#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d1r n GLY 30 N 0.00 -0.84 3.64 0.72 0.00 -1.26 -5.16 105.19 102.29 1d1r n GLY 30 Ca 0.00 -1.53 -0.03 0.00 0.00 0.00 0.00 46.02 44.45 1d1r n GLY 30 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1d1r s ASP 31 N -2.30 -0.09 -0.14 1.61 1.01 -1.26 -5.15 116.67 110.35 1d1r s ASP 31 Ca 0.00 0.15 -0.00 0.00 0.71 0.00 0.00 52.55 53.41 1d1r s ASP 31 Cb 0.00 0.15 0.03 0.00 1.01 0.00 0.00 42.92 44.10 1d1r s ASP 31 CO 0.00 -0.05 -0.10 -0.83 0.21 0.00 0.00 175.17 174.40 1d1r s GLY 32 N -0.29 1.01 -0.46 0.21 0.00 -1.26 -4.86 107.32 101.66 1d1r s GLY 32 Ca 0.07 -0.79 0.03 0.00 0.00 0.00 0.00 44.72 44.03 1d1r s GLY 32 CO -0.12 0.69 0.24 -1.34 0.00 0.00 0.00 173.10 172.57 1d1r s VAL 33 N 1.58 1.88 0.34 1.40 -7.23 -1.26 -2.85 120.40 114.26 1d1r s VAL 33 Ca 0.04 -2.81 0.04 0.00 -1.81 0.00 0.00 61.98 57.44 1d1r s VAL 33 Cb -0.13 -2.32 -0.02 0.00 0.56 0.00 0.00 36.38 34.48 1d1r s VAL 33 CO -0.09 -0.84 0.51 -0.69 -0.31 0.00 0.00 175.10 173.67 1d1r s VAL 34 N 0.16 4.45 -0.14 1.32 1.01 -0.85 -4.53 120.40 121.83 1d1r s VAL 34 Ca 0.17 -0.80 -0.05 0.00 0.00 0.00 0.00 61.98 61.29 1d1r s VAL 34 Cb -0.25 -3.59 0.07 0.00 0.00 0.00 0.00 36.38 32.61 1d1r s VAL 34 CO -0.01 -0.29 0.29 -0.13 0.00 0.00 0.00 175.10 174.96 1d1r s ARG 35 N -4.24 0.19 -0.49 2.72 0.52 -1.24 -2.08 118.95 114.33 1d1r s ARG 35 Ca 0.43 0.77 0.00 0.00 -0.52 0.00 0.00 55.73 56.41 1d1r s ARG 35 Cb -0.10 0.01 0.13 0.00 0.52 0.00 0.00 34.95 35.51 1d1r s ARG 35 CO 0.33 -0.26 0.26 0.42 0.02 0.00 0.00 175.30 176.07 1d1r s ILE 36 N 2.26 3.02 0.35 1.52 1.09 -1.26 -3.22 121.20 124.96 1d1r s ILE 36 Ca -0.01 -2.72 0.04 0.00 -1.10 0.00 0.00 60.65 56.86 1d1r s ILE 36 Cb -0.12 -3.07 0.04 0.00 -1.06 0.00 0.00 42.46 38.26 1d1r s ILE 36 CO -0.09 -0.76 0.33 0.00 -0.10 0.00 0.00 174.94 174.32 1d1r n GLN 37 N 3.80 0.92 -4.99 2.79 10.64 -1.26 -4.77 117.38 124.51 1d1r n GLN 37 Ca 0.04 -2.08 -0.29 0.00 -1.83 0.00 0.00 57.00 52.85 1d1r n GLN 37 Cb 0.38 0.12 -0.15 0.00 -0.86 0.00 0.00 30.24 29.73 1d1r n GLN 37 CO 0.00 0.00 0.00 1.03 -1.83 0.00 0.00 177.06 176.26 1d1r s ARG 38 N -3.47 1.77 -0.45 2.61 0.52 -1.26 -3.01 118.95 115.66 1d1r s ARG 38 Ca 0.25 -0.93 -0.10 0.00 -0.52 0.00 0.00 55.73 54.42 1d1r s ARG 38 Cb -0.02 -1.81 0.10 0.00 0.52 0.00 0.00 34.95 33.74 1d1r s ARG 38 CO 0.16 0.48 0.33 -1.14 0.02 0.00 0.00 175.30 175.14 1d1r s GLN 39 N -0.86 2.62 -0.02 3.54 0.74 -0.96 -4.97 119.66 119.76 1d1r s GLN 39 Ca 0.09 -1.59 0.05 0.00 0.05 0.00 0.00 55.36 53.96 1d1r s GLN 39 Cb -0.09 -3.91 -0.01 0.00 1.10 0.00 0.00 33.01 30.09 1d1r s GLN 39 CO 