#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d89 n TYR 15 N 0.00 0.87 -4.42 5.58 4.02 -1.26 -4.74 117.16 117.21 3d89 n TYR 15 Ca 0.00 -1.62 -0.24 0.00 -0.01 0.00 0.00 57.90 56.02 3d89 n TYR 15 Cb 0.00 -0.26 -0.09 0.00 -0.02 0.00 0.00 39.34 38.97 3d89 n TYR 15 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 3d89 s THR 16 N -3.26 2.63 0.01 -0.72 2.01 -1.26 -4.78 115.64 110.27 3d89 s THR 16 Ca 0.40 -2.16 -0.30 0.00 0.31 0.00 0.00 61.69 59.95 3d89 s THR 16 Cb 0.38 -2.60 -0.15 0.00 0.01 0.00 0.00 72.50 70.14 3d89 s THR 16 CO -0.05 -0.30 0.78 -1.20 -0.69 0.00 0.00 174.62 173.16 3d89 n SER 17 N -0.80 -0.06 -4.27 3.53 7.64 -1.26 -4.79 113.62 113.62 3d89 n SER 17 Ca -0.05 0.87 -0.33 0.00 1.01 0.00 0.00 58.87 60.37 3d89 n SER 17 Cb 0.61 -0.69 -0.15 0.00 -1.01 0.00 0.00 64.21 62.96 3d89 n SER 17 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3d89 s VAL 18 N -0.04 2.58 -0.20 0.44 1.01 -0.26 -4.93 120.40 118.99 3d89 s VAL 18 Ca 0.67 -0.81 -0.29 0.00 0.00 0.00 0.00 61.98 61.55 3d89 s VAL 18 Cb -0.94 -2.07 -0.02 0.00 0.00 0.00 0.00 36.38 33.36 3d89 s VAL 18 CO 0.43 0.53 1.37 0.00 0.00 0.00 0.00 175.10 177.42 3d89 n VAL 20 N 5.79 0.00 -1.34 0.00 0.24 0.13 -4.98 118.33 118.17 3d89 n VAL 20 Ca 0.15 -0.17 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 3d89 n VAL 20 Cb 0.45 1.16 0.00 0.00 -1.47 0.00 0.00 33.84 33.98 3d89 n VAL 20 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3d89 n GLY 21 N 1.43 0.37 3.74 7.63 0.00 -1.24 -4.97 105.19 112.15 3d89 n GLY 21 Ca 0.07 -1.65 -0.36 0.00 0.00 0.00 0.00 46.02 44.08 3d89 n GLY 21 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3d89 s ARG 22 N -2.00 4.22 0.27 1.61 3.52 -1.26 -0.15 118.95 125.15 3d89 s ARG 22 Ca 0.00 0.08 -0.01 0.00 -0.13 0.00 0.00 55.73 55.67 3d89 s ARG 22 Cb 0.00 -3.41 0.62 0.00 -1.56 0.00 0.00 34.95 30.60 3d89 s ARG 22 CO 0.00 0.27 1.66 1.49 -0.81 0.00 0.00 175.30 177.92 3d89 h GLU 23 N 6.56 0.23 -0.28 5.12 4.81 -1.26 -1.14 114.58 128.62 3d89 h GLU 23 Ca -0.42 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 58.78 3d89 h GLU 23 Cb 1.17 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.48 3d89 h GLU 23 CO 0.75 0.15 0.10 0.93 -0.73 0.00 0.00 179.01 180.21 3d89 h GLU 24 N 0.24 0.39 -0.02 1.92 5.08 -1.94 -2.76 114.58 117.49 3d89 h GLU 24 Ca 0.50 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.82 3d89 h GLU 24 Cb 0.95 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.13 3d89 