#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q86 s GLU 96 N 0.00 1.49 0.27 -2.82 -1.05 -0.91 -4.88 118.70 110.79 1q86 s GLU 96 Ca 0.00 -1.77 -0.21 0.00 -0.15 0.00 0.00 54.97 52.84 1q86 s GLU 96 Cb 0.00 -0.89 -0.09 0.00 -0.44 0.00 0.00 34.13 32.71 1q86 s GLU 96 CO 0.00 -0.06 0.80 -0.51 0.95 0.00 0.00 175.26 176.44 1q86 s LEU 97 N -3.40 4.31 -0.15 1.83 1.43 -1.26 0.46 118.68 121.90 1q86 s LEU 97 Ca 0.30 1.55 -0.05 0.00 -1.03 0.00 0.00 54.13 54.91 1q86 s LEU 97 Cb 0.06 -3.79 0.07 0.00 0.03 0.00 0.00 46.19 42.56 1q86 s LEU 97 CO 0.11 -0.03 0.30 -1.10 0.23 0.00 0.00 176.35 175.86 1q86 s GLN 98 N -2.11 0.20 0.49 1.70 -1.52 0.74 -4.88 119.66 114.27 1q86 s GLN 98 Ca 0.47 0.78 -0.23 0.00 -1.95 0.00 0.00 55.36 54.43 1q86 s GLN 98 Cb -0.17 -0.02 -0.06 0.00 -0.22 0.00 0.00 33.01 32.54 1q86 s GLN 98 CO 0.21 -0.31 1.27 0.00 -0.25 0.00 0.00 175.29 176.22 1q86 s ALA 99 N 2.47 2.95 0.64 6.09 0.00 -1.26 -2.38 121.76 130.27 1q86 s ALA 99 Ca 0.01 1.16 -0.11 0.00 0.00 0.00 0.00 51.96 53.02 1q86 s ALA 99 Cb -0.12 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 19.49 1q86 s ALA 99 CO -0.10 -1.00 1.04 1.03 0.00 0.00 0.00 175.76 176.73 1q86 s ARG 100 N -2.72 3.42 1.07 0.00 0.52 -0.76 -4.92 118.95 115.57 1q86 s ARG 100 Ca 0.66 0.75 0.00 0.00 -0.52 0.00 0.00 55.73 56.62 1q86 s ARG 100 Cb -0.35 -2.06 0.00 0.00 0.52 0.00 0.00 34.95 33.06 1q86 s ARG 100 CO 0.43 -0.70 0.00 0.41 0.02 0.00 0.00 175.30 175.46 1q86 n GLY 101 N -2.67 -1.84 2.76 -3.53 0.00 -1.26 -4.50 105.19 94.15 1q86 n GLY 101 Ca 0.06 -1.33 -0.42 0.00 0.00 0.00 0.00 46.02 44.34 1q86 n GLY 101 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1q86 n LEU 102 N 0.00 6.85 0.12 0.99 4.77 -1.26 -4.77 117.00 123.70 1q86 n LEU 102 Ca 0.00 -4.32 0.02 0.00 -0.03 0.00 0.00 56.01 51.68 1q86 n LEU 102 Cb 0.03 -1.59 0.37 0.00 -2.33 0.00 0.00 43.42 39.90 1q86 n LEU 102 CO 0.00 1.23 0.85 0.74 -1.33 0.00 0.00 177.39 178.88 1q86 h THR 103 N 3.88 1.20 -0.01 -5.08 2.02 -1.90 -2.77 112.91 110.25 1q86 h THR 103 Ca 0.52 -0.89 0.00 0.00 0.77 0.00 0.00 66.41 66.81 1q86 h THR 103 Cb 0.63 1.28 0.00 0.00 -1.74 0.00 0.00 68.15 68.32 1q86 h THR 103 CO 1.80 0.27 -0.17 -0.62 0.37 0.00 0.00 175.52 177.17 1q86 n GLU 104 N -4.24 0.78 -1.74 6.66 -0.58 -1.26 -4.94 120.64 115.32 1q86 n GLU 104 Ca -0.01 -0.36 -0.42 0.00 -0.42 0.00 0.00 57.16 55.95 1q86 n GLU 104 Cb 0.30 -1.49 -0.02 0.00 -0.57 0.00 0.00 31.44 29.66 1q86 n GLU 104 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 1q86 n LYS 105 N -0.79 2.63 -5.27 3.49 4.81 -1.05 -5.02 118.16 116.97 1q86 n LYS 105 Ca 0.14 0.94 -0.31 0.00 -0.87 0.00 0.00 58.31 58.20 1q86 n LYS 105 Cb 0.31 -2.71 -0.16 0.00 0.02 0.00 0.00 35.03 32.49 1q86 n LYS 105 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1q86 s THR 106 N -0.01 2.01 0.86 3.15 2.01 -1.26 -5.02 115.64 117.38 1q86 s THR 106 Ca 0.64 -1.08 -0.12 0.00 0.31 0.00 0.00 61.69 61.45 1q86 s THR 106 Cb -0.51 -1.67 0.11 0.00 0.01 0.00 0.00 72.50 70.43 1q86 s THR 106 CO 0.49 0.57 1.10 -2.16 -0.69 0.00 0.00 174.62 173.92 1q86 s PRO 107 N -0.50 1.57 -0.26 4.92 0.04 -1.26 -5.00 135.00 134.52 1q86 s PRO 107 Ca 0.07 0.66 -0.07 0.00 0.04 0.00 0.00 61.00 61.69 1q86 s PRO 107 Cb -0.11 -1.86 -0.02 0.00 0.04 0.00 0.00 34.50 32.56 1q86 s PRO 107 CO -0.00 -1.98 0.07 0.16 0.04 0.00 0.00 177.00 175.29 1q86 s ASP 108 N -3.72 5.09 -0.02 6.66 -4.77 -1.18 -5.01 116.67 113.72 1q86 s ASP 108 Ca 0.62 -0.31 0.07 0.00 -3.30 0.00 0.00 52.55 49.63 1q86 s ASP 108 Cb -0.16 -1.91 -0.02 0.00 -1.09 0.00 0.00 42.92 39.75 1q86 s ASP 108 CO 0.55 -0.07 -0.22 -0.76 0.70 0.00 0.00 175.17 175.37 1q86 s LEU 109 N 1.59 2.04 0.87 2.11 1.43 -1.26 -4.89 118.68 120.57 1q86 s LEU 109 Ca 0.06 -0.41 -0.14 0.00 -1.03 0.00 0.00 54.13 52.61 1q86 s LEU 109 Cb -0.15 -1.17 0.02 0.00 0.03 0.00 0.00 46.19 44.92 1q86 s LEU 109 CO 0.03 0.27 0.51 -1.54 0.23 0.00 0.00 176.35 175.84 1q86 n SER 110 N 2.59 -1.58 -0.34 2.29 3.41 -1.26 -4.63 113.62 114.11 1q86 n SER 110 Ca -0.16 0.42 0.07 0.00 -0.26 0.00 0.00 58.87 58.94 1q86 n SER 110 Cb 0.52 -1.23 0.23 0.00 -0.26 0.00 0.00 64.21 63.46 1q86 n SER 110 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1q86 h ASP 111 N -1.17 0.80 0.04 4.04 3.32 -1.99 -2.05 116.42 119.41 1q86 h ASP 111 Ca -0.44 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 56.66 1q86 h ASP 111 Cb 1.30 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.76 1q86 h ASP 111 CO 0.37 0.41 -0.02 -0.08 -1.72 0.00 0.00 179.24 178.21 1q86 h GLU 112 N 0.88 -0.05 -0.95 3.56 4.57 -1.99 -1.73 114.58 118.86 1q86 h GLU 112 Ca 0.48 0.00 0.03 0.00 -1.18 0.00 0.00 59.36 58.69 1q86 h GLU 112 Cb 0.51 0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 29.06 1q86 h GLU 112 CO -0.28 0.16 0.62 -0.44 -1.18 0.00 0.00 179.01 177.89 1q86 h ASP 113 N -0.26 1.05 0.29 1.04 5.19 -1.81 0.24 116.42 122.16 1q86 h ASP 113 Ca -0.01 -0.02 -0.08 0.00 -0.62 0.00 0.00 57.03 56.31 1q86 h ASP 113 Cb 0.24 -0.25 -0.01 0.00 0.18 0.00 0.00 39.33 39.49 1q86 h ASP 113 CO 0.01 0.74 -0.34 0.00 -3.12 0.00 0.00 179.24 176.52 1q86 h ALA 114 N 1.37 1.35 0.44 3.45 0.00 -1.32 0.55 119.26 125.10 1q86 h ALA 114 Ca 0.37 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1q86 h ALA 114 Cb -0.05 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1q86 h ALA 114 CO -0.11 0.47 -0.21 -0.09 0.00 0.00 0.00 179.25 179.32 1q86 h ARG 115 N 0.07 -0.56 -0.96 0.00 2.43 -0.21 -1.70 114.38 113.44 1q86 h ARG 115 Ca 0.01 0.04 0.07 0.00 -0.81 0.00 0.00 59.98 59.28 1q86 h ARG 115 Cb 0.65 0.13 -0.07 0.00 -0.42 0.00 0.00 29.97 30.26 1q86 h ARG 115 CO 0.05 -0.26 0.62 -0.07 -1.51 0.00 0.00 179.97 178.80 1q86 h LEU 116 N -0.94 0.98 -0.33 3.80 3.38 -0.30 0.31 115.31 122.21 1q86 h LEU 116 Ca -0.06 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.93 1q86 h LEU 116 Cb 0.57 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1q86 h LEU 116 CO 0.10 0.62 0.21 0.25 0.09 0.00 0.00 178.44 179.71 1q86 h LEU 117 N 1.12 0.35 -1.86 1.67 5.85 0.10 -1.13 115.31 121.41 1q86 h LEU 117 Ca 0.42 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 59.11 1q86 h LEU 117 Cb 0.17 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.12 1q86 h LEU 117 CO -0.17 0.25 -0.13 0.74 -0.34 0.00 0.00 178.44 178.78 1q86 h THR 118 N 0.42 0.66 0.20 1.05 2.02 -0.22 -2.08 112.91 114.96 1q86 h THR 118 Ca 0.13 -0.56 -0.01 0.00 0.77 0.00 0.00 66.41 66.73 1q86 h THR 118 Cb -0.03 1.35 0.00 0.00 -1.74 0.00 0.00 68.15 67.74 1q86 h THR 118 CO -0.04 0.13 -0.10 -0.61 0.37 0.00 0.00 175.52 175.27 1q86 h GLN 119 N 0.00 -0.26 -0.59 6.66 4.15 0.20 -2.24 115.11 123.03 1q86 h GLN 119 Ca -0.00 0.02 0.10 0.00 0.77 0.00 0.00 58.65 59.54 1q86 h GLN 119 Cb 0.34 0.06 -0.08 0.00 0.21 0.00 0.00 27.48 28.01 1q86 h GLN 119 CO 0.02 0.12 0.17 -0.09 -1.93 0.00 0.00 178.83 177.11 1q86 h ARG 120 N -0.71 0.31 0.00 1.69 2.43 -1.07 0.17 114.38 117.20 1q86 h ARG 120 Ca -0.03 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.10 1q86 h ARG 120 Cb 0.49 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.97 1q86 h ARG 120 CO 0.04 0.21 -0.12 1.25 -1.51 0.00 0.00 179.97 179.84 1q86 h HIS 121 N 0.32 0.00 0.00 2.20 2.76 -1.36 -0.98 115.15 118.09 1q86 h HIS 121 Ca 0.31 0.00 -0.09 0.00 -2.20 0.00 0.00 60.37 58.38 1q86 h HIS 121 Cb 0.42 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.37 1q86 h HIS 121 CO -0.21 0.12 -0.57 -0.09 -1.30 0.00 0.00 177.93 175.88 1q86 h ARG 122 N 0.00 0.00 -0.14 5.26 2.43 -0.32 -3.39 114.38 118.22 1q86 h ARG 122 Ca -0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1q86 h ARG 122 Cb 0.27 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 1q86 h ARG 122 CO 0.02 0.78 0.00 0.28 -1.51 0.00 0.00 179.97 179.54 1q86 h VAL 123 N -1.00 1.25 -0.71 0.20 2.07 -0.76 -3.49 116.25 113.81 1q86 h VAL 123 Ca -0.14 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 66.55 1q86 h VAL 123 Cb 0.96 1.52 0.00 0.00 -1.52 0.00 0.00 31.29 32.25 1q86 h VAL 123 CO -0.09 0.24 0.00 0.61 0.02 0.00 0.00 177.57 178.36 1q86 n GLY 124 N -0.30 0.41 3.64 2.17 0.00 -0.37 -4.96 105.19 105.77 1q86 n GLY 124 Ca -0.05 -0.93 -0.09 0.00 0.00 0.00 0.00 46.02 44.95 1q86 n GLY 124 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1q86 s LYS 125 N 0.00 1.53 0.86 1.61 -2.85 -1.26 -5.04 119.74 114.59 1q86 s LYS 125 Ca 0.00 -0.82 -0.12 0.00 -1.00 0.00 0.00 55.97 54.03 1q86 s LYS 125 Cb 0.00 0.58 0.11 0.00 -2.06 0.00 0.00 37.83 36.46 1q86 s LYS 125 CO 0.00 -0.68 1.10 -1.25 0.10 0.00 0.00 175.35 174.62 1q86 s PRO 126 N -3.86 1.52 0.36 1.78 0.04 -1.26 -4.93 135.00 128.65 1q86 s PRO 126 Ca 0.08 0.70 0.04 0.00 0.04 0.00 0.00 61.00 61.85 1q86 s PRO 126 Cb -0.03 -1.85 0.68 0.00 0.04 0.00 0.00 34.50 33.34 1q86 s PRO 126 CO -0.01 -2.03 1.99 1.96 0.04 0.00 0.00 177.00 178.96 1q86 h GLN 127 N -1.39 0.70 -6.02 4.56 4.20 -2.02 -3.46 115.11 111.68 1q86 h GLN 127 Ca -0.49 -0.06 -0.41 0.00 0.06 0.00 0.00 58.65 57.75 1q86 h GLN 127 Cb 1.28 -0.15 0.07 0.00 0.30 0.00 0.00 27.48 28.98 1q86 h GLN 127 CO 0.57 0.51 -0.78 1.19 -0.67 0.00 0.00 178.83 179.65 1q86 n PHE 128 N -4.42 -2.21 -3.29 2.96 0.99 -1.26 -4.99 117.46 105.25 1q86 n PHE 128 Ca 0.04 0.90 -0.26 0.00 -0.00 0.00 0.00 57.45 58.14 1q86 n PHE 128 Cb 0.09 -4.52 -0.02 0.00 -1.00 0.00 0.00 39.48 34.03 1q86 n PHE 128 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 176.76 175.96 1q86 s ASN 129 N -3.95 6.34 0.35 4.37 0.01 -1.26 -4.41 114.94 116.39 1q86 s ASN 129 Ca 0.25 0.58 -0.28 0.00 -0.71 0.00 0.00 52.86 52.70 1q86 s ASN 129 Cb -0.12 -2.09 -0.11 0.00 0.41 0.00 0.00 41.25 39.34 1q86 s ASN 129 CO 0.79 -0.29 1.46 -0.60 -1.51 0.00 0.00 177.10 176.95 1q86 s ARG 130 N -4.10 4.16 0.02 -0.60 3.52 0.07 -4.89 118.95 117.14 1q86 s ARG 130 Ca 0.42 2.49 -0.35 0.00 -0.13 0.00 0.00 