0.00 -1.09 -0.18 -0.08 -0.55 0.00 0.00 175.29 173.40 1d1r s THR 40 N 1.43 1.41 -0.26 -0.34 -1.32 -1.26 -4.09 115.64 111.21 1d1r s THR 40 Ca 0.04 -0.76 -0.26 0.00 -1.21 0.00 0.00 61.69 59.50 1d1r s THR 40 Cb -0.25 -1.18 0.14 0.00 -1.51 0.00 0.00 72.50 69.71 1d1r s THR 40 CO 0.01 0.40 1.14 -0.94 -2.21 0.00 0.00 174.62 173.02 1d1r s SER 41 N -0.36 -0.31 0.34 8.08 1.04 -1.26 -5.15 113.70 116.08 1d1r s SER 41 Ca 0.05 0.54 0.00 0.00 0.48 0.00 0.00 55.95 57.02 1d1r s SER 41 Cb -0.08 0.52 0.00 0.00 0.10 0.00 0.00 66.02 66.56 1d1r s SER 41 CO -0.00 -0.16 0.00 0.61 0.98 0.00 0.00 173.24 174.67 1d1r n GLY 42 N 1.61 -1.80 3.97 7.32 0.00 -1.26 -4.92 105.19 110.12 1d1r n GLY 42 Ca -0.11 -1.27 -0.23 0.00 0.00 0.00 0.00 46.02 44.41 1d1r n GLY 42 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1d1r s ARG 43 N -0.84 2.29 -0.46 1.61 1.70 -1.26 -4.82 118.95 117.17 1d1r s ARG 43 Ca 0.00 -1.81 -0.01 0.00 -0.47 0.00 0.00 55.73 53.44 1d1r s ARG 43 Cb 0.00 -2.39 -0.01 0.00 -0.57 0.00 0.00 34.95 31.98 1d1r s ARG 43 CO 0.00 -0.73 0.42 1.17 -1.08 0.00 0.00 175.30 175.08 1d1r n LYS 44 N -2.01 -0.88 0.00 3.89 4.81 -1.26 -5.06 118.16 117.66 1d1r n LYS 44 Ca 0.07 0.88 0.00 0.00 -0.87 0.00 0.00 58.31 58.40 1d1r n LYS 44 Cb 0.63 -3.86 0.00 0.00 0.02 0.00 0.00 35.03 31.82 1d1r n LYS 44 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1d1r n GLY 45 N -1.40 1.14 0.07 3.14 0.00 -1.26 -5.04 105.19 101.84 1d1r n GLY 45 Ca -0.01 -0.16 -0.03 0.00 0.00 0.00 0.00 46.02 45.82 1d1r n GLY 45 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1d1r n LYS 46 N -0.03 0.68 0.00 1.61 5.02 -1.26 -5.07 118.16 119.11 1d1r n LYS 46 Ca 0.00 -0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.24 1d1r n LYS 46 Cb 0.00 -1.54 0.00 0.00 -0.02 0.00 0.00 35.03 33.47 1d1r n LYS 46 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1d1r n GLY 47 N 1.59 3.11 3.15 0.72 0.00 -1.26 -5.01 105.19 107.48 1d1r n GLY 47 Ca -0.23 -1.67 -0.09 0.00 0.00 0.00 0.00 46.02 44.02 1d1r n GLY 47 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1d1r s VAL 48 N -1.63 0.30 -0.07 1.61 -7.23 -1.26 -4.53 120.40 107.59 1d1r s VAL 48 Ca 0.00 -1.89 0.02 0.00 -1.81 0.00 0.00 61.98 58.30 1d1r s VAL 48 Cb 0.00 -1.83 -0.03 0.00 0.56 0.00 0.00 36.38 35.08 1d1r s VAL 48 CO 0.00 -0.70 -0.11 0.00 -0.31 0.00 0.00 175.10 173.99 1d1r s LEU 50 N -0.57 1.33 -0.04 0.00 2.34 -1.16 -2.11 118.68 118.46 1d1r s LEU 50 Ca 0.08 -0.68 -0.24 0.00 0.06 0.00 0.00 54.13 53.36 1d1r s LEU 50 Cb -0.12 -0.72 -0.04 0.00 -0.56 0.00 0.00 46.19 44.76 1d1r s LEU 50 CO 0.02 -0.24 0.73 -0.63 -1.06 0.00 0.00 176.35 