#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 -1.42 3.46 3.14 0.00 -1.26 -5.06 105.19 104.05 1d1r n GLY 30 Ca 0.00 0.53 -0.15 0.00 0.00 0.00 0.00 46.02 46.40 1d1r n GLY 30 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1d1r n ASP 31 N -3.03 -6.21 -4.87 1.61 -0.08 -1.26 -4.95 116.55 97.77 1d1r n ASP 31 Ca 0.00 -0.59 -0.37 0.00 -1.51 0.00 0.00 54.79 52.32 1d1r n ASP 31 Cb 0.00 -3.53 -0.06 0.00 2.34 0.00 0.00 41.12 39.87 1d1r n ASP 31 CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 1d1r s GLY 32 N -3.07 2.17 -0.09 0.27 0.00 -1.26 -4.97 107.32 100.37 1d1r s GLY 32 Ca 0.08 -0.61 -0.03 0.00 0.00 0.00 0.00 44.72 44.15 1d1r s GLY 32 CO 0.83 -0.31 0.17 -1.34 0.00 0.00 0.00 173.10 172.45 1d1r s VAL 33 N -0.94 -0.25 0.13 1.40 -7.23 -1.26 -4.19 120.40 108.06 1d1r s VAL 33 Ca 0.15 0.32 0.00 0.00 -1.81 0.00 0.00 61.98 60.65 1d1r s VAL 33 Cb -0.12 -0.31 -0.04 0.00 0.56 0.00 0.00 36.38 36.47 1d1r s VAL 33 CO 0.04 0.13 0.29 -0.69 -0.31 0.00 0.00 175.10 174.57 1d1r s VAL 34 N 2.14 5.31 -0.07 1.32 1.01 -0.93 -3.99 120.40 125.19 1d1r s VAL 34 Ca 0.01 -0.46 -0.02 0.00 0.00 0.00 0.00 61.98 61.51 1d1r s VAL 34 Cb -0.12 -3.69 0.03 0.00 0.00 0.00 0.00 36.38 32.60 1d1r s VAL 34 CO -0.06 -0.02 0.05 -0.13 0.00 0.00 0.00 175.10 174.94 1d1r s ARG 35 N -2.96 0.09 -0.17 2.72 0.52 -0.70 -2.25 118.95 116.19 1d1r s ARG 35 Ca 0.36 0.25 0.00 0.00 -0.52 0.00 0.00 55.73 55.83 1d1r s ARG 35 Cb -0.12 -0.80 0.03 0.00 0.52 0.00 0.00 34.95 34.59 1d1r s ARG 35 CO 0.28 -0.37 -0.10 0.42 0.02 0.00 0.00 175.30 175.54 1d1r s ILE 36 N 2.12 1.47 0.28 1.52 1.09 -1.26 -2.71 121.20 123.72 1d1r s ILE 36 Ca 0.04 -0.76 -0.05 0.00 -1.10 0.00 0.00 60.65 58.79 1d1r s ILE 36 Cb -0.13 -1.51 -0.01 0.00 -1.06 0.00 0.00 42.46 39.76 1d1r s ILE 36 CO -0.04 0.27 0.39 0.00 -0.10 0.00 0.00 174.94 175.46 1d1r s GLN 37 N 1.49 1.65 0.06 2.79 -2.07 -1.24 -4.45 119.66 117.89 1d1r s GLN 37 Ca 0.02 -1.60 0.01 0.00 -1.82 0.00 0.00 55.36 51.97 1d1r s GLN 37 Cb -0.15 0.41 -0.04 0.00 -1.09 0.00 0.00 33.01 32.14 1d1r s GLN 37 CO -0.09 -0.66 0.16 0.50 -1.32 0.00 0.00 175.29 173.88 1d1r s ARG 38 N -3.59 3.23 -0.21 9.60 3.52 -1.26 -2.48 118.95 127.75 1d1r s ARG 38 Ca 0.31 -0.53 -0.03 0.00 -0.13 0.00 0.00 55.73 55.34 1d1r s ARG 38 Cb 0.01 -2.92 0.07 0.00 -1.56 0.00 0.00 34.95 30.55 1d1r s ARG 38 CO 0.16 0.60 0.06 -0.65 -0.81 0.00 0.00 175.30 174.66 1d1r s GLN 39 N -2.42 0.46 1.20 5.12 -0.21 -0.85 -4.96 119.66 117.99 1d1r s GLN 39 Ca 0.32 -0.41 -0.20 0.00 0.02 0.00 0.00 55.36 55.09 1d1r s GLN 39 Cb -0.13 -1.93 0.30 0.00 1.00 0.00 