#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l3e n GLY 102 N 0.00 -0.49 3.57 -5.12 0.00 -1.26 -4.85 105.19 97.04 1l3e n GLY 102 Ca 0.00 0.03 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 1l3e n GLY 102 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1l3e s SER 103 N -2.29 4.59 -1.18 1.61 0.15 -1.26 -4.87 113.70 110.46 1l3e s SER 103 Ca 0.10 -0.87 -0.19 0.00 0.70 0.00 0.00 55.95 55.68 1l3e s SER 103 Cb -0.04 -2.57 0.07 0.00 -1.71 0.00 0.00 66.02 61.77 1l3e s SER 103 CO 0.12 -3.39 1.59 -0.83 1.20 0.00 0.00 173.24 171.94 1l3e s GLY 104 N 8.21 1.58 -0.78 9.45 0.00 -1.26 -4.35 107.32 120.17 1l3e s GLY 104 Ca 0.76 -2.72 -0.01 0.00 0.00 0.00 0.00 44.72 42.75 1l3e s GLY 104 CO 0.08 2.64 0.72 0.00 0.00 0.00 0.00 173.10 176.54 1l3e n ALA 105 N 8.30 -2.46 -3.24 3.20 0.00 -1.26 -4.94 120.51 120.10 1l3e n ALA 105 Ca 0.42 0.03 -0.46 0.00 0.00 0.00 0.00 53.44 53.43 1l3e n ALA 105 Cb 0.48 -2.27 -0.01 0.00 0.00 0.00 0.00 19.45 17.64 1l3e n ALA 105 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1l3e s HIS 106 N -3.07 3.82 -0.30 0.00 2.46 -1.26 -4.88 115.29 112.06 1l3e s HIS 106 Ca 0.09 -2.16 -0.08 0.00 0.47 0.00 0.00 55.06 53.38 1l3e s HIS 106 Cb -0.01 -3.94 0.19 0.00 -0.13 0.00 0.00 32.58 28.69 1l3e s HIS 106 CO 0.73 -1.08 0.96 -0.08 -2.47 0.00 0.00 174.74 172.79 1l3e s THR 107 N 0.17 -0.39 -0.94 0.89 -1.32 -1.26 -5.07 115.64 107.72 1l3e s THR 107 Ca 0.27 0.00 -0.26 0.00 -1.21 0.00 0.00 61.69 60.49 1l3e s THR 107 Cb -0.09 -0.40 -0.20 0.00 -1.51 0.00 0.00 72.50 70.30 1l3e s THR 107 CO -0.08 0.00 1.96 0.00 -2.21 0.00 0.00 174.62 174.29 1l3e n ALA 108 N 5.17 1.13 -1.83 11.08 0.00 -1.26 -4.88 120.51 129.92 1l3e n ALA 108 Ca 0.08 -2.67 -0.43 0.00 0.00 0.00 0.00 53.44 50.43 1l3e n ALA 108 Cb 0.57 -3.48 -0.03 0.00 0.00 0.00 0.00 19.45 16.51 1l3e n ALA 108 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1l3e s ASP 109 N 7.30 5.91 0.46 0.00 -1.08 -1.26 -4.85 116.67 123.14 1l3e s ASP 109 Ca 0.73 1.79 0.30 0.00 -0.52 0.00 0.00 52.55 54.86 1l3e s ASP 109 Cb 0.01 -2.52 1.17 0.00 -1.46 0.00 0.00 42.92 40.12 1l3e s ASP 109 CO 0.19 -1.62 1.88 1.55 0.52 0.00 0.00 175.17 177.69 1l3e h PRO 110 N 12.93 0.00 -0.12 4.34 0.13 -2.02 -3.11 132.00 144.14 1l3e h PRO 110 Ca -0.39 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.78 1l3e h PRO 110 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 1l3e h PRO 110 CO 0.98 0.00 0.28 0.93 -0.23 0.00 0.00 178.00 179.97 1l3e h GLU 111 N 0.00 0.00 0.00 0.86 5.08 -2.00 0.30 114.58 118.81 1l3e h GLU 111 Ca 0.00 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.23 1l3e h GLU 111 Cb 0.53 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 1l3e h GLU 111 CO 0.00 0.00 -1.09 0.87 -1.00 0.00 0.00 179.01 177.79 1l3e h LYS 112 N 0.00 0.00 -0.38 2.33 6.56 -1.95 -3.32 116.57 119.81 1l3e h LYS 112 Ca 0.06 0.00 0.11 0.00 -1.06 0.00 0.00 60.65 59.76 1l3e h LYS 112 Cb 0.62 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 32.27 1l3e h LYS 112 CO -0.00 0.32 0.43 -0.09 -2.06 0.00 0.00 179.45 178.05 1l3e h ARG 113 N 0.00 0.00 -0.10 3.15 2.43 -0.58 0.12 114.38 119.40 1l3e h ARG 113 Ca -0.10 0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 