h GLU 24 CO -0.60 0.34 0.00 -0.40 -1.00 0.00 0.00 179.01 177.34 3d89 n ASP 25 N -4.41 0.79 -0.02 1.42 5.68 -0.44 -3.53 116.55 116.03 3d89 n ASP 25 Ca 0.01 -1.30 0.01 0.00 -0.50 0.00 0.00 54.79 53.01 3d89 n ASP 25 Cb 0.14 -0.01 -0.07 0.00 -1.14 0.00 0.00 41.12 40.04 3d89 n ASP 25 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3d89 n ILE 26 N -0.37 0.23 -0.25 2.12 3.06 -1.11 -4.60 119.36 118.45 3d89 n ILE 26 Ca 0.21 -0.26 -0.07 0.00 -2.50 0.00 0.00 62.75 60.13 3d89 n ILE 26 Cb 0.23 -0.16 0.04 0.00 0.54 0.00 0.00 39.64 40.30 3d89 n ILE 26 CO 0.00 0.00 0.00 0.03 -2.50 0.00 0.00 176.55 174.08 3d89 h ARG 27 N 0.00 1.05 0.18 9.51 3.08 -1.54 0.45 114.38 127.11 3d89 h ARG 27 Ca -0.09 -0.22 -0.00 0.00 0.07 0.00 0.00 59.98 59.74 3d89 h ARG 27 Cb 0.86 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.75 3d89 h ARG 27 CO 0.01 0.90 -0.20 -0.22 -1.07 0.00 0.00 179.97 179.39 3d89 h LYS 28 N 0.99 -0.36 0.00 0.04 3.64 -1.83 -3.21 116.57 115.83 3d89 h LYS 28 Ca 0.22 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 3d89 h LYS 28 Cb 0.28 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 3d89 h LYS 28 CO -0.01 -0.24 0.00 0.66 -2.27 0.00 0.00 179.45 177.59 3d89 h SER 29 N -0.38 0.00 0.00 4.20 4.64 -1.80 -3.47 113.55 116.74 3d89 h SER 29 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 3d89 h SER 29 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 3d89 h SER 29 CO -0.03 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.31 3d89 n GLU 30 N -2.54 -1.23 -3.50 4.77 1.02 0.16 -4.94 120.64 114.38 3d89 n GLU 30 Ca 0.05 0.31 -0.16 0.00 -0.02 0.00 0.00 57.16 57.33 3d89 n GLU 30 Cb 0.43 -4.50 -0.05 0.00 -0.02 0.00 0.00 31.44 27.30 3d89 n GLU 30 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 3d89 s ARG 31 N -1.43 1.10 0.07 3.49 1.70 -1.25 -1.10 118.95 121.53 3d89 s ARG 31 Ca 0.00 0.06 -0.20 0.00 -0.47 0.00 0.00 55.73 55.13 3d89 s ARG 31 Cb 0.00 0.52 0.04 0.00 -0.57 0.00 0.00 34.95 34.94 3d89 s ARG 31 CO 0.00 -0.38 0.46 0.00 -1.08 0.00 0.00 175.30 174.30 3d89 s MET 32 N -1.84 1.01 0.26 3.89 0.23 -0.65 -4.94 119.30 117.26 3d89 s MET 32 Ca -0.08 -0.38 0.07 0.00 -1.03 0.00 0.00 55.69 54.27 3d89 s MET 32 Cb -0.00 0.46 -0.03 0.00 -1.53 0.00 0.00 34.83 33.72 3d89 s MET 32 CO 0.04 -0.37 0.24 0.95 -2.03 0.00 0.00 175.02 173.85 3d89 s THR 33 N -2.77 4.52 0.13 3.16 -4.23 -1.26 -0.40 115.64 114.79 3d89 s THR 33 Ca -0.03 -1.31 -0.13 0.00 -1.18 0.00 0.00 61.69 59.03 3d89 s