#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2of5 n ILE 110 N 0.00 1.11 0.22 0.61 3.06 -1.26 -4.43 119.36 118.66 2of5 n ILE 110 Ca 0.00 -1.06 0.11 0.00 -2.50 0.00 0.00 62.75 59.30 2of5 n ILE 110 Cb 0.00 0.44 0.33 0.00 0.54 0.00 0.00 39.64 40.95 2of5 n ILE 110 CO 0.00 0.00 0.00 -0.07 -2.50 0.00 0.00 176.55 173.98 2of5 h LEU 111 N 2.40 0.00 -5.44 9.51 3.38 -2.02 -3.29 115.31 119.86 2of5 h LEU 111 Ca 0.00 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.34 2of5 h LEU 111 Cb 0.84 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 41.20 2of5 h LEU 111 CO 0.02 0.14 -0.33 0.59 0.09 0.00 0.00 178.44 178.96 2of5 n ASN 112 N -3.19 5.04 -3.46 -0.43 4.13 -1.26 -1.30 115.26 114.79 2of5 n ASN 112 Ca 0.02 -3.69 0.01 0.00 1.68 0.00 0.00 54.58 52.60 2of5 n ASN 112 Cb 0.49 -0.67 -0.03 0.00 -1.54 0.00 0.00 39.78 38.03 2of5 n ASN 112 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 2of5 s SER 113 N -3.08 -1.06 0.86 6.41 0.15 -1.24 -4.97 113.70 110.77 2of5 s SER 113 Ca 0.47 1.20 -0.11 0.00 0.70 0.00 0.00 55.95 58.21 2of5 s SER 113 Cb 0.27 2.10 0.12 0.00 -1.71 0.00 0.00 66.02 66.80 2of5 s SER 113 CO -0.14 -0.20 1.15 -0.94 1.20 0.00 0.00 173.24 174.31 2of5 s SER 114 N 2.81 3.33 0.88 5.45 1.04 -1.26 -3.82 113.70 122.13 2of5 s SER 114 Ca 0.01 2.17 0.00 0.00 0.48 0.00 0.00 55.95 58.62 2of5 s SER 114 Cb -0.11 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.44 2of5 s SER 114 CO -0.19 -2.83 0.00 -0.81 0.98 0.00 0.00 173.24 170.39 2of5 n PRO 115 N -3.89 0.13 -0.88 4.02 -0.04 -1.26 -4.93 135.00 128.15 2of5 n PRO 115 Ca 0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 2of5 n PRO 115 Cb 0.52 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.98 2of5 n PRO 115 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2of5 n SER 116 N -2.92 0.34 0.26 3.54 3.41 -1.26 -4.92 113.62 112.07 2of5 n SER 116 Ca 0.00 -0.44 0.18 0.00 -0.26 0.00 0.00 58.87 58.35 2of5 n SER 116 Cb 0.00 0.00 0.83 0.00 -0.26 0.00 0.00 64.21 64.78 2of5 n SER 116 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2of5 h ASP 117 N 0.00 0.00 0.00 4.04 3.32 -2.00 0.45 116.42 122.22 2of5 h ASP 117 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 2of5 h ASP 117 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 2of5 h ASP 117 CO 0.00 0.00 -1.65 -1.14 -1.72 0.00 0.00 179.24 174.73 2of5 n ARG 118 N -2.85 0.53 -0.04 3.56 0.63 -1.26 -4.09 116.66 113.15 2of5 n ARG 118 Ca -0.01 -0.12 -0.16 0.00 -0.92 0.00 0.00 57.85 56.64 2of5 n ARG 118 Cb 0.18 -1.33 -0.13 0.00 0.45 0.00 0.00 32.46 31.63 2of5 n ARG 118 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 2of5 h GLN 119 N 0.00 0.09 0.00 -0.14 1.08 -1.82 -3.18 115.11 111.14 2of5 h GLN 119 Ca -0.03 -0.16 -0.03 0.00 -1.45 0.00 0.00 58.65 56.99 2of5 h GLN 119 Cb 0.72 0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 28.20 2of5 h GLN 119 CO 0.00 1.08 -0.12 0.82 -0.95 0.00 0.00 178.83 179.66 2of5 h ILE 120 N -0.80 0.54 -0.00 2.54 2.04 -0.35 -1.77 117.51 119.70 2of5 h ILE 120 Ca -0.07 -0.56 0.00 0.00 1.00 0.00 0.00 64.86 65.23 2of5 h ILE 120 Cb 1.22 1.37 0.00 0.00 -0.74 