#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ulm n PRO 102 N 0.00 1.45 0.00 0.00 -0.02 -1.26 -4.93 135.00 130.24 1ulm n PRO 102 Ca 0.00 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1ulm n PRO 102 Cb 0.00 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.26 1ulm n PRO 102 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1ulm n GLU 103 N -0.25 2.55 -3.71 -0.52 0.28 0.10 -4.88 120.64 114.21 1ulm n GLU 103 Ca 0.10 -0.27 -0.09 0.00 -0.16 0.00 0.00 57.16 56.73 1ulm n GLU 103 Cb 0.42 -0.76 -0.03 0.00 1.43 0.00 0.00 31.44 32.49 1ulm n GLU 103 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1ulm n GLY 105 N -0.38 -2.28 0.30 0.00 0.00 -0.68 -4.27 105.19 97.87 1ulm n GLY 105 Ca -0.10 -1.89 0.11 0.00 0.00 0.00 0.00 46.02 44.14 1ulm n GLY 105 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1ulm h GLU 106 N 0.00 0.06 -0.65 1.61 5.08 -1.91 0.15 114.58 118.92 1ulm h GLU 106 Ca 0.00 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1ulm h GLU 106 Cb 0.00 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1ulm h GLU 106 CO 0.00 0.04 0.00 0.54 -1.00 0.00 0.00 179.01 178.59 1ulm n ARG 107 N -4.49 3.31 -2.46 2.33 1.74 -1.26 -3.89 116.66 111.94 1ulm n ARG 107 Ca 0.01 -2.12 0.00 0.00 -0.77 0.00 0.00 57.85 54.98 1ulm n ARG 107 Cb 0.22 -1.86 0.04 0.00 -1.02 0.00 0.00 32.46 29.85 1ulm n ARG 107 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ulm n ALA 108 N 0.61 2.62 -2.02 7.54 0.00 -0.36 -4.82 120.51 124.07 1ulm n ALA 108 Ca 0.19 -2.69 -0.20 0.00 0.00 0.00 0.00 53.44 50.74 1ulm n ALA 108 Cb 0.78 -0.82 -0.04 0.00 0.00 0.00 0.00 19.45 19.37 1ulm n ALA 108 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1ulm n SER 109 N -0.34 -5.52 -0.04 0.00 7.64 -1.21 -2.16 113.62 111.99 1ulm n SER 109 Ca 0.08 0.20 -0.01 0.00 1.01 0.00 0.00 58.87 60.16 1ulm n SER 109 Cb 0.89 -4.63 -0.00 0.00 -1.01 0.00 0.00 64.21 59.45 1ulm n SER 109 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ulm n GLY 110 N -0.82 0.43 3.77 0.23 0.00 0.38 -4.99 105.19 104.19 1ulm n GLY 110 Ca -0.22 -0.10 -0.41 0.00 0.00 0.00 0.00 46.02 45.29 1ulm n GLY 110 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1ulm n LYS 111 N -2.18 2.59 -3.69 1.61 4.81 -0.92 -4.64 118.16 115.74 1ulm n LYS 111 Ca -0.01 0.91 -0.25 0.00 -0.87 0.00 0.00 58.31 58.10 1ulm n LYS 111 Cb 0.12 -2.66 -0.02 0.00 0.02 0.00 0.00 35.03 32.48 1ulm n LYS 111 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1ulm s ARG 112 N -2.18 3.49 0.39 1.64 0.52 -1.26 -1.69 118.95 119.85 1ulm s ARG 112 Ca 0.55 -0.46 -0.21 0.00 -0.52 0.00 0.00 55.73 55.09 1ulm s ARG 112 Cb -0.47 -2.81 -0.10 0.00 0.52 0.00 0.00 34.95 32.09 1ulm s ARG 112 CO 0.63 0.35 0.91 0.00 0.02 0.00 0.00 175.30 177.20 1ulm s PRO 114 N -2.94 2.85 0.00 0.00 0.04 -1.26 -3.58 135.00 130.11 1ulm s PRO 114 Ca 0.58 0.79 0.00 0.00 0.04 0.00 0.00 61.00 62.41 1ulm