55.73 58.16 1q86 s ARG 130 Cb -0.10 -3.00 -0.14 0.00 -1.56 0.00 0.00 34.95 30.15 1q86 s ARG 130 CO 0.35 -0.47 1.64 0.00 -0.81 0.00 0.00 175.30 176.01 1q86 n GLN 131 N 0.79 1.86 -0.99 5.12 10.64 -1.26 -1.66 117.38 131.88 1q86 n GLN 131 Ca 0.02 0.68 0.00 0.00 -1.83 0.00 0.00 57.00 55.86 1q86 n GLN 131 Cb 0.40 -2.44 0.00 0.00 -0.86 0.00 0.00 30.24 27.34 1q86 n GLN 131 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 1q86 n ASP 132 N 4.42 -4.44 0.18 2.61 8.00 -1.26 -4.86 116.55 121.21 1q86 n ASP 132 Ca 0.20 0.00 0.18 0.00 0.71 0.00 0.00 54.79 55.88 1q86 n ASP 132 Cb 0.25 -2.09 0.81 0.00 -0.02 0.00 0.00 41.12 40.08 1q86 n ASP 132 CO 0.00 0.00 0.00 1.12 -0.39 0.00 0.00 177.20 177.93 1q86 h HIS 133 N 0.00 0.00 0.00 1.24 2.07 -1.58 0.37 115.15 117.25 1q86 h HIS 133 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1q86 h HIS 133 Cb 0.52 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.50 1q86 h HIS 133 CO 0.33 0.00 -0.09 -2.39 -3.07 0.00 0.00 177.93 172.71 1q86 n HIS 134 N -3.64 0.00 0.98 6.12 1.44 -1.26 -3.68 115.22 115.18 1q86 n HIS 134 Ca 0.03 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.85 1q86 n HIS 134 Cb 0.43 -0.46 -0.03 0.00 0.12 0.00 0.00 29.99 30.06 1q86 n HIS 134 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 1q86 n LYS 135 N -1.50 0.01 -3.47 -1.40 5.02 0.13 -4.89 118.16 112.07 1q86 n LYS 135 Ca 0.07 -0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.28 1q86 n LYS 135 Cb 0.34 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.77 1q86 n LYS 135 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1q86 s LYS 136 N -3.01 0.36 0.37 1.97 2.47 -1.21 -5.03 119.74 115.66 1q86 s LYS 136 Ca 0.08 0.79 0.15 0.00 -1.56 0.00 0.00 55.97 55.43 1q86 s LYS 136 Cb 0.16 -0.05 1.02 0.00 -1.46 0.00 0.00 37.83 37.50 1q86 s LYS 136 CO 0.83 -0.47 1.77 0.87 0.16 0.00 0.00 175.35 178.50 1q86 h LYS 137 N 8.16 0.46 0.00 4.03 1.57 -1.90 0.34 116.57 129.23 1q86 h LYS 137 Ca -0.18 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 1q86 h LYS 137 Cb 1.14 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.34 1q86 h LYS 137 CO 0.21 0.31 0.00 2.89 -0.57 0.00 0.00 179.45 182.28 1q86 n ARG 138 N -4.68 0.16 -3.50 3.15 1.85 -1.26 -4.48 116.66 107.89 1q86 n ARG 138 Ca 0.25 0.47 -0.39 0.00 -1.00 0.00 0.00 57.85 57.18 1q86 n ARG 138 Cb 0.80 -1.85 -0.10 0.00 -1.05 0.00 0.00 32.46 30.26 1q86 n ARG 138 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1q86 s VAL 139 N -3.35 5.25 0.67 8.89 1.01 0.12 -5.07 120.40 127.93 1q86 s VAL 139 Ca 0.02 0.26 -0.10 0.00 0.00 0.00 0.00 61.98 62.16 1q86 s VAL 139 Cb 0.08 -3.63 0.01 0.00 0.00 0.00 0.00 36.38 32.85 1q86 s VAL 139 CO 0.31 0.17 1.04 -0.94 0.00 0.00 0.00 175.10 175.68 1q86 s SER 140 N 1.72 5.49 0.40 3.32 1.04 -1.26 -4.67 113.70 119.74 1q86 s SER 140 Ca 0.10 1.01 0.18 0.00 0.48 0.00 0.00 55.95 57.73 1q86 s SER 140 Cb -0.16 -1.87 0.82 0.00 0.10 0.00 0.00 66.02 64.92 1q86 s SER 140 CO 0.11 -1.26 1.82 0.00 0.98 0.00 0.00 173.24 174.88 1q86 h THR 141 N -0.52 0.95 -1.65 2.02 1.03 -1.92 -3.41 112.91 109.41 1q86 h THR 141 Ca -0.45 -1.29 -0.66 0.00 -0.01 0.00 0.00 66.41 64.00 1q86 h THR 141 Cb 1.25 1.76 0.10 0.00 -1.07 0.00 0.00 68.15 70.19 1q86 h THR 141 CO 0.63 0.33 -0.07 -0.24 -0.01 0.00 0.00 175.52 176.16 1q86 n SER 142 N -3.72 0.27 -4.72 0.00 2.88 -1.26 -0.75 113.62 106.32 1q86 n SER 142 Ca -0.01 1.15 -0.42 0.00 -1.33 0.00 0.00 58.87 58.26 1q86 n SER 142 Cb 0.43 -1.11 -0.03 0.00 -0.75 0.00 0.00 64.21 62.75 1q86 n SER 142 CO 0.00 0.00 0.00 0.86 -1.23 0.00 0.00 175.04 174.67 1q86 s TRP 143 N -0.68 3.48 -0.02 0.66 -0.11 -1.26 -3.77 118.94 117.23 1q86 s TRP 143 Ca 0.68 1.40 0.01 0.00 1.22 0.00 0.00 56.10 59.41 1q86 s TRP 143 Cb -0.88 -3.38 0.01 0.00 -1.50 0.00 0.00 33.47 27.72 1q86 s TRP 143 CO 0.56 -1.08 -0.02 1.03 -4.62 0.00 0.00 176.95 172.82 1q86 s ARG 144 N 0.51 0.32 0.10 5.86 1.81 -1.26 -4.97 118.95 121.32 1q86 s ARG 144 Ca 0.55 -0.03 -0.31 0.00 -1.72 0.00 0.00 55.73 54.23 1q86 s ARG 144 Cb -0.30 -0.40 -0.09 0.00 -0.45 0.00 0.00 34.95 33.71 1q86 s ARG 144 CO 0.32 -0.04 1.75 0.21 -0.68 0.00 0.00 175.30 176.86 1q86 s LYS 145 N 0.50 4.17 0.07 3.54 2.20 -1.26 -4.70 119.74 124.25 1q86 s LYS 145 Ca -0.05 2.47 -0.31 0.00 -0.36 0.00 0.00 55.97 57.72 1q86 s LYS 145 Cb -0.08 -3.60 -0.08 0.00 -1.51 0.00 0.00 37.83 32.56 1q86 s LYS 145 CO -0.01 -0.79 1.63 -1.25 -0.36 0.00 0.00 175.35 174.57 1q86 s PRO 146 N 2.70 4.20 0.00 4.03 0.04 -1.26 -4.88 135.00 139.83 1q86 s PRO 146 Ca 0.78 2.30 0.07 0.00 0.04 0.00 0.00 61.00 64.19 1q86 s PRO 146 Cb -0.43 -3.59 -0.03 0.00 0.04 0.00 0.00 34.50 30.49 1q86 s PRO 146 CO 0.34 -0.72 0.41 0.54 0.04 0.00 0.00 177.00 177.61 1q86 n ARG 147 N 5.54 3.44 -1.69 4.56 1.74 -1.26 -4.72 116.66 124.27 1q86 n ARG 147 Ca 0.16 -0.28 -0.45 0.00 -0.77 0.00 0.00 57.85 56.51 1q86 n ARG 147 Cb 0.41 -0.90 -0.04 0.00 -1.02 