175.16 1d1r s ILE 51 N 1.77 4.98 0.16 1.48 1.09 -0.81 -4.09 121.20 125.77 1d1r s ILE 51 Ca 0.00 1.51 0.03 0.00 -1.10 0.00 0.00 60.65 61.09 1d1r s ILE 51 Cb -0.16 -4.07 -0.01 0.00 -1.06 0.00 0.00 42.46 37.17 1d1r s ILE 51 CO -0.07 0.27 0.16 0.35 -0.10 0.00 0.00 174.94 175.55 1d1r n THR 52 N 3.57 0.00 -3.76 2.92 -2.24 -1.20 -2.13 114.28 111.45 1d1r n THR 52 Ca -0.01 -1.06 -0.23 0.00 -2.27 0.00 0.00 64.05 60.47 1d1r n THR 52 Cb 0.51 0.56 0.02 0.00 -2.10 0.00 0.00 70.33 69.32 1d1r n THR 52 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1d1r n GLY 53 N -0.29 -0.37 3.49 3.38 0.00 -1.26 -3.60 105.19 106.54 1d1r n GLY 53 Ca 0.03 0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.80 1d1r n GLY 53 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1d1r s VAL 54 N -3.73 5.12 -1.14 1.61 1.01 -1.26 -4.10 120.40 117.91 1d1r s VAL 54 Ca 0.06 -0.33 -0.09 0.00 0.00 0.00 0.00 61.98 61.62 1d1r s VAL 54 Cb -0.02 -4.00 0.26 0.00 0.00 0.00 0.00 36.38 32.62 1d1r s VAL 54 CO 0.84 -0.37 1.27 0.47 0.00 0.00 0.00 175.10 177.31 1d1r n ASP 55 N 5.53 5.58 -1.54 3.32 9.92 -1.26 -4.91 116.55 133.18 1d1r n ASP 55 Ca -0.08 -3.08 0.00 0.00 -0.53 0.00 0.00 54.79 51.10 1d1r n ASP 55 Cb 0.48 -1.41 0.00 0.00 -0.64 0.00 0.00 41.12 39.55 1d1r n ASP 55 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1d1r n LEU 56 N 3.13 0.00 -0.07 0.64 7.99 -1.26 -4.72 117.00 122.70 1d1r n LEU 56 Ca 0.28 0.00 -0.07 0.00 -0.01 0.00 0.00 56.01 56.21 1d1r n LEU 56 Cb 0.39 0.00 -0.02 0.00 -0.11 0.00 0.00 43.42 43.68 1d1r n LEU 56 CO 0.55 -0.08 -0.51 0.47 -1.51 0.00 0.00 177.39 176.32 1d1r n ASP 57 N -1.09 1.70 0.00 -1.43 9.92 -1.26 -5.03 116.55 119.36 1d1r n ASP 57 Ca 0.00 0.40 0.00 0.00 -0.53 0.00 0.00 54.79 54.66 1d1r n ASP 57 Cb 0.00 -0.76 0.00 0.00 -0.64 0.00 0.00 41.12 39.72 1d1r n ASP 57 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 1d1r n ASP 58 N -4.30 0.00 0.20 -2.24 -0.08 -1.26 -4.94 116.55 103.94 1d1r n ASP 58 Ca -0.10 0.00 0.09 0.00 -1.51 0.00 0.00 54.79 53.27 1d1r n ASP 58 Cb 0.39 0.00 0.30 0.00 2.34 0.00 0.00 41.12 44.14 1d1r n ASP 58 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1d1r h ALA 59 N 0.00 0.91 -0.01 -1.67 0.00 -2.00 -3.08 119.26 113.41 1d1r h ALA 59 Ca 0.00 -0.22 -0.19 0.00 0.00 0.00 0.00 54.91 54.50 1d1r h ALA 59 Cb 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1d1r h ALA 59 CO 0.00 0.30 -0.84 0.93 0.00 0.00 0.00 179.25 179.64 1d1r h GLU 60 N 0.00 0.26 -0.35 0.00 3.07 -1.98 -2.36 114.58 113.22 1d1r h GLU 60 Ca -0.00 -0.26 -0.05 0.00 -0.50 0.00 0.00 59.36 58.55 1d1r h GLU 60 Cb 0.96 