s PRO 114 Cb -0.11 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.44 1ulm s PRO 114 CO 0.16 -1.12 0.00 0.09 0.04 0.00 0.00 177.00 176.17 1ulm n ASN 115 N -3.12 -4.50 0.00 6.66 3.02 -1.26 -1.98 115.26 114.08 1ulm n ASN 115 Ca 0.07 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.62 1ulm n ASN 115 Cb 0.55 -3.04 0.00 0.00 -0.61 0.00 0.00 39.78 36.68 1ulm n ASN 115 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ulm n GLY 116 N 0.47 0.47 3.72 7.41 0.00 -1.23 -5.04 105.19 110.99 1ulm n GLY 116 Ca 0.00 -0.81 -0.34 0.00 0.00 0.00 0.00 46.02 44.87 1ulm n GLY 116 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ulm s LYS 117 N -1.49 2.03 0.32 1.61 -0.14 -0.84 -4.59 119.74 116.65 1ulm s LYS 117 Ca 0.00 1.74 -0.26 0.00 -1.36 0.00 0.00 55.97 56.09 1ulm s LYS 117 Cb 0.00 -1.82 -0.10 0.00 -1.68 0.00 0.00 37.83 34.23 1ulm s LYS 117 CO 0.00 -1.91 0.95 0.00 -0.76 0.00 0.00 175.35 173.63 1ulm s SER 120 N 1.63 2.30 0.61 0.00 1.04 0.01 0.02 113.70 119.30 1ulm s SER 120 Ca 0.04 1.55 0.35 0.00 0.48 0.00 0.00 55.95 58.38 1ulm s SER 120 Cb -0.18 -2.23 1.96 0.00 0.10 0.00 0.00 66.02 65.67 1ulm s SER 120 CO 0.08 -3.39 2.26 -0.61 0.98 0.00 0.00 173.24 172.56 1ulm h GLN 121 N -2.06 0.00 -0.02 4.02 4.15 -1.78 -1.10 115.11 118.32 1ulm h GLN 121 Ca -0.54 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.88 1ulm h GLN 121 Cb 1.31 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.00 1ulm h GLN 121 CO 0.51 0.02 -0.13 0.91 -1.93 0.00 0.00 178.83 178.22 1ulm n TRP 122 N -3.51 0.00 -1.05 3.99 8.01 -1.26 -4.96 117.44 118.65 1ulm n TRP 122 Ca -0.03 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.16 1ulm n TRP 122 Cb 0.11 -0.03 0.00 0.00 -2.01 0.00 0.00 31.31 29.38 1ulm n TRP 122 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1ulm n GLY 123 N 1.28 1.14 3.30 6.99 0.00 -0.42 -4.72 105.19 112.77 1ulm n GLY 123 Ca 0.15 -0.46 -0.23 0.00 0.00 0.00 0.00 46.02 45.49 1ulm n GLY 123 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ulm s TYR 124 N -2.02 1.76 -0.06 1.61 2.02 -1.26 0.01 117.35 119.41 1ulm s TYR 124 Ca 0.00 -0.44 -0.16 0.00 -0.37 0.00 0.00 57.07 56.10 1ulm s TYR 124 Cb 0.00 -0.93 -0.05 0.00 -0.40 0.00 0.00 41.96 40.58 1ulm s TYR 124 CO 0.00 0.24 0.42 0.00 -1.57 0.00 0.00 175.55 174.64 1ulm n GLY 126 N 2.49 0.75 0.00 0.00 0.00 -0.67 -4.95 105.19 102.81 1ulm n GLY 126 Ca -0.11 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.86 1ulm n GLY 126 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ulm n THR 127 N -0.49 0.00 -2.18 2.61 -2.24 -1.26 -0.41 114.28 110.30 1ulm n THR 127 Ca -0.00 -0.27 -0.27 0.00 -2.27 0.00 0.00 64.05 61.23 1ulm n THR 127 Cb 0.37 1.38 0.16 0.00 -2.10 0.00 0.00 70.33 70.15 1ulm n THR 127 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1ulm s THR 128 N -0.09 2.04 0.37 4.28 -4.23 -1.26 -4.75 115.64 111.99 1ulm s THR 128 Ca 0.00 -0.23 0.04 0.00 -1.18 0.00 0.00 61.69 60.32 1ulm s THR 128 Cb 0.00 -2.81 0.26 0.00 1.34 0.00 0.00 72.50 71.29 1ulm s THR 128 CO 0.00 0.00 2.02 -0.78 -0.54 0.00 0.00 174.62 175.32 1ulm h ASP 129 N -1.25 0.64 0.25 3.99 1.82 -1.98 -0.63 116.42 119.27 1ulm h ASP 129 Ca -0.41 -0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.21 1ulm h ASP 129 Cb 1.24 -0.16 0.00 0.00 0.68 0.00 0.00 39.33 41.09 1ulm h ASP 129 CO 0.37 0.48 0.00 0.78 -1.61 0.00 0.00 179.24 179.26 1ulm h ASN 130 N 0.75 0.00 0.00 2.28 2.35 -1.94 0.48 115.58 119.50 1ulm h ASN 130 Ca 0.20 0.00 -0.33 0.00 -0.55 0.00 0.00 56.30 55.62 1ulm h ASN 130 Cb -0.07 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.25 1ulm h ASN 130 CO -0.04 0.00 -2.18 -1.22 -1.65 0.00 0.00 177.43 172.34 1ulm n TYR 131 N -2.35 0.00 0.10 1.19 4.01 -0.41 -4.60 117.16 115.10 1ulm n TYR 131 Ca -0.00 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.85 1ulm n TYR 131 Cb 0.10 -0.78 -0.08 0.00 -0.31 0.00 0.00 39.34 38.27 1ulm n TYR 131 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ulm n GLY 133 N 1.24 -0.61 3.73 0.00 0.00 0.17 -4.63 105.19 105.09 1ulm n GLY 133 Ca -0.02 -0.98 -0.42 0.00 0.00 0.00 0.00 46.02 44.61 1ulm n GLY 133 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ulm s GLN 134 N 0.00 4.19 0.00 1.61 0.74 -1.26 -2.35 119.66 122.59 1ulm s GLN 134 Ca 0.00 2.45 0.00 0.00 0.05 0.00 0.00 55.36 57.86 1ulm s GLN 134 Cb 0.00 -3.10 0.00 0.00 1.10 0.00 0.00 33.01 31.01 1ulm s GLN 134 CO 0.00 -0.61 0.00 0.41 -0.55 0.00 0.00 175.29 174.54 1ulm n GLY 135 N 3.19 1.16 3.66 2.59 0.00 -1.26 -4.74 105.19 109.78 1ulm n GLY 135 Ca 0.12 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.68 1ulm n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ulm n GLN 137 N 2.11 0.68 -3.71 0.00 6.02 0.10 -4.89 117.38 117.70 1ulm n GLN 137 Ca 0.12 0.36 -0.11 0.00 -0.01 0.00 0.00 57.00 57.37 1ulm n GLN 137 Cb 0.30 -1.70 -0.06 0.00 1.02 0.00 0.00 30.24 29.80 1ulm n GLN 137 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1ulm s SER 138 N -6.97 -0.15 -1.57 1.08 1.04 -1.24 -4.91 113.70 100.97 1ulm s SER 138 Ca -0.26 -0.30 -0.14 0.00 0.48 0.00 0.00 55.95 55.73 1ulm s SER 138 Cb 0.07 0.41 0.10 0.00 0.10 0.00 0.00 66.02 66.70 1ulm s SER 138 CO 0.69 -0.74 0.87 0.00 0.98 0.00 0.00 173.24 175.04 1ulm n GLN 139 N 0.10 -4.63 0.00 4.02 6.02 -1.26 -1.75 117.38 119.88 1ulm n GLN 139 Ca -0.17 0.52 0.11 0.00 -0.01 0.00 0.00 57.00 57.45 1ulm n GLN 139 Cb 0.62 -5.29 0.59 0.00 1.02 0.00 0.00 30.24 27.17 1ulm n GLN 139 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ulm n ASP 141 N -1.19 4.97 -0.09 0.00 8.00 -1.26 -4.69 116.55 122.28 1ulm n ASP 141 Ca 0.12 -3.73 0.17 0.00 0.71 0.00 0.00 54.79 52.06 1ulm n ASP 141 Cb 0.14 -0.78 0.58 0.00 -0.02 0.00 0.00 41.12 41.04 1ulm n ASP 141 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1ulm h TYR 142 N 