0.00 0.00 32.46 30.91 1q86 n ARG 147 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1q86 n GLY 148 N 0.93 1.35 0.39 -0.13 0.00 -1.26 -4.81 105.19 101.66 1q86 n GLY 148 Ca 0.02 0.67 0.21 0.00 0.00 0.00 0.00 46.02 46.92 1q86 n GLY 148 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1q86 h GLN 149 N 6.78 0.00 -0.01 1.61 1.08 -2.02 -0.38 115.11 122.17 1q86 h GLN 149 Ca -0.45 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.75 1q86 h GLN 149 Cb 1.24 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.67 1q86 h GLN 149 CO 0.92 0.00 -0.40 1.28 -0.95 0.00 0.00 178.83 179.68 1q86 n LEU 150 N -4.25 1.75 -4.64 1.46 4.77 -1.26 -4.98 117.00 109.85 1q86 n LEU 150 Ca 0.10 -0.76 -0.62 0.00 -0.03 0.00 0.00 56.01 54.70 1q86 n LEU 150 Cb 0.64 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.64 1q86 n LEU 150 CO 0.36 0.33 0.93 -0.24 -1.33 0.00 0.00 177.39 177.44 1q86 n SER 151 N -0.12 0.93 0.18 -1.43 2.88 -0.15 -4.83 113.62 111.08 1q86 n SER 151 Ca 0.07 1.16 0.03 0.00 -1.33 0.00 0.00 58.87 58.80 1q86 n SER 151 Cb 0.38 -0.95 0.40 0.00 -0.75 0.00 0.00 64.21 63.29 1q86 n SER 151 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 1q86 h LYS 152 N 4.46 0.05 0.01 -1.46 1.79 -1.95 -1.84 116.57 117.63 1q86 h LYS 152 Ca -0.47 -0.02 -0.02 0.00 -2.18 0.00 0.00 60.65 57.96 1q86 h LYS 152 Cb 1.38 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 32.03 1q86 h LYS 152 CO 0.84 0.33 -0.08 0.37 -1.08 0.00 0.00 179.45 179.83 1q86 h GLN 153 N 0.05 0.04 -0.43 3.15 4.15 -1.88 -1.31 115.11 118.88 1q86 h GLN 153 Ca 0.01 -0.06 0.13 0.00 0.77 0.00 0.00 58.65 59.50 1q86 h GLN 153 Cb 0.52 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.21 1q86 h GLN 153 CO 0.04 0.92 0.41 -0.09 -1.93 0.00 0.00 178.83 178.18 1q86 h ARG 154 N -0.81 0.00 -0.00 1.69 2.43 -1.81 1.05 114.38 116.92 1q86 h ARG 154 Ca -0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1q86 h ARG 154 Cb 0.96 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.51 1q86 h ARG 154 CO 0.02 0.00 -0.33 0.54 -1.51 0.00 0.00 179.97 178.69 1q86 n ARG 155 N -3.91 0.43 -2.83 0.20 1.74 -0.71 -4.96 116.66 106.64 1q86 n ARG 155 Ca 0.08 -0.24 -0.07 0.00 -0.77 0.00 0.00 57.85 56.85 1q86 n ARG 155 Cb 0.60 -1.50 0.02 0.00 -1.02 0.00 0.00 32.46 30.56 1q86 n ARG 155 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1q86 n GLY 156 N 1.41 0.51 3.70 -0.13 0.00 0.36 -4.99 105.19 106.04 1q86 n GLY 156 Ca 0.09 -0.40 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 1q86 n GLY 156 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1q86 s ILE 157 N -3.10 4.83 0.00 -0.61 1.01 -0.51 -4.94 121.20 117.88 1q86 s ILE 157 Ca 0.18 2.05 -0.34 0.00 0.00 0.00 0.00 60.65 62.53 1q86 s ILE 157 Cb -0.08 -4.31 -0.12 0.00 0.01 0.00 0.00 42.46 37.96 1q86 s ILE 157 CO 0.22 0.11 1.79 1.17 0.00 0.00 0.00 174.94 178.23 1q86 n LYS 158 N 4.26 2.23 0.00 2.79 4.81 -1.26 -1.86 118.16 129.12 1q86 n LYS 158 Ca 0.07 0.81 0.00 0.00 -0.87 0.00 0.00 58.31 58.32 1q86 n LYS 158 Cb 0.50 -2.64 0.00 0.00 0.02 0.00 0.00 35.03 32.91 1q86 n LYS 158 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1q86 n GLY 159 N 4.09 0.90 1.14 3.14 0.00 -1.26 -4.94 105.19 108.26 1q86 n GLY 159 Ca 0.21 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.32 1q86 n GLY 159 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1q86 n LYS 160 N -1.03 2.43 0.00 1.61 4.76 -0.78 -5.05 118.16 120.10 1q86 n LYS 160 Ca 0.00 -2.22 0.00 0.00 -2.87 0.00 0.00 58.31 53.22 1q86 n LYS 160 Cb 0.00 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 31.71 1q86 n LYS 160 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1q86 n GLY 161 N 1.48 0.58 3.76 0.72 0.00 -1.26 -4.72 105.19 105.75 1q86 n GLY 161 Ca 0.21 -1.73 -0.40 0.00 0.00 0.00 0.00 46.02 44.10 1q86 n GLY 161 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1q86 s ASP 162 N -1.31 7.49 0.00 1.61 1.01 -1.26 -4.93 116.67 119.29 1q86 s ASP 162 Ca 0.00 1.77 -0.19 0.00 0.71 0.00 0.00 52.55 54.83 1q86 s ASP 162 Cb 0.00 -2.55 -0.06 0.00 1.01 0.00 0.00 42.92 41.33 1q86 s ASP 162 CO 0.00 0.17 0.56 -0.89 0.21 0.00 0.00 175.17 175.22 1q86 s THR 163 N -1.06 4.91 0.04 -1.27 2.01 -1.26 -4.82 115.64 114.18 1q86 s THR 163 Ca 0.38 1.17 -0.32 0.00 0.31 0.00 0.00 61.69 63.23 1q86 s THR 163 Cb -0.24 -3.89 -0.11 0.00 0.01 0.00 0.00 72.50 68.27 1q86 s THR 163 CO 0.29 0.46 1.87 0.52 -0.69 0.00 0.00 174.62 177.06 1q86 n VAL 164 N 2.47 0.51 -4.11 3.82 0.31 -1.26 -4.97 118.33 115.11 1q86 n VAL 164 Ca -0.08 -0.09 -0.09 0.00 -0.01 0.00 0.00 64.34 64.06 1q86 n VAL 164 Cb 0.51 -2.05 -0.10 0.00 -0.91 0.00 0.00 33.84 31.29 1q86 n VAL 164 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1q86 s GLU 165 N 3.46 0.65 0.40 5.55 2.02 -1.26 -5.04 118.70 124.48 1q86 s GLU 165 Ca 0.87 -1.15 0.11 0.00 0.02 0.00 0.00 54.97 54.82 1q86 s GLU 165 Cb -0.55 -0.01 0.81 0.00 0.10 0.00 