0.00 33.01 32.25 1d1r s GLN 39 CO 0.25 -0.72 1.04 0.25 -2.12 0.00 0.00 175.29 173.99 1d1r n THR 40 N 5.11 0.00 0.08 -0.19 -2.24 -1.26 -4.14 114.28 111.64 1d1r n THR 40 Ca -0.07 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 1d1r n THR 40 Cb 0.47 -1.21 0.00 0.00 -2.10 0.00 0.00 70.33 67.48 1d1r n THR 40 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1d1r n SER 41 N -4.87 -0.93 0.00 3.42 7.64 -1.26 -5.02 113.62 112.60 1d1r n SER 41 Ca 0.15 0.31 0.00 0.00 1.01 0.00 0.00 58.87 60.33 1d1r n SER 41 Cb 0.57 1.04 0.00 0.00 -1.01 0.00 0.00 64.21 64.81 1d1r n SER 41 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1d1r n GLY 42 N 0.13 1.10 1.08 0.23 0.00 -1.26 -5.05 105.19 101.41 1d1r n GLY 42 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1d1r n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d1r n ARG 43 N 0.00 0.00 -4.08 1.61 1.74 -1.26 -5.10 116.66 109.57 1d1r n ARG 43 Ca 0.00 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.99 1d1r n ARG 43 Cb 0.00 -0.42 -0.10 0.00 -1.02 0.00 0.00 32.46 30.91 1d1r n ARG 43 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 1d1r s LYS 44 N -1.92 0.58 1.43 5.56 -2.85 -1.26 -5.10 119.74 116.18 1d1r s LYS 44 Ca 0.00 -1.05 0.00 0.00 -1.00 0.00 0.00 55.97 53.92 1d1r s LYS 44 Cb 0.00 0.03 0.00 0.00 -2.06 0.00 0.00 37.83 35.80 1d1r s LYS 44 CO 0.00 -0.06 0.00 0.41 0.10 0.00 0.00 175.35 175.80 1d1r n GLY 45 N 0.58 -1.27 3.52 0.59 0.00 -1.26 -4.89 105.19 102.47 1d1r n GLY 45 Ca -0.17 -1.05 -0.19 0.00 0.00 0.00 0.00 46.02 44.61 1d1r n GLY 45 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1d1r n LYS 46 N -2.69 -6.27 -4.34 1.61 3.00 -1.26 -4.79 118.16 103.42 1d1r n LYS 46 Ca 0.00 0.78 -0.34 0.00 -0.00 0.00 0.00 58.31 58.75 1d1r n LYS 46 Cb 0.21 -5.69 -0.10 0.00 0.00 0.00 0.00 35.03 29.45 1d1r n LYS 46 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 1d1r s GLY 47 N -4.26 1.81 0.25 3.14 0.00 -1.26 -4.43 107.32 102.58 1d1r s GLY 47 Ca 0.06 -0.80 0.02 0.00 0.00 0.00 0.00 44.72 44.00 1d1r s GLY 47 CO 0.75 -0.31 0.07 -1.34 0.00 0.00 0.00 173.10 172.27 1d1r s VAL 48 N -0.27 0.73 -0.21 1.40 -7.23 -1.26 -3.87 120.40 109.70 1d1r s VAL 48 Ca 0.06 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.24 1d1r s VAL 48 Cb -0.12 -2.56 0.03 0.00 0.56 0.00 0.00 36.38 34.28 1d1r s VAL 48 CO 0.02 -0.10 -0.17 0.00 -0.31 0.00 0.00 175.10 174.54 1d1r s LEU 50 N 1.24 4.26 -0.32 0.00 1.43 -1.04 -1.88 118.68 122.37 1d1r s LEU 50 Ca 0.01 0.74 -0.06 0.00 -1.03 0.00 0.00 54.13 53.79 1d1r s LEU 50 Cb -0.15 -2.63 0.03 0.00 0.03 0.00 