58.95 1l3e h ARG 113 Cb 1.47 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.02 1l3e h ARG 113 CO 0.05 0.00 -0.41 -0.22 -1.51 0.00 0.00 179.97 177.88 1l3e h LYS 114 N 0.00 0.46 0.00 0.20 1.63 -1.66 -2.05 116.57 115.14 1l3e h LYS 114 Ca 0.18 -0.36 -0.10 0.00 -0.85 0.00 0.00 60.65 59.52 1l3e h LYS 114 Cb 1.03 0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 32.71 1l3e h LYS 114 CO -0.00 0.98 -0.49 -0.07 -3.45 0.00 0.00 179.45 176.42 1l3e h LEU 115 N 0.03 0.00 -0.67 5.20 3.38 -1.05 -2.64 115.31 119.56 1l3e h LEU 115 Ca -0.02 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.80 1l3e h LEU 115 Cb 1.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 1l3e h LEU 115 CO 0.09 0.49 -0.59 0.40 0.09 0.00 0.00 178.44 178.91 1l3e h ILE 116 N 0.00 1.38 -0.16 1.22 2.04 -1.03 -1.78 117.51 119.17 1l3e h ILE 116 Ca -0.00 -1.95 -0.04 0.00 1.00 0.00 0.00 64.86 63.86 1l3e h ILE 116 Cb 0.88 1.98 -0.00 0.00 -0.74 0.00 0.00 36.82 38.94 1l3e h ILE 116 CO 0.06 0.58 -0.06 1.56 0.00 0.00 0.00 178.15 180.29 1l3e h GLN 117 N 0.18 0.33 -0.55 2.37 7.50 -1.05 -0.85 115.11 123.04 1l3e h GLN 117 Ca -0.00 -0.13 -0.08 0.00 0.50 0.00 0.00 58.65 58.93 1l3e h GLN 117 Cb 1.09 -0.01 -0.02 0.00 0.05 0.00 0.00 27.48 28.58 1l3e h GLN 117 CO 0.09 0.62 0.03 1.96 -1.50 0.00 0.00 178.83 180.03 1l3e h GLN 118 N 0.02 0.92 -0.14 1.46 4.20 -1.46 0.11 115.11 120.22 1l3e h GLN 118 Ca 0.04 -0.25 -0.07 0.00 0.06 0.00 0.00 58.65 58.42 1l3e h GLN 118 Cb 0.51 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 1l3e h GLN 118 CO 0.02 0.89 -0.24 1.96 -0.67 0.00 0.00 178.83 180.79 1l3e h GLN 119 N 0.86 0.25 0.00 1.46 7.50 -1.25 0.98 115.11 124.91 1l3e h GLN 119 Ca 0.17 -0.08 -0.18 0.00 0.50 0.00 0.00 58.65 59.05 1l3e h GLN 119 Cb 0.46 -0.02 -0.02 0.00 0.05 0.00 0.00 27.48 27.95 1l3e h GLN 119 CO 0.02 0.49 -0.86 1.25 -1.50 0.00 0.00 178.83 178.23 1l3e h LEU 120 N 0.23 0.08 0.17 1.46 6.46 -0.51 -1.15 115.31 122.06 1l3e h LEU 120 Ca 0.04 -0.07 -0.24 0.00 -0.12 0.00 0.00 57.88 57.49 1l3e h LEU 120 Cb 0.56 -0.02 0.02 0.00 -0.73 0.00 0.00 40.66 40.49 1l3e h LEU 120 CO 0.04 0.89 -1.06 0.58 -0.62 0.00 0.00 178.44 178.27 1l3e h VAL 121 N 0.03 1.40 -0.43 1.05 2.07 -0.09 -1.80 116.25 118.48 1l3e h VAL 121 Ca -0.02 -2.57 -0.08 0.00 0.82 0.00 0.00 66.70 64.84 1l3e h VAL 121 Cb 1.50 3.12 -0.02 0.00 -1.52 0.00 0.00 31.29 34.37 1l3e h VAL 121 CO 0.12 0.74 -0.08 0.25 0.02 0.00 0.00 177.57 178.62 1l3e h LEU 122 N -0.22 0.73 -0.49 2.57 5.85 0.91 0.93 115.31 125.59 1l3e h LEU 122 Ca -0.19 -0.20 -0.10 0.00 0.84 0.00 0.00 57.88 58.23 1l3e h LEU 122 Cb 1.81 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 42.62 1l3e h LEU 122 CO 0.18 0.85 -0.09 -0.07 -0.34 0.00 0.00 178.44 178.97 1l3e h LEU 123 N 0.68 0.93 -0.65 2.25 3.38 -1.28 0.91 115.31 121.54 1l3e h LEU 123 Ca 0.12 -0.35 -0.04 0.00 0.09 0.00 0.00 57.88 57.71 1l3e h LEU 123 Cb 0.53 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 1l3e h LEU 123 CO 0.03 1.06 0.25 -0.07 0.09 0.00 0.00 178.44 179.80 1l3e h LEU 124 N 0.79 0.90 0.00 1.67 4.07 -0.73 0.56 115.31 122.57 1l3e h LEU 124 Ca 0.13 -0.18 0.00 0.00 0.08 0.00 0.00 57.88 57.91 1l3e