1.50 0.28 -0.16 1.24 5.03 -1.80 0.01 116.97 123.07 1ulm h TYR 142 Ca 0.50 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.82 1ulm h TYR 142 Cb 1.72 -0.09 0.00 0.00 1.55 0.00 0.00 36.73 39.92 1ulm h TYR 142 CO 1.33 0.11 0.00 0.91 -1.32 0.00 0.00 178.16 179.19 1ulm n TRP 143 N -4.43 0.20 -3.45 -3.82 7.02 -1.26 -4.80 117.44 106.89 1ulm n TRP 143 Ca 0.12 -0.10 -0.21 0.00 -1.02 0.00 0.00 57.50 56.29 1ulm n TRP 143 Cb 0.55 0.00 -0.01 0.00 -2.42 0.00 0.00 31.31 29.43 1ulm n TRP 143 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 1ulm s ARG 144 N -1.80 3.26 0.08 -0.99 1.81 -0.01 -1.00 118.95 120.31 1ulm s ARG 144 Ca 0.34 -0.67 -0.27 0.00 -1.72 0.00 0.00 55.73 53.40 1ulm s ARG 144 Cb 0.19 -2.74 0.09 0.00 -0.45 0.00 0.00 34.95 32.04 1ulm s ARG 144 CO 0.28 0.09 1.11 0.00 -0.68 0.00 0.00 175.30 176.09 1ulm n GLY 146 N -0.52 -2.15 0.26 0.00 0.00 -0.90 -4.40 105.19 97.50 1ulm n GLY 146 Ca -0.06 -1.94 0.03 0.00 0.00 0.00 0.00 46.02 44.05 1ulm n GLY 146 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1ulm h ARG 147 N 0.00 0.45 0.00 1.61 0.11 -1.90 0.26 114.38 114.90 1ulm h ARG 147 Ca 0.00 -0.03 0.00 0.00 0.10 0.00 0.00 59.98 60.05 1ulm h ARG 147 Cb 0.00 -0.10 0.00 0.00 1.11 0.00 0.00 29.97 30.98 1ulm h ARG 147 CO 0.00 0.30 0.00 -0.25 0.10 0.00 0.00 179.97 180.12 1ulm n ASP 148 N -4.98 0.00 -2.81 0.08 8.00 -1.26 -3.09 116.55 112.50 1ulm n ASP 148 Ca 0.12 -0.21 -0.13 0.00 0.71 0.00 0.00 54.79 55.27 1ulm n ASP 148 Cb 0.35 -0.08 0.01 0.00 -0.02 0.00 0.00 41.12 41.38 1ulm n ASP 148 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1ulm n PHE 149 N -1.08 1.13 -2.26 1.24 3.01 -0.00 -4.95 117.46 114.56 1ulm n PHE 149 Ca 0.07 -3.14 -0.18 0.00 1.01 0.00 0.00 57.45 55.21 1ulm n PHE 149 Cb 0.05 -0.37 -0.02 0.00 -0.01 0.00 0.00 39.48 39.13 1ulm n PHE 149 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ulm n GLY 150 N -0.00 -0.11 2.41 1.37 0.00 -1.18 -1.28 105.19 106.40 1ulm n GLY 150 Ca 0.16 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.00 1ulm n GLY 150 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ulm n GLY 151 N -0.85 -0.01 3.76 -0.02 0.00 0.69 -4.90 105.19 103.87 1ulm n GLY 151 Ca -0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.42 1ulm n GLY 151 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ulm s ARG 152 N -4.72 3.45 0.09 1.61 3.52 -0.41 -4.62 118.95 117.88 1ulm s ARG 152 Ca 0.00 2.33 -0.07 0.00 -0.13 0.00 0.00 55.73 57.86 1ulm s ARG 152 Cb 0.00 -2.48 -0.05 0.00 -1.56 0.00 0.00 34.95 30.85 1ulm s ARG 152 CO 0.00 -0.97 0.37 -0.51 -0.81 0.00 0.00 175.30 173.37 1ulm s LEU 153 N -3.07 4.32 0.47 -0.88 1.43 -1.26 -2.11 118.68 117.59 1ulm s LEU 153 Ca 0.65 0.68 -0.22 0.00 -1.03 0.00 0.00 54.13 54.21 1ulm s LEU 153 Cb -0.42 -3.03 -0.07 0.00 0.03 0.00 0.00 46.19 42.69 1ulm s LEU 153 CO 0.52 0.15 1.12 0.00 0.23 0.00 0.00 176.35 178.37 1ulm s