#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 3.79 3.54 0.72 0.00 -1.26 -5.04 105.19 106.94 1d1r n GLY 30 Ca 0.00 -0.75 -0.33 0.00 0.00 0.00 0.00 46.02 44.94 1d1r n GLY 30 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1d1r n ASP 31 N 0.00 1.76 -4.71 1.61 5.68 -1.26 -4.89 116.55 114.74 1d1r n ASP 31 Ca 0.00 -0.54 -0.35 0.00 -0.50 0.00 0.00 54.79 53.40 1d1r n ASP 31 Cb 0.00 -1.45 0.10 0.00 -1.14 0.00 0.00 41.12 38.63 1d1r n ASP 31 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 1d1r s GLY 32 N 11.08 2.48 -0.28 6.12 0.00 -1.26 -4.94 107.32 120.52 1d1r s GLY 32 Ca 1.05 1.02 -0.03 0.00 0.00 0.00 0.00 44.72 46.76 1d1r s GLY 32 CO 0.29 1.44 0.18 -1.34 0.00 0.00 0.00 173.10 173.67 1d1r s VAL 33 N -1.80 -0.18 0.27 1.40 -7.23 -1.26 -3.44 120.40 108.15 1d1r s VAL 33 Ca 0.78 -0.61 -0.12 0.00 -1.81 0.00 0.00 61.98 60.22 1d1r s VAL 33 Cb -0.33 -0.94 -0.08 0.00 0.56 0.00 0.00 36.38 35.59 1d1r s VAL 33 CO 0.46 -0.60 0.62 -0.69 -0.31 0.00 0.00 175.10 174.58 1d1r s VAL 34 N 2.19 4.83 -0.14 1.32 1.01 -0.72 -4.49 120.40 124.41 1d1r s VAL 34 Ca 0.09 0.66 -0.00 0.00 0.00 0.00 0.00 61.98 62.72 1d1r s VAL 34 Cb -0.15 -3.61 0.03 0.00 0.00 0.00 0.00 36.38 32.64 1d1r s VAL 34 CO -0.33 -0.12 -0.10 -0.13 0.00 0.00 0.00 175.10 174.42 1d1r s ARG 35 N -2.89 1.87 -0.20 2.72 0.52 -1.21 -2.86 118.95 116.90 1d1r s ARG 35 Ca 0.50 -0.44 0.00 0.00 -0.52 0.00 0.00 55.73 55.27 1d1r s ARG 35 Cb -0.11 -1.89 0.02 0.00 0.52 0.00 0.00 34.95 33.49 1d1r s ARG 35 CO 0.20 -0.28 -0.15 0.42 0.02 0.00 0.00 175.30 175.51 1d1r s ILE 36 N 1.59 2.38 0.33 1.52 1.09 -1.26 -3.75 121.20 123.10 1d1r s ILE 36 Ca 0.04 -0.95 -0.11 0.00 -1.10 0.00 0.00 60.65 58.53 1d1r s ILE 36 Cb -0.13 -2.09 0.02 0.00 -1.06 0.00 0.00 42.46 39.20 1d1r s ILE 36 CO -0.09 0.42 0.60 0.00 -0.10 0.00 0.00 174.94 175.77 1d1r s GLN 37 N 1.31 1.91 -0.10 2.79 -2.07 -1.24 -4.69 119.66 117.57 1d1r s GLN 37 Ca 0.03 -1.45 -0.03 0.00 -1.82 0.00 0.00 55.36 52.08 1d1r s GLN 37 Cb -0.14 0.52 -0.04 0.00 -1.09 0.00 0.00 33.01 32.27 1d1r s GLN 37 CO -0.10 -0.84 0.04 -0.98 -1.32 0.00 0.00 175.29 172.10 1d1r s ARG 38 N -3.16 3.12 -0.50 9.60 1.70 -1.26 -2.79 118.95 125.66 1d1r s ARG 38 Ca 0.22 -0.32 0.07 0.00 -0.47 0.00 0.00 55.73 55.23 1d1r s ARG 38 Cb -0.02 -2.91 0.36 0.00 -0.57 0.00 0.00 34.95 31.80 1d1r s ARG 38 CO 0.13 0.73 0.94 0.94 -1.08 0.00 0.00 175.30 176.96 1d1r n GLN 39 N 2.08 2.73 -1.62 3.89 7.27 -1.08 -4.99 117.38 125.66 1d1r n GLN 39 Ca -0.19 -4.43 -0.30 0.00 0.07 0.00 0.00 57.00 52.15 1d1r n GLN 39 Cb 0.54 -2.08 0.09 0.00 2.41 0.00 