0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.93 1d1r h GLU 60 CO 0.03 0.96 0.01 1.25 -1.40 0.00 0.00 179.01 179.86 1d1r h LEU 61 N 0.15 0.60 -1.11 1.33 6.46 -1.92 -1.63 115.31 119.20 1d1r h LEU 61 Ca -0.04 -0.30 -0.09 0.00 -0.12 0.00 0.00 57.88 57.33 1d1r h LEU 61 Cb 1.45 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 41.21 1d1r h LEU 61 CO 0.13 0.75 -0.44 0.74 -0.62 0.00 0.00 178.44 179.00 1d1r h THR 62 N 0.43 1.29 -0.18 1.05 2.02 -1.57 -2.28 112.91 113.67 1d1r h THR 62 Ca 0.10 -1.52 -0.15 0.00 0.77 0.00 0.00 66.41 65.61 1d1r h THR 62 Cb 0.43 1.83 -0.01 0.00 -1.74 0.00 0.00 68.15 68.66 1d1r h THR 62 CO 0.02 0.43 -0.51 0.50 0.37 0.00 0.00 175.52 176.33 1d1r h LYS 63 N 0.00 0.50 0.38 6.66 3.64 -1.09 -2.18 116.57 124.48 1d1r h LYS 63 Ca -0.00 -0.30 -0.02 0.00 -1.27 0.00 0.00 60.65 59.06 1d1r h LYS 63 Cb 0.79 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.64 1d1r h LYS 63 CO 0.06 0.89 -0.18 1.25 -2.27 0.00 0.00 179.45 179.20 1d1r h LEU 64 N 0.39 -0.43 -0.78 5.20 7.12 -1.03 -1.51 115.31 124.28 1d1r h LEU 64 Ca 0.02 0.00 0.18 0.00 0.13 0.00 0.00 57.88 58.21 1d1r h LEU 64 Cb 1.02 0.11 -0.12 0.00 -0.53 0.00 0.00 40.66 41.15 1d1r h LEU 64 CO 0.09 0.01 0.20 0.00 -0.13 0.00 0.00 178.44 178.61 1d1r h ALA 65 N -1.11 1.04 -0.70 1.25 0.00 -1.50 0.26 119.26 118.49 1d1r h ALA 65 Ca -0.05 0.18 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1d1r h ALA 65 Cb 0.40 0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 1d1r h ALA 65 CO 0.09 -0.36 0.28 0.00 0.00 0.00 0.00 179.25 179.26 1d1r h ALA 66 N 1.65 0.91 -0.31 0.00 0.00 -1.44 -0.80 119.26 119.27 1d1r h ALA 66 Ca 0.45 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 55.20 1d1r h ALA 66 Cb 0.80 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1d1r h ALA 66 CO -0.54 0.52 0.21 1.49 0.00 0.00 0.00 179.25 180.93 1d1r h GLU 67 N 0.99 0.34 0.00 0.00 4.81 0.56 -0.38 114.58 120.91 1d1r h GLU 67 Ca 0.23 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.39 1d1r h GLU 67 Cb 0.20 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 1d1r h GLU 67 CO -0.02 0.22 -0.50 -0.07 -0.73 0.00 0.00 179.01 177.92 1d1r h LEU 68 N 0.35 0.00 -0.73 1.64 3.38 -0.50 -3.23 115.31 116.23 1d1r h LEU 68 Ca 0.12 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1d1r h LEU 68 Cb 0.