GLU 155 N -2.86 1.74 -1.32 0.00 0.41 -1.26 -3.99 118.70 111.41 1ulm s GLU 155 Ca 0.65 -0.11 -0.02 0.00 -0.41 0.00 0.00 54.97 55.08 1ulm s GLU 155 Cb -0.25 -1.99 0.01 0.00 -1.78 0.00 0.00 34.13 30.13 1ulm s GLU 155 CO 0.30 -1.68 0.17 0.39 -0.49 0.00 0.00 175.26 173.95 1ulm n GLU 156 N -3.31 -2.71 -4.24 1.61 1.02 -1.26 -1.73 120.64 110.02 1ulm n GLU 156 Ca 0.10 0.71 -0.37 0.00 -0.02 0.00 0.00 57.16 57.58 1ulm n GLU 156 Cb 0.61 -5.38 -0.03 0.00 -0.02 0.00 0.00 31.44 26.62 1ulm n GLU 156 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1ulm n ASP 157 N -2.04 -3.32 -4.87 1.62 9.92 -1.26 -4.93 116.55 111.68 1ulm n ASP 157 Ca -0.14 -1.01 -0.31 0.00 -0.53 0.00 0.00 54.79 52.79 1ulm n ASP 157 Cb 0.62 -2.72 -0.04 0.00 -0.64 0.00 0.00 41.12 38.33 1ulm n ASP 157 CO 0.00 0.00 0.00 -0.04 0.13 0.00 0.00 177.20 177.29 1ulm s MET 158 N -6.94 3.86 0.40 -1.24 -1.94 -0.71 -5.03 119.30 107.71 1ulm s MET 158 Ca 0.76 0.54 -0.23 0.00 -1.71 0.00 0.00 55.69 55.04 1ulm s MET 158 Cb -0.41 -2.42 -0.10 0.00 2.01 0.00 0.00 34.83 33.91 1ulm s MET 158 CO 0.93 0.05 0.97 0.00 -0.01 0.00 0.00 175.02 176.96 1ulm s SER 161 N 1.83 2.01 0.50 0.00 1.04 0.14 -0.37 113.70 118.86 1ulm s SER 161 Ca 0.04 1.57 0.34 0.00 0.48 0.00 0.00 55.95 58.38 1ulm s SER 161 Cb -0.20 -2.25 1.65 0.00 0.10 0.00 0.00 66.02 65.32 1ulm s SER 161 CO 0.08 -3.57 2.02 0.50 0.98 0.00 0.00 173.24 173.25 1ulm h LYS 162 N -2.19 0.00 -0.18 4.02 3.11 -1.79 -0.98 116.57 118.56 1ulm h LYS 162 Ca -0.55 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.29 1ulm h LYS 162 Cb 1.31 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.54 1ulm h LYS 162 CO 0.51 0.00 0.00 0.66 -2.81 0.00 0.00 179.45 177.81 1ulm n TYR 163 N -2.79 0.21 -1.83 1.91 4.01 -1.26 -4.95 117.16 112.47 1ulm n TYR 163 Ca -0.01 -0.11 0.00 0.00 -0.16 0.00 0.00 57.90 57.63 1ulm n TYR 163 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.19 1ulm n TYR 163 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ulm n GLY 164 N 1.31 0.45 3.37 2.72 0.00 -0.37 -4.99 105.19 107.66 1ulm n GLY 164 Ca 0.17 -0.86 -0.31 0.00 0.00 0.00 0.00 46.02 45.02 1ulm n GLY 164 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1ulm s TRP 165 N -2.00 2.44 0.06 1.61 0.52 -1.26 -1.95 118.94 118.36 1ulm s TRP 165 Ca 0.00 -0.35 -0.22 0.00 0.02 0.00 0.00 56.10 55.55 1ulm s TRP 165 Cb 0.00 -1.51 -0.06 0.00 -1.15 0.00 0.00 33.47 30.75 1ulm s TRP 165 CO 0.00 0.07 0.65 0.00 0.02 0.00 0.00 176.95 177.70 1ulm s GLY 167 N -0.60 0.12 -0.02 0.00 0.00 -0.89 -4.97 107.32 100.96 1ulm s GLY 167 Ca 0.33 -0.36 0.06 0.00 0.00 0.00 0.00 44.72 44.76 1ulm s GLY 167 CO 0.20 2.02 0.12 -1.72 0.00 0.00 0.00 173.10 173.73 1ulm n TYR 168 N -0.67 0.00 -0.94 1.90 4.01 -1.26 -1.27 117.16 118.92 1ulm n TYR 168 Ca -0.04 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.39 1ulm n TYR 168 Cb 0.60 -0.18 0.14 0.00 -0.31 0.00 