0.00 30.24 31.19 1d1r n GLN 39 CO 0.00 0.00 0.00 -0.08 0.07 0.00 0.00 177.06 177.05 1d1r s THR 40 N -4.21 3.04 -0.30 1.69 -1.32 -1.26 -4.78 115.64 108.50 1d1r s THR 40 Ca 0.46 0.34 -0.24 0.00 -1.21 0.00 0.00 61.69 61.04 1d1r s THR 40 Cb 0.33 -3.14 0.18 0.00 -1.51 0.00 0.00 72.50 68.36 1d1r s THR 40 CO -0.13 -0.44 1.34 -0.55 -2.21 0.00 0.00 174.62 172.63 1d1r s SER 41 N -4.02 -0.14 0.00 8.08 0.15 -1.26 -5.02 113.70 111.50 1d1r s SER 41 Ca 0.61 0.25 0.00 0.00 0.70 0.00 0.00 55.95 57.51 1d1r s SER 41 Cb -0.14 0.39 0.00 0.00 -1.71 0.00 0.00 66.02 64.56 1d1r s SER 41 CO 0.54 -0.04 0.00 0.61 1.20 0.00 0.00 173.24 175.54 1d1r n GLY 42 N 1.95 3.33 3.52 9.45 0.00 -1.26 -5.04 105.19 117.14 1d1r n GLY 42 Ca -0.12 -0.90 -0.08 0.00 0.00 0.00 0.00 46.02 44.92 1d1r n GLY 42 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1d1r s ARG 43 N 0.00 0.74 -0.13 1.61 3.52 -1.26 -5.13 118.95 118.31 1d1r s ARG 43 Ca 0.00 -0.24 -0.27 0.00 -0.13 0.00 0.00 55.73 55.10 1d1r s ARG 43 Cb 0.00 0.34 -0.02 0.00 -1.56 0.00 0.00 34.95 33.72 1d1r s ARG 43 CO 0.00 -0.32 0.88 0.21 -0.81 0.00 0.00 175.30 175.26 1d1r s LYS 44 N -2.86 4.37 0.00 5.12 2.20 -1.26 -4.46 119.74 122.86 1d1r s LYS 44 Ca 0.05 1.14 0.00 0.00 -0.36 0.00 0.00 55.97 56.79 1d1r s LYS 44 Cb -0.01 -3.54 0.00 0.00 -1.51 0.00 0.00 37.83 32.77 1d1r s LYS 44 CO -0.08 -0.26 0.00 0.41 -0.36 0.00 0.00 175.35 175.07 1d1r n GLY 45 N 3.27 0.86 3.55 5.54 0.00 -1.26 -5.15 105.19 112.01 1d1r n GLY 45 Ca 0.05 -0.05 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1d1r n GLY 45 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1d1r s LYS 46 N 0.00 2.02 -0.21 1.61 -2.85 -1.26 -5.17 119.74 113.87 1d1r s LYS 46 Ca 0.00 -2.25 -0.29 0.00 -1.00 0.00 0.00 55.97 52.43 1d1r s LYS 46 Cb 0.00 -0.66 0.14 0.00 -2.06 0.00 0.00 37.83 35.25 1d1r s LYS 46 CO 0.00 -0.52 1.10 0.20 0.10 0.00 0.00 175.35 176.23 1d1r s GLY 47 N -3.66 -0.14 0.25 0.59 0.00 -1.26 -4.87 107.32 98.23 1d1r s GLY 47 Ca 0.20 2.38 0.12 0.00 0.00 0.00 0.00 44.72 47.42 1d1r s GLY 47 CO 0.14 1.23 -0.21 -1.34 0.00 0.00 0.00 173.10 172.92 1d1r s VAL 48 N -0.80 2.47 -0.17 1.40 -7.23 -1.26 -3.98 120.40 110.82 1d1r s VAL 48 Ca 0.02 -2.27 0.01 0.00 -1.81 0.00 0.00 61.98 57.93 1d1r s VAL 48 Cb -0.02 -2.26 0.02 0.00 0.56 0.00 0.00 36.38 34.68 1d1r s VAL 48 CO -0.03 -0.30 -0.19 0.00 -0.31 0.00 0.00 175.10 174.27 1d1r s LEU 50 N 1.29 3.17 -0.06 0.00 1.02 -1.12 -1.25 118.68 121.74 1d1r s LEU 50 Ca 0.04 -0.30 0.00 0.00 0.02 0.00 0.00 54.13 53.89 1d1r s LEU 50 Cb -0.13 -1.93 0.02 0.00 0.02 0.00 0.00 