0.00 46.19 43.47 1d1r s LEU 50 CO -0.10 0.00 0.08 -0.63 0.23 0.00 0.00 176.35 175.93 1d1r s ILE 51 N 0.68 3.70 0.31 -0.59 1.01 -0.74 -3.67 121.20 121.89 1d1r s ILE 51 Ca 0.24 -1.03 0.04 0.00 0.00 0.00 0.00 60.65 59.90 1d1r s ILE 51 Cb -0.15 -3.03 -0.03 0.00 0.01 0.00 0.00 42.46 39.26 1d1r s ILE 51 CO 0.09 -0.08 0.21 0.42 0.00 0.00 0.00 174.94 175.58 1d1r s THR 52 N 1.41 0.14 0.00 2.92 -4.23 -1.10 -2.18 115.64 112.60 1d1r s THR 52 Ca -0.01 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.50 1d1r s THR 52 Cb -0.19 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 71.17 1d1r s THR 52 CO 0.02 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.71 1d1r n GLY 53 N -0.58 1.79 3.68 3.99 0.00 -1.26 -1.72 105.19 111.09 1d1r n GLY 53 Ca 0.04 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.60 1d1r n GLY 53 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1d1r n VAL 54 N -2.00 0.52 -3.46 1.61 0.31 -1.26 -4.17 118.33 109.89 1d1r n VAL 54 Ca 0.00 -0.09 -0.27 0.00 -0.01 0.00 0.00 64.34 63.97 1d1r n VAL 54 Cb 0.00 -1.95 -0.09 0.00 -0.91 0.00 0.00 33.84 30.89 1d1r n VAL 54 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1d1r n ASP 55 N 6.29 2.82 -2.97 4.52 2.03 -1.26 -4.91 116.55 123.07 1d1r n ASP 55 Ca 0.21 -3.23 -0.10 0.00 0.52 0.00 0.00 54.79 52.19 1d1r n ASP 55 Cb 0.33 -0.67 -0.01 0.00 -0.72 0.00 0.00 41.12 40.05 1d1r n ASP 55 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1d1r n LEU 56 N 1.22 0.00 0.00 -2.67 4.77 -1.26 -4.85 117.00 114.21 1d1r n LEU 56 Ca 0.27 -1.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.22 1d1r n LEU 56 Cb 0.42 0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 1d1r n LEU 56 CO 0.33 -0.30 0.12 0.47 -1.33 0.00 0.00 177.39 176.68 1d1r n ASP 57 N -1.68 0.00 0.21 -1.43 9.92 -1.26 -4.92 116.55 117.38 1d1r n ASP 57 Ca -0.03 0.23 0.00 0.00 -0.53 0.00 0.00 54.79 54.46 1d1r n ASP 57 Cb 0.22 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.70 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 -0.32 -3.28 0.24 -2.24 2.03 -1.26 -4.90 116.55 106.82 1d1r n ASP 58 Ca 0.00 0.78 0.09 0.00 0.52 0.00 0.00 54.79 56.18 1d1r n ASP 58 Cb 0.00 3.11 0.61 0.00 -0.72 0.00 0.00 41.12 44.12 1d1r n ASP 58 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1d1r h ALA 59 N 0.00 1.37 -0.63 -1.67 0.00 -2.00 -2.57 119.26 113.75 1d1r h ALA 59 Ca 0.00 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 1d1r h ALA 59 Cb 0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1d1r h ALA 59 CO 0.00 0.22 0.29 0.93 0.00 0.00 0.00 179.25 180.69 