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 1d1r h LEU 68 CO -0.03 0.23 -0.08 0.50 0.09 0.00 0.00 178.44 179.15 1d1r h LYS 69 N 0.00 0.00 0.00 1.13 3.64 0.35 -2.20 116.57 119.49 1d1r h LYS 69 Ca -0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1d1r h LYS 69 Cb 1.19 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 1d1r h LYS 69 CO 0.03 0.08 0.00 1.63 -2.27 0.00 0.00 179.45 178.92 1d1r n LYS 70 N -3.15 0.20 -2.50 1.90 5.02 -0.94 -3.64 118.16 115.04 1d1r n LYS 70 Ca 0.02 0.33 -0.00 0.00 -2.02 0.00 0.00 58.31 56.63 1d1r n LYS 70 Cb 0.45 -1.81 0.05 0.00 -0.02 0.00 0.00 35.03 33.70 1d1r n LYS 70 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1d1r n LYS 71 N -2.17 1.29 -0.05 1.97 4.76 -1.11 -4.95 118.16 117.91 1d1r n LYS 71 Ca 0.04 -2.68 -0.04 0.00 -2.87 0.00 0.00 58.31 52.75 1d1r n LYS 71 Cb 0.29 -0.84 -0.01 0.00 -1.84 0.00 0.00 35.03 32.63 1d1r n LYS 71 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1d1r n GLY 73 N 1.50 1.76 0.00 0.00 0.00 -1.26 -5.03 105.19 102.16 1d1r n GLY 73 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1d1r n GLY 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d1r n GLY 75 N 0.00 0.14 0.00 0.00 0.00 -1.26 -4.63 105.19 99.44 1d1r n GLY 75 Ca 0.00 0.73 0.00 0.00 0.00 0.00 0.00 46.02 46.75 1d1r n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1d1r n GLY 76 N 6.07 -0.97 3.78 -0.02 0.00 -1.26 -4.99 105.19 107.81 1d1r n GLY 76 Ca 0.40 -1.56 -0.36 0.00 0.00 0.00 0.00 46.02 44.50 1d1r n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d1r s ALA 77 N -3.74 3.04 -0.36 4.61 0.00 -1.26 -4.91 121.76 119.14 1d1r s ALA 77 Ca 0.00 0.73 -0.00 0.00 0.00 0.00 0.00 51.96 52.69 1d1r s ALA 77 Cb 0.00 -3.29 0.12 0.00 0.00 0.00 0.00 23.12 19.95 1d1r s ALA 77 CO 0.00 -0.31 0.18 0.08 0.00 0.00 0.00 175.76 175.71 1d1r s VAL 78 N -1.68 0.64 0.19 0.00 1.01 -1.26 -1.94 120.40 117.35 1d1r s VAL 78 Ca 0.60 -1.73 0.06 0.00 0.00 0.00 0.00 61.98 60.91 1d1r s VAL 78 Cb -0.22 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.65 1d1r s VAL 78 CO 0.28 -0.85 0.12 -0.75 0.00 0.00 0.00 175.10 173.90 1d1r s LYS 79 N 1.15 2.78 -0.60 2.72 2.20 -0.41 -5.02 119.74 122.57 1d1r s LYS 79 Ca 0.15 -0.99 -0.27 0.00 -0.36 0.00 0.00 55.97 54.50 1d1r s LYS 79 Cb -0.21 -2.55 -0.01 0.00 -1.51 0.00 0.00 37.83 33.55 1d1r s LYS 79 CO -0.11 0.45 1.74 -0.51 -0.36 0.00 0.00 175.35 176.56 1d1r s ASP 80 N -3.28 5.53 0.00 1.43 1.01 -1.26 -1.99 116.67 118.11 1d1r s ASP 80 Ca 0.31 0.32 0.00 0.00 0.71 0.00 0.00 52.55 53.89 1d1r s ASP 80 Cb -0.09 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.30 1d1r s ASP 80 CO 0.23 -2.18 0.00 0.61 0.21 0.00 0.00 175.17 174.04 1d1r n GLY 81 N 5.59 1.52 3.22 0.21 0.00 -1.26 -5.06 105.19 109.40 1d1r n GLY 81 Ca 0.18 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.12 1d1r n GLY 81 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1d1r s VAL 82 N -2.02 -0.67 -0.13 1.61 1.01 -0.84 -4.09 120.40 115.25 1d1r s VAL 82 Ca 0.00 0.11 0.02 0.00 0.00 0.00 0.00 61.98 62.10 1d1r s VAL 82 Cb 0.00 -0.72 0.02 0.00 0.00 0.00 0.00 36.38 35.67 1d1r s VAL 82 CO 0.00 0.03 -0.18 -0.63 0.00 0.00 0.00 175.10 174.32 1d1r s ILE 83 N 2.63 1.76 -0.03 2.22 1.01 -0.91 -1.28 121.20 126.60 1d1r s ILE 83 Ca 0.02 -0.79 -0.17 0.00 0.00 0.00 0.00 60.65 59.71 1d1r s ILE 83 Cb -0.13 -1.59 -0.05 0.00 0.01 0.00 0.00 42.46 40.69 1d1r s ILE 83 CO -0.14 0.49 0.46 -0.70 0.00 0.00 0.00 174.94 175.05 1d1r s GLU 84 N 1.05 4.13 -0.35 2.79 2.12 -0.82 -1.93 118.70 125.69 1d1r s GLU 84 Ca -0.03 0.47 0.00 0.00 0.36 0.00 0.00 54.97 55.77 1d1r s GLU 84 Cb -0.14 -3.31 0.11 0.00 0.26 0.00 0.00 34.13 31.05 1d1r s GLU 84 CO -0.05 0.47 0.15 0.42 -0.54 0.00 0.00 175.26 175.72 1d1r s ILE 85 N -0.42 0.98 0.24 -3.70 -1.09 -0.90 -4.20 121.20 112.12 1d1r s ILE 85 Ca 0.25 -1.79 -0.31 0.00 -2.23 0.00 0.00 60.65 56.57 1d1r s ILE 85 Cb -0.16 -1.72 -0.13 0.00 -1.58 0.00 0.00 42.46 38.86 1d1r s ILE 85 CO 0.13 -0.77 1.51 1.67 -1.23 0.00 0.00 174.94 176.24 1d1r n GLN 86 N 4.36 2.29 0.00 2.79 7.27 -1.26 -3.53 117.38 129.31 1d1r n GLN 86 Ca 0.03 0.82 0.00 0.00 0.07 0.00 0.00 57.00 57.91 1d1r n GLN 86 Cb 0.39 -2.54 0.00 0.00 2.41 0.00 0.00 30.24 30.50 1d1r n GLN 86 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1d1r n GLY 87 N 2.46 2.12 2.40 1.69 0.00 -1.26 -4.92 105.19 107.67 1d1r n GLY 87 Ca 0.12 -1.69 -0.27 0.00 0.00 0.00 0.00 46.02 44.18 1d1r n GLY 87 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1d1r s ASP 88 N 0.00 1.61 -0.34 1.61 1.01 -1.26 -4.14 116.67 115.16 1d1r s ASP 88 Ca 0.00 -2.96 0.16 0.00 0.71 0.00 0.00 52.55 50.46 1d1r s ASP 88 Cb 0.00 -0.43 0.44 0.00 1.01 0.00 0.00 42.92 43.95 1d1r s ASP 88 CO 0.00 -0.19 1.08 2.29 0.21 0.00 0.00 175.17 178.56 1d1r n LYS 89 N 3.00 1.20 -0.34 8.23 2.85 -1.26 -4.93 118.16 126.90 1d1r n LYS 89 Ca 0.28 -2.85 0.23 0.00 -1.05 0.00 0.00 58.31 54.91 1d1r n LYS 89 Cb 0.47 -0.92 0.49 0.00 -0.65 0.00 0.00 35.03 34.42 1d1r n LYS 89 CO 0.00 0.00 0.00 0.07 -0.05 0.00 0.00 177.40 177.42 1d1r h ARG 90 N 2.67 0.39 -0.22 -1.58 0.11 -1.94 0.18 114.38 113.99 1d1r h ARG 90 Ca -0.16 -0.02 0.04 0.00 0.10 0.00 0.00 59.98 59.94 1d1r h ARG 90 Cb 1.22 -0.09 -0.04 0.00 1.11 0.00 0.00 29.97 32.17 1d1r h ARG 90 CO 0.32 0.25 -0.02 -0.44 0.10 0.00 0.00 179.97 180.18 1d1r h ASP 91 N 0.40 -0.14 -0.59 0.08 3.32 -1.97 -1.26 116.42 116.26 1d1r h ASP 91 Ca 0.65 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.76 1d1r h ASP 91 Cb 1.58 0.11 -0.03 0.00 0.22 0.00 0.00 39.33 41.21 1d1r h ASP 91 CO -0.38 -0.04 0.38 0.25 -1.72 