THR 33 Cb -0.00 -3.47 0.02 0.00 1.34 0.00 0.00 72.50 70.38 3d89 s THR 33 CO -0.04 -0.33 0.35 0.00 -0.54 0.00 0.00 174.62 174.06 3d89 s ALA 34 N -2.12 -0.63 -0.25 3.99 0.00 -0.44 -4.95 121.76 117.37 3d89 s ALA 34 Ca 0.34 -0.33 -0.09 0.00 0.00 0.00 0.00 51.96 51.88 3d89 s ALA 34 Cb -0.08 0.69 -0.04 0.00 0.00 0.00 0.00 23.12 23.69 3d89 s ALA 34 CO 0.26 -0.63 0.13 0.08 0.00 0.00 0.00 175.76 175.59 3d89 s VAL 35 N -3.85 4.91 -0.25 0.00 1.01 -1.26 -1.02 120.40 119.94 3d89 s VAL 35 Ca 0.06 0.03 0.02 0.00 0.00 0.00 0.00 61.98 62.10 3d89 s VAL 35 Cb 0.02 -3.30 0.06 0.00 0.00 0.00 0.00 36.38 33.16 3d89 s VAL 35 CO -0.09 0.32 -0.10 -0.69 0.00 0.00 0.00 175.10 174.55 3d89 s VAL 36 N 1.41 1.99 -1.36 2.92 1.01 0.81 -4.74 120.40 122.45 3d89 s VAL 36 Ca 0.06 -1.52 -0.11 0.00 0.00 0.00 0.00 61.98 60.41 3d89 s VAL 36 Cb -0.15 -2.14 0.01 0.00 0.00 0.00 0.00 36.38 34.10 3d89 s VAL 36 CO 0.06 -0.04 0.43 1.41 0.00 0.00 0.00 175.10 176.95 3d89 n HIS 37 N 4.50 -1.53 -1.10 5.22 8.25 -1.26 -0.41 115.22 128.89 3d89 n HIS 37 Ca -0.14 0.51 -0.03 0.00 -0.26 0.00 0.00 57.72 57.80 3d89 n HIS 37 Cb 0.43 -3.23 -0.01 0.00 1.12 0.00 0.00 29.99 28.29 3d89 n HIS 37 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 3d89 n ASP 38 N -2.73 -5.41 -4.35 0.41 8.00 -1.26 -4.98 116.55 106.24 3d89 n ASP 38 Ca -0.24 0.08 -0.35 0.00 0.71 0.00 0.00 54.79 55.00 3d89 n ASP 38 Cb 0.65 -3.20 -0.14 0.00 -0.02 0.00 0.00 41.12 38.41 3d89 n ASP 38 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 3d89 s ARG 39 N -2.00 3.44 -0.09 -1.24 3.52 0.45 -5.01 118.95 118.03 3d89 s ARG 39 Ca 0.00 -0.61 -0.25 0.00 -0.13 0.00 0.00 55.73 54.75 3d89 s ARG 39 Cb 0.00 -2.97 -0.03 0.00 -1.56 0.00 0.00 34.95 30.39 3d89 s ARG 39 CO 0.00 -0.09 0.77 -2.00 -0.81 0.00 0.00 175.30 173.17 3d89 s GLU 40 N 1.20 4.41 0.19 5.12 2.12 -1.26 -0.13 118.70 130.35 3d89 s GLU 40 Ca 0.02 0.98 0.06 0.00 0.36 0.00 0.00 54.97 56.39 3d89 s GLU 40 Cb -0.14 -3.49 -0.05 0.00 0.26 0.00 0.00 34.13 30.71 3d89 s GLU 40 CO -0.01 -0.06 -0.10 0.14 -0.54 0.00 0.00 175.26 174.69 3d89 s VAL 41 N 1.20 1.40 -0.07 3.70 -7.23 -0.19 -2.59 120.40 116.64 3d89 s VAL 41 Ca 0.39 -2.12 0.04 0.00 -1.81 0.00 0.00 61.98 58.49 3d89 s VAL 41 Cb -0.18 -2.04 -0.02 0.00 0.56 0.00 0.00 36.38 34.71 3d89 s VAL 41 CO 0.18 -0.60 -0.19 0.54 -0.31 0.00 0.00 175.10 174.72 3d89 s VAL 42 N -3.18 2.61 -0.15 1.32 0.11 0.03 -1.32 120.40 119.82 3d89 s VAL 42 Ca 0.21 -0.87 -0.03 0.00 -2.93 0.00 0.00 