1d1r h GLU 60 N 0.00 0.92 0.55 0.00 5.08 -1.94 -0.96 114.58 118.23 1d1r h GLU 60 Ca -0.00 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.20 1d1r h GLU 60 Cb 0.40 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 1d1r h GLU 60 CO 0.02 0.75 -0.47 -0.07 -1.00 0.00 0.00 179.01 178.24 1d1r h LEU 61 N 0.88 -1.26 -2.86 1.33 4.07 -1.81 0.02 115.31 115.67 1d1r h LEU 61 Ca 0.22 0.09 0.00 0.00 0.08 0.00 0.00 57.88 58.27 1d1r h LEU 61 Cb 0.14 0.40 -0.00 0.00 1.08 0.00 0.00 40.66 42.28 1d1r h LEU 61 CO -0.03 -0.66 0.03 0.00 -1.08 0.00 0.00 178.44 176.71 1d1r h THR 62 N -1.00 0.06 0.00 0.22 1.03 -1.57 -2.36 112.91 109.29 1d1r h THR 62 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.33 1d1r h THR 62 Cb 0.86 0.97 0.00 0.00 -1.07 0.00 0.00 68.15 68.91 1d1r h THR 62 CO -0.02 0.00 0.00 1.17 -0.01 0.00 0.00 175.52 176.66 1d1r n LYS 63 N -3.15 0.00 -0.32 0.00 4.81 -0.10 -1.70 118.16 117.70 1d1r n LYS 63 Ca -0.03 0.45 0.31 0.00 -0.87 0.00 0.00 58.31 58.17 1d1r n LYS 63 Cb 0.10 -1.17 0.67 0.00 0.02 0.00 0.00 35.03 34.65 1d1r n LYS 63 CO 0.00 0.00 0.00 1.25 1.17 0.00 0.00 177.40 179.82 1d1r h LEU 64 N 0.00 0.15 -0.01 3.14 7.12 -1.22 0.52 115.31 125.01 1d1r h LEU 64 Ca 0.00 0.03 -0.00 0.00 0.13 0.00 0.00 57.88 58.04 1d1r h LEU 64 Cb 0.00 0.01 -0.00 0.00 -0.53 0.00 0.00 40.66 40.14 1d1r h LEU 64 CO 0.00 0.02 -0.00 0.00 -0.13 0.00 0.00 178.44 178.33 1d1r h ALA 65 N 1.49 0.01 0.00 1.25 0.00 -1.45 -1.82 119.26 118.74 1d1r h ALA 65 Ca 0.58 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.30 1d1r h ALA 65 Cb 2.02 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.81 1d1r h ALA 65 CO -0.11 -0.30 -0.00 0.00 0.00 0.00 0.00 179.25 178.84 1d1r h ALA 66 N 0.63 1.90 0.02 0.00 0.00 -0.02 -1.39 119.26 120.40 1d1r h ALA 66 Ca 0.00 -0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.70 1d1r h ALA 66 Cb 0.38 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1d1r h ALA 66 CO 0.00 0.00 -0.95 1.49 0.00 0.00 0.00 179.25 179.79 1d1r h GLU 67 N 0.00 0.26 -0.20 0.00 4.81 -1.17 -2.93 114.58 115.35 1d1r h GLU 67 Ca -0.00 -0.31 -0.14 0.00 -0.13 0.00 0.00 59.36 58.78 1d1r h GLU 67 Cb 0.00 0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.48 1d1r h GLU 67 CO 0.00 1.03 -0.42 -0.07 -0.73 0.00 0.00 179.01 178.82 1d1r h LEU 68 N 0.13 0.71 0.00 1.64 3.38 -0.41 -2.68 115.31 118.08 1d1r h LEU 68 Ca -0.07 -0.56 0.00 0.00 0.09 0.00 0.00 57.88 57.35 1d1r h LEU 68 Cb 1.60 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 42.14 1d1r h LEU 68 CO 0.15 1.14 0.00 0.29 0.09 0.00 0.00 178.44 