#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 0.45 -0.10 0.61 3.06 -1.26 -3.66 119.36 118.46 2of5 n ILE 110 Ca 0.00 -0.51 0.25 0.00 -2.50 0.00 0.00 62.75 59.99 2of5 n ILE 110 Cb 0.00 -0.22 0.72 0.00 0.54 0.00 0.00 39.64 40.67 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 0.00 0.00 -3.26 9.51 3.38 -1.99 -1.33 115.31 121.62 2of5 h LEU 111 Ca 0.00 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.67 2of5 h LEU 111 Cb 0.98 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.55 2of5 h LEU 111 CO 0.00 0.00 0.38 0.59 0.09 0.00 0.00 178.44 179.50 2of5 n ASN 112 N -4.19 3.63 -3.98 -0.43 4.13 -1.24 -1.84 115.26 111.34 2of5 n ASN 112 Ca 0.15 -3.02 -0.10 0.00 1.68 0.00 0.00 54.58 53.29 2of5 n ASN 112 Cb 0.84 -0.71 -0.12 0.00 -1.54 0.00 0.00 39.78 38.25 2of5 n ASN 112 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 2of5 s SER 113 N -0.55 0.32 0.57 6.41 1.04 -0.50 -4.96 113.70 116.03 2of5 s SER 113 Ca 0.38 -0.43 -0.17 0.00 0.48 0.00 0.00 55.95 56.21 2of5 s SER 113 Cb 0.32 0.07 -0.04 0.00 0.10 0.00 0.00 66.02 66.46 2of5 s SER 113 CO 0.08 -0.23 1.08 -0.44 0.98 0.00 0.00 173.24 174.71 2of5 s SER 114 N -1.24 5.75 0.48 7.02 0.01 -1.25 -2.60 113.70 121.87 2of5 s SER 114 Ca -0.12 1.97 -0.16 0.00 1.31 0.00 0.00 55.95 58.94 2of5 s SER 114 Cb -0.08 -2.55 -0.08 0.00 0.21 0.00 0.00 66.02 63.51 2of5 s SER 114 CO -0.01 -1.19 0.94 -2.16 0.41 0.00 0.00 173.24 171.23 2of5 s PRO 115 N -3.70 3.96 0.76 12.44 0.04 -1.26 -4.93 135.00 142.31 2of5 s PRO 115 Ca 0.67 0.89 -0.13 0.00 0.04 0.00 0.00 61.00 62.48 2of5 s PRO 115 Cb -0.19 -2.19 0.18 0.00 0.04 0.00 0.00 34.50 32.34 2of5 s PRO 115 CO 0.32 -0.19 0.91 -1.13 0.04 0.00 0.00 177.00 176.95 2of5 n SER 116 N -1.36 -0.46 0.10 6.66 3.41 -1.26 -4.81 113.62 115.90 2of5 n SER 116 Ca 0.06 -1.24 -0.04 0.00 -0.26 0.00 0.00 58.87 57.39 2of5 n SER 116 Cb 0.54 -0.73 0.03 0.00 -0.26 0.00 0.00 64.21 63.79 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 -1.55 0.00 -0.22 4.04 3.45 -1.99 -1.69 116.42 118.47 2of5 h ASP 117 Ca -0.31 0.00 -0.06 0.00 0.43 0.00 0.00 57.03 57.10 2of5 h ASP 117 Cb 0.87 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.63 2of5 h ASP 117 CO 0.21 0.80 -0.09 -0.09 -1.57 0.00 0.00 179.24 178.50 2of5 h ARG 118 N 0.00 0.44 0.18 3.56 2.43 -1.99 -0.77 114.38 118.23 2of5 h ARG 118 Ca -0.01 -0.19 0.00 0.00 -0.81 0.00 0.00 59.98 58.98 2of5 h ARG 118 Cb 1.43 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.94 2of5 h ARG 118 CO 0.10 0.71 -0.18 1.96 -1.51 0.00 0.00 179.97 181.05 2of5 h GLN 119 N 0.16 -0.38 -0.06 0.20 4.20 -1.90 -1.03 115.11 116.30 2of5 h GLN 119 Ca 0.05 0.03 0.03 0.00 0.06 0.00 0.00 58.65 58.82 2of5 h GLN 119 Cb 0.57 0.09 -0.06 0.00 0.30 0.00 0.00 27.48 28.37 2of5 h GLN 119 CO 0.03 -0.25 -0.48 0.82 -0.67 0.00 0.00 178.83 178.28 2of5 h ILE 120 N -0.40 0.08 -0.91 2.54 2.04 -1.25 -0.58 117.51 119.03 2of5 h ILE 120 Ca 0.00 0.00 0.24 0.00 1.00 0.00 0.00 64.86 66.10 2of5 h ILE 120 Cb 0.37 0.08 -0.13 0.00 -0.74 0.00 0.00 36.82 36.40 2of5 h ILE 120 CO -0.05 0.00 0.38 -1.13 0.00 