0.00 0.00 36.82 38.67 2of5 h ILE 120 CO 0.03 0.12 -0.27 -3.20 0.00 0.00 0.00 178.15 174.83 2of5 n ASN 121 N -3.60 0.41 -0.04 1.72 5.15 -1.25 -2.39 115.26 115.26 2of5 n ASN 121 Ca -0.02 -0.17 -0.16 0.00 -0.60 0.00 0.00 54.58 53.64 2of5 n ASN 121 Cb 0.25 -0.02 -0.14 0.00 -0.53 0.00 0.00 39.78 39.34 2of5 n ASN 121 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2of5 n GLN 122 N -1.32 0.69 0.11 1.20 6.02 -0.71 -3.66 117.38 119.72 2of5 n GLN 122 Ca 0.08 0.21 -0.02 0.00 -0.01 0.00 0.00 57.00 57.26 2of5 n GLN 122 Cb 0.33 -1.66 0.06 0.00 1.02 0.00 0.00 30.24 29.99 2of5 n GLN 122 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 2of5 h LEU 123 N 0.03 0.00 -0.76 1.08 5.85 -1.52 -3.20 115.31 116.78 2of5 h LEU 123 Ca -0.44 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.15 2of5 h LEU 123 Cb 2.03 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 43.04 2of5 h LEU 123 CO 0.04 0.73 -0.62 0.00 -0.34 0.00 0.00 178.44 178.25 2of5 h ALA 124 N 1.27 0.98 0.32 1.25 0.00 -1.63 -3.14 119.26 118.31 2of5 h ALA 124 Ca -0.01 -0.56 -0.02 0.00 0.00 0.00 0.00 54.91 54.32 2of5 h ALA 124 Cb 1.36 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2of5 h ALA 124 CO 0.09 0.77 -0.15 1.96 0.00 0.00 0.00 179.25 181.92 2of5 h GLN 125 N 0.00 -0.42 -0.98 0.00 4.20 -1.62 -3.34 115.11 112.96 2of5 h GLN 125 Ca -0.01 0.03 0.14 0.00 0.06 0.00 0.00 58.65 58.87 2of5 h GLN 125 Cb 1.10 0.09 -0.09 0.00 0.30 0.00 0.00 27.48 28.89 2of5 h GLN 125 CO 0.08 -0.28 0.62 0.00 -0.67 0.00 0.00 178.83 178.58 2of5 h ARG 126 N -0.62 0.84 -6.18 1.46 3.08 -1.69 -3.42 114.38 107.85 2of5 h ARG 126 Ca -0.04 -0.05 -0.65 0.00 0.07 0.00 0.00 59.98 59.30 2of5 h ARG 126 Cb 0.33 -0.19 0.01 0.00 0.08 0.00 0.00 29.97 30.20 2of5 h ARG 126 CO 0.07 0.55 1.13 1.28 -1.07 0.00 0.00 179.97 181.94 2of5 n LEU 127 N -4.63 2.97 0.00 3.04 4.77 -1.19 -4.96 117.00 117.00 2of5 n LEU 127 Ca 0.20 0.86 0.00 0.00 -0.03 0.00 0.00 56.01 57.04 2of5 n LEU 127 Cb 0.44 -1.31 0.00 0.00 -2.33 0.00 0.00 43.42 40.22 2of5 n LEU 127 CO 0.27 -0.29 0.00 0.61 -1.33 0.00 0.00 177.39 176.65 2of5 n GLY 128 N 4.81 -2.35 0.00 -0.72 0.00 -1.26 -4.74 105.19 100.92 2of5 n GLY 128 Ca 0.27 -1.14 0.02 0.00 0.00 0.00 0.00 46.02 45.17 2of5 n GLY 128 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2of5 n PRO 129 N 0.00 0.53 -1.02 1.61 -0.04 -1.26 -3.42 135.00 131.40 2of5 n PRO 129 Ca 0.00 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.30 2of5 n PRO 129 Cb 0.00 -1.12 0.20 0.00 -0.04 0.00 0.00 33.50 32.53 2of5 n PRO 129 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2of5 n GLU 130 N -0.62 2.55 0.00 0.54 -0.00 -1.26 -4.37 120.64 117.47 2of5 n GLU 130 Ca 0.03 -2.65 0.14 0.00 -0.00 0.00 0.00 57.16 54.68 2of5 n GLU 130 Cb 0.01 -2.06 0.68 0.00 -0.00 0.00 0.00 31.44 30.08 2of5 n GLU 130 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.13 174.46 2of5 n TRP 131 N -0.65 0.00 -0.10 -1.84 4.27 -1.22 -1.45 117.44 116.44 2of5 n TRP 131 Ca 0.47 0.00 -0.24 0.00 -3.89 0.00 0.00 57.50 53.84 2of5 n TRP 131 Cb 1.44 -0.39 -0.11 0.00 -1.36 0.00 0.00 31.31 30.89 2of5 n TRP 131 CO 0.00 