180.11 1d1r n LYS 69 N -4.22 0.34 0.23 1.13 5.02 -0.72 -2.64 118.16 117.30 1d1r n LYS 69 Ca -0.06 0.09 0.12 0.00 -2.02 0.00 0.00 58.31 56.44 1d1r n LYS 69 Cb 0.55 -1.50 0.42 0.00 -0.02 0.00 0.00 35.03 34.48 1d1r n LYS 69 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1d1r h LYS 70 N 0.00 0.00 -1.84 1.97 1.57 -1.28 -3.34 116.57 113.65 1d1r h LYS 70 Ca 0.00 0.00 -0.46 0.00 -1.87 0.00 0.00 60.65 58.32 1d1r h LYS 70 Cb 0.14 0.00 -0.39 0.00 0.08 0.00 0.00 32.23 32.06 1d1r h LYS 70 CO 0.00 0.13 -1.16 1.17 -0.57 0.00 0.00 179.45 179.01 1d1r n LYS 71 N -3.20 0.98 0.00 3.15 0.00 -1.08 -4.85 118.16 113.16 1d1r n LYS 71 Ca 0.01 -3.30 0.00 0.00 0.00 0.00 0.00 58.31 55.02 1d1r n LYS 71 Cb 0.44 -1.64 0.00 0.00 0.00 0.00 0.00 35.03 33.83 1d1r n LYS 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1d1r n GLY 73 N 0.11 0.53 0.00 0.00 0.00 -1.26 -4.88 105.19 99.68 1d1r n GLY 73 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 3.81 0.00 0.00 0.00 -1.26 -4.76 105.19 102.98 1d1r n GLY 75 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.54 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 0.00 0.44 3.69 -0.02 0.00 -1.26 -4.39 105.19 103.64 1d1r n GLY 76 Ca 0.00 -1.78 -0.40 0.00 0.00 0.00 0.00 46.02 43.84 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 -1.05 3.46 -0.88 4.61 0.00 -1.22 -4.90 121.76 121.78 1d1r s ALA 77 Ca 0.00 -0.05 -0.13 0.00 0.00 0.00 0.00 51.96 51.77 1d1r s ALA 77 Cb 0.00 -3.01 0.22 0.00 0.00 0.00 0.00 23.12 20.33 1d1r s ALA 77 CO 0.00 -0.39 0.85 0.14 0.00 0.00 0.00 175.76 176.36 1d1r s VAL 78 N 1.51 5.63 0.19 0.00 -7.23 -1.26 -1.79 120.40 117.44 1d1r s VAL 78 Ca 0.34 -2.58 -0.10 0.00 -1.81 0.00 0.00 61.98 57.83 1d1r s VAL 78 Cb -0.17 -4.51 -0.07 0.00 0.56 0.00 0.00 36.38 32.20 1d1r s VAL 78 CO 0.14 -1.08 0.52 -0.75 -0.31 0.00 0.00 175.10 173.61 1d1r s LYS 79 N 0.07 3.82 -0.92 4.82 2.47 -0.34 -4.97 119.74 124.69 1d1r s LYS 79 Ca 0.21 0.29 -0.24 0.00 -1.56 0.00 0.00 55.97 54.66 1d1r s LYS 79 Cb -0.10 -2.77 -0.04 0.00 -1.46 0.00 0.00 37.83 33.46 1d1r s LYS 79 CO -0.09 0.40 1.90 0.34 0.16 0.00 0.00 175.35 178.05 1d1r s ASP 80 N -2.14 5.28 0.00 1.43 2.15 -1.26 -1.90 116.67 120.23 1d1r s ASP 80 Ca 0.43 -0.77 0.00 0.00 0.43 0.00 0.00 52.55 52.64 1d1r s ASP 80 Cb -0.12 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 39.93 1d1r s ASP 80 CO 0.21 -2.62 0.00 0.61 -0.17 0.00 0.00 175.17 173.20 1d1r n GLY 81 N 6.85 1.39 3.46 2.66 0.00 -1.26 -5.08 105.19 113.21 1d1r n GLY 81 Ca 0.39 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.36 