46.19 44.17 1d1r s LEU 50 CO -0.11 0.19 -0.04 -0.63 0.02 0.00 0.00 176.35 175.78 1d1r s ILE 51 N -1.21 0.54 0.20 -0.59 1.01 -0.86 -3.66 121.20 116.62 1d1r s ILE 51 Ca 0.22 -0.07 -0.13 0.00 0.00 0.00 0.00 60.65 60.67 1d1r s ILE 51 Cb -0.11 -0.59 0.00 0.00 0.01 0.00 0.00 42.46 41.77 1d1r s ILE 51 CO 0.14 0.25 0.43 -0.89 0.00 0.00 0.00 174.94 174.86 1d1r s THR 52 N 1.24 0.03 0.00 2.92 2.01 -1.25 -1.77 115.64 118.83 1d1r s THR 52 Ca -0.06 -1.20 0.00 0.00 0.31 0.00 0.00 61.69 60.74 1d1r s THR 52 Cb -0.14 -1.88 0.00 0.00 0.01 0.00 0.00 72.50 70.49 1d1r s THR 52 CO -0.02 -0.14 0.00 0.61 -0.69 0.00 0.00 174.62 174.38 1d1r n GLY 53 N -0.31 0.79 3.58 4.40 0.00 -1.26 -3.31 105.19 109.08 1d1r n GLY 53 Ca -0.06 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.00 3.83 -1.04 1.61 1.01 -1.26 -4.06 120.40 118.49 1d1r s VAL 54 Ca 0.00 0.77 -0.14 0.00 0.00 0.00 0.00 61.98 62.61 1d1r s VAL 54 Cb 0.00 -4.35 0.20 0.00 0.00 0.00 0.00 36.38 32.23 1d1r s VAL 54 CO 0.00 -1.02 1.13 -0.62 0.00 0.00 0.00 175.10 174.60 1d1r s ASP 55 N 4.26 6.97 0.10 3.32 2.15 -1.26 -4.94 116.67 127.27 1d1r s ASP 55 Ca 0.56 -2.88 0.01 0.00 0.43 0.00 0.00 52.55 50.67 1d1r s ASP 55 Cb -0.12 -2.31 -0.00 0.00 -0.30 0.00 0.00 42.92 40.19 1d1r s ASP 55 CO 0.28 -0.66 0.12 0.18 -0.17 0.00 0.00 175.17 174.92 1d1r n LEU 56 N 4.70 0.00 -4.77 -1.34 4.32 -1.26 -4.55 117.00 114.10 1d1r n LEU 56 Ca 0.25 -0.89 -0.35 0.00 -0.02 0.00 0.00 56.01 55.00 1d1r n LEU 56 Cb 0.44 0.65 0.01 0.00 -1.62 0.00 0.00 43.42 42.90 1d1r n LEU 56 CO 0.49 -0.18 0.80 -1.81 -1.22 0.00 0.00 177.39 175.47 1d1r s ASP 57 N -1.66 5.57 0.21 -1.43 1.01 -1.26 -4.90 116.67 114.20 1d1r s ASP 57 Ca 0.10 2.22 -0.10 0.00 0.71 0.00 0.00 52.55 55.48 1d1r s ASP 57 Cb 0.00 -2.58 0.29 0.00 1.01 0.00 0.00 42.92 41.64 1d1r s ASP 57 CO 0.07 -1.32 1.72 0.44 0.21 0.00 0.00 175.17 176.29 1d1r h ASP 58 N 1.08 0.11 -0.56 0.27 3.32 -2.00 -0.80 116.42 117.82 1d1r h ASP 58 Ca -0.50 0.10 0.03 0.00 0.02 0.00 0.00 57.03 56.67 1d1r h ASP 58 Cb 1.27 0.11 -0.04 0.00 0.22 0.00 0.00 39.33 40.89 1d1r h ASP 58 CO 0.56 0.06 0.34 0.00 -1.72 0.00 0.00 179.24 178.49 1d1r h ALA 59 N 1.45 0.72 -0.93 3.45 0.00 -2.01 -1.17 119.26 120.77 1d1r h ALA 59 Ca 0.31 -0.01 0.22 0.00 0.00 0.00 0.00 54.91 55.43 1d1r h ALA 59 Cb 0.43 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 17.99 1d1r h ALA 59 CO -0.36 0.07 0.62 0.93 0.00 0.00 0.00 179.25 180.50 1d1r h GLU 60 N 0.68 0.36 0.25 0.00 4.39 -1.51 -0.96 114.58 117.79 1d1r h GLU 60 Ca 0.23 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.91 