0.00 39.34 39.58 1ulm n TYR 168 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 1ulm s SER 169 N -2.95 3.50 0.48 7.72 1.04 -1.26 -4.78 113.70 117.44 1ulm s SER 169 Ca -0.03 2.12 0.32 0.00 0.48 0.00 0.00 55.95 58.85 1ulm s SER 169 Cb 0.04 -2.56 1.63 0.00 0.10 0.00 0.00 66.02 65.23 1ulm s SER 169 CO 0.27 -2.72 1.98 0.44 0.98 0.00 0.00 173.24 174.20 1ulm h ASP 170 N -1.46 0.00 0.98 7.02 3.45 -1.96 -0.38 116.42 124.07 1ulm h ASP 170 Ca -0.44 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.02 1ulm h ASP 170 Cb 1.26 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.03 1ulm h ASP 170 CO 0.45 0.00 0.00 0.44 -1.57 0.00 0.00 179.24 178.56 1ulm h ASP 171 N 0.00 0.00 0.00 6.45 5.19 -1.90 0.30 116.42 126.47 1ulm h ASP 171 Ca 0.00 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 56.38 1ulm h ASP 171 Cb 0.15 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.66 1ulm h ASP 171 CO 0.00 0.00 -1.84 1.41 -3.12 0.00 0.00 179.24 175.69 1ulm n HIS 172 N -2.54 0.00 0.95 4.55 8.25 -0.20 -4.50 115.22 121.74 1ulm n HIS 172 Ca 0.02 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.58 1ulm n HIS 172 Cb 0.29 -0.45 -0.09 0.00 1.12 0.00 0.00 29.99 30.87 1ulm n HIS 172 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ulm s GLU 174 N -2.79 0.81 -0.51 0.00 2.02 0.10 -4.71 118.70 113.62 1ulm s GLU 174 Ca 0.10 -1.26 -0.05 0.00 0.02 0.00 0.00 54.97 53.77 1ulm s GLU 174 Cb 0.16 -0.24 0.01 0.00 0.10 0.00 0.00 34.13 34.15 1ulm s GLU 174 CO 0.77 -0.00 0.55 -0.25 0.02 0.00 0.00 175.26 176.34 1ulm n ASP 175 N 0.15 -6.88 0.00 -0.19 10.43 -1.26 -4.26 116.55 114.54 1ulm n ASP 175 Ca -0.13 0.15 0.00 0.00 2.57 0.00 0.00 54.79 57.37 1ulm n ASP 175 Cb 0.60 -4.62 0.00 0.00 1.84 0.00 0.00 41.12 38.94 1ulm n ASP 175 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1ulm n GLY 176 N -1.11 0.70 3.67 0.44 0.00 -1.26 -4.59 105.19 103.04 1ulm n GLY 176 Ca 0.04 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.60 1ulm n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ulm h GLN 178 N 6.08 0.05 -2.30 0.00 4.20 -0.90 -3.47 115.11 118.77 1ulm h GLN 178 Ca -0.45 -0.09 0.02 0.00 0.06 0.00 0.00 58.65 58.20 1ulm h GLN 178 Cb 1.25 0.03 -0.17 0.00 0.30 0.00 0.00 27.48 28.90 1ulm h GLN 178 CO 0.89 0.83 0.34 -1.54 -0.67 0.00 0.00 178.83 178.68 1ulm s SER 179 N -6.53 -0.50 -0.99 1.46 1.04 -1.25 -5.00 113.70 101.93 1ulm s SER 179 Ca -0.03 0.24 -0.13 0.00 0.48 0.00 0.00 55.95 56.51 1ulm s SER 179 Cb 0.09 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.68 1ulm s SER 179 CO 0.83 -0.67 0.71 0.00 0.98 0.00 0.00 173.24 175.09 1ulm n GLN 180 N 0.16 -1.20 -0.13 4.02 6.02 -1.26 -2.16 117.38 122.83 1ulm n GLN 180 Ca -0.14 0.67 0.11 0.00 -0.01 0.00 0.00 57.00 57.63 1ulm n GLN 180 Cb 0.61 -3.69 0.17 0.00 1.02 0.00 0.00 30.24 28.35 1ulm n GLN 180 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05