h LEU 124 Cb 0.63 -0.23 0.00 0.00 1.08 0.00 0.00 40.66 42.14 1l3e h LEU 124 CO 0.04 0.83 0.00 1.57 -1.08 0.00 0.00 178.44 179.80 1l3e n HIS 125 N -4.41 0.00 -0.57 1.13 -0.00 0.32 -2.35 115.22 109.34 1l3e n HIS 125 Ca 0.04 0.00 0.45 0.00 -0.00 0.00 0.00 57.72 58.22 1l3e n HIS 125 Cb 0.18 -0.38 0.75 0.00 -0.00 0.00 0.00 29.99 30.54 1l3e n HIS 125 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1l3e h ALA 126 N -2.00 3.34 -0.33 1.57 0.00 0.85 2.13 119.26 124.82 1l3e h ALA 126 Ca 0.00 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1l3e h ALA 126 Cb 0.00 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1l3e h ALA 126 CO 0.00 -1.93 0.14 1.25 0.00 0.00 0.00 179.25 178.71 1l3e h HIS 127 N 0.02 0.50 0.00 0.00 6.17 -0.61 -2.80 115.15 118.44 1l3e h HIS 127 Ca 0.87 -0.04 -0.13 0.00 0.71 0.00 0.00 60.37 61.79 1l3e h HIS 127 Cb 3.18 -0.15 -0.02 0.00 2.52 0.00 0.00 27.41 32.94 1l3e h HIS 127 CO -0.00 0.46 -1.52 1.63 0.71 0.00 0.00 177.93 179.21 1l3e n LYS 128 N -4.72 0.63 0.14 5.26 5.02 0.34 -4.15 118.16 120.68 1l3e n LYS 128 Ca -0.01 0.11 -0.13 0.00 -2.02 0.00 0.00 58.31 56.25 1l3e n LYS 128 Cb 0.13 -1.74 -0.06 0.00 -0.02 0.00 0.00 35.03 33.34 1l3e n LYS 128 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1l3e h GLN 130 N -0.50 0.00 -0.00 0.00 7.50 -1.69 -0.15 115.11 120.27 1l3e h GLN 130 Ca 0.02 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.17 1l3e h GLN 130 Cb 0.49 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.02 1l3e h GLN 130 CO -0.11 0.00 -0.52 -2.13 -1.50 0.00 0.00 178.83 174.56 1l3e n ARG 131 N -2.91 0.37 -0.07 1.46 0.63 -0.32 -3.82 116.66 112.00 1l3e n ARG 131 Ca -0.01 -0.25 -0.22 0.00 -0.92 0.00 0.00 57.85 56.45 1l3e n ARG 131 Cb 0.14 -1.49 -0.12 0.00 0.45 0.00 0.00 32.46 31.43 1l3e n ARG 131 CO 0.00 0.00 0.00 -0.09 -2.51 0.00 0.00 177.63 175.03 1l3e h ARG 132 N 0.62 0.08 0.00 -0.14 2.43 0.11 -3.36 114.38 114.12 1l3e h ARG 132 Ca 0.00 -0.14 -0.04 0.00 -0.81 0.00 0.00 59.98 58.99 1l3e h ARG 132 Cb 0.53 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.13 1l3e h ARG 132 CO 0.00 1.07 -0.18 0.93 -1.51 0.00 0.00 179.97 180.28 1l3e h GLU 133 N -0.68 0.00 -0.31 0.20 5.08 -1.67 -0.67 114.58 116.52 1l3e h GLU 133 Ca -0.37 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 57.99 1l3e h GLU 133 Cb 1.52 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.75 1l3e h GLU 133 CO -0.12 0.18 0.19 1.96 -1.00 0.00 0.00 179.01 180.23 1l3e h GLN 134 N 0.00 0.42 0.06 2.33 4.20 -1.72 0.83 115.11 121.23 1l3e h GLN 134 Ca -0.00 -0.03 -0.26 0.00 0.06 0.00 0.00 58.65 58.42 1l3e h GLN 134 Cb 0.38 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.05 1l3e h GLN 134 CO 0.02 0.31 -1.25 0.00 -0.67 0.00 0.00 178.83 177.24 1l3e h ALA 135 N 1.08 0.31 -0.03 3.87 0.00 -1.65 -3.25 119.26 119.60 1l3e h ALA 135 Ca 0.11 -1.01 0.00 0.00 0.00 0.00 0.00 54.91 54.02 1l3e h ALA 135 Cb -0.00 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1l3e h ALA 135 CO -0.02 1.19 0.00 0.09 0.00 0.00 0.00 179.25 180.51 1l3e n ASN 136 N -3.39 1.11 0.00 0.00 4.13 -0.28 -5.02 115.26 111.82 1l3e n ASN 136 Ca -0.07 -1.41 0.00 0.00 1.68 0.00 0.00 54.58 54.78 1l3e n