Ca -0.15 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.85 2hgm n GLN 188 Cb 0.62 -1.26 0.00 0.00 -4.06 0.00 0.00 30.24 25.54 2hgm n GLN 188 CO 0.00 0.00 0.00 -0.85 -0.20 0.00 0.00 177.06 176.01 2hgm n GLU 189 N -0.28 3.29 -0.00 3.69 0.28 -1.26 -4.64 120.64 121.72 2hgm n GLU 189 Ca 0.00 0.00 0.03 0.00 -0.16 0.00 0.00 57.16 57.03 2hgm n GLU 189 Cb 0.00 -0.59 -0.05 0.00 1.43 0.00 0.00 31.44 32.23 2hgm n GLU 189 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 2hgm n GLU 190 N -0.84 0.21 0.18 3.44 0.00 -0.54 -4.54 120.64 118.54 2hgm n GLU 190 Ca 0.00 -0.06 0.07 0.00 0.00 0.00 0.00 57.16 57.17 2hgm n GLU 190 Cb 0.00 -1.15 0.12 0.00 0.00 0.00 0.00 31.44 30.41 2hgm n GLU 190 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.13 176.74 2hgm h VAL 191 N 0.00 0.52 -1.56 6.31 -1.51 -1.81 -3.38 116.25 114.83 2hgm h VAL 191 Ca 0.00 -1.68 -0.76 0.00 -1.23 0.00 0.00 66.70 63.03 2hgm h VAL 191 Cb 0.28 2.21 -0.17 0.00 -2.13 0.00 0.00 31.29 31.49 2hgm h VAL 191 CO 0.00 0.29 1.94 -2.11 -1.23 0.00 0.00 177.57 176.46 2hgm n ARG 192 N -3.19 4.44 -0.06 5.19 1.85 -1.26 -4.72 116.66 118.91 2hgm n ARG 192 Ca 0.03 -3.77 0.18 0.00 -1.00 0.00 0.00 57.85 53.29 2hgm n ARG 192 Cb 0.63 -2.68 0.61 0.00 -1.05 0.00 0.00 32.46 29.98 2hgm n ARG 192 CO 0.00 0.00 0.00 0.77 -0.01 0.00 0.00 177.63 178.39 2hgm h SER 193 N 4.95 0.16 0.00 2.89 0.02 -1.92 -3.50 113.55 116.15 2hgm h SER 193 Ca 0.54 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.50 2hgm h SER 193 Cb 0.43 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.94 2hgm h SER 193 CO 1.46 0.08 0.00 0.00 -1.14 0.00 0.00 176.83 177.24