1d1r h GLU 60 Cb 0.02 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.57 1d1r h GLU 60 CO -0.10 0.24 -0.26 -0.07 -1.16 0.00 0.00 179.01 177.66 1d1r h LEU 61 N 0.37 -0.71 -1.92 1.33 3.38 -0.89 0.08 115.31 116.95 1d1r h LEU 61 Ca 0.49 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.53 1d1r h LEU 61 Cb 1.29 0.25 0.00 0.00 0.09 0.00 0.00 40.66 42.28 1d1r h LEU 61 CO -0.18 -0.38 0.00 0.00 0.09 0.00 0.00 178.44 177.97 1d1r h THR 62 N -0.55 0.00 0.04 0.22 1.03 -1.23 -2.22 112.91 110.21 1d1r h THR 62 Ca -0.00 -0.14 -0.00 0.00 -0.01 0.00 0.00 66.41 66.25 1d1r h THR 62 Cb 0.52 0.96 0.00 0.00 -1.07 0.00 0.00 68.15 68.56 1d1r h THR 62 CO -0.07 0.00 -0.02 0.50 -0.01 0.00 0.00 175.52 175.93 1d1r h LYS 63 N 0.00 -0.05 -0.91 0.00 3.64 -0.35 -2.16 116.57 116.74 1d1r h LYS 63 Ca 0.00 0.00 0.21 0.00 -1.27 0.00 0.00 60.65 59.59 1d1r h LYS 63 Cb 0.16 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 31.93 1d1r h LYS 63 CO 0.00 -0.03 0.60 -0.07 -2.27 0.00 0.00 179.45 177.68 1d1r h LEU 64 N -0.14 0.38 0.89 5.20 -0.00 -1.33 -1.31 115.31 119.00 1d1r h LEU 64 Ca -0.01 0.04 -0.04 0.00 -0.00 0.00 0.00 57.88 57.87 1d1r h LEU 64 Cb 0.04 -0.03 0.01 0.00 -0.00 0.00 0.00 40.66 40.68 1d1r h LEU 64 CO 0.01 0.14 -0.43 0.00 -0.00 0.00 0.00 178.44 178.16 1d1r h ALA 65 N 1.61 -1.20 -0.24 1.53 0.00 -1.46 -1.95 119.26 117.54 1d1r h ALA 65 Ca 0.47 -0.26 0.07 0.00 0.00 0.00 0.00 54.91 55.19 1d1r h ALA 65 Cb 1.23 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 19.48 1d1r h ALA 65 CO -0.17 -1.14 0.30 0.00 0.00 0.00 0.00 179.25 178.24 1d1r h ALA 66 N -1.22 1.85 0.51 0.00 0.00 -0.63 0.14 119.26 119.91 1d1r h ALA 66 Ca -0.12 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1d1r h ALA 66 Cb 0.92 0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.74 1d1r h ALA 66 CO 0.20 -0.43 -0.25 1.49 0.00 0.00 0.00 179.25 180.27 1d1r h GLU 67 N 0.00 -0.66 0.00 0.00 4.81 -0.54 -2.93 114.58 115.26 1d1r h GLU 67 Ca 0.12 0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 1d1r h GLU 67 Cb 0.71 0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.25 1d1r h GLU 67 CO -0.00 -0.44 0.00 1.28 -0.73 0.00 0.00 179.01 179.12 1d1r n LEU 68 N -4.55 0.48 -0.02 1.64 4.77 -0.88 -2.24 117.00 116.20 1d1r n LEU 68 Ca -0.09 0.64 -0.08 0.00 -0.03 0.00 0.00 56.01 56.46 1d1r n LEU 68 Cb 0.27 -0.61 0.08 0.00 -2.33 0.00 0.00 43.42 40.84 1d1r n LEU 68 CO 0.21 -0.58 0.57 0.50 -1.33 0.00 0.00 177.39 176.76 1d1r h LYS 69 N 0.00 0.60 0.00 3.23 3.64 -0.81 -2.56 116.57 120.67 1d1r h LYS 69 Ca 0.00 -0.32 0.00 0.00 -1.27 0.00 