ASN 136 Cb 1.00 -0.01 0.00 0.00 -1.54 0.00 0.00 39.78 39.22 1l3e n ASN 136 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1l3e n GLY 137 N 1.11 3.34 3.58 7.41 0.00 0.29 -4.45 105.19 116.47 1l3e n GLY 137 Ca 0.20 -0.22 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 1l3e n GLY 137 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1l3e s GLU 138 N 0.00 3.00 0.24 1.61 2.12 -1.26 -4.57 118.70 119.84 1l3e s GLU 138 Ca 0.00 1.39 0.09 0.00 0.36 0.00 0.00 54.97 56.81 1l3e s GLU 138 Cb 0.00 -4.32 -0.04 0.00 0.26 0.00 0.00 34.13 30.03 1l3e s GLU 138 CO 0.00 -2.26 0.00 0.08 -0.54 0.00 0.00 175.26 172.54 1l3e s VAL 139 N 8.28 3.54 0.79 3.70 1.01 -1.26 -5.11 120.40 131.35 1l3e s VAL 139 Ca 0.84 -1.75 -0.14 0.00 0.00 0.00 0.00 61.98 60.92 1l3e s VAL 139 Cb -0.22 -2.86 0.06 0.00 0.00 0.00 0.00 36.38 33.36 1l3e s VAL 139 CO 0.30 -0.29 1.16 -2.11 0.00 0.00 0.00 175.10 174.16 1l3e n ARG 140 N -0.66 0.29 -1.95 2.72 0.00 -1.26 -4.86 116.66 110.93 1l3e n ARG 140 Ca -0.08 0.17 -0.43 0.00 -0.00 0.00 0.00 57.85 57.52 1l3e n ARG 140 Cb 0.58 -2.40 -0.03 0.00 -0.00 0.00 0.00 32.46 30.61 1l3e n ARG 140 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.63 178.77 1l3e s GLN 141 N -3.93 3.30 0.00 2.89 -2.07 -1.26 -4.89 119.66 113.70 1l3e s GLN 141 Ca 0.74 1.49 -0.37 0.00 -1.82 0.00 0.00 55.36 55.39 1l3e s GLN 141 Cb -0.30 -4.22 -0.19 0.00 -1.09 0.00 0.00 33.01 27.21 1l3e s GLN 141 CO 0.50 -1.90 1.00 0.00 -1.32 0.00 0.00 175.29 173.57 1l3e h ASN 143 N 2.80 0.00 -4.02 0.00 -0.26 -2.04 -3.35 115.58 108.71 1l3e h ASN 143 Ca -0.48 0.00 -0.71 0.00 -0.56 0.00 0.00 56.30 54.55 1l3e h ASN 143 Cb 1.34 0.00 -0.34 0.00 -1.06 0.00 0.00 38.32 38.27 1l3e h ASN 143 CO 0.61 0.12 -0.30 -1.48 -1.06 0.00 0.00 177.43 175.31 1l3e s LEU 144 N -7.26 5.49 0.63 1.61 0.05 -1.26 -4.94 118.68 113.01 1l3e s LEU 144 Ca -0.03 -2.75 0.21 0.00 0.05 0.00 0.00 54.13 51.62 1l3e s LEU 144 Cb 0.13 -1.92 1.00 0.00 -2.05 0.00 0.00 46.19 43.35 1l3e s LEU 144 CO 0.58 -0.42 1.52 -0.65 -0.55 0.00 0.00 176.35 176.83 1l3e h PRO 145 N 7.25 0.00 -1.62 1.48 0.11 -1.97 -2.01 132.00 135.25 1l3e h PRO 145 Ca -0.01 0.00 0.48 0.00 0.11 0.00 0.00 66.00 66.57 1l3e h PRO 145 Cb 0.98 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.01 1l3e h PRO 145 CO 0.73 0.00 1.15 0.45 -0.21 0.00 0.00 178.00 180.12 1l3e h HIS 146 N 0.00 0.07 0.00 0.65 3.86 -1.94 -2.39 115.15 115.41 1l3e h HIS 146 Ca 0.19 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.40 1l3e h HIS 146 Cb 1.74 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 30.20 1l3e h HIS 146 CO 0.00 -0.02 0.00 0.00 0.86 0.00 0.00 177.93 178.77 1l3e h ARG 148 N 0.00 0.24 -0.25 0.00 0.11 -1.70 0.58 114.38 113.37 1l3e h ARG 148 Ca 0.00 -0.01 -0.02 0.00 0.10 0.00 0.00 59.98 60.05 1l3e h ARG 148 Cb 0.00 -0.05 -0.01 0.00 1.11 0.00 0.00 29.97 31.01 1l3e h ARG 148 CO 0.00 0.16 0.08 1.15 0.10 0.00 0.00 179.97 181.46 1l3e h THR 149 N 0.25 1.19 -0.76 0.08 2.02 -1.45 -1.93 112.91 112.31 1l3e h THR 149 Ca 0.76 -0.62 -0.02 0.00 0.77 0.00 0.00 66.41 67.29 1l3e h THR 149 Cb 1.84 1.14 -0.04 0.00 -1.74 0.00 0.00 68.15 69.35 1l3e h THR 149 CO -0.61 0.20 0.38 -0.03 0.37 0.00 0.00 175.52 