0.00 0.00 0.39 -2.29 0.00 0.00 177.69 175.79 2of5 n GLU 132 N -1.39 0.62 0.23 -2.67 1.02 -1.26 -4.03 120.64 113.15 2of5 n GLU 132 Ca 0.11 0.35 0.13 0.00 -0.02 0.00 0.00 57.16 57.73 2of5 n GLU 132 Cb 0.28 -1.61 0.31 0.00 -0.02 0.00 0.00 31.44 30.40 2of5 n GLU 132 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 2of5 h PRO 133 N -0.69 0.00 -0.08 3.49 0.11 -1.86 -3.24 132.00 129.73 2of5 h PRO 133 Ca -0.53 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.37 2of5 h PRO 133 Cb 1.62 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.74 2of5 h PRO 133 CO -0.23 0.00 -0.77 1.98 -0.21 0.00 0.00 178.00 178.78 2of5 h MET 134 N 0.00 0.66 0.00 1.05 4.05 -1.45 -3.07 114.93 116.16 2of5 h MET 134 Ca 0.00 -0.60 0.00 0.00 -0.28 0.00 0.00 59.70 58.82 2of5 h MET 134 Cb 0.86 0.15 0.00 0.00 -0.80 0.00 0.00 31.60 31.81 2of5 h MET 134 CO 0.00 1.21 0.00 1.33 0.23 0.00 0.00 176.91 179.68 2of5 n VAL 135 N -4.02 0.16 0.39 -5.77 0.24 -1.23 -3.13 118.33 104.97 2of5 n VAL 135 Ca -0.09 0.04 0.03 0.00 -2.04 0.00 0.00 64.34 62.28 2of5 n VAL 135 Cb 0.74 -0.65 0.15 0.00 -1.47 0.00 0.00 33.84 32.61 2of5 n VAL 135 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2of5 n LEU 136 N -1.18 2.61 0.00 1.34 4.77 -1.16 -1.92 117.00 121.46 2of5 n LEU 136 Ca 0.14 -1.32 0.00 0.00 -0.03 0.00 0.00 56.01 54.80 2of5 n LEU 136 Cb 0.15 -0.53 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 2of5 n LEU 136 CO 0.16 0.39 0.00 -1.54 -1.33 0.00 0.00 177.39 175.07 2of5 n SER 137 N 0.24 0.00 0.07 -1.43 3.41 -1.18 -4.88 113.62 109.85 2of5 n SER 137 Ca 0.10 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.59 2of5 n SER 137 Cb 0.56 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.38 2of5 n SER 137 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2of5 h LEU 138 N 0.00 0.23 0.00 1.04 3.38 -1.60 -3.47 115.31 114.88 2of5 h LEU 138 Ca 0.00 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2of5 h LEU 138 Cb 0.00 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.68 2of5 h LEU 138 CO 0.00 1.22 0.00 0.61 0.09 0.00 0.00 178.44 180.36 2of5 n GLY 139 N 1.49 -0.43 3.75 0.83 0.00 -1.22 -5.01 105.19 104.60 2of5 n GLY 139 Ca -0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.58 2of5 n GLY 139 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2of5 s LEU 140 N 0.00 4.26 0.00 0.99 1.43 -0.81 -5.08 118.68 119.47 2of5 s LEU 140 Ca 0.00 0.46 0.00 0.00 -1.03 0.00 0.00 54.13 53.56 2of5 s LEU 140 Cb 0.00 -2.29 0.00 0.00 0.03 0.00 0.00 46.19 43.93 2of5 s LEU 140 CO 0.00 0.15 0.00 -1.54 0.23 0.00 0.00 176.35 175.19 2of5 n SER 141 N 3.35 0.00 -0.04 2.29 3.41 -1.26 -4.11 113.62 117.26 2of5 n SER 141 Ca -0.14 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.48 2of5 n SER 141 Cb 0.52 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.37 2of5 n SER 141 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2of5 n GLN 142 N 0.00 1.18 -0.01 4.33 1.13 -1.26 -4.09 117.38 118.66 2of5 n GLN 142 Ca 0.00 -0.06 0.13 0.00 -1.94 0.00 0.00 57.00 55.13 2of5 n GLN 142 Cb 0.00 -1.33 0.66 0.00 0.11 0.00 0.00 30.24 29.68 2of5 n GLN 142 