0.00 0.00 178.15 177.35 2of5 h ASN 121 N -0.59 0.29 -0.28 1.72 -1.24 -0.77 0.46 115.58 115.17 2of5 h ASN 121 Ca 0.04 0.17 -0.04 0.00 0.71 0.00 0.00 56.30 57.18 2of5 h ASN 121 Cb 0.68 0.16 -0.02 0.00 0.73 0.00 0.00 38.32 39.87 2of5 h ASN 121 CO -0.37 -0.05 0.05 1.56 -1.29 0.00 0.00 177.43 177.33 2of5 h GLN 122 N 0.35 0.56 -0.12 6.67 4.20 0.20 -1.81 115.11 125.16 2of5 h GLN 122 Ca 0.58 -0.11 -0.21 0.00 0.06 0.00 0.00 58.65 58.97 2of5 h GLN 122 Cb 1.15 -0.09 0.01 0.00 0.30 0.00 0.00 27.48 28.85 2of5 h GLN 122 CO -0.57 0.55 -0.75 1.25 -0.67 0.00 0.00 178.83 178.64 2of5 h LEU 123 N 0.54 0.87 -2.71 1.46 5.85 0.70 -2.87 115.31 119.16 2of5 h LEU 123 Ca 0.12 -0.65 0.00 0.00 0.84 0.00 0.00 57.88 58.20 2of5 h LEU 123 Cb 0.27 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 41.04 2of5 h LEU 123 CO 0.00 1.38 0.08 0.00 -0.34 0.00 0.00 178.44 179.56 2of5 h ALA 124 N 0.51 1.17 0.19 1.25 0.00 0.24 -1.17 119.26 121.46 2of5 h ALA 124 Ca -0.06 -0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.55 2of5 h ALA 124 Cb 1.39 0.00 0.02 0.00 0.00 0.00 0.00 17.79 19.20 2of5 h ALA 124 CO 0.15 -0.08 -1.38 1.96 0.00 0.00 0.00 179.25 179.90 2of5 h GLN 125 N 0.00 0.40 -0.72 0.00 4.20 -1.14 -3.32 115.11 114.53 2of5 h GLN 125 Ca 0.01 -0.69 0.00 0.00 0.06 0.00 0.00 58.65 58.03 2of5 h GLN 125 Cb 0.16 0.26 0.00 0.00 0.30 0.00 0.00 27.48 28.20 2of5 h GLN 125 CO -0.00 1.33 0.00 0.54 -0.67 0.00 0.00 178.83 180.03 2of5 n ARG 126 N -3.82 2.24 -4.48 1.46 1.74 -0.48 -4.84 116.66 108.48 2of5 n ARG 126 Ca -0.20 -1.10 -0.31 0.00 -0.77 0.00 0.00 57.85 55.47 2of5 n ARG 126 Cb 1.00 -1.65 -0.11 0.00 -1.02 0.00 0.00 32.46 30.67 2of5 n ARG 126 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2of5 s LEU 127 N -1.00 3.01 0.00 0.55 1.43 -0.99 -5.07 118.68 116.61 2of5 s LEU 127 Ca 0.19 -0.25 0.00 0.00 -1.03 0.00 0.00 54.13 53.05 2of5 s LEU 127 Cb 0.14 -1.75 0.00 0.00 0.03 0.00 0.00 46.19 44.61 2of5 s LEU 127 CO 0.07 0.26 0.00 0.61 0.23 0.00 0.00 176.35 177.52 2of5 n GLY 128 N 1.45 2.99 0.31 -3.19 0.00 -1.26 -4.95 105.19 100.54 2of5 n GLY 128 Ca -0.15 -1.84 0.20 0.00 0.00 0.00 0.00 46.02 44.22 2of5 n GLY 128 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2of5 h PRO 129 N 0.00 0.00 0.00 1.61 0.13 -2.01 -2.61 132.00 129.11 2of5 h PRO 129 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2of5 h PRO 129 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2of5 h PRO 129 CO 0.00 0.02 0.00 0.39 -0.23 0.00 0.00 178.00 178.18 2of5 n GLU 130 N -3.26 0.25 -0.35 0.86 4.71 -1.26 -3.15 120.64 118.43 2of5 n GLU 130 Ca -0.02 0.08 0.00 0.00 -0.01 0.00 0.00 57.16 57.21 2of5 n GLU 130 Cb 0.13 -1.50 0.14 0.00 -1.01 0.00 0.00 31.44 29.20 2of5 n GLU 130 CO 0.00 0.00 0.00 0.11 0.09 0.00 0.00 177.13 177.33 2of5 h TRP 131 N 0.00 1.14 0.57 -0.32 5.08 -1.83 -2.06 115.95 118.52 2of5 h TRP 131 Ca 0.00 0.03 -0.02 0.00 1.08 0.00 0.00 58.89 59.98 2of5 h TRP 131 Cb 0.04 -0.38 -0.01 0.00 -3.00 0.00 0.00 29.16 25.81 2of5 h TRP 131 CO 0.00 0.63 -0.43 0.93 -1.28 0.00 0.00 178.44 178.29 2of5 h GLU 132 N 1.15 -0.93 -0.75 0.12 5.08 -1.84 0.20 114.58 117.61 2of5 h GLU 132 Ca 0.39 0.06 0.14 0.00 -1.00 0.00 0.00 59.36 58.96 2of5 h GLU 132 Cb 0.07 0.21 -0.10 0.00 0.50 0.00 0.00 28.75 29.44 2of5 h GLU 132 CO -0.14 -0.62 0.30 -1.35 -1.00 0.00 0.00 179.01 176.19 2of5 h PRO 133 N -0.97 0.43 0.43 2.33 0.11 -1.75 -1.27 132.00 131.31 2of5 h PRO 133 Ca -0.07 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.01 2of5 h PRO 133 Cb 0.81 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 31.80 2of5 h PRO 133 CO 0.02 0.28 -0.47 1.98 -0.21 0.00 0.00 178.00 179.60 2of5 h MET 134 N 0.44 -0.88 0.00 1.05 4.05 -0.74 -0.39 114.93 118.46 2of5 h MET 134 Ca 0.42 0.06 -0.00 0.00 -0.28 0.00 0.00 59.70 59.90 2of5 h MET 134 Cb 0.63 0.20 -0.00 0.00 -0.80 0.00 0.00 31.60 31.63 2of5 h MET 134 CO -0.41 -0.59 -0.00 -0.39 0.23 0.00 0.00 176.91 175.75 2of5 h VAL 135 N -0.92 0.02 0.24 -5.77 -1.51 -0.19 -1.54 116.25 106.57 2of5 h VAL 135 Ca -0.05 -0.06 -0.01 0.00 -1.23 0.00 0.00 66.70 65.36 2of5 h VAL 135 Cb 0.81 1.06 0.00 0.00 -2.13 0.00 0.00 31.29 31.03 2of5 h VAL 135 CO -0.08 0.00 -0.12 -0.07 -1.23 0.00 0.00 177.57 176.07 2of5 h LEU 136 N 0.00 -0.27 0.00 4.19 3.38 -0.03 -2.02 115.31 120.56 2of5 h LEU 136 Ca -0.00 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2of5 h LEU 136 Cb 0.06 0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2of5 h LEU 136 CO 0.00 0.23 0.00 -1.54 0.09 0.00 0.00 178.44 177.22 2of5 n SER 137 N -5.00 0.00 0.01 -0.43 3.41 -0.28 -0.64 113.62 110.69 2of5 n SER 137 Ca -0.07 -0.26 0.09 0.00 -0.26 0.00 0.00 58.87 58.37 2of5 n SER 137 Cb 0.24 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.06 2of5 n SER 137 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2of5 n LEU 138 N -0.94 0.21 0.00 1.04 4.77 -0.63 -4.93 117.00 116.53 2of5 n LEU 138 Ca 0.05 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 2of5 n LEU 138 Cb 0.02 0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 2of5 n LEU 138 CO 0.04 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.71 2of5 n GLY 139 N 1.28 1.24 3.64 -0.72 0.00 0.19 -5.08 105.19 105.73 2of5 n GLY 139 Ca -0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.68 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 1.36 0.28 0.99 1.43 -0.79 -5.01 118.68 116.94 2of5 s LEU 140 Ca 0.00 1.19 0.08 0.00 -1.03 0.00 0.00 54.13 54.38 2of5 s LEU 140 Cb 0.00 -3.29 -0.06 0.00 0.03 0.00 0.00 46.19 42.87 2of5 s LEU 140 CO 0.00 -3.41 -0.11 -0.94 0.23 0.00 0.00 176.35 172.13 2of5 s SER 141 N -3.31 3.07 0.30 2.29 1.04 -1.26 -4.54 113.70 111.28 2of5 s SER 141 Ca 0.66 -1.13 0.13 0.00 0.48 0.00 0.00 55.95 56.09 2of5 s SER 141 Cb -0.20 -0.22 0.71 0.00 0.10 0.00 0.00 66.02 66.42 2of5 s SER 141 CO 0.59 -0.21 1.31 0.00 0.98 0.00 0.00 173.24 175.90 2of5 n GLN 142 N -0.59 0.09 -0.03 4.02 1.13 -1.26 -1.18 117.38 119.56 2of5 n GLN 142 Ca -0.06 0.56 -0.07 0.00 -1.94 0.00 0.00 57.00 55.49 2of5 n GLN 142 Cb 0.62 -2.04 -0.06 0.00 0.11 0.00 0.00 30.24 28.88 2of5 n GLN 142 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 2of5 h THR 143 N 0.00 0.72 -0.79 5.09 2.02 -2.00 -2.95 112.91 115.00 2of5 h THR 143 Ca 0.00 -1.43 0.19 0.00 0.77 0.00 0.00 66.41 65.93 2of5 h THR 143 Cb 0.50 1.33 -0.05 0.00 -1.74 0.00 0.00 68.15 68.19 2of5 h THR 143 CO 0.00 0.23 0.54 0.44 0.37 0.00 0.00 175.52 177.10 2of5 h ASP 144 N -0.98 0.26 0.73 4.18 3.32 -1.55 0.25 116.42 122.63 2of5 h ASP 144 Ca -0.01 0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.03 2of5 h ASP 144 Cb 0.43 -0.03 0.01 0.00 0.22 0.00 0.00 39.33 39.96 2of5 h ASP 144 CO 0.01 0.12 -0.35 0.40 -1.72 0.00 0.00 179.24 177.70 2of5 h ILE 145 N 0.27 0.22 -0.64 0.35 2.04 -1.51 -1.99 117.51 116.25 2of5 h ILE 145 Ca 0.39 -0.14 0.12 0.00 1.00 0.00 0.00 64.86 66.23 2of5 h ILE 145 Cb 1.13 0.25 -0.09 0.00 -0.74 0.00 0.00 36.82 37.38 2of5 h ILE 145 CO -0.10 0.01 0.17 1.88 0.00 0.00 0.00 178.15 180.11 2of5 h TYR 146 N -1.09 0.27 -0.83 1.37 0.05 -0.81 -0.07 116.97 115.88 2of5 h TYR 146 Ca -0.10 0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.72 2of5 h TYR 146 Cb 0.77 -0.02 -0.04 0.00 1.01 0.00 0.00 36.73 38.45 2of5 h TYR 146 CO -0.01 -0.01 0.53 0.00 -1.05 0.00 0.00 178.16 177.62 2of5 h ARG 147 N 0.30 1.10 -0.48 4.88 3.08 -1.23 0.77 114.38 122.80 2of5 h ARG 147 Ca 0.34 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.30 2of5 h ARG 147 Cb 0.51 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 30.30 2of5 h ARG 147 CO -0.41 0.74 0.25 0.00 -1.07 0.00 0.00 179.97 179.48 2of5 h LYS 149 N 0.63 0.62 0.00 0.00 1.57 0.10 -2.70 116.57 116.80 2of5 h LYS 149 Ca 0.17 -0.21 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2of5 h LYS 149 Cb 0.08 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.34 2of5 h LYS 149 CO -0.02 0.76 0.00 0.00 -0.57 0.00 0.00 179.45 179.61 2of5 h ALA 150 N 1.26 1.00 0.00 3.86 0.00 0.12 -2.72 119.26 122.78 2of5 h ALA 150 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2of5 h ALA 150 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2of5 h ALA 150 CO 0.04 0.00 -0.46 0.09 0.00 0.00 0.00 179.25 178.92 2of5 n ASN 151 N -2.87 0.72 -3.05 0.00 3.02 0.96 -4.34 115.26 109.69 2of5 n ASN 151 Ca 0.04 0.23 -0.16 0.00 -0.03 0.00 0.00 54.58 54.65 2of5 n ASN 151 Cb 0.47 -0.08 -0.01 0.00 -0.61 0.00 0.00 39.78 39.56 2of5 n ASN 151 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2of5 n HIS 152 N -2.13 -0.90 -0.30 3.10 8.25 -1.12 -4.99 115.22 117.13 2of5 n HIS 152 Ca 0.04 -3.22 0.15 0.00 -0.26 0.00 0.00 57.72 54.43 2of5 n HIS 152 Cb 0.43 0.21 0.32 0.00 1.12 0.00 0.00 29.99 32.08 2of5 n HIS 152 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2of5 h PRO 153 N 3.30 0.26 -5.92 -0.41 0.13 -1.68 -3.36 132.00 124.33 2of5 h PRO 153 Ca 0.03 -0.02 -0.67 0.00 -0.87 0.00 0.00 66.00 64.47 2of5 h PRO 153 Cb 0.98 -0.06 -0.18 0.00 0.13 0.00 0.00 31.00 31.88 2of5 h PRO 153 CO 0.40 0.17 -0.66 -1.01 -0.23 0.00 0.00 178.00 176.67 2of5 s HIS 154 N -5.88 3.05 0.00 1.56 3.76 -1.26 -4.88 115.29 111.64 2of5 s HIS 154 Ca -0.12 0.04 0.00 0.00 -0.15 0.00 0.00 55.06 54.84 2of5 s HIS 154 Cb 0.26 -1.79 0.00 0.00 1.11 0.00 0.00 32.58 32.16 2of5 s HIS 154 CO 