175.82 1l3e h MET 150 N 0.23 1.08 -0.66 6.66 4.05 0.21 0.19 114.93 126.69 1l3e h MET 150 Ca 0.08 -0.14 0.10 0.00 -0.28 0.00 0.00 59.70 59.46 1l3e h MET 150 Cb 0.24 -0.20 -0.08 0.00 -0.80 0.00 0.00 31.60 30.76 1l3e h MET 150 CO -0.00 0.82 0.28 -0.22 0.23 0.00 0.00 176.91 178.01 1l3e h LYS 151 N 1.07 0.46 -0.29 0.39 3.11 -0.44 1.90 116.57 122.77 1l3e h LYS 151 Ca 0.26 -0.03 -0.03 0.00 -2.81 0.00 0.00 60.65 58.04 1l3e h LYS 151 Cb 0.09 -0.10 -0.01 0.00 -1.00 0.00 0.00 32.23 31.20 1l3e h LYS 151 CO -0.04 0.30 0.05 -0.97 -2.81 0.00 0.00 179.45 175.98 1l3e h ASN 152 N 0.47 0.46 -0.22 4.20 -0.00 -0.44 -0.43 115.58 119.62 1l3e h ASN 152 Ca 0.34 -0.26 -0.10 0.00 -0.00 0.00 0.00 56.30 56.28 1l3e h ASN 152 Cb 0.41 -0.12 -0.02 0.00 -0.00 0.00 0.00 38.32 38.59 1l3e h ASN 152 CO -0.31 0.60 -0.17 0.58 -0.00 0.00 0.00 177.43 178.13 1l3e h VAL 153 N 0.30 1.26 -0.47 2.57 2.07 0.91 -2.33 116.25 120.55 1l3e h VAL 153 Ca 0.09 -1.21 -0.05 0.00 0.82 0.00 0.00 66.70 66.34 1l3e h VAL 153 Cb 0.34 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1l3e h VAL 153 CO 0.01 0.40 0.09 -0.07 0.02 0.00 0.00 177.57 178.02 1l3e h LEU 154 N 0.58 0.74 -1.60 2.57 3.38 0.31 -2.00 115.31 119.30 1l3e h LEU 154 Ca 0.09 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 1l3e h LEU 154 Cb 0.63 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 1l3e h LEU 154 CO 0.04 0.80 0.21 -1.13 0.09 0.00 0.00 178.44 178.45 1l3e h ASN 155 N 0.65 0.42 0.53 -0.43 -1.24 -0.84 -2.34 115.58 112.33 1l3e h ASN 155 Ca 0.15 -0.02 -0.03 0.00 0.71 0.00 0.00 56.30 57.11 1l3e h ASN 155 Cb 0.37 -0.10 0.01 0.00 0.73 0.00 0.00 38.32 39.32 1l3e h ASN 155 CO 0.01 0.33 -0.25 -0.74 -1.29 0.00 0.00 177.43 175.48 1l3e h HIS 156 N 0.48 -0.66 -0.94 0.67 2.76 -0.87 -3.15 115.15 113.45 1l3e h HIS 156 Ca 0.13 -0.02 0.28 0.00 -2.20 0.00 0.00 60.37 58.56 1l3e h HIS 156 Cb -0.01 0.22 -0.15 0.00 1.55 0.00 0.00 27.41 29.02 1l3e h HIS 156 CO 0.00 -0.41 0.39 1.98 -1.30 0.00 0.00 177.93 178.59 1l3e h MET 157 N -0.80 0.25 0.00 5.26 1.85 -1.20 1.03 114.93 121.31 1l3e h MET 157 Ca -0.07 -0.01 0.00 0.00 -0.61 0.00 0.00 59.70 59.00 1l3e h MET 157 Cb 0.54 -0.06 0.00 0.00 0.43 0.00 0.00 31.60 32.52 1l3e h MET 157 CO 0.12 0.16 0.09 1.15 -0.40 0.00 0.00 176.91 178.03 1l3e h THR 158 N 0.26 0.00 0.00 -0.77 2.02 -1.38 -0.34 112.91 112.70 1l3e h THR 158 Ca 0.65 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.83 1l3e h THR 158 Cb 1.40 0.81 0.00 0.00 -1.74 0.00 0.00 68.15 68.61 1l3e h THR 158 CO -0.64 0.00 -0.13 1.57 0.37 0.00 0.00 175.52 176.68 1l3e n HIS 159 N -2.85 0.00 -3.54 3.16 -0.00 0.34 -4.96 115.22 107.37 1l3e n HIS 159 Ca -0.02 -0.65 -0.41 0.00 -0.00 0.00 0.00 57.72 56.63 1l3e n HIS 159 Cb 0.14 -0.11 -0.08 0.00 -0.00 0.00 0.00 29.99 29.95 1l3e n HIS 159 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1l3e n GLN 161 N 4.63 0.29 0.01 0.00 6.02 -1.26 -4.32 117.38 122.75 1l3e n GLN 161 Ca -0.04 -0.19 -0.10 0.00 -0.01 0.00 0.00 57.00 56.67 1l3e n GLN 161 Cb 0.41 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.14 1l3e n GLN 161 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.06 176.82 1l3e h SER 162 N 0.46 -0.65 -4.20 