0.00 0.00 179.24 177.73 1d1r h LEU 92 N 0.04 0.68 -1.49 1.55 7.12 -1.07 -1.56 115.31 120.58 1d1r h LEU 92 Ca 0.10 -0.02 0.10 0.00 0.13 0.00 0.00 57.88 58.19 1d1r h LEU 92 Cb 0.15 -0.17 -0.05 0.00 -0.53 0.00 0.00 40.66 40.06 1d1r h LEU 92 CO -0.20 0.50 0.47 -0.07 -0.13 0.00 0.00 178.44 179.01 1d1r h LEU 93 N 0.80 0.51 0.77 2.25 -0.00 -0.78 0.46 115.31 119.32 1d1r h LEU 93 Ca 0.21 0.01 -0.04 0.00 -0.00 0.00 0.00 57.88 58.07 1d1r h LEU 93 Cb -0.08 -0.09 0.01 0.00 -0.00 0.00 0.00 40.66 40.49 1d1r h LEU 93 CO -0.05 0.30 -0.37 0.50 -0.00 0.00 0.00 178.44 178.83 1d1r h LYS 94 N 0.57 -1.00 0.00 1.13 3.64 -0.21 -1.82 116.57 118.88 1d1r h LYS 94 Ca 0.33 0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.77 1d1r h LYS 94 Cb 0.51 0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.56 1d1r h LYS 94 CO -0.11 -0.67 0.00 0.43 -2.27 0.00 0.00 179.45 176.83 1d1r n SER 95 N -4.89 0.51 0.13 4.20 7.64 -1.02 -1.99 113.62 118.21 1d1r n SER 95 Ca -0.13 0.70 -0.06 0.00 1.01 0.00 0.00 58.87 60.39 1d1r n SER 95 Cb 0.41 -0.78 -0.03 0.00 -1.01 0.00 0.00 64.21 62.80 1d1r n SER 95 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1d1r h LEU 96 N 0.00 -0.33 -1.65 -3.43 6.46 -0.12 -1.28 115.31 114.96 1d1r h LEU 96 Ca 0.00 0.01 -0.02 0.00 -0.12 0.00 0.00 57.88 57.75 1d1r h LEU 96 Cb 0.10 0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 40.10 1d1r h LEU 96 CO 0.00 0.02 0.02 0.25 -0.62 0.00 0.00 178.44 178.10 1d1r h LEU 97 N -0.90 0.22 -1.00 2.25 5.85 -1.22 -0.82 115.31 119.70 1d1r h LEU 97 Ca -0.04 -0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.59 1d1r h LEU 97 Cb 0.30 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1d1r h LEU 97 CO 0.07 0.25 -0.33 -0.08 -0.34 0.00 0.00 178.44 178.00 1d1r h GLU 98 N 0.24 0.00 0.00 1.25 4.81 -1.46 -2.61 114.58 116.82 1d1r h GLU 98 Ca 0.06 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.23 1d1r h GLU 98 Cb 0.14 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 1d1r h GLU 98 CO 0.00 0.33 -0.30 0.00 -0.73 0.00 0.00 179.01 178.31 1d1r h ALA 99 N 1.67 1.19 0.17 2.92 0.00 0.10 -3.06 119.26 122.25 1d1r h ALA 99 Ca -0.00 -0.27 -0.35 0.00 0.00 0.00 0.00 54.91 54.29 1d1r h ALA 99 Cb 0.85 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1d1r h ALA 99 CO 0.04 0.37 -1.75 -0.22 0.00 0.00 0.00 179.25 177.70 1d1r h LYS 100 N 0.00 0.36 0.00 0.00 3.64 -1.43 -3.48 116.57 115.66 1d1r h LYS 100 Ca -0.00 -0.62 0.00 0.00 -1.27 0.00 0.00 60.65 58.75 1d1r h LYS 100 Cb 0.67 0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.72 1d1r h LYS 100 CO 0.04 1.28 0.00 0.41 -2.27 0.00 0.00 179.45 178.91 