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 -1.62 -0.71 -0.13 1.61 1.01 -0.80 -4.52 120.40 115.24 1d1r s VAL 82 Ca 0.00 0.08 0.03 0.00 0.00 0.00 0.00 61.98 62.08 1d1r s VAL 82 Cb 0.00 -0.84 0.01 0.00 0.00 0.00 0.00 36.38 35.55 1d1r s VAL 82 CO 0.00 0.03 -0.22 -0.63 0.00 0.00 0.00 175.10 174.29 1d1r s ILE 83 N 2.59 2.15 -0.25 2.22 1.01 -0.92 -1.20 121.20 126.79 1d1r s ILE 83 Ca -0.05 -0.96 -0.18 0.00 0.00 0.00 0.00 60.65 59.46 1d1r s ILE 83 Cb -0.11 -1.85 -0.03 0.00 0.01 0.00 0.00 42.46 40.48 1d1r s ILE 83 CO -0.16 0.55 0.50 -1.61 0.00 0.00 0.00 174.94 174.22 1d1r s GLU 84 N 0.67 4.09 -0.55 2.79 2.02 -0.74 -1.80 118.70 125.18 1d1r s GLU 84 Ca -0.10 0.32 0.07 0.00 0.02 0.00 0.00 54.97 55.27 1d1r s GLU 84 Cb -0.16 -3.64 0.24 0.00 0.10 0.00 0.00 34.13 30.68 1d1r s GLU 84 CO 0.02 -0.31 0.65 -0.89 0.02 0.00 0.00 175.26 174.74 1d1r n ILE 85 N 5.05 1.19 -0.82 -1.63 2.08 -0.79 -3.41 119.36 121.03 1d1r n ILE 85 Ca -0.05 -4.74 -0.33 0.00 0.56 0.00 0.00 62.75 58.19 1d1r n ILE 85 Cb 0.50 -2.04 0.11 0.00 -0.75 0.00 0.00 39.64 37.46 1d1r n ILE 85 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1d1r n GLN 86 N 1.14 -0.35 0.00 0.38 10.64 -1.26 -3.28 117.38 124.65 1d1r n GLN 86 Ca 0.26 -0.07 0.00 0.00 -1.83 0.00 0.00 57.00 55.36 1d1r n GLN 86 Cb 0.45 -1.71 0.00 0.00 -0.86 0.00 0.00 30.24 28.12 1d1r n GLN 86 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1d1r n GLY 87 N 1.86 0.69 2.90 2.61 0.00 -1.25 -4.74 105.19 107.25 1d1r n GLY 87 Ca 0.05 -2.15 -0.11 0.00 0.00 0.00 0.00 46.02 43.81 1d1r n GLY 87 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1d1r s ASP 88 N -4.00 0.37 0.00 1.61 2.15 -1.26 -4.52 116.67 111.02 1d1r s ASP 88 Ca 0.00 -0.99 0.09 0.00 0.43 0.00 0.00 52.55 52.07 1d1r s ASP 88 Cb 0.00 1.03 0.14 0.00 -0.30 0.00 0.00 42.92 43.79 1d1r s ASP 88 CO 0.00 -0.28 1.03 0.29 -0.17 0.00 0.00 175.17 176.04 1d1r n LYS 89 N 4.68 0.00 -0.33 4.34 5.02 -1.26 -4.93 118.16 125.68 1d1r n LYS 89 Ca 0.07 -1.28 0.18 0.00 -2.02 0.00 0.00 58.31 55.27 1d1r n LYS 89 Cb 0.49 0.27 0.42 0.00 -0.02 0.00 0.00 35.03 36.19 1d1r n LYS 89 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1d1r h ARG 90 N 0.34 0.53 0.33 1.97 3.08 -1.94 -0.59 114.38 118.10 1d1r h ARG 90 Ca -0.40 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.62 1d1r h ARG 90 Cb 1.55 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 31.45 1d1r h ARG 90 CO -0.13 0.35 -0.39 0.22 -1.07 0.00 0.00 179.97 178.96 1d1r h ASP 91 N 0.55 -1.06 0.26 7.04 1.82 -1.97 0.07 116.42 123.12 1d1r h ASP 91 Ca 0.60 0.10 -0.00 0.00 -0.39 