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 2of5 n THR 143 N -2.23 0.03 -0.13 5.09 -1.04 -1.26 -3.12 114.28 111.63 2of5 n THR 143 Ca -0.12 -0.13 -0.27 0.00 -2.04 0.00 0.00 64.05 61.49 2of5 n THR 143 Cb 0.64 -0.01 -0.09 0.00 -1.82 0.00 0.00 70.33 69.05 2of5 n THR 143 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2of5 n ASP 144 N -0.39 1.88 0.00 8.00 8.00 -1.26 -4.13 116.55 128.66 2of5 n ASP 144 Ca 0.20 0.33 -0.10 0.00 0.71 0.00 0.00 54.79 55.92 2of5 n ASP 144 Cb 0.21 -0.78 0.04 0.00 -0.02 0.00 0.00 41.12 40.58 2of5 n ASP 144 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 2of5 h ILE 145 N -0.96 1.32 -0.03 0.53 2.04 -1.71 -2.76 117.51 115.95 2of5 h ILE 145 Ca -0.61 -1.82 0.00 0.00 1.00 0.00 0.00 64.86 63.44 2of5 h ILE 145 Cb 1.52 1.78 0.00 0.00 -0.74 0.00 0.00 36.82 39.39 2of5 h ILE 145 CO -0.37 0.57 0.00 -1.22 0.00 0.00 0.00 178.15 177.13 2of5 n TYR 146 N -3.95 0.03 0.71 1.37 4.01 -1.18 -1.62 117.16 116.52 2of5 n TYR 146 Ca -0.03 -0.02 0.08 0.00 -0.16 0.00 0.00 57.90 57.77 2of5 n TYR 146 Cb 0.61 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.66 2of5 n TYR 146 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2of5 n ARG 147 N -0.61 1.58 -0.06 -0.72 5.12 -1.05 -3.89 116.66 117.04 2of5 n ARG 147 Ca 0.15 -1.02 -0.08 0.00 -1.93 0.00 0.00 57.85 54.97 2of5 n ARG 147 Cb 0.11 -1.29 -0.06 0.00 -1.16 0.00 0.00 32.46 30.06 2of5 n ARG 147 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2of5 h LYS 149 N 0.00 0.00 0.20 0.00 1.57 -1.51 -2.89 116.57 113.95 2of5 h LYS 149 Ca -0.27 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.50 2of5 h LYS 149 Cb 1.47 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.78 2of5 h LYS 149 CO -0.03 0.21 -0.10 0.00 -0.57 0.00 0.00 179.45 178.96 2of5 h ALA 150 N 1.79 -0.27 -1.10 3.86 0.00 -1.77 -2.96 119.26 118.80 2of5 h ALA 150 Ca -0.00 -0.07 0.30 0.00 0.00 0.00 0.00 54.91 55.14 2of5 h ALA 150 Cb 0.40 0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.21 2of5 h ALA 150 CO 0.03 -0.25 0.74 -0.91 0.00 0.00 0.00 179.25 178.85 2of5 h ASN 151 N -1.07 0.28 -3.34 0.00 2.35 -1.65 -3.15 115.58 109.00 2of5 h ASN 151 Ca -0.03 0.06 -0.60 0.00 -0.55 0.00 0.00 56.30 55.18 2of5 h ASN 151 Cb 0.22 0.02 -0.40 0.00 0.05 0.00 0.00 38.32 38.21 2of5 h ASN 151 CO 0.05 0.04 -0.76 -1.00 -1.65 0.00 0.00 177.43 174.11 2of5 s HIS 152 N -5.29 1.77 0.10 1.19 3.76 -1.09 -5.01 115.29 110.71 2of5 s HIS 152 Ca -0.07 -2.25 -0.23 0.00 -0.15 0.00 0.00 55.06 52.35 2of5 s HIS 152 Cb 0.25 -1.73 -0.13 0.00 1.11 0.00 0.00 32.58 32.08 2of5 s HIS 152 CO 0.80 -0.80 1.72 -1.00 -0.85 0.00 0.00 174.74 174.62 2of5 h PRO 153 N 6.87 -0.06 -6.71 8.40 0.13 -1.48 -3.42 132.00 135.73 2of5 h PRO 153 Ca -0.01 0.00 -0.44 0.00 -0.87 0.00 0.00 66.00 64.68 2of5 h PRO 153 Cb 0.94 0.01 0.04 0.00 0.13 0.00 0.00 31.00 32.12 2of5 h PRO 153 CO 0.45 -0.04 -0.10 -1.01 -0.23 0.00 0.00 178.00 177.07 2of5 s HIS 154 N -6.18 2.48 -0.32 1.56 3.76 -1.26 -4.79 115.29 110.53 2of5 s HIS 154 Ca -0.13 -0.27 -0.05 0.00 -0.15 0.00 0.00 55.06 54.45 2of5 s HIS 154 Cb 0.07 -2.59 0.01 0.00 1.11 0.00 0.00 32.58 31.18 