0.78 0.33 0.00 -1.71 -0.85 0.00 0.00 174.74 173.28 2of5 n ASN 155 N 2.43 -0.43 -0.14 1.40 2.85 -1.26 -4.99 115.26 115.13 2of5 n ASN 155 Ca -0.18 0.00 -0.11 0.00 -0.11 0.00 0.00 54.58 54.18 2of5 n ASN 155 Cb 0.53 -0.21 -0.02 0.00 1.24 0.00 0.00 39.78 41.32 2of5 n ASN 155 CO 0.00 0.00 0.00 0.58 -2.11 0.00 0.00 177.26 175.73 2of5 h VAL 156 N 0.00 1.27 -0.76 3.44 2.07 -1.90 -3.24 116.25 117.13 2of5 h VAL 156 Ca 0.00 -1.17 0.07 0.00 0.82 0.00 0.00 66.70 66.42 2of5 h VAL 156 Cb 0.00 1.22 -0.09 0.00 -1.52 0.00 0.00 31.29 30.90 2of5 h VAL 156 CO 0.00 0.39 -0.46 -0.61 0.02 0.00 0.00 177.57 176.91 2of5 h GLN 157 N 0.57 -0.01 -1.02 1.57 5.75 -1.95 0.25 115.11 120.28 2of5 h GLN 157 Ca 0.10 0.00 0.27 0.00 -0.15 0.00 0.00 58.65 58.87 2of5 h GLN 157 Cb 0.61 0.00 -0.13 0.00 1.07 0.00 0.00 27.48 29.03 2of5 h GLN 157 CO 0.04 -0.01 0.60 0.77 -2.65 0.00 0.00 178.83 177.59 2of5 h SER 158 N -0.01 0.61 0.86 -0.69 0.02 -1.93 -0.36 113.55 112.05 2of5 h SER 158 Ca 0.12 0.14 -0.04 0.00 -0.84 0.00 0.00 61.79 61.17 2of5 h SER 158 Cb 0.32 0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.92 2of5 h SER 158 CO -0.72 0.05 -0.47 1.56 -1.14 0.00 0.00 176.83 176.11 2of5 h GLN 159 N 0.50 -1.18 -0.20 3.45 4.20 -0.59 -0.26 115.11 121.03 2of5 h GLN 159 Ca 0.66 0.08 0.06 0.00 0.06 0.00 0.00 58.65 59.51 2of5 h GLN 159 Cb 1.37 0.27 -0.06 0.00 0.30 0.00 0.00 27.48 29.36 2of5 h GLN 159 CO -0.48 -0.79 -0.22 0.28 -0.67 0.00 0.00 178.83 176.96 2of5 h VAL 160 N -1.23 0.45 -0.91 -0.54 2.07 -0.89 0.18 116.25 115.37 2of5 h VAL 160 Ca -0.12 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.55 2of5 h VAL 160 Cb 0.96 0.45 -0.07 0.00 -1.52 0.00 0.00 31.29 31.11 2of5 h VAL 160 CO 0.16 0.00 0.59 0.58 0.02 0.00 0.00 177.57 178.91 2of5 h VAL 161 N -0.24 0.84 -0.06 2.57 2.07 -0.98 -1.09 116.25 119.36 2of5 h VAL 161 Ca 0.12 -0.25 -0.20 0.00 0.82 0.00 0.00 66.70 67.19 2of5 h VAL 161 Cb 0.42 0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 30.23 2of5 h VAL 161 CO -0.34 0.13 -0.80 -0.08 0.02 0.00 0.00 177.57 176.50 2of5 h GLU 162 N 0.73 0.42 0.19 1.57 4.81 0.26 -1.37 114.58 121.20 2of5 h GLU 162 Ca 0.46 -0.38 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 2of5 h GLU 162 Cb 0.71 0.09 -0.00 0.00 0.63 0.00 0.00 28.75 30.18 2of5 h GLU 162 CO -0.22 1.03 -0.12 0.00 -0.73 0.00 0.00 179.01 178.96 2of5 h ALA 163 N 0.85 -0.98 -0.99 2.92 0.00 0.21 0.16 119.26 121.43 2of5 h ALA 163 Ca -0.05 -0.06 0.27 0.00 0.00 0.00 0.00 54.91 55.07 2of5 h ALA 163 Cb 1.40 0.25 -0.13 0.00 0.00 0.00 0.00 17.79 19.31 2of5 h ALA 163 CO 0.14 -0.97 0.56 0.74 0.00 0.00 0.00 179.25 179.73 2of5 h PHE 164 N -0.30 0.95 0.60 0.00 0.04 -1.40 0.36 116.94 117.19 2of5 h PHE 164 Ca -0.03 0.04 -0.02 0.00 2.80 0.00 0.00 57.97 60.76 2of5 h PHE 164 Cb 0.24 -0.26 -0.01 0.00 2.20 0.00 0.00 35.95 38.12 2of5 h PHE 164 CO 0.03 -0.04 -0.40 0.82 -0.60 0.00 0.00 178.31 178.12 2of5 h ILE 165 N 0.46 0.19 -1.03 -0.55 1.08 -0.84 0.87 117.51 117.69 2of5 h ILE 165 Ca 0.67 0.00 0.29 0.00 -0.39 0.00 0.00 64.86 65.43 2of5 h ILE 165 Cb 1.38 0.19 -0.13 0.00 -3.07 0.00 0.00 36.82 35.19 2of5 h ILE 165 CO -0.53 0.00 0.61 0.03 -0.69 0.00 0.00 178.15 177.57 2of5 h ARG 166 N -0.96 0.41 0.02 2.37 2.47 0.25 0.55 114.38 119.49 2of5 h ARG 166 Ca -0.07 -0.02 -0.00 0.00 -1.26 0.00 0.00 59.98 58.62 2of5 h ARG 166 Cb 0.79 -0.09 0.00 0.00 -1.65 0.00 0.00 29.97 29.02 2of5 h ARG 166 CO 0.05 0.27 -0.01 2.35 0.56 0.00 0.00 179.97 183.19 2of5 h TRP 167 N 0.42 -0.02 -0.63 3.04 7.01 0.60 -0.71 115.95 125.65 2of5 h TRP 167 Ca 0.69 -0.00 -0.07 0.00 2.11 0.00 0.00 58.89 61.62 2of5 h TRP 167 Cb 1.54 0.01 -0.03 0.00 -2.10 0.00 0.00 29.16 28.58 2of5 h TRP 167 CO -0.01 0.12 0.12 -0.09 -2.79 0.00 0.00 178.44 175.80 2of5 h ARG 168 N -0.16 1.02 0.00 2.65 2.43 0.22 -2.39 114.38 118.16 2of5 h ARG 168 Ca -0.00 -0.25 -0.03 0.00 -0.81 0.00 0.00 59.98 58.88 2of5 h ARG 168 Cb 0.15 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.56 2of5 h ARG 168 CO 0.00 0.93 -0.16 1.96 -1.51 0.00 0.00 179.97 181.19 2of5 h GLN 169 N 0.97 0.00 0.12 0.20 4.20 -0.09 0.09 115.11 120.60 2of5 h GLN 169 Ca 0.20 0.00 -0.33 0.00 0.06 0.00 0.00 58.65 58.58 2of5 h GLN 169 Cb 0.39 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 2of5 h GLN 169 CO 0.01 0.16 -1.68 -0.09 -0.67 0.00 0.00 178.83 176.56 2of5 h ARG 170 N 0.00 0.26 -0.02 1.46 2.43 -0.65 -3.37 114.38 114.49 2of5 h ARG 170 Ca -0.00 -0.45 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 2of5 h ARG 170 Cb 0.42 0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.13 2of5 h ARG 170 CO 0.02 1.12 -0.31 1.19 -1.51 0.00 0.00 179.97 180.48 2of5 n PHE 171 N -3.45 0.00 0.00 2.20 3.01 -0.96 -5.03 117.46 113.23 2of5 n PHE 171 Ca -0.21 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.25 2of5 n PHE 171 Cb 1.05 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 40.52 2of5 n PHE 171 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2of5 n GLY 172 N 1.39 3.24 0.32 1.37 0.00 0.01 -1.19 105.19 110.33 2of5 n GLY 172 Ca 0.11 0.18 0.20 0.00 0.00 0.00 0.00 46.02 46.52 2of5 n GLY 172 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2of5 h LYS 173 N 0.00 0.00 0.00 1.61 2.10 -1.96 -2.50 116.57 115.82 2of5 h LYS 173 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2of5 h LYS 173 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2of5 h LYS 173 CO 0.00 0.01 -0.11 1.04 -2.00 0.00 0.00 179.45 178.39 2of5 n GLN 174 N -3.20 0.05 -2.45 0.07 6.02 -0.33 -4.37 117.38 113.16 2of5 n GLN 174 Ca -0.02 0.04 -0.43 0.00 -0.01 0.00 0.00 57.00 56.57 2of5 n GLN 174 Cb 0.12 -1.55 0.00 0.00 1.02 0.00 0.00 30.24 29.83 2of5 n GLN 174 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2of5 n ALA 175 N -1.56 4.35 -2.44 -1.58 0.00 -0.94 -4.79 120.51 113.55 2of5 n ALA 175 Ca 0.06 -4.03 -0.20 0.00 0.00 0.00 0.00 53.44 49.28 2of5 n ALA 175 Cb 0.36 -3.36 -0.02 0.00 0.00 0.00 0.00 19.45 16.43 2of5 n ALA 175 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2of5 s THR 176 N 2.73 3.76 0.25 0.00 -4.23 -1.26 -3.91 115.64 112.98 2of5 s THR 176 Ca 0.47 -1.14 0.30 0.00 -1.18 0.00 0.00 61.69 60.14 2of5 s THR 176 Cb 