0.00 60.65 59.06 1d1r h LYS 69 Cb 0.25 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1d1r h LYS 69 CO 0.00 0.91 0.00 -0.22 -2.27 0.00 0.00 179.45 177.87 1d1r h LYS 70 N 0.49 0.00 0.00 1.90 3.64 -1.28 -2.80 116.57 118.52 1d1r h LYS 70 Ca 0.04 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.35 1d1r h LYS 70 Cb 0.94 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.75 1d1r h LYS 70 CO 0.08 0.00 -0.31 0.87 -2.27 0.00 0.00 179.45 177.82 1d1r h LYS 71 N 0.00 0.00 0.00 1.90 1.57 -1.51 -2.78 116.57 115.74 1d1r h LYS 71 Ca 0.00 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.50 1d1r h LYS 71 Cb 0.65 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.92 1d1r h LYS 71 CO 0.00 0.31 -1.64 0.00 -0.57 0.00 0.00 179.45 177.55 1d1r n GLY 73 N 1.54 3.24 0.00 0.00 0.00 -1.05 -4.84 105.19 104.08 1d1r n GLY 73 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 4.17 0.00 0.00 0.00 -1.26 -5.17 105.19 102.93 1d1r n GLY 75 Ca 0.00 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.06 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 -1.56 -2.30 3.16 -0.02 0.00 -1.26 -4.79 105.19 98.42 1d1r n GLY 76 Ca 0.00 -1.31 0.05 0.00 0.00 0.00 0.00 46.02 44.76 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 -1.63 -3.70 0.11 4.61 0.00 -1.24 -4.97 121.76 114.93 1d1r s ALA 77 Ca 0.00 1.46 0.11 0.00 0.00 0.00 0.00 51.96 53.53 1d1r s ALA 77 Cb 0.00 -2.51 -0.04 0.00 0.00 0.00 0.00 23.12 20.58 1d1r s ALA 77 CO 0.00 -1.29 -0.27 0.54 0.00 0.00 0.00 175.76 174.74 1d1r s VAL 78 N 2.60 2.23 -0.46 0.00 0.11 -1.26 -0.92 120.40 122.70 1d1r s VAL 78 Ca -0.06 -1.67 0.06 0.00 -2.93 0.00 0.00 61.98 57.38 1d1r s VAL 78 Cb -0.05 -1.96 0.20 0.00 -1.53 0.00 0.00 36.38 33.04 1d1r s VAL 78 CO -0.10 0.16 0.58 0.29 -3.33 0.00 0.00 175.10 172.69 1d1r n LYS 79 N 1.13 0.45 -3.49 1.54 4.76 0.16 -4.92 118.16 117.79 1d1r n LYS 79 Ca -0.18 -2.56 -0.15 0.00 -2.87 0.00 0.00 58.31 52.55 1d1r n LYS 79 Cb 0.53 -1.52 0.00 0.00 -1.84 0.00 0.00 35.03 32.21 1d1r n LYS 79 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1d1r n ASP 80 N 2.58 -6.09 0.00 4.39 2.03 -1.26 -1.26 116.55 116.93 1d1r n ASP 80 Ca 0.22 -0.61 0.00 0.00 0.52 0.00 0.00 54.79 54.92 1d1r n ASP 80 Cb 0.53 -3.31 0.00 0.00 -0.72 0.00 0.00 41.12 37.62 1d1r n ASP 80 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1d1r n GLY 81 N -1.71 2.60 3.35 0.27 0.00 -1.26 -4.95 105.19 103.49 1d1r n GLY 81 Ca -0.17 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.60 5.46 0.14 1.61 1.01 -0.39 -4.03 120.40 121.60 1d1r s VAL 82 Ca 0.00 -2.33 