2of5 s HIS 154 CO 0.66 -0.87 0.37 -1.71 -0.85 0.00 0.00 174.74 172.34 2of5 n ASN 155 N -2.23 -5.39 -0.08 1.40 5.15 -1.26 -4.82 115.26 108.04 2of5 n ASN 155 Ca 0.10 0.16 0.00 0.00 -0.60 0.00 0.00 54.58 54.24 2of5 n ASN 155 Cb 0.60 -3.51 0.00 0.00 -0.53 0.00 0.00 39.78 36.34 2of5 n ASN 155 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 2of5 n VAL 156 N -0.83 0.00 -0.06 3.44 0.31 -1.26 -3.01 118.33 116.92 2of5 n VAL 156 Ca 0.04 0.00 -0.04 0.00 -0.01 0.00 0.00 64.34 64.33 2of5 n VAL 156 Cb 0.36 -0.34 -0.01 0.00 -0.91 0.00 0.00 33.84 32.94 2of5 n VAL 156 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 2of5 h GLN 157 N 0.11 0.00 0.00 5.55 5.75 -1.93 -3.38 115.11 121.21 2of5 h GLN 157 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2of5 h GLN 157 Cb 0.02 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.57 2of5 h GLN 157 CO 0.00 0.00 0.00 0.43 -2.65 0.00 0.00 178.83 176.61 2of5 n SER 158 N -4.36 0.00 0.12 -0.69 7.64 -1.17 -1.94 113.62 113.23 2of5 n SER 158 Ca -0.06 -0.23 -0.23 0.00 1.01 0.00 0.00 58.87 59.36 2of5 n SER 158 Cb 0.21 -0.10 -0.15 0.00 -1.01 0.00 0.00 64.21 63.15 2of5 n SER 158 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 2of5 h GLN 159 N 0.00 0.48 -0.06 1.43 4.20 -1.75 -2.86 115.11 116.54 2of5 h GLN 159 Ca 0.00 -0.82 -0.19 0.00 0.06 0.00 0.00 58.65 57.70 2of5 h GLN 159 Cb 0.04 0.30 -0.00 0.00 0.30 0.00 0.00 27.48 28.12 2of5 h GLN 159 CO 0.00 1.39 -0.76 0.28 -0.67 0.00 0.00 178.83 179.06 2of5 h VAL 160 N 0.13 1.39 0.00 -0.54 2.07 -1.56 -3.18 116.25 114.55 2of5 h VAL 160 Ca -0.27 -2.20 -0.03 0.00 0.82 0.00 0.00 66.70 65.02 2of5 h VAL 160 Cb 2.14 2.17 -0.00 0.00 -1.52 0.00 0.00 31.29 34.07 2of5 h VAL 160 CO 0.24 0.66 -0.14 0.58 0.02 0.00 0.00 177.57 178.94 2of5 h VAL 161 N 0.27 0.40 -0.01 2.57 2.07 -1.51 -2.65 116.25 117.38 2of5 h VAL 161 Ca -0.04 -0.79 0.00 0.00 0.82 0.00 0.00 66.70 66.70 2of5 h VAL 161 Cb 1.35 1.57 0.00 0.00 -1.52 0.00 0.00 31.29 32.69 2of5 h VAL 161 CO 0.13 0.13 -0.39 1.21 0.02 0.00 0.00 177.57 178.67 2of5 n GLU 162 N -3.36 0.71 0.10 1.57 2.13 -1.08 -3.83 120.64 116.88 2of5 n GLU 162 Ca -0.00 -0.47 -0.23 0.00 0.66 0.00 0.00 57.16 57.11 2of5 n GLU 162 Cb 0.34 -1.49 -0.15 0.00 0.27 0.00 0.00 31.44 30.41 2of5 n GLU 162 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2of5 h ALA 163 N 3.56 -0.01 0.00 4.31 0.00 -1.48 -3.29 119.26 122.35 2of5 h ALA 163 Ca 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 54.91 53.94 2of5 h ALA 163 Cb 0.55 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2of5 h ALA 163 CO 0.00 0.80 0.00 1.19 0.00 0.00 0.00 179.25 181.24 2of5 n PHE 164 N -3.74 0.89 0.24 0.00 3.72 -1.22 -1.92 117.46 115.42 2of5 n PHE 164 Ca -0.20 0.27 0.12 0.00 -0.05 0.00 0.00 57.45 57.59 2of5 n PHE 164 Cb 1.05 -0.94 0.52 0.00 -0.94 0.00 0.00 39.48 39.16 2of5 n PHE 164 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 2of5 h ILE 165 N 0.00 0.37 -0.17 4.37 1.08 -1.66 0.53 117.51 122.03 2of5 h ILE 165 Ca 0.00 -0.93 0.00 0.00 -0.39 0.00 0.00 64.86 63.54 2of5 h ILE 165 Cb 0.67 1.70 0.00 0.00 -3.07 0.00 0.00 36.82 36.11 2of5 