0.00 34.13 34.48 1q86 s GLU 165 CO 0.43 -0.05 1.91 0.00 0.02 0.00 0.00 175.26 177.57 1q86 h ALA 166 N 3.38 1.52 0.00 5.21 0.00 -2.02 -2.39 119.26 124.97 1q86 h ALA 166 Ca -0.34 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1q86 h ALA 166 Cb 1.16 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1q86 h ALA 166 CO 0.60 0.35 0.14 0.78 0.00 0.00 0.00 179.25 181.12 1q86 h GLY 167 N 0.76 0.00 0.48 0.00 0.00 -1.98 -0.85 103.07 101.48 1q86 h GLY 167 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 1q86 h GLY 167 CO 0.03 0.00 -0.16 0.69 0.00 0.00 0.00 176.54 177.10 1q86 n PHE 168 N -2.26 0.00 -1.26 5.60 3.01 -0.90 -4.96 117.46 116.69 1q86 n PHE 168 Ca -0.01 0.00 -0.35 0.00 1.01 0.00 0.00 57.45 58.09 1q86 n PHE 168 Cb 0.17 -0.13 0.09 0.00 -0.01 0.00 0.00 39.48 39.60 1q86 n PHE 168 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1q86 n ARG 169 N -0.71 0.34 -2.82 -1.08 5.12 -0.33 -5.01 116.66 112.18 1q86 n ARG 169 Ca 0.14 0.17 -0.27 0.00 -1.93 0.00 0.00 57.85 55.96 1q86 n ARG 169 Cb 0.31 -2.08 -0.01 0.00 -1.16 0.00 0.00 32.46 29.53 1q86 n ARG 169 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1q86 s SER 170 N -1.66 6.29 0.10 0.55 1.04 -1.26 -5.00 113.70 113.77 1q86 s SER 170 Ca 0.69 0.85 -0.34 0.00 0.48 0.00 0.00 55.95 57.63 1q86 s SER 170 Cb -0.33 -2.21 -0.14 0.00 0.10 0.00 0.00 66.02 63.44 1q86 s SER 170 CO 0.54 -0.50 1.63 -2.65 0.98 0.00 0.00 173.24 173.24 1q86 n PRO 171 N -2.05 2.09 -0.40 4.02 -0.02 -1.26 -4.75 135.00 132.63 1q86 n PRO 171 Ca -0.00 0.76 -0.10 0.00 -2.02 0.00 0.00 63.50 62.13 1q86 n PRO 171 Cb 0.55 -2.53 -0.09 0.00 -0.02 0.00 0.00 33.50 31.40 1q86 n PRO 171 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1q86 n THR 172 N 3.73 -0.64 -0.48 3.45 -1.04 -1.26 -1.09 114.28 116.95 1q86 n THR 172 Ca 0.18 2.36 0.43 0.00 -2.04 0.00 0.00 64.05 64.98 1q86 n THR 172 Cb 0.28 -2.92 0.76 0.00 -1.82 0.00 0.00 70.33 66.63 1q86 n THR 172 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1q86 h ALA 173 N 0.43 3.43 0.00 2.41 0.00 -2.00 -2.59 119.26 120.94 1q86 h ALA 173 Ca 0.15 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1q86 h ALA 173 Cb 0.39 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 1q86 h ALA 173 CO -0.89 -1.92 -1.27 0.28 0.00 0.00 0.00 179.25 175.45 1q86 n VAL 174 N -3.98 0.06 -1.70 0.00 0.31 -0.49 -5.01 118.33 107.53 1q86 n VAL 174 Ca 0.34 -0.14 -0.66 0.00 -0.01 0.00 0.00 64.34 63.86 1q86 n VAL 174 Cb 1.61 0.17 -0.10 0.00 -0.91 0.00 0.00 33.84 34.61 1q86 n VAL 174 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1q86 n ARG 175 N -1.78 0.11 -0.27 5.55 0.63 -0.25 -0.57 116.66 120.08 1q86 n ARG 175 Ca -0.02 0.04 0.00 0.00 -0.92 0.00 0.00 57.85 56.95 1q86 n ARG 175 Cb 0.23 -1.56 0.00 0.00 0.45 0.00 0.00 32.46 31.58 1q86 n ARG 175 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1q86 n GLY 176 N 4.33 0.70 3.76 5.14 0.00 -1.26 -5.05 105.19 112.81 1q86 n GLY 176 Ca 0.33 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.95 1q86 n GLY 176 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1q86 s LYS 177 N -0.68 4.74 0.77 1.61 1.02 0.26 -4.65 119.74 122.81 1q86 s LYS 177 Ca 0.00 1.37 -0.15 0.00 0.02 0.00 0.00 55.97 57.21 1q86 s LYS 177 Cb 0.00 -3.24 0.04 0.00 -0.52 0.00 0.00 37.83 34.12 1q86 s LYS 177 CO 0.00 0.52 1.10 1.58 -0.92 0.00 0.00 175.35 177.63 1q86 n HIS 178 N 1.45 1.03 0.30 3.18 -0.00 -0.70 -4.82 115.22 115.66 1q86 n HIS 178 Ca -0.03 0.40 0.18 0.00 -0.00 0.00 0.00 57.72 58.27 1q86 n HIS 178 Cb 0.48 -2.10 0.92 0.00 -0.00 0.00 0.00 29.99 29.29 1q86 n HIS 178 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1q86 h PRO 179 N -0.54 0.00 0.00 1.57 0.13 -1.95 -0.56 132.00 130.65 1q86 h PRO 179 Ca -0.47 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.58 1q86 h PRO 179 Cb 1.32 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.43 1q86 h PRO 179 CO 0.47 0.00 -0.39 0.66 -0.23 0.00 0.00 178.00 178.51 1q86 h SER 180 N 0.00 0.00 0.00 1.44 4.64 -2.01 -3.47 113.55 114.15 1q86 h SER 180 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1q86 h SER 180 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1q86 h SER 180 CO -0.00 0.39 0.00 0.61 -0.87 0.00 0.00 176.83 176.96 1q86 n GLY 181 N -0.08 1.60 3.75 -0.77 0.00 -0.22 -4.64 105.19 104.83 1q86 n GLY 181 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 1q86 n GLY 181 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1q86 s PHE 182 N -1.69 2.36 -0.22 1.61 2.99 -1.26 -4.72 117.98 117.05 1q86 s PHE 182 Ca 0.00 1.57 -0.10 0.00 0.00 0.00 0.00 56.93 58.40 1q86 s PHE 182 Cb 0.00 -3.33 -0.05 0.00 0.00 0.00 0.00 43.02 39.64 1q86 s PHE 182 CO 0.00 -2.12 0.13 -1.21 -0.00 0.00 0.00 175.22 172.02 1q86 s GLU 183 N -3.90 4.07 0.50 0.44 0.41 -0.93 -1.73 118.70 117.56 1q86 s GLU 183 Ca 0.71 -0.28 -0.19 0.00 -0.41 0.00 0.00 54.97 54.80 1q86 s GLU 183 Cb -0.25 -3.44 -0.08 0.00 -1.78 0.00 0.00 34.13 28.57 1q86 s GLU 183 CO 0.41 0.15 1.02 -1.21 -0.49 0.00 0.00 175.26 175.15 1q86 s GLU 184 N 0.78 3.80 -0.10 1.61 2.02 -1.26 -2.51 118.70 123.03 1q86 s GLU 184 Ca 0.07 1.25 -0.02 0.00 0.02 0.00 0.00 54.97 56.29 1q86 s GLU 184 Cb -0.13 -2.10 0.04 0.00 0.10 0.00 0.00 34.13 32.04 1q86 s GLU 184 CO 0.02 -0.42 0.02 0.08 0.02 0.00 0.00 175.26 174.98 1q86 s VAL 185 N -2.16 0.33 -0.19 2.63 1.01 -0.99 -4.93 120.40 116.09 1q86 s VAL 185 Ca 0.65 0.00 -0.29 0.00 0.00 0.00 0.00 61.98 62.34 1q86 s VAL 185 Cb -0.14 -0.59 -0.02 0.00 0.00 0.00 0.00 36.38 35.62 1q86 s VAL 185 CO 0.23 0.13 1.39 -0.60 0.00 0.00 0.00 175.10 176.25 1q86 s ARG 186 N 1.98 4.07 -0.07 2.72 6.06 -1.26 -1.06 118.95 131.39 1q86 s ARG 186 Ca 0.04 1.63 0.04 0.00 -2.50 0.00 0.00 55.73 54.94 1q86 s ARG 186 Cb -0.13 -3.87 -0.02 0.00 0.06 0.00 0.00 34.95 30.99 1q86 s ARG 186 CO -0.06 -0.93 -0.19 0.54 -2.50 0.00 0.00 175.30 172.16 1q86 s VAL 187 N 4.09 2.59 -0.02 7.11 0.11 0.28 -4.93 120.40 129.63 1q86 s VAL 187 Ca 0.61 -0.87 0.05 0.00 -2.93 0.00 0.00 61.98 58.84 1q86 s VAL 187 Cb -0.23 -2.00 -0.08 0.00 -1.53 0.00 0.00 36.38 32.54 1q86 s VAL 187 CO 0.21 0.57 0.09 1.41 -3.33 0.00 0.00 175.10 174.05 1q86 n HIS 188 N 2.88 0.00 -3.39 1.54 8.25 -1.26 -1.07 115.22 122.17 1q86 n HIS 188 Ca -0.17 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.29 1q86 n HIS 188 Cb 0.52 -0.17 0.00 0.00 1.12 0.00 0.00 29.99 31.46 1q86 n HIS 188 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1q86 n ASN 189 N -1.86 0.00 0.09 0.41 2.04 -1.26 -4.90 115.26 109.78 1q86 n ASN 189 Ca -0.04 -0.85 -0.09 0.00 -0.44 0.00 0.00 54.58 53.17 1q86 n ASN 189 Cb 0.32 0.00 -0.02 0.00 -2.53 0.00 0.00 39.78 37.55 1q86 n ASN 189 CO 0.00 0.00 0.00 0.58 -0.44 0.00 0.00 177.26 177.40 1q86 h VAL 190 N 0.85 1.53 0.00 3.53 2.07 -1.97 -3.22 116.25 119.04 1q86 h VAL 190 Ca 0.00 -2.75 -0.01 0.00 0.82 0.00 0.00 66.70 64.76 1q86 h VAL 190 Cb 0.00 2.54 -0.00 0.00 -1.52 0.00 0.00 31.29 32.31 1q86 h VAL 190 CO 0.00 0.80 -0.04 0.44 0.02 0.00 0.00 177.57 178.78 1q86 h ASP 191 N 0.08 0.00 1.19 0.57 3.32 -1.99 -1.13 116.42 118.46 1q86 h ASP 191 Ca -0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1q86 h ASP 191 Cb 1.56 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.11 1q86 h ASP 191 CO 0.14 0.04 0.00 0.44 -1.72 0.00 0.00 179.24 178.14 1q86 h ASP 192 N 0.00 0.00 0.64 6.45 3.32 -1.96 -2.79 116.42 122.08 1q86 h ASP 192 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1q86 h ASP 192 Cb 0.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1q86 h ASP 192 CO 0.01 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.71 1q86 n LEU 193 N -3.03 0.00 -4.63 1.55 4.77 -0.43 -4.75 117.00 110.49 1q86 n LEU 193 Ca 0.01 0.47 -0.42 0.00 -0.03 0.00 0.00 56.01 56.04 1q86 n LEU 193 Cb 0.34 -0.47 -0.03 0.00 -2.33 0.00 0.00 43.42 40.93 1q86 n LEU 193 CO 0.28 -0.16 0.78 -0.70 -1.33 0.00 0.00 177.39 176.27 1q86 s GLU 194 N -2.95 4.01 0.00 3.23 2.12 -1.05 -3.19 118.70 120.87 1q86 s GLU 194 Ca 0.11 0.83 0.00 0.00 0.36 0.00 0.00 54.97 56.27 1q86 s GLU 194 Cb 0.13 -3.73 0.00 0.00 0.26 0.00 0.00 34.13 30.78 1q86 s GLU 194 CO 0.35 -0.80 0.00 0.41 -0.54 0.00 0.00 175.26 174.68 1q86 n GLY 195 N 4.03 0.72 3.65 -1.50 0.00 -1.26 -5.08 105.19 105.75 1q86 n GLY 195 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 1q86 n GLY 195 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1q86 s VAL 196 N -2.00 4.72 -0.41 1.61 1.01 -1.19 -5.01 120.40 119.13 1q86 s VAL 196 Ca 0.00 1.80 -0.29 0.00 0.00 0.00 0.00 61.98 63.49 1q86 s VAL 196 Cb 0.00 -4.25 0.02 0.00 0.00 0.00 0.00 36.38 32.16 1q86 s VAL 196 CO 0.00 -0.18 1.09 -0.62 0.00 0.00 0.00 175.10 175.40 1q86 s ASP 197 N 1.32 6.75 0.03 3.32 -1.08 -1.26 -4.91 116.67 120.83 1q86 s ASP 197 Ca 0.40 0.69 0.13 0.00 -0.52 0.00 0.00 52.55 53.26 1q86 s ASP 197 Cb -0.15 -2.54 0.56 0.00 -1.46 0.00 0.00 42.92 39.33 1q86 s ASP 197 CO 0.08 -1.08 1.41 0.61 0.52 0.00 0.00 175.17 176.71 1q86 n GLY 198 N 4.44 -0.94 0.14 2.66 0.00 -1.26 -0.21 105.19 110.02 1q86 n GLY 198 Ca 0.12 -0.03 -0.22 0.00 0.00 0.00 0.00 46.02 45.89 1q86 n GLY 198 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1q86 h ASP 199 N 0.00 0.52 0.08 1.61 3.32 -1.91 -3.41 116.42 116.63 1q86 h ASP 199 Ca 0.00 -0.88 -0.37 0.00 0.02 0.00 0.00 57.03 55.80 1q86 h ASP 199 Cb 0.21 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 39.55 1q86 h ASP 199 CO 0.00 1.76 -2.22 0.41 -1.72 0.00 0.00 179.24 177.46 1q86 n THR 200 N -3.53 1.62 -4.47 0.35 -1.04 -1.12 -3.09 114.28 103.01 1q86 n THR 200 Ca -0.26 -0.63 -0.30 0.00 -2.04 0.00 0.00 64.05 60.82 1q86 n THR 200 Cb 1.06 -1.50 -0.12 0.00 -1.82 0.00 0.00 70.33 67.96 1q86 n THR 200 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1q86 s GLU 201 N -2.54 1.97 0.34 -2.82 2.02 0.71 -2.19 118.70 116.18 1q86 s GLU 201 Ca -0.27 -1.06 0.09 0.00 0.02 0.00 0.00 54.97 53.75 1q86 s GLU 201 Cb 0.08 -2.18 -0.05 0.00 0.10 0.00 0.00 34.13 32.08 1q86 s GLU 201 CO 0.70 0.51 0.01 0.00 0.02 0.00 0.00 175.26 176.50 1q86 s ALA 202 N -1.04 3.20 0.13 5.21 0.00 -1.04 -4.25 121.76 123.97 1q86 s ALA 202 Ca 0.17 -1.94 0.11 0.00 0.00 0.00 0.00 51.96 50.29 1q86 s ALA 202 Cb -0.11 -0.39 -0.04 0.00 0.00 0.00 0.00 23.12 22.58 1q86 s ALA 202 CO 0.08 0.08 -0.25 0.54 0.00 0.00 0.00 175.76 176.21 1q86 s VAL 203 N -2.51 2.38 -0.18 0.00 0.11 -0.43 -2.34 120.40 117.43 1q86 s VAL 203 Ca 0.35 -1.73 -0.00 0.00 -2.93 0.00 0.00 61.98 57.67 1q86 s VAL 203 Cb -0.01 -2.07 0.04 0.00 -1.53 0.00 0.00 36.38 32.82 1q86 s VAL 203 CO 0.19 0.08 -0.06 -0.60 -3.33 0.00 0.00 175.10 171.38 1q86 s ARG 204 N -2.12 1.57 -0.15 1.54 3.52 -0.22 -0.95 118.95 122.13 1q86 s ARG 204 Ca 0.15 -0.64 -0.29 0.00 -0.13 0.00 0.00 55.73 54.82 1q86 s ARG 204 Cb -0.10 -2.17 -0.01 0.00 -1.56 0.00 0.00 34.95 31.11 1q86 s ARG 204 CO 0.07 -0.45 1.14 0.42 -0.81 0.00 0.00 175.30 175.67 1q86 s ILE 205 N 1.56 4.47 0.50 4.11 1.01 -1.26 -0.55 121.20 131.04 1q86 s ILE 205 Ca -0.00 1.78 -0.18 0.00 0.00 0.00 0.00 60.65 62.24 1q86 s ILE 205 Cb -0.16 -4.14 -0.14 0.00 0.01 0.00 0.00 42.46 38.03 1q86 s ILE 205 CO -0.08 -0.10 0.01 0.00 0.00 0.00 0.00 174.94 174.77 1q86 n ALA 206 N 6.00 -2.72 0.20 9.38 0.00 -0.23 -4.81 120.51 128.33 1q86 n ALA 206 Ca 0.12 -0.02 0.07 0.00 0.00 0.00 0.00 53.44 53.60 1q86 n ALA 206 Cb 0.46 -1.49 0.37 0.00 0.00 0.00 0.00 19.45 18.79 1q86 n ALA 206 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1q86 h SER 207 N 0.07 0.00 0.18 0.00 4.64 -1.93 -3.06 113.55 113.45 1q86 h SER 207 Ca -0.41 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.85 1q86 h SER 207 Cb 1.44 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.52 1q86 h SER 207 CO 0.43 0.33 -0.23 0.11 -0.87 0.00 0.00 176.83 176.60 1q86 h LYS 208 N 0.00 0.09 -6.62 4.77 1.57 -1.99 -3.44 116.57 110.95 1q86 h LYS 208 Ca -0.00 -0.03 -0.55 0.00 -1.87 0.00 0.00 60.65 58.20 1q86 h LYS 208 Cb 0.85 -0.01 0.07 0.00 0.08 0.00 0.00 32.23 33.21 1q86 h LYS 208 CO 0.04 0.33 0.86 0.28 -0.57 0.00 0.00 179.45 180.39 1q86 n VAL 209 N -4.23 0.33 -1.89 0.50 0.31 -1.16 -4.97 118.33 107.23 1q86 n VAL 209 Ca -0.02 -0.08 -0.31 0.00 -0.01 0.00 0.00 64.34 63.92 1q86 n VAL 209 Cb 0.31 -1.76 0.01 0.00 -0.91 0.00 0.00 33.84 31.49 1q86 n VAL 209 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1q86 s GLY 210 N 0.83 1.71 0.31 2.92 0.00 -1.26 -4.83 107.32 107.00 1q86 s GLY 210 Ca 0.73 -0.04 0.07 0.00 0.00 0.00 0.00 44.72 45.49 1q86 s GLY 210 CO 0.40 0.24 1.75 0.00 0.00 0.00 0.00 173.10 175.49 1q86 h ALA 211 N -0.23 1.70 0.11 3.20 0.00 -1.97 0.10 119.26 122.17 1q86 h ALA 211 Ca -0.44 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 1q86 h ALA 211 Cb 1.19 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1q86 h ALA 211 CO 0.61 -0.15 -0.05 -0.09 0.00 0.00 0.00 179.25 179.57 1q86 h ARG 212 N 0.67 -0.14 0.00 0.00 2.43 -2.01 -2.06 114.38 113.27 1q86 h ARG 212 Ca 0.60 0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.69 1q86 h ARG 212 Cb 1.04 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.61 1q86 h ARG 212 CO -0.43 -0.06 -0.47 -0.22 -1.51 0.00 0.00 179.97 177.28 1q86 h LYS 213 N -0.19 0.00 0.41 0.20 3.64 -1.77 -3.23 116.57 115.63 1q86 h LYS 213 Ca -0.01 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 1q86 h LYS 213 Cb 0.15 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 1q86 h LYS 213 CO 0.02 0.47 -0.19 0.00 -2.27 0.00 0.00 179.45 177.48 1q86 h ARG 214 N 0.00 -0.52 -0.89 1.90 3.08 -0.60 -1.89 114.38 115.46 1q86 h ARG 214 Ca -0.00 0.04 0.24 0.00 0.07 0.00 0.00 59.98 60.32 1q86 h ARG 214 Cb 1.04 0.12 -0.14 0.00 0.08 0.00 0.00 29.97 31.08 1q86 h ARG 214 CO 0.06 -0.30 0.31 1.49 -1.07 0.00 0.00 179.97 180.45 1q86 h GLU 215 N -0.63 0.26 0.42 0.04 4.81 -1.39 0.81 114.58 118.89 1q86 h GLU 215 Ca -0.06 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.14 1q86 h GLU 215 Cb 0.47 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.79 1q86 h GLU 215 CO 0.09 0.17 -0.20 0.00 -0.73 0.00 0.00 179.01 178.34 1q86 h ARG 216 N 0.27 -0.54 -0.24 1.92 3.08 -1.57 -2.31 114.38 114.99 1q86 h ARG 216 Ca 0.57 0.04 0.06 0.00 0.07 0.00 0.00 59.98 60.71 1q86 h ARG 216 Cb 1.14 0.12 -0.07 0.00 0.08 0.00 0.00 29.97 31.24 1q86 h ARG 216 CO -0.61 -0.23 -0.27 0.82 -1.07 0.00 0.00 179.97 178.61 1q86 h ILE 217 N -0.91 0.35 -0.98 2.04 2.04 -0.31 -1.63 117.51 118.11 1q86 h ILE 217 Ca -0.06 0.00 0.14 0.00 1.00 0.00 0.00 64.86 65.94 1q86 h ILE 217 Cb 0.56 0.35 -0.09 0.00 -0.74 0.00 0.00 36.82 36.90 1q86 h ILE 217 CO 0.09 0.00 0.60 -0.33 0.00 0.00 0.00 178.15 178.52 1q86 h GLU 218 N -0.28 0.87 -0.08 2.37 5.08 0.53 0.87 114.58 123.95 1q86 h GLU 218 Ca 0.13 -0.05 -0.19 0.00 -1.00 0.00 0.00 59.36 58.25 1q86 h GLU 218 Cb 0.49 -0.20 0.01 