0.02 0.00 0.00 0.00 0.00 61.98 59.67 1d1r s VAL 82 Cb 0.00 -4.53 -0.04 0.00 0.00 0.00 0.00 36.38 31.81 1d1r s VAL 82 CO 0.00 -1.13 0.28 -0.63 0.00 0.00 0.00 175.10 173.63 1d1r s ILE 83 N 0.61 5.32 -0.27 2.22 1.01 -0.73 0.36 121.20 129.73 1d1r s ILE 83 Ca 0.21 -0.61 -0.01 0.00 0.00 0.00 0.00 60.65 60.24 1d1r s ILE 83 Cb -0.09 -3.73 0.14 0.00 0.01 0.00 0.00 42.46 38.79 1d1r s ILE 83 CO -0.09 -0.06 0.34 -0.70 0.00 0.00 0.00 174.94 174.42 1d1r s GLU 84 N -3.13 0.33 -0.11 2.79 2.12 -0.10 -2.04 118.70 118.57 1d1r s GLU 84 Ca 0.35 0.16 0.02 0.00 0.36 0.00 0.00 54.97 55.85 1d1r s GLU 84 Cb -0.11 -0.60 0.02 0.00 0.26 0.00 0.00 34.13 33.70 1d1r s GLU 84 CO 0.28 -0.87 -0.14 0.42 -0.54 0.00 0.00 175.26 174.41 1d1r s ILE 85 N 2.45 1.44 0.72 -3.70 1.01 -0.38 -3.73 121.20 119.02 1d1r s ILE 85 Ca 0.10 -0.60 -0.14 0.00 0.00 0.00 0.00 60.65 60.01 1d1r s ILE 85 Cb -0.14 -1.33 0.03 0.00 0.01 0.00 0.00 42.46 41.03 1d1r s ILE 85 CO -0.25 0.43 1.14 -1.58 0.00 0.00 0.00 174.94 174.68 1d1r s GLN 86 N 1.04 2.36 0.00 2.79 0.74 -1.26 -2.43 119.66 122.90 1d1r s GLN 86 Ca -0.06 1.48 0.00 0.00 0.05 0.00 0.00 55.36 56.83 1d1r s GLN 86 Cb -0.15 -1.89 0.00 0.00 1.10 0.00 0.00 33.01 32.08 1d1r s GLN 86 CO -0.02 -1.61 0.00 0.41 -0.55 0.00 0.00 175.29 173.52 1d1r n GLY 87 N -0.30 4.91 2.69 2.59 0.00 -1.26 -4.79 105.19 109.03 1d1r n GLY 87 Ca 0.11 -0.89 -0.32 0.00 0.00 0.00 0.00 46.02 44.92 1d1r n GLY 87 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1d1r n ASP 88 N 0.00 5.71 -2.12 1.61 9.92 -1.26 -4.32 116.55 126.08 1d1r n ASP 88 Ca 0.00 -3.75 -0.23 0.00 -0.53 0.00 0.00 54.79 50.28 1d1r n ASP 88 Cb 0.00 -0.71 0.02 0.00 -0.64 0.00 0.00 41.12 39.79 1d1r n ASP 88 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1d1r n LYS 89 N -0.43 3.48 0.14 -1.24 5.02 -1.26 -4.79 118.16 119.09 1d1r n LYS 89 Ca 0.43 -4.17 0.17 0.00 -2.02 0.00 0.00 58.31 52.71 1d1r n LYS 89 Cb 0.46 -2.24 0.75 0.00 -0.02 0.00 0.00 35.03 33.99 1d1r n LYS 89 CO 0.00 0.00 0.00 0.07 -0.52 0.00 0.00 177.40 176.95 1d1r h ARG 90 N 2.26 0.00 -0.37 1.97 0.11 -1.93 -1.26 114.38 115.16 1d1r h ARG 90 Ca 0.33 0.00 0.03 0.00 0.10 0.00 0.00 59.98 60.44 1d1r h ARG 90 Cb 1.44 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 32.49 1d1r h ARG 90 CO 0.74 0.00 0.17 0.22 0.10 0.00 0.00 179.97 181.20 1d1r h ASP 91 N 0.00 0.24 0.44 0.08 3.58 -1.96 -1.97 116.42 116.84 1d1r h ASP 91 Ca 0.13 0.02 -0.18 0.00 0.42 0.00 0.00 57.03 57.42 1d1r h ASP 91 Cb 0.61 -0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.63 1d1r h ASP 91 CO -0.00 0.18 -0.77 