h ILE 165 CO 0.00 0.15 0.00 0.54 -0.69 0.00 0.00 178.15 178.15 2of5 n ARG 166 N -3.30 1.61 0.00 2.37 5.12 -0.81 -3.09 116.66 118.56 2of5 n ARG 166 Ca 0.00 -0.92 0.12 0.00 -1.93 0.00 0.00 57.85 55.12 2of5 n ARG 166 Cb 0.40 -1.34 0.08 0.00 -1.16 0.00 0.00 32.46 30.44 2of5 n ARG 166 CO 0.00 0.00 0.00 1.87 -1.93 0.00 0.00 177.63 177.57 2of5 n TRP 167 N 0.17 0.00 -0.67 -1.55 -0.00 0.18 -3.83 117.44 111.73 2of5 n TRP 167 Ca 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.64 2of5 n TRP 167 Cb 0.27 -0.01 0.00 0.00 -0.00 0.00 0.00 31.31 31.57 2of5 n TRP 167 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 2of5 n ARG 168 N 0.43 0.99 0.00 5.87 1.74 -1.18 -1.90 116.66 122.61 2of5 n ARG 168 Ca 0.12 -0.83 0.00 0.00 -0.77 0.00 0.00 57.85 56.36 2of5 n ARG 168 Cb 0.50 -0.67 0.00 0.00 -1.02 0.00 0.00 32.46 31.28 2of5 n ARG 168 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2of5 n GLN 169 N -0.17 4.16 0.00 5.56 10.64 -1.23 -4.80 117.38 131.55 2of5 n GLN 169 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 2of5 n GLN 169 Cb 0.42 -0.37 0.00 0.00 -0.86 0.00 0.00 30.24 29.43 2of5 n GLN 169 CO 0.00 0.00 0.00 -2.13 -1.83 0.00 0.00 177.06 173.10 2of5 n ARG 170 N -0.66 2.28 0.00 2.61 0.00 -1.25 -5.05 116.66 114.59 2of5 n ARG 170 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2of5 n ARG 170 Cb 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 32.46 31.74 2of5 n ARG 170 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 2of5 n PHE 171 N -0.99 0.00 0.00 -0.14 0.99 -1.25 -4.98 117.46 111.08 2of5 n PHE 171 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 2of5 n PHE 171 Cb 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.63 2of5 n PHE 171 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2of5 n GLY 172 N 4.92 2.61 0.00 1.37 0.00 -0.80 -4.87 105.19 108.42 2of5 n GLY 172 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.37 2of5 n GLY 172 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2of5 n LYS 173 N 0.00 0.00 -0.24 1.61 4.76 -1.26 -4.31 118.16 118.72 2of5 n LYS 173 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2of5 n LYS 173 Cb 0.00 -0.03 0.00 0.00 -1.84 0.00 0.00 35.03 33.16 2of5 n LYS 173 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 2of5 n GLN 174 N -0.04 0.69 -3.06 1.97 3.00 -1.26 -4.06 117.38 114.62 2of5 n GLN 174 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 56.88 2of5 n GLN 174 Cb 0.00 -1.16 -0.03 0.00 0.00 0.00 0.00 30.24 29.05 2of5 n GLN 174 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2of5 s ALA 175 N 0.53 -1.02 0.00 -1.58 0.00 -1.26 -4.71 121.76 113.72 2of5 s ALA 175 Ca 0.00 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 51.03 2of5 s ALA 175 Cb 0.00 -2.34 0.00 0.00 0.00 0.00 0.00 23.12 20.78 2of5 s ALA 175 CO 0.00 -2.16 0.00 0.25 0.00 0.00 0.00 175.76 173.85 2of5 n THR 176 N 3.30 0.00 0.00 0.00 -2.24 -1.26 -4.02 114.28 110.06 2of5 n THR 176 Ca 0.19 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.97 2of5 n THR 176 Cb 0.52 -0.05 0.00 0.00 -2.10 0.00 0.00 70.33 68.70 2of5 n THR 176 