1d1r n GLY 101 N 1.85 1.64 3.92 5.01 0.00 -1.01 -5.12 105.19 111.48 1d1r n GLY 101 Ca -0.24 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.50 1d1r n GLY 101 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1d1r s MET 102 N -0.06 3.53 -0.26 1.61 -1.94 -1.10 -5.04 119.30 116.04 1d1r s MET 102 Ca 0.00 -0.31 -0.28 0.00 -1.71 0.00 0.00 55.69 53.39 1d1r s MET 102 Cb 0.00 -2.84 0.01 0.00 2.01 0.00 0.00 34.83 34.01 1d1r s MET 102 CO 0.00 0.40 1.00 0.15 -0.01 0.00 0.00 175.02 176.56 1d1r s LYS 103 N -3.27 4.18 -0.08 2.03 3.01 -1.13 -4.41 119.74 120.07 1d1r s LYS 103 Ca 0.39 1.18 0.03 0.00 -1.01 0.00 0.00 55.97 56.55 1d1r s LYS 103 Cb -0.11 -3.67 -0.02 0.00 -1.01 0.00 0.00 37.83 33.02 1d1r s LYS 103 CO 0.29 -0.68 -0.16 0.54 0.51 0.00 0.00 175.35 175.84 1d1r s VAL 104 N 3.24 2.85 -0.58 3.17 0.11 -1.26 -2.00 120.40 125.93 1d1r s VAL 104 Ca 0.42 -0.77 -0.13 0.00 -2.93 0.00 0.00 61.98 58.57 1d1r s VAL 104 Cb -0.14 -2.14 0.15 0.00 -1.53 0.00 0.00 36.38 32.72 1d1r s VAL 104 CO 0.09 0.56 0.51 -0.75 -3.33 0.00 0.00 175.10 172.18 1d1r s LYS 105 N -0.19 2.97 0.54 1.54 2.20 -0.88 -4.91 119.74 121.01 1d1r s LYS 105 Ca -0.01 -1.91 0.40 0.00 -0.36 0.00 0.00 55.97 54.09 1d1r s LYS 105 Cb -0.13 -4.21 1.60 0.00 -1.51 0.00 0.00 37.83 33.58 1d1r s LYS 105 CO 0.03 -1.28 1.73 1.25 -0.36 0.00 0.00 175.35 176.72 1d1r h LEU 106 N 8.47 0.02 0.00 5.43 5.85 -1.90 -3.34 115.31 129.83 1d1r h LEU 106 Ca -0.18 0.01 0.29 0.00 0.84 0.00 0.00 57.88 58.83 1d1r h LEU 106 Cb 1.07 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 42.04 1d1r h LEU 106 CO 0.92 -0.00 -0.39 0.00 -0.34 0.00 0.00 178.44 178.63 1d1r n ALA 107 N -2.80 -2.75 0.00 1.25 0.00 -1.26 -4.38 120.51 110.57 1d1r n ALA 107 Ca 0.32 0.33 0.00 0.00 0.00 0.00 0.00 53.44 54.09 1d1r n ALA 107 Cb 1.48 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1d1r n ALA 107 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1d1r n GLY 108 N -3.24 0.08 3.56 0.00 0.00 -1.26 -5.03 105.19 99.31 1d1r n GLY 108 Ca 0.01 -0.92 -0.55 0.00 0.00 0.00 0.00 46.02 44.55 1d1r n GLY 108 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1d1r n GLY 109 N 0.00 0.18 3.29 -0.02 0.00 -1.26 -4.92 105.19 102.46 1d1r n GLY 109 Ca 0.00 0.73 0.03 0.00 0.00 0.00 0.00 46.02 46.78 1d1r n GLY 109 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1d1r s LEU 110 N 0.39 -0.35 0.00 0.99 0.20 -1.26 -5.27 118.68 113.39 1d1r s LEU 110 Ca 0.88 0.46 0.00 0.00 0.69 0.00 0.00 54.13 56.16 1d1r s LEU 110 Cb -1.09 1.39 0.00 0.00 -0.43 0.00 0.00 46.19 46.06 1d1r s LEU 110 CO 0.52 -0.07 0.22 -1.84 -0.29 0.00 0.00 176.35 174.89