0.00 0.50 0.00 0.00 28.75 29.55 1q86 h GLU 218 CO -0.40 0.58 -0.70 1.05 -1.00 0.00 0.00 179.01 178.54 1q86 h GLU 219 N 0.90 0.61 0.00 2.33 4.11 -0.76 -2.83 114.58 118.93 1q86 h GLU 219 Ca 0.51 -0.55 -0.06 0.00 0.07 0.00 0.00 59.36 59.33 1q86 h GLU 219 Cb 0.60 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 1q86 h GLU 219 CO -0.30 1.17 -0.28 1.49 0.07 0.00 0.00 179.01 181.16 1q86 h GLU 220 N 0.24 0.00 -0.33 1.06 4.81 -1.07 -2.61 114.58 116.69 1q86 h GLU 220 Ca -0.07 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.01 1q86 h GLU 220 Cb 1.36 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.73 1q86 h GLU 220 CO 0.14 0.28 -0.42 0.00 -0.73 0.00 0.00 179.01 178.27 1q86 h ALA 221 N 1.72 0.63 -0.52 2.92 0.00 -0.85 -2.46 119.26 120.72 1q86 h ALA 221 Ca -0.00 -0.46 -0.11 0.00 0.00 0.00 0.00 54.91 54.33 1q86 h ALA 221 Cb 1.01 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 1q86 h ALA 221 CO 0.04 0.67 -0.13 1.49 0.00 0.00 0.00 179.25 181.32 1q86 h GLU 222 N 0.66 1.00 0.00 0.00 4.81 -1.36 -0.05 114.58 119.63 1q86 h GLU 222 Ca 0.05 -0.38 -0.02 0.00 -0.13 0.00 0.00 59.36 58.87 1q86 h GLU 222 Cb 1.00 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 30.32 1q86 h GLU 222 CO 0.10 1.06 -0.10 -0.44 -0.73 0.00 0.00 179.01 178.90 1q86 h ASP 223 N 0.87 0.00 -0.41 1.04 3.32 -1.32 0.47 116.42 120.39 1q86 h ASP 223 Ca 0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 1q86 h ASP 223 Cb 0.69 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.24 1q86 h ASP 223 CO 0.05 0.10 0.00 0.00 -1.72 0.00 0.00 179.24 177.67 1q86 n ALA 224 N -2.24 2.45 -1.25 3.45 0.00 -0.94 -4.89 120.51 117.09 1q86 n ALA 224 Ca -0.02 -0.72 -0.09 0.00 0.00 0.00 0.00 53.44 52.62 1q86 n ALA 224 Cb 0.24 -0.97 -0.04 0.00 0.00 0.00 0.00 19.45 18.68 1q86 n ALA 224 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1q86 n GLY 225 N 1.14 1.04 3.81 0.00 0.00 0.16 -4.59 105.19 106.75 1q86 n GLY 225 Ca 0.14 -0.58 -0.36 0.00 0.00 0.00 0.00 46.02 45.22 1q86 n GLY 225 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1q86 s ILE 226 N -2.29 5.45 0.32 -0.61 1.01 -0.06 -4.55 121.20 120.46 1q86 s ILE 226 Ca 0.00 0.23 -0.16 0.00 0.00 0.00 0.00 60.65 60.72 1q86 s ILE 226 Cb 0.00 -3.44 -0.09 0.00 0.01 0.00 0.00 42.46 38.94 1q86 s ILE 226 CO 0.00 0.54 0.74 -0.60 0.00 0.00 0.00 174.94 175.62 1q86 s ARG 227 N -0.41 4.04 -0.22 2.79 3.52 -1.26 -3.80 118.95 123.61 1q86 s ARG 227 Ca 0.12 0.71 -0.02 0.00 -0.13 0.00 0.00 55.73 56.41 1q86 s ARG 227 Cb -0.12 -2.47 0.01 0.00 -1.56 0.00 0.00 34.95 30.81 1q86 s ARG 227 CO 0.02 0.18 -0.08 0.08 -0.81 0.00 0.00 175.30 174.68 1q86 s VAL 228 N -1.94 2.98 0.32 7.11 1.01 -1.26 -1.31 120.40 127.31 1q86 s VAL 228 Ca 0.53 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.82 1q86 s VAL 228 Cb -0.11 -2.37 0.20 0.00 0.00 0.00 0.00 36.38 34.10 1q86 s VAL 228 CO 0.18 0.40 1.92 -0.07 0.00 0.00 0.00 175.10 177.52 1q86 h LEU 229 N 8.06 0.68 -7.17 3.92 3.38 -1.42 -3.31 115.31 119.44 1q86 h LEU 229 Ca -0.41 -0.08 -0.65 0.00 0.09 0.00 0.00 57.88 56.83 1q86 h LEU 229 Cb 1.14 -0.17 -0.39 0.00 0.09 0.00 0.00 40.66 41.33 1q86 h LEU 229 CO 0.61 0.61 -0.38 0.54 0.09 0.00 0.00 178.44 179.90 1q86 s ASN 230 N -6.58 5.30 0.48 -0.43 4.22 -1.26 -5.09 114.94 111.58 1q86 s ASN 230 Ca -0.09 -3.82 -0.13 0.00 -2.14 0.00 0.00 52.86 46.68 1q86 s ASN 230 Cb 0.16 -1.74 -0.07 0.00 1.28 0.00 0.00 41.25 40.88 1q86 s ASN 230 CO 0.78 -0.12 0.90 -2.16 -2.04 0.00 0.00 177.10 174.46 1q86 s PRO 231 N -1.43 3.84 0.11 3.55 0.04 -1.25 -4.79 135.00 135.06 1q86 s PRO 231 Ca 0.26 0.73 -0.26 0.00 0.04 0.00 0.00 61.00 61.77 1q86 s PRO 231 Cb -0.05 -2.23 -0.07 0.00 0.04 0.00 0.00 34.50 32.19 1q86 s PRO 231 CO -0.15 -0.21 0.82 0.99 0.04 0.00 0.00 177.00 178.48 1q86 s THR 232 N -2.59 4.52 -0.37 1.26 2.01 -1.26 -4.83 115.64 114.38 1q86 s THR 232 Ca 0.55 1.76 -0.13 0.00 0.31 0.00 0.00 61.69 64.18 1q86 s THR 232 Cb -0.10 -4.17 0.01 0.00 0.01 0.00 0.00 72.50 68.24 1q86 s THR 232 CO 0.34 0.42 0.26 -0.31 -0.69 0.00 0.00 174.62 174.64 1q86 s TYR 233 N -0.48 3.23 0.19 4.92 1.51 -1.26 -1.82 117.35 123.63 1q86 s TYR 233 Ca 0.39 -0.51 0.05 0.00 -1.01 0.00 0.00 57.07 56.00 1q86 s TYR 233 Cb -0.22 -2.51 -0.04 0.00 -0.11 0.00 0.00 41.96 39.08 1q86 s TYR 233 CO 0.26 -0.51 0.18 0.08 -1.11 0.00 0.00 175.55 174.45 1q86 s VAL 234 N 1.67 4.63 -0.33 0.71 1.01 -1.00 -4.80 120.40 122.29 1q86 s VAL 234 Ca 0.05 -1.11 -0.20 0.00 0.00 0.00 0.00 61.98 60.72 1q86 s VAL 234 Cb -0.18 -3.41 -0.00 0.00 0.00 0.00 0.00 36.38 32.78 1q86 s VAL 234 CO 0.09 -0.18 0.62 -1.61 0.00 0.00 0.00 175.10 174.03 1q86 s GLU 235 N -3.36 3.80 0.00 2.72 8.01 -1.26 -0.18 118.70 128.42 1q86 s GLU 235 Ca 0.32 0.17 0.00 0.00 0.01 0.00 0.00 54.97 55.47 1q86 s GLU 235 Cb -0.10 -3.76 0.00 0.00 -4.31 0.00 0.00 34.13 25.96 1q86 s GLU 235 CO 0.25 -0.64 0.47 0.28 0.01 0.00 0.00 175.26 175.63