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2of5 n PHE 177 N -0.21 0.00 0.02 4.78 -0.00 -1.25 -4.01 117.46 116.79 2of5 n PHE 177 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 57.45 57.38 2of5 n PHE 177 Cb 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 39.48 39.36 2of5 n PHE 177 CO 0.00 0.00 0.00 0.37 -0.00 0.00 0.00 176.76 177.13 2of5 h GLN 178 N 0.00 0.00 -0.26 -4.13 5.75 -1.52 -3.22 115.11 111.73 2of5 h GLN 178 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2of5 h GLN 178 Cb 0.00 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.55 2of5 h GLN 178 CO 0.00 0.67 0.00 -1.13 -2.65 0.00 0.00 178.83 175.72 2of5 n SER 179 N -3.15 1.39 -0.13 -0.69 3.41 -1.26 -3.13 113.62 110.06 2of5 n SER 179 Ca -0.10 -1.99 0.11 0.00 -0.26 0.00 0.00 58.87 56.63 2of5 n SER 179 Cb 0.99 -0.17 0.04 0.00 -0.26 0.00 0.00 64.21 64.81 2of5 n SER 179 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 2of5 n LEU 180 N 0.26 1.10 -0.02 1.04 0.00 -1.22 -3.72 117.00 114.43 2of5 n LEU 180 Ca 0.09 -0.41 -0.22 0.00 0.00 0.00 0.00 56.01 55.47 2of5 n LEU 180 Cb 0.22 -0.07 -0.13 0.00 0.00 0.00 0.00 43.42 43.44 2of5 n LEU 180 CO 0.06 0.24 -0.65 -0.74 0.00 0.00 0.00 177.39 176.30 2of5 h HIS 181 N 0.63 0.34 -0.00 1.96 2.76 -1.72 -3.08 115.15 116.03 2of5 h HIS 181 Ca 0.00 -0.25 0.00 0.00 -2.20 0.00 0.00 60.37 57.92 2of5 h HIS 181 Cb 0.55 -0.01 0.00 0.00 1.55 0.00 0.00 27.41 29.50 2of5 h HIS 181 CO 0.00 1.66 -0.01 0.09 -1.30 0.00 0.00 177.93 178.37 2of5 n ASN 182 N -3.85 0.35 -0.10 3.26 4.13 -1.26 -3.49 115.26 114.30 2of5 n ASN 182 Ca -0.31 -0.99 -0.20 0.00 1.68 0.00 0.00 54.58 54.76 2of5 n ASN 182 Cb 0.91 -0.03 -0.07 0.00 -1.54 0.00 0.00 39.78 39.05 2of5 n ASN 182 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2of5 n GLY 183 N 1.09 -0.31 0.19 7.41 0.00 -1.24 -4.06 105.19 108.25 2of5 n GLY 183 Ca 0.21 -0.10 -0.15 0.00 0.00 0.00 0.00 46.02 45.98 2of5 n GLY 183 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2of5 h LEU 184 N -0.60 -0.34 0.00 0.99 3.38 -1.67 -2.24 115.31 114.84 2of5 h LEU 184 Ca -0.49 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.48 2of5 h LEU 184 Cb 1.48 0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.31 2of5 h LEU 184 CO -0.27 -0.24 0.00 -1.14 0.09 0.00 0.00 178.44 176.89 2of5 n ARG 185 N -5.26 0.69 -0.40 1.13 0.63 -0.61 -2.13 116.66 110.72 2of5 n ARG 185 Ca -0.10 0.01 0.06 0.00 -0.92 0.00 0.00 57.85 56.90 2of5 n ARG 185 Cb 0.18 -1.50 0.23 0.00 0.45 0.00 0.00 32.46 31.82 2of5 n ARG 185 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2of5 n ALA 186 N -1.06 2.90 -2.26 5.13 0.00 -0.84 -3.75 120.51 120.62 2of5 n ALA 186 Ca 0.17 -1.00 -0.04 0.00 0.00 0.00 0.00 53.44 52.57 2of5 n ALA 186 Cb 0.11 -1.02 -0.00 0.00 0.00 0.00 0.00 19.45 18.54 2of5 n ALA 186 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2of5 n VAL 187 N 0.62 0.05 -3.18 0.00 3.14 -1.03 -4.91 118.33 113.02 2of5 n VAL 187 Ca 0.16 -0.48 -0.14 0.00 -2.96 0.00 0.00 64.34 60.92 2of5 n VAL 187 Cb 0.61 0.71 0.07 0.00 -1.06 0.00 0.00 33.84 34.18 2of5 n VAL 187 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2of5 n