0.00 0.00 57.03 57.33 1d1r h ASP 91 Cb 1.24 0.37 -0.00 0.00 0.68 0.00 0.00 39.33 41.62 1d1r h ASP 91 CO -0.37 -0.52 -0.02 0.25 -1.61 0.00 0.00 179.24 176.97 1d1r h LEU 92 N -0.76 0.00 -0.34 2.28 5.85 -1.58 -2.13 115.31 118.64 1d1r h LEU 92 Ca -0.02 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.59 1d1r h LEU 92 Cb 0.70 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 1d1r h LEU 92 CO -0.10 0.02 -0.22 -0.07 -0.34 0.00 0.00 178.44 177.73 1d1r h LEU 93 N 0.00 0.78 -1.47 2.25 -0.00 0.42 -2.29 115.31 115.00 1d1r h LEU 93 Ca -0.00 -0.43 -0.03 0.00 -0.00 0.00 0.00 57.88 57.41 1d1r h LEU 93 Cb 0.15 -0.22 -0.00 0.00 -0.00 0.00 0.00 40.66 40.59 1d1r h LEU 93 CO 0.00 1.04 -0.16 0.50 -0.00 0.00 0.00 178.44 179.82 1d1r h LYS 94 N 0.52 0.00 0.21 1.13 3.64 -0.62 -2.05 116.57 119.39 1d1r h LYS 94 Ca 0.07 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.44 1d1r h LYS 94 Cb 0.78 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 1d1r h LYS 94 CO 0.06 0.16 -0.10 0.77 -2.27 0.00 0.00 179.45 178.08 1d1r h SER 95 N 0.00 -0.23 -0.84 4.20 0.02 -1.32 -2.27 113.55 113.11 1d1r h SER 95 Ca -0.00 0.01 0.15 0.00 -0.84 0.00 0.00 61.79 61.11 1d1r h SER 95 Cb 0.57 0.06 -0.06 0.00 0.14 0.00 0.00 62.40 63.10 1d1r h SER 95 CO 0.02 0.11 0.55 0.17 -1.14 0.00 0.00 176.83 176.54 1d1r h LEU 96 N -0.83 0.53 0.22 5.07 8.10 -1.45 -0.95 115.31 126.00 1d1r h LEU 96 Ca -0.03 0.03 -0.01 0.00 0.11 0.00 0.00 57.88 57.99 1d1r h LEU 96 Cb 0.21 -0.07 0.00 0.00 -0.44 0.00 0.00 40.66 40.36 1d1r h LEU 96 CO 0.05 0.27 -0.11 0.25 -4.11 0.00 0.00 178.44 174.79 1d1r h LEU 97 N 0.56 -0.25 -1.66 0.17 7.12 -1.43 -1.87 115.31 117.95 1d1r h LEU 97 Ca 0.42 -0.11 0.00 0.00 0.13 0.00 0.00 57.88 58.32 1d1r h LEU 97 Cb 0.82 0.06 0.00 0.00 -0.53 0.00 0.00 40.66 41.01 1d1r h LEU 97 CO -0.17 -0.04 0.00 -0.08 -0.13 0.00 0.00 178.44 178.02 1d1r h GLU 98 N -0.46 0.00 -0.38 1.25 4.81 -0.67 -1.83 114.58 117.30 1d1r h GLU 98 Ca -0.03 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.12 1d1r h GLU 98 Cb 0.35 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 1d1r h GLU 98 CO 0.05 0.00 -0.09 0.00 -0.73 0.00 0.00 179.01 178.24 1d1r h ALA 99 N 2.05 1.13 0.21 2.92 0.00 -0.34 -3.01 119.26 122.22 1d1r h ALA 99 Ca 0.00 -0.28 -0.32 0.00 0.00 0.00 0.00 54.91 54.30 1d1r h ALA 99 Cb 0.13 -0.16 0.02 0.00 0.00 0.00 0.00 17.79 17.78 1d1r h ALA 99 CO 0.00 0.55 -1.47 0.87 0.00 0.00 0.00 179.25 179.20 1d1r h LYS 100 N 0.60 0.44 0.00 0.00 6.56 -1.33 -3.48 116.57 119.37 1d1r h LYS 100 Ca 0.11 -0.76 0.00 0.00 -1.06 0.00 0.00 60.65 58.94 