1.08 0.02 -1.90 -3.49 113.55 104.87 1l3e h SER 162 Ca 0.00 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1l3e h SER 162 Cb 0.52 0.29 0.00 0.00 0.14 0.00 0.00 62.40 63.34 1l3e h SER 162 CO 0.00 -0.26 -0.80 0.61 -1.14 0.00 0.00 176.83 175.23 1l3e n GLY 163 N -1.34 -5.11 2.34 -3.77 0.00 -1.26 -4.32 105.19 91.73 1l3e n GLY 163 Ca -0.03 -0.31 -0.01 0.00 0.00 0.00 0.00 46.02 45.67 1l3e n GLY 163 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1l3e n LYS 164 N 1.58 -2.74 -0.91 1.61 2.85 -1.26 -4.47 118.16 114.81 1l3e n LYS 164 Ca 0.00 0.05 -0.04 0.00 -1.05 0.00 0.00 58.31 57.27 1l3e n LYS 164 Cb 0.00 -4.50 -0.03 0.00 -0.65 0.00 0.00 35.03 29.85 1l3e n LYS 164 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 1l3e n SER 165 N -1.27 -0.62 -4.59 -5.58 7.64 -1.26 -5.12 113.62 102.83 1l3e n SER 165 Ca -0.01 -1.24 -0.25 0.00 1.01 0.00 0.00 58.87 58.38 1l3e n SER 165 Cb 0.46 0.20 0.12 0.00 -1.01 0.00 0.00 64.21 63.98 1l3e n SER 165 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1l3e n GLN 167 N -3.04 1.73 -4.72 0.00 3.00 -1.26 -4.81 117.38 108.28 1l3e n GLN 167 Ca 0.14 -1.12 -0.25 0.00 -0.01 0.00 0.00 57.00 55.77 1l3e n GLN 167 Cb 0.60 -1.32 -0.16 0.00 0.00 0.00 0.00 30.24 29.37 1l3e n GLN 167 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1l3e s VAL 168 N -1.67 1.27 -0.05 5.09 1.01 -1.26 -5.04 120.40 119.75 1l3e s VAL 168 Ca 0.27 -0.62 -0.24 0.00 0.00 0.00 0.00 61.98 61.39 1l3e s VAL 168 Cb 0.14 -1.10 -0.19 0.00 0.00 0.00 0.00 36.38 35.23 1l3e s VAL 168 CO 0.20 0.37 1.03 0.00 0.00 0.00 0.00 175.10 176.71 1l3e h ALA 169 N 6.37 -0.12 0.00 5.51 0.00 -2.01 -3.13 119.26 125.88 1l3e h ALA 169 Ca -0.32 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1l3e h ALA 169 Cb 1.18 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1l3e h ALA 169 CO 0.48 -0.26 0.00 0.45 0.00 0.00 0.00 179.25 179.92 1l3e h HIS 170 N -0.72 0.00 0.00 0.00 3.86 -1.97 -0.85 115.15 115.47 1l3e h HIS 170 Ca -0.01 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.20 1l3e h HIS 170 Cb 0.56 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.03 1l3e h HIS 170 CO 0.11 0.00 -0.00 0.00 0.86 0.00 0.00 177.93 178.90 1l3e h ALA 172 N -1.98 1.03 0.63 0.00 0.00 -1.57 -1.03 119.26 116.34 1l3e h ALA 172 Ca -0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1l3e h ALA 172 Cb 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.56 1l3e h ALA 172 CO 0.00 0.26 -0.32 1.03 0.00 0.00 0.00 179.25 180.22 1l3e h SER 173 N 0.93 -0.77 -0.65 0.00 0.87 -1.31 -2.36 113.55 110.25 1l3e h SER 173 Ca 0.32 0.03 0.14 0.00 -1.23 0.00 0.00 61.79 61.05 1l3e h SER 173 Cb 0.06 0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 62.19 1l3e h SER 173 CO -0.13 -0.53 0.44 -1.28 -0.53 0.00 0.00 176.83 174.79 1l3e h SER 174 N -0.87 0.27 -0.66 6.23 0.87 -1.15 -0.41 113.55 117.83 1l3e h SER 174 Ca -0.08 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.48 1l3e h SER 174 Cb 0.68 -0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 62.56 1l3e h SER 174 CO 0.13 0.15 0.38 -0.09 -0.53 0.00 0.00 176.83 176.87 1l3e h ARG 175 N 0.30 0.91 0.00 2.24 1.12 -0.69 -2.16 114.38 116.10 1l3e h ARG 175 Ca 0.31 -0.10 -0.11 0.00 -1.11 0.00 0.00 59.98 58.97 1l3e h ARG 175 Cb 0.81 -0.18 -0.02 0.00 -0.01 0.00 0.00 29.97 30.57 1l3e h ARG 175 CO -0.07 0.67 -0.53 1.96 -3.11 0.00 0.00 179.97 178.89 1l3e h GLN 176 N 0.90 0.00 0.00 0.20 1.08 -0.68 -2.27 115.11 114.34 1l3e h GLN 176 Ca 0.23 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.43 1l3e h GLN 176 Cb 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.44 1l3e h GLN 176 CO -0.04 0.53 -0.00 0.82 -0.95 0.00 0.00 178.83 179.19 1l3e h ILE 177 N 0.00 0.00 -0.11 2.54 2.04 -0.79 -2.56 117.51 118.64 1l3e h ILE 177 Ca -0.01 -0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.89 1l3e h ILE 177 Cb 1.01 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.06 1l3e h ILE 177 CO 0.07 0.00 -0.09 0.40 0.00 0.00 0.00 178.15 178.53 1l3e h ILE 178 N -0.00 0.75 -0.51 -0.67 2.04 -1.54 -2.68 117.51 114.90 1l3e h ILE 178 Ca -0.00 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.96 1l3e h ILE 178 Cb 0.00 0.75 -0.10 0.00 -0.74 0.00 0.00 36.82 36.72 1l3e h ILE 178 CO 0.00 0.00 -0.31 0.77 0.00 0.00 0.00 178.15 178.61 1l3e h SER 179 N -0.10 -1.07 -0.25 1.72 4.64 -1.54 -1.25 113.55 115.69 1l3e h SER 179 Ca 0.07 0.21 0.06 0.00 -0.47 0.00 0.00 61.79 61.66 1l3e h SER 179 Cb 0.20 0.53 -0.07 0.00 -0.31 0.00 0.00 62.40 62.74 1l3e h SER 179 CO -0.17 -0.30 -0.26 -0.74 -0.87 0.00 0.00 176.83 174.49 1l3e h HIS 180 N -0.19 -0.71 -0.39 4.77 -0.00 -1.21 -1.59 115.15 115.83 1l3e h HIS 180 Ca 0.21 0.04 0.04 0.00 -0.00 0.00 0.00 60.37 60.66 1l3e h HIS 180 Cb 0.53 0.35 -0.05 0.00 -0.00 0.00 0.00 27.41 28.24 1l3e h HIS 180 CO -0.58 -0.34 -0.30 2.35 -0.00 0.00 0.00 177.93 179.06 1l3e h TRP 181 N -0.27 -0.94 0.00 5.26 2.91 -0.91 1.22 115.95 123.22 1l3e h TRP 181 Ca 0.14 0.06 -0.00 0.00 1.13 0.00 0.00 58.89 60.21 1l3e h TRP 181 Cb 0.48 0.46 -0.00 0.00 -0.51 0.00 0.00 29.16 29.60 1l3e h TRP 181 CO -0.42 -0.22 -0.00 -0.22 -1.03 0.00 0.00 178.44 176.55 1l3e h LYS 182 N -0.09 0.00 -0.52 2.65 1.63 -1.28 -0.93 116.57 118.03 1l3e h LYS 182 Ca 0.06 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.86 1l3e h LYS 182 Cb 0.25 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.88 1l3e h LYS 182 CO -0.41 0.00 0.00 -1.71 -3.45 0.00 0.00 179.45 173.88 1l3e n ASN 183 N -3.76 3.98 -4.21 4.20 2.85 0.69 -4.86 115.26 114.16 1l3e n ASN 183 Ca -0.03 -2.32 -0.41 0.00 -0.11 0.00 0.00 54.58 51.71 1l3e n ASN 183 Cb 0.08 -0.46 -0.09 0.00 1.24 0.00 0.00 39.78 40.55 1l3e n ASN 183 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1l3e n THR 185 N 4.89 0.00 -2.26 0.00 -2.24 -1.26 -4.92 114.28 108.50 1l3e n THR 185 Ca -0.08 -0.71 0.15 0.00 -2.27 0.00 0.00 64.05 61.14 1l3e n THR 185 Cb 0.41 0.18 -0.04 0.00 -2.10 0.00 0.00 70.33 68.79 1l3e n THR 185 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1l3e n ARG 186 N -0.34 -2.16 -1.58 -0.78 5.12 -1.26 -3.88 116.66 111.78 1l3e n ARG 186 Ca -0.05 1.43 -0.42 0.00 -1.93 0.00 0.00 57.85 56.88 1l3e n ARG 186 Cb 0.19 -2.64 -0.01 0.00 -1.16 0.00 0.00 32.46 28.83 1l3e n ARG 186 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 1l3e n HIS 187 N -3.63 3.11 -2.46 -1.55 8.25 -1.26 -4.07 115.22 113.61 1l3e n HIS 187 Ca 0.01 -2.70 -0.03 0.00 -0.26 0.00 0.00 57.72 54.73 1l3e n HIS 187 Cb 0.49 -2.35 0.06 0.00 1.12 0.00 0.00 29.99 29.31 1l3e n HIS 187 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1l3e n ASP 188 N 6.35 -1.13 -3.99 0.41 2.03 -1.25 -5.05 116.55 113.92 1l3e n ASP 188 Ca 0.52 -2.14 -0.32 0.00 0.52 0.00 0.00 54.79 53.38 1l3e n ASP 188 Cb 0.39 0.49 -0.11 0.00 -0.72 0.00 0.00 41.12 41.17 1l3e n ASP 188 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1l3e h PRO 190 N 6.14 0.00 0.00 0.00 0.13 -1.97 -2.78 132.00 133.53 1l3e h PRO 190 Ca 0.05 0.00 -0.43 0.00 -0.87 0.00 0.00 66.00 64.75 1l3e h PRO 190 Cb 0.84 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.91 1l3e h PRO 190 CO 0.73 0.00 -2.42 0.28 -0.23 0.00 0.00 178.00 176.36 1l3e n VAL 191 N -2.91 1.53 0.18 1.56 0.31 -1.26 -4.19 118.33 113.55 1l3e n VAL 191 Ca 0.03 -0.42 0.05 0.00 -0.01 0.00 0.00 64.34 63.99 1l3e n VAL 191 Cb 0.39 -1.77 0.51 0.00 -0.91 0.00 0.00 33.84 32.07 1l3e n VAL 191 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1l3e h LEU 193 N 0.12 -0.59 -1.62 0.00 4.07 -1.70 0.94 115.31 116.54 1l3e h LEU 193 Ca 0.03 0.02 0.27 0.00 0.08 0.00 0.00 57.88 58.28 1l3e h LEU 193 Cb 0.19 0.15 -0.07 0.00 1.08 0.00 0.00 40.66 42.01 1l3e h LEU 193 CO 0.01 -0.35 0.69 -0.65 -1.08 0.00 0.00 178.44 177.06 1l3e h PRO 194 N -0.84 0.25 0.20 1.13 0.11 -1.71 1.27 132.00 132.41 1l3e h PRO 194 Ca -0.07 -0.01 -0.33 0.00 0.11 0.00 0.00 66.00 65.70 1l3e h PRO 194 Cb 0.53 -0.06 0.02 0.00 0.11 0.00 0.00 31.00 31.61 1l3e h PRO 194 CO 0.12 0.16 -1.52 -0.07 -0.21 0.00 0.00 178.00 176.48 1l3e h LEU 195 N 0.25 0.66 -5.24 2.35 3.38 -1.39 -3.43 115.31 111.90 1l3e h LEU 195 Ca 0.54 -0.79 -0.27 0.00 0.09 0.00 0.00 57.88 57.44 1l3e h LEU 195 Cb 1.64 -0.22 -0.20 0.00 0.09 0.00 0.00 40.66 41.97 1l3e h LEU 195 CO -0.17 1.64 -0.61 0.29 0.09 0.00 0.00 178.44 179.68 1l3e n LYS 196 N -3.62 0.65 -1.44 1.13 5.02 0.33 -5.09 118.16 115.14 1l3e n LYS 196 Ca -0.17 -2.14 -0.48 0.00 -2.02 0.00 0.00 58.31 53.50 1l3e n LYS 196 Cb 1.08 -1.45 -0.03 0.00 -0.02 0.00 0.00 35.03 34.61 1l3e n LYS 196 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1l3e n ASN 197 N 2.12 -0.74 -2.17 4.39 4.13 0.42 -4.43 115.26 118.98 1l3e n ASN 197 Ca 0.15 1.14 -0.28 0.00 1.68 0.00 0.00 54.58 57.27 1l3e n ASN 197 Cb 0.58 -1.01 0.08 0.00 -1.54 0.00 0.00 39.78 37.89 1l3e n ASN 197 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1l3e n ALA 198 N 0.07 5.84 -2.98 5.41 0.00 -1.26 -4.49 120.51 123.10 1l3e n ALA 198 Ca 0.16 -2.82 -0.14 0.00 0.00 0.00 0.00 53.44 50.64 1l3e n ALA 198 Cb 0.26 -1.61 -0.00 0.00 0.00 0.00 0.00 19.45 18.09 1l3e n ALA 198 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l3e n GLY 199 N -0.55 2.77 3.73 0.00 0.00 -1.26 -5.11 105.19 104.78 1l3e n GLY 199 Ca 0.52 -1.51 -0.24 0.00 0.00 0.00 0.00 46.02 44.79 1l3e n GLY 199 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1l3e s ASP 200 N -2.66 4.53 0.00 1.61 2.15 -1.26 -5.29 116.67 115.75 1l3e s ASP 200 Ca 0.35 -0.93 0.27 0.00 0.43 0.00 0.00 52.55 52.66 1l3e s ASP 200 Cb 0.39 -0.58 1.59 0.00 -0.30 0.00 0.00 42.92 44.02 1l3e s ASP 200 CO -0.04 -0.42 1.94 0.29 -0.17 0.00 0.00 175.17 176.77