GLU 188 N -0.40 -3.33 -3.35 1.45 -0.58 -1.24 -4.98 120.64 108.21 2of5 n GLU 188 Ca -0.21 0.80 -0.15 0.00 -0.42 0.00 0.00 57.16 57.18 2of5 n GLU 188 Cb 0.79 -5.53 -0.07 0.00 -0.57 0.00 0.00 31.44 26.06 2of5 n GLU 188 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2of5 s VAL 189 N -3.35 -0.39 -0.04 2.62 1.01 -0.90 -4.97 120.40 114.37 2of5 s VAL 189 Ca 0.29 -0.88 -0.38 0.00 0.00 0.00 0.00 61.98 61.01 2of5 s VAL 189 Cb -0.04 -0.64 -0.17 0.00 0.00 0.00 0.00 36.38 35.54 2of5 s VAL 189 CO 0.68 -0.53 1.45 0.47 0.00 0.00 0.00 175.10 177.17 2of5 n ASP 190 N 4.31 1.75 -0.16 3.32 10.43 -1.26 -1.57 116.55 133.37 2of5 n ASP 190 Ca 0.10 1.11 0.00 0.00 2.57 0.00 0.00 54.79 58.58 2of5 n ASP 190 Cb 0.46 -1.15 0.00 0.00 1.84 0.00 0.00 41.12 42.27 2of5 n ASP 190 CO 0.00 0.00 0.00 -2.65 -1.07 0.00 0.00 177.20 173.48 2of5 n PRO 191 N 3.33 0.04 0.00 -0.24 -0.02 -1.26 -3.14 135.00 133.70 2of5 n PRO 191 Ca 0.21 0.00 0.14 0.00 -2.02 0.00 0.00 63.50 61.83 2of5 n PRO 191 Cb 0.16 -1.01 0.63 0.00 -0.02 0.00 0.00 33.50 33.27 2of5 n PRO 191 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2of5 n SER 192 N -0.19 0.13 0.05 2.55 3.41 -1.26 -3.01 113.62 115.29 2of5 n SER 192 Ca 0.00 0.02 0.10 0.00 -0.26 0.00 0.00 58.87 58.73 2of5 n SER 192 Cb 0.00 -0.28 0.43 0.00 -0.26 0.00 0.00 64.21 64.10 2of5 n SER 192 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2of5 n LEU 193 N -1.33 0.26 0.10 1.04 4.77 -1.19 -2.62 117.00 118.03 2of5 n LEU 193 Ca 0.11 0.55 -0.04 0.00 -0.03 0.00 0.00 56.01 56.60 2of5 n LEU 193 Cb 0.29 -0.50 0.02 0.00 -2.33 0.00 0.00 43.42 40.90 2of5 n LEU 193 CO 0.26 -0.28 0.31 -0.07 -1.33 0.00 0.00 177.39 176.28 2of5 h LEU 194 N 0.00 0.00 0.11 2.23 3.38 -1.84 -3.18 115.31 116.01 2of5 h LEU 194 Ca 0.00 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.64 2of5 h LEU 194 Cb 0.38 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 2of5 h LEU 194 CO 0.00 0.81 -1.78 0.25 0.09 0.00 0.00 178.44 177.81 2of5 h LEU 195 N 0.00 0.37 0.00 1.67 6.46 -1.73 -3.28 115.31 118.80 2of5 h LEU 195 Ca -0.01 -0.67 0.00 0.00 -0.12 0.00 0.00 57.88 57.09 2of5 h LEU 195 Cb 1.46 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 41.27 2of5 h LEU 195 CO 0.11 1.58 0.00 1.41 -0.62 0.00 0.00 178.44 180.92 2of5 n HIS 196 N -3.41 0.00 0.43 1.25 8.25 -1.19 -2.77 115.22 117.78 2of5 n HIS 196 Ca -0.24 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.27 2of5 n HIS 196 Cb 1.05 -0.05 -0.06 0.00 1.12 0.00 0.00 29.99 32.05 2of5 n HIS 196 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2of5 n MET 197 N -1.05 3.00 -1.77 -0.41 0.00 -1.20 -4.51 117.12 111.17 2of5 n MET 197 Ca 0.22 -0.02 -0.37 0.00 0.00 0.00 0.00 57.70 57.54 2of5 n MET 197 Cb 0.13 -1.04 0.05 0.00 0.00 0.00 0.00 33.22 32.36 2of5 n MET 197 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 2of5 n LEU 198 N -1.35 7.29 0.00 3.17 4.77 -1.12 -5.06 117.00 124.70 2of5 n LEU 198 Ca 0.01 -4.68 0.00 0.00 -0.03 0.00 0.00 56.01 51.31 2of5 n LEU 198 Cb 0.18 -0.97 0.00 0.00 -2.33 0.00 0.00 43.42 40.31 2of5 n LEU 198 CO 0.22 1.71 0.18 -0.62 -1.33 0.00 0.00 177.39 177.55