1d1r h LYS 100 Cb 0.51 0.28 0.00 0.00 -0.57 0.00 0.00 32.23 32.45 1d1r h LYS 100 CO 0.03 1.35 0.00 0.41 -2.06 0.00 0.00 179.45 179.18 1d1r n GLY 101 N 1.69 1.33 3.91 3.86 0.00 -1.14 -5.11 105.19 109.74 1d1r n GLY 101 Ca -0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.30 3.56 -0.23 1.61 -1.94 -1.25 -5.03 119.30 115.72 1d1r s MET 102 Ca 0.00 0.05 -0.28 0.00 -1.71 0.00 0.00 55.69 53.75 1d1r s MET 102 Cb 0.00 -2.49 0.01 0.00 2.01 0.00 0.00 34.83 34.36 1d1r s MET 102 CO 0.00 -0.04 1.00 0.15 -0.01 0.00 0.00 175.02 176.12 1d1r s LYS 103 N -4.39 4.25 0.01 2.03 1.02 -1.26 -4.68 119.74 116.71 1d1r s LYS 103 Ca 0.45 1.28 0.06 0.00 0.02 0.00 0.00 55.97 57.78 1d1r s LYS 103 Cb -0.10 -3.64 -0.03 0.00 -0.52 0.00 0.00 37.83 33.54 1d1r s LYS 103 CO 0.39 -0.61 -0.17 0.54 -0.92 0.00 0.00 175.35 174.58 1d1r s VAL 104 N 3.12 2.82 -0.76 3.17 0.11 -1.26 -2.18 120.40 125.42 1d1r s VAL 104 Ca 0.42 -1.03 0.00 0.00 -2.93 0.00 0.00 61.98 58.44 1d1r s VAL 104 Cb -0.15 -2.14 0.19 0.00 -1.53 0.00 0.00 36.38 32.74 1d1r s VAL 104 CO 0.06 0.44 0.60 -0.75 -3.33 0.00 0.00 175.10 172.12 1d1r s LYS 105 N -1.15 2.82 0.59 1.54 2.20 -0.95 -4.90 119.74 119.88 1d1r s LYS 105 Ca 0.13 -3.09 0.33 0.00 -0.36 0.00 0.00 55.97 52.98 1d1r s LYS 105 Cb -0.10 -3.73 1.30 0.00 -1.51 0.00 0.00 37.83 33.79 1d1r s LYS 105 CO 0.03 -1.24 1.58 1.25 -0.36 0.00 0.00 175.35 176.62 1d1r h LEU 106 N 6.10 0.00 0.00 5.43 6.46 -1.89 -3.35 115.31 128.06 1d1r h LEU 106 Ca 0.10 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.86 1d1r h LEU 106 Cb 0.83 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.76 1d1r h LEU 106 CO 0.78 0.00 0.00 0.00 -0.62 0.00 0.00 178.44 178.60 1d1r n ALA 107 N -2.46 0.00 0.00 1.25 0.00 -1.26 -4.28 120.51 113.77 1d1r n ALA 107 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1d1r n ALA 107 Cb 1.33 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.78 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 0.00 0.02 0.00 0.00 0.00 -1.26 -5.05 105.19 98.90 1d1r n GLY 108 Ca 0.00 -2.26 0.00 0.00 0.00 0.00 0.00 46.02 43.76 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 -1.60 3.53 -0.02 0.00 -1.26 -5.05 105.19 100.78 1d1r n GLY 109 Ca 0.00 -1.24 -0.40 0.00 0.00 0.00 0.00 46.02 44.39 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 0.00 1.87 -0.29 0.99 7.94 -1.26 -5.29 117.00 120.96 1d1r n LEU 110 Ca 0.00 -0.17 0.04 0.00 -1.11 0.00 0.00 56.01 54.77 1d1r n LEU 110 Cb 0.00 -1.38 0.03 0.00 0.53 0.00 0.00 43.42 42.60 1d1r n LEU 110 CO 0.00 -1.20 0.37 1.21 -1.11 0.00 0.00 177.39 176.66