0.05 -3.29 0.30 0.00 1.34 0.00 0.00 72.50 70.90 2of5 s THR 176 CO 0.01 -0.15 1.90 -0.26 -0.54 0.00 0.00 174.62 175.58 2of5 h PHE 177 N 1.01 0.00 -0.03 3.99 0.04 -1.10 0.37 116.94 121.21 2of5 h PHE 177 Ca -0.45 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.30 2of5 h PHE 177 Cb 1.26 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.41 2of5 h PHE 177 CO 0.46 0.00 -0.08 0.37 -0.60 0.00 0.00 178.31 178.46 2of5 h GLN 178 N 0.00 0.11 -0.04 1.51 5.75 -1.70 -2.23 115.11 118.51 2of5 h GLN 178 Ca 0.00 -0.08 0.03 0.00 -0.15 0.00 0.00 58.65 58.45 2of5 h GLN 178 Cb 0.17 0.01 -0.04 0.00 1.07 0.00 0.00 27.48 28.70 2of5 h GLN 178 CO 0.00 0.69 -0.16 0.77 -2.65 0.00 0.00 178.83 177.47 2of5 h SER 179 N -0.46 -0.48 -0.90 -0.69 0.02 -0.61 0.64 113.55 111.06 2of5 h SER 179 Ca -0.00 0.08 0.20 0.00 -0.84 0.00 0.00 61.79 61.22 2of5 h SER 179 Cb 0.69 0.21 -0.11 0.00 0.14 0.00 0.00 62.40 63.33 2of5 h SER 179 CO 0.02 -0.22 0.45 -0.07 -1.14 0.00 0.00 176.83 175.86 2of5 h LEU 180 N -0.25 0.46 0.47 5.07 3.38 -1.33 1.67 115.31 124.79 2of5 h LEU 180 Ca 0.07 0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 2of5 h LEU 180 Cb 0.34 0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 2of5 h LEU 180 CO -0.18 0.09 -0.30 -0.74 0.09 0.00 0.00 178.44 177.40 2of5 h HIS 181 N 0.51 -0.81 -0.54 1.13 2.76 -0.40 -1.13 115.15 116.68 2of5 h HIS 181 Ca 0.54 -0.01 0.11 0.00 -2.20 0.00 0.00 60.37 58.82 2of5 h HIS 181 Cb 0.95 0.29 -0.10 0.00 1.55 0.00 0.00 27.41 30.11 2of5 h HIS 181 CO -0.10 -0.45 -0.06 -0.91 -1.30 0.00 0.00 177.93 175.12 2of5 h ASN 182 N -0.73 -0.35 -1.02 3.26 -0.26 0.68 0.18 115.58 117.33 2of5 h ASN 182 Ca -0.06 0.15 0.28 0.00 -0.56 0.00 0.00 56.30 56.10 2of5 h ASN 182 Cb 0.59 0.28 -0.06 0.00 -1.06 0.00 0.00 38.32 38.07 2of5 h ASN 182 CO 0.06 -0.13 0.71 1.23 -1.06 0.00 0.00 177.43 178.23 2of5 h GLY 183 N 0.06 0.40 0.68 2.83 0.00 0.27 0.11 103.07 107.41 2of5 h GLY 183 Ca 0.27 -0.07 -0.09 0.00 0.00 0.00 0.00 47.33 47.43 2of5 h GLY 183 CO -0.50 -0.03 -0.33 1.41 0.00 0.00 0.00 176.54 177.08 2of5 h LEU 184 N 0.14 0.40 -0.26 3.11 3.38 0.64 -3.10 115.31 119.62 2of5 h LEU 184 Ca 0.51 -0.66 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 2of5 h LEU 184 Cb 1.76 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 42.38 2of5 h LEU 184 CO -0.10 0.99 0.14 0.03 0.09 0.00 0.00 178.44 179.59 2of5 h ARG 185 N -0.17 0.37 -0.84 1.13 3.08 -0.83 -1.09 114.38 116.03 2of5 h ARG 185 Ca -0.02 -0.05 0.28 0.00 0.07 0.00 0.00 59.98 60.26 2of5 h ARG 185 Cb 0.99 -0.07 -0.15 0.00 0.08 0.00 0.00 29.97 30.81 2of5 h ARG 185 CO 0.07 0.34 0.18 0.00 -1.07 0.00 0.00 179.97 179.48 2of5 n ALA 186 N -2.22 0.59 -1.12 0.04 0.00 0.22 0.25 120.51 118.27 2of5 n ALA 186 Ca -0.02 0.88 -0.01 0.00 0.00 0.00 0.00 53.44 54.29 2of5 n ALA 186 Cb 0.08 -0.73 0.27 0.00 0.00 0.00 0.00 19.45 19.07 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 -5.09 2.66 -3.49 0.00 3.14 -0.84 -4.99 118.33 109.72 2of5 n VAL 187 Ca 0.24 -1.97 -0.19 0.00 -2.96 0.00 0.00 64.34 59.47 2of5 n VAL 187 Cb 0.81 -0.32 0.02 0.00 -1.06 0.00 0.00 33.84 33.29 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 -0.50 -1.38 -4.22 1.45 -0.58 0.70 -5.03 120.64 111.08 2of5 n GLU 188 Ca 0.33 0.90 -0.17 0.00 -0.42 0.00 0.00 57.16 57.80 2of5 n GLU 188 Cb 1.16 -4.21 -0.13 0.00 -0.57 0.00 0.00 31.44 27.69 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 -3.18 0.78 -0.22 2.62 1.01 -0.48 -4.99 120.40 115.94 2of5 s VAL 189 Ca 0.19 -0.85 -0.29 0.00 0.00 0.00 0.00 61.98 61.02 2of5 s VAL 189 Cb -0.06 -0.74 -0.01 0.00 0.00 0.00 0.00 36.38 35.57 2of5 s VAL 189 CO 0.83 -0.09 1.30 -0.62 0.00 0.00 0.00 175.10 176.52 2of5 s ASP 190 N -1.05 6.81 0.09 3.32 3.68 -1.26 -4.12 116.67 124.14 2of5 s ASP 190 Ca -0.02 1.49 0.04 0.00 2.13 0.00 0.00 52.55 56.19 2of5 s ASP 190 Cb -0.07 -2.54 0.22 0.00 -1.45 0.00 0.00 42.92 39.08 2of5 s ASP 190 CO 0.01 -0.92 0.96 -2.65 0.13 0.00 0.00 175.17 172.70 2of5 n PRO 191 N 6.95 0.03 0.02 4.34 -0.02 -1.26 -2.66 135.00 142.40 2of5 n PRO 191 Ca 0.14 0.39 0.06 0.00 -2.02 0.00 0.00 63.50 62.07 2of5 n PRO 191 Cb 0.46 -1.80 0.27 0.00 -0.02 0.00 0.00 33.50 32.40 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 -1.53 0.10 -0.06 2.55 3.41 -1.26 -2.17 113.62 114.65 2of5 n SER 192 Ca -0.00 0.53 -0.08 0.00 -0.26 0.00 0.00 58.87 59.06 2of5 n SER 192 Cb 0.22 -0.55 -0.01 0.00 -0.26 0.00 0.00 64.21 63.61 2of5 n SER 192 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2of5 h LEU 193 N 0.00 0.07 -1.46 1.04 3.38 -1.90 0.10 115.31 116.54 2of5 h LEU 193 Ca 0.00 0.03 0.16 0.00 0.09 0.00 0.00 57.88 58.16 2of5 h LEU 193 Cb 0.19 0.03 -0.06 0.00 0.09 0.00 0.00 40.66 40.91 2of5 h LEU 193 CO 0.00 0.07 0.55 -0.07 0.09 0.00 0.00 178.44 179.09 2of5 h LEU 194 N 0.19 0.48 0.60 1.67 3.38 -1.73 -1.99 115.31 117.92 2of5 h LEU 194 Ca 0.11 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 2of5 h LEU 194 Cb 0.09 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 40.79 2of5 h LEU 194 CO -0.13 0.23 -0.29 -0.07 0.09 0.00 0.00 178.44 178.28 2of5 h LEU 195 N 0.51 -0.69 -1.39 1.67 3.38 -0.99 -3.13 115.31 114.67 2of5 h LEU 195 Ca 0.42 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.40 2of5 h LEU 195 Cb 0.89 0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.82 2of5 h LEU 195 CO -0.17 -0.29 0.00 1.41 0.09 0.00 0.00 178.44 179.48 2of5 n HIS 196 N -5.32 0.00 -2.07 1.13 8.25 -0.23 -0.72 115.22 116.26 2of5 n HIS 196 Ca -0.10 -0.11 0.01 0.00 -0.26 0.00 0.00 57.72 57.25 2of5 n HIS 196 Cb 0.33 -0.11 0.00 0.00 1.12 0.00 0.00 29.99 31.34 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 0.42 0.00 0.00 -0.41 0.00 -0.81 -4.76 117.12 111.57 2of5 n MET 197 Ca 0.00 -1.13 0.00 0.00 0.00 0.00 0.00 57.70 56.57 2of5 n MET 197 Cb 0.19 -0.42 0.00 0.00 0.00 0.00 0.00 33.22 32.99 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 0.07 0.00 0.00 3.17 4.77 0.10 -4.94 117.00 120.17 2of5 n LEU 198 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 2of5 n LEU 198 Cb 0.76 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.85 2of5 n LEU 198 CO -0.01 0.00 0.21 -0.62 -1.33 0.00 0.00 177.39 175.64