0.25 -2.88 0.00 0.00 179.24 176.02 1d1r h LEU 92 N 0.36 0.32 -1.13 2.28 6.46 -1.65 -3.13 115.31 118.81 1d1r h LEU 92 Ca 0.16 -0.23 0.10 0.00 -0.12 0.00 0.00 57.88 57.79 1d1r h LEU 92 Cb 0.08 -0.10 -0.07 0.00 -0.73 0.00 0.00 40.66 39.85 1d1r h LEU 92 CO -0.12 0.97 0.60 -0.07 -0.62 0.00 0.00 178.44 179.20 1d1r h LEU 93 N 0.17 0.86 -0.38 2.25 -0.00 -0.78 -1.29 115.31 116.15 1d1r h LEU 93 Ca -0.03 0.03 0.07 0.00 -0.00 0.00 0.00 57.88 57.95 1d1r h LEU 93 Cb 1.35 -0.15 -0.06 0.00 -0.00 0.00 0.00 40.66 41.79 1d1r h LEU 93 CO 0.12 0.50 -0.03 0.50 -0.00 0.00 0.00 178.44 179.53 1d1r h LYS 94 N 0.95 0.06 0.00 1.13 3.64 -1.32 0.37 116.57 121.41 1d1r h LYS 94 Ca 0.43 -0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.73 1d1r h LYS 94 Cb 0.39 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 1d1r h LYS 94 CO -0.19 0.04 -0.39 1.03 -2.27 0.00 0.00 179.45 177.67 1d1r h SER 95 N 0.07 0.00 0.07 4.20 0.87 -1.42 -1.76 113.55 115.58 1d1r h SER 95 Ca 0.18 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.75 1d1r h SER 95 Cb 0.27 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.21 1d1r h SER 95 CO -0.34 0.39 -0.11 0.25 -0.53 0.00 0.00 176.83 176.49 1d1r h LEU 96 N 0.00 -0.31 -0.65 2.23 6.46 0.13 0.19 115.31 123.36 1d1r h LEU 96 Ca -0.00 0.04 -0.15 0.00 -0.12 0.00 0.00 57.88 57.65 1d1r h LEU 96 Cb 0.72 0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.75 1d1r h LEU 96 CO 0.05 -0.17 -0.62 0.25 -0.62 0.00 0.00 178.44 177.33 1d1r h LEU 97 N -0.23 0.23 -0.56 2.25 5.85 -1.29 -2.63 115.31 118.92 1d1r h LEU 97 Ca 0.02 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.60 1d1r h LEU 97 Cb 0.24 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.20 1d1r h LEU 97 CO -0.06 0.79 0.00 1.21 -0.34 0.00 0.00 178.44 180.04 1d1r n GLU 98 N -3.85 0.20 0.15 1.25 2.13 -0.67 -2.63 120.64 117.21 1d1r n GLU 98 Ca -0.02 0.38 0.03 0.00 0.66 0.00 0.00 57.16 58.21 1d1r n GLU 98 Cb 0.62 -1.85 0.42 0.00 0.27 0.00 0.00 31.44 30.91 1d1r n GLU 98 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1d1r h ALA 99 N 2.32 1.57 0.00 4.31 0.00 -0.24 -2.45 119.26 124.77 1d1r h ALA 99 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1d1r h ALA 99 Cb 0.42 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1d1r h ALA 99 CO 0.00 0.31 -1.39 1.63 0.00 0.00 0.00 179.25 179.81 1d1r n LYS 100 N -4.29 0.62 0.00 0.00 5.02 -1.08 -4.96 118.16 113.47 1d1r n LYS 100 Ca -0.01 -0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 1d1r n LYS 100 Cb 0.26 -1.70 0.00 0.00 -0.02 0.00 0.00 35.03 33.57 1d1r n LYS 100 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1d1r n GLY 101 N 1.22 1.01 3.85 0.72 0.00 -0.92 -5.08 105.19 105.98 1d1r n GLY 101 Ca -0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.68 3.71 0.04 1.61 -1.94 -1.15 -5.01 119.30 115.87 1d1r s MET 102 Ca 0.00 0.89 -0.28 0.00 -1.71 0.00 0.00 55.69 54.59 1d1r s MET 102 Cb 0.00 -2.10 -0.05 0.00 2.01 0.00 0.00 34.83 34.70 1d1r s MET 102 CO 0.00 -0.48 0.89 0.21 -0.01 0.00 0.00 175.02 175.63 1d1r s LYS 103 N -4.57 4.57 0.00 2.03 2.20 -1.22 -4.49 119.74 118.26 1d1r s LYS 103 Ca 0.58 1.28 0.03 0.00 -0.36 0.00 0.00 55.97 57.49 1d1r s LYS 103 Cb -0.11 -3.41 -0.01 0.00 -1.51 0.00 0.00 37.83 32.79 1d1r s LYS 103 CO 0.42 0.13 -0.08 0.54 -0.36 0.00 0.00 175.35 175.99 1d1r s VAL 104 N 0.41 0.65 -0.42 4.02 0.11 -1.26 -1.76 120.40 122.15 1d1r s VAL 104 Ca 0.45 -0.47 -0.00 0.00 -2.93 0.00 0.00 61.98 59.04 1d1r s VAL 104 Cb -0.21 -0.57 0.11 0.00 -1.53 0.00 0.00 36.38 34.18 1d1r s VAL 104 CO 0.26 0.10 0.18 -0.75 -3.33 0.00 0.00 175.10 171.57 1d1r s LYS 105 N -0.41 1.89 0.59 1.54 2.20 -1.14 -4.94 119.74 119.48 1d1r s LYS 105 Ca 0.02 -1.99 0.31 0.00 -0.36 0.00 0.00 55.97 53.95 1d1r s LYS 105 Cb -0.04 -3.46 1.31 0.00 -1.51 0.00 0.00 37.83 34.13 1d1r s LYS 105 CO -0.00 -1.04 1.63 1.25 -0.36 0.00 0.00 175.35 176.82 1d1r h LEU 106 N 7.67 0.00 -2.56 5.43 5.85 -1.90 -3.38 115.31 126.41 1d1r h LEU 106 Ca -0.08 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.61 1d1r h LEU 106 Cb 1.01 0.00 0.02 0.00 0.37 0.00 0.00 40.66 42.07 1d1r h LEU 106 CO 0.64 0.00 -0.09 0.00 -0.34 0.00 0.00 178.44 178.65 1d1r n ALA 107 N -2.43 -2.17 0.06 1.25 0.00 -1.26 -4.59 120.51 111.37 1d1r n ALA 107 Ca 0.20 0.01 -0.13 0.00 0.00 0.00 0.00 53.44 53.53 1d1r n ALA 107 Cb 1.21 -1.56 -0.08 0.00 0.00 0.00 0.00 19.45 19.03 1d1r n ALA 107 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1d1r h GLY 108 N 0.17 -1.19 -0.34 0.00 0.00 -2.00 -3.48 103.07 96.22 1d1r h GLY 108 Ca -0.06 0.64 0.04 0.00 0.00 0.00 0.00 47.33 47.94 1d1r h GLY 108 CO 0.23 -0.30 -0.10 0.61 0.00 0.00 0.00 176.54 176.97 1d1r n GLY 109 N -1.37 -2.21 0.60 4.60 0.00 -1.26 -5.06 105.19 100.49 1d1r n GLY 109 Ca -0.06 -1.45 0.07 0.00 0.00 0.00 0.00 46.02 44.59 1d1r n GLY 109 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1d1r n LEU 110 N -2.55 -0.42 0.00 0.99 7.94 -1.26 -5.30 117.00 116.40 1d1r n LEU 110 Ca -0.01 0.98 0.00 0.00 -1.11 0.00 0.00 56.01 55.87 1d1r n LEU 110 Cb 0.07 -1.36 0.00 0.00 0.53 0.00 0.00 43.42 42.66 1d1r n LEU 110 CO 0.00 -0.94 0.02 1.21 -1.11 0.00 0.00 177.39 176.58