61.98 58.37 3d89 s VAL 42 Cb 0.02 -2.01 -0.02 0.00 -1.53 0.00 0.00 36.38 32.84 3d89 s VAL 42 CO 0.05 0.57 -0.06 -0.63 -3.33 0.00 0.00 175.10 171.70 3d89 s ILE 43 N -0.31 3.64 -0.10 7.04 1.09 0.46 -1.78 121.20 131.24 3d89 s ILE 43 Ca 0.02 -0.45 -0.01 0.00 -1.10 0.00 0.00 60.65 59.11 3d89 s ILE 43 Cb -0.13 -2.58 -0.03 0.00 -1.06 0.00 0.00 42.46 38.66 3d89 s ILE 43 CO 0.02 0.50 -0.06 -0.36 -0.10 0.00 0.00 174.94 174.95 3d89 s PHE 44 N 0.41 2.98 -0.31 3.97 0.08 0.14 -1.64 117.98 123.60 3d89 s PHE 44 Ca -0.06 -0.11 -0.09 0.00 0.12 0.00 0.00 56.93 56.79 3d89 s PHE 44 Cb -0.15 -1.81 0.00 0.00 -0.57 0.00 0.00 43.02 40.49 3d89 s PHE 44 CO 0.04 0.18 0.14 -0.47 -0.10 0.00 0.00 175.22 175.00 3d89 s TYR 45 N -0.34 3.18 -0.04 0.36 5.04 -0.26 -0.33 117.35 124.95 3d89 s TYR 45 Ca 0.05 -0.74 -0.02 0.00 -2.44 0.00 0.00 57.07 53.92 3d89 s TYR 45 Cb -0.12 -2.33 0.03 0.00 0.35 0.00 0.00 41.96 39.88 3d89 s TYR 45 CO 0.02 -0.51 0.09 -1.58 -1.34 0.00 0.00 175.55 172.24 3d89 s HIS 46 N 1.57 -0.09 -1.47 4.97 5.65 0.93 -4.74 115.29 122.12 3d89 s HIS 46 Ca 0.04 0.30 -0.01 0.00 0.25 0.00 0.00 55.06 55.64 3d89 s HIS 46 Cb -0.17 -0.09 0.01 0.00 -1.18 0.00 0.00 32.58 31.15 3d89 s HIS 46 CO 0.05 -0.11 0.31 1.63 -0.65 0.00 0.00 174.74 175.97 3d89 n LYS 47 N 3.84 -2.56 -1.00 2.88 5.02 -1.26 -0.72 118.16 124.36 3d89 n LYS 47 Ca -0.22 0.31 0.00 0.00 -2.02 0.00 0.00 58.31 56.37 3d89 n LYS 47 Cb 0.54 -4.27 0.00 0.00 -0.02 0.00 0.00 35.03 31.27 3d89 n LYS 47 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3d89 n GLY 48 N -2.13 0.23 3.34 0.72 0.00 -1.26 -5.00 105.19 101.08 3d89 n GLY 48 Ca -0.30 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.49 3d89 n GLY 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3d89 s GLU 49 N -1.09 1.27 -0.14 1.61 2.02 0.10 -5.14 118.70 117.34 3d89 s GLU 49 Ca 0.00 -1.35 -0.05 0.00 0.02 0.00 0.00 54.97 53.58 3d89 s GLU 49 Cb 0.00 -1.44 -0.04 0.00 0.10 0.00 0.00 34.13 32.75 3d89 s GLU 49 CO 0.00 0.31 0.05 0.71 0.02 0.00 0.00 175.26 176.35 3d89 s TYR 50 N -1.71 3.26 -0.05 1.61 2.02 -1.26 -0.05 117.35 121.18 3d89 s TYR 50 Ca 0.14 0.16 -0.00 0.00 -0.37 0.00 0.00 57.07 57.00 3d89 s TYR 50 Cb -0.07 -1.94 0.03 0.00 -0.40 0.00 0.00 41.96 39.57 3d89 s TYR 50 CO 0.06 0.35 -0.01 -1.01 -1.57 0.00 0.00 175.55 173.37 3d89 s HIS 51 N -0.31 0.55 -0.10 2.71 3.76 0.55 -4.85 115.29 117.60 3d89 s HIS 51 Ca 0.08 -0.11 -0.01 0.00 -0.15 0.00 0.00 55.06 54.87 3d89 s HIS 51 Cb -0.12 -0.61 -0.03 0.00 1.11 0.00 0.00 32.58 32.93 3d89 s HIS 51 CO 0.02 -0.21 -0.05 0.00 -0.85 0.00 0.00 174.74 173.64 3d89 s ALA 52 N 1.33 3.01 0.19 -1.40 0.00 -1.26 0.23 121.76 123.86 3d89 s ALA 52 Ca -0.05 -0.86 -0.11 0.00 0.00 0.00 0.00 51.96 50.94 3d89 s ALA 52 Cb -0.13 -1.37 -0.00 0.00 0.00 0.00 0.00 23.12 21.62 3d89 s ALA 52 CO -0.02 0.44 0.37 0.00 0.00 0.00 0.00 175.76 176.55 3d89 s MET 53 N -0.38 1.30 0.32 0.00 0.23 -0.73 -0.44 119.30 119.60 3d89 s MET 53 Ca 0.06 -1.16 -0.28 0.00 -1.03 0.00 0.00 55.69 53.28 3d89 s MET 53 Cb -0.12 0.42 -0.13 0.00 -1.53 0.00 0.00 34.83 33.47 3d89 s MET 53 CO 0.02 -0.51 1.23 -0.25 -2.03 0.00 0.00 175.02 173.48 3d89 n ASP 54 N -0.28 2.40 0.08 -1.18 8.00 -0.80 -0.79 116.55 123.99 3d89 n ASP 54 Ca -0.06 1.20 -0.16 0.00 0.71 0.00 0.00 54.79 56.48 3d89 n ASP 54 Cb 0.63 -1.43 -0.08 0.00 -0.02 0.00 0.00 41.12 40.21 3d89 n ASP 54 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 3d89 h ILE 55 N 2.43 1.39 -3.35 0.53 2.10 -1.80 -3.42 117.51 115.39 3d89 h ILE 55 Ca -0.44 -2.57 -0.57 0.00 1.08 0.00 0.00 64.86 62.36 3d89 h ILE 55 Cb 1.30 2.58 -0.07 0.00 -1.09 0.00 0.00 36.82 39.54 3d89 h ILE 55 CO 0.62 0.77 0.21 -0.13 -1.08 0.00 0.00 178.15 178.54 3d89 s ARG 56 N -3.08 4.35 0.17 2.19 0.52 -1.26 -1.89 118.95 119.95 3d89 s ARG 56 Ca -0.06 0.90 -0.33 0.00 -0.52 0.00 0.00 55.73 55.71 3d89 s ARG 56 Cb 0.08 -3.52 -0.13 0.00 0.52 0.00 0.00 34.95 31.90 3d89 s ARG 56 CO 0.89 -0.14 1.65 0.00 0.02 0.00 0.00 175.30 177.72 3d89 h TYR 58 N 6.41 0.00 0.40 0.00 -0.00 -1.87 0.24 116.97 122.14 3d89 h TYR 58 Ca -0.44 0.00 -0.02 0.00 -0.00 0.00 0.00 58.73 58.27 3d89 h TYR 58 Cb 1.23 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.97 3d89 h TYR 58 CO 0.64 0.00 -0.19 1.25 -0.00 0.00 0.00 178.16 179.86 3d89 h HIS 59 N 0.00 -0.49 0.00 0.10 2.76 -1.92 -3.42 115.15 112.18 3d89 h HIS 59 Ca 0.13 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.29 3d89 h HIS 59 Cb 0.80 0.16 0.00 0.00 1.55 0.00 0.00 27.41 29.92 3d89 h HIS 59 CO 0.00 -0.31 -0.24 0.43 -1.30 0.00 0.00 177.93 176.52 3d89 n SER 60 N -4.11 0.13 0.00 3.26 7.64 -1.21 -5.03 113.62 114.30 3d89 n SER 60 Ca -0.07 -1.57 0.00 0.00 1.01 0.00 0.00 58.87 58.25 3d89 n SER 60 Cb 0.21 -0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.30 3d89 n SER 60 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3d89 n GLY 61 N -0.06 0.55 3.69 0.23 0.00 0.83 -1.56 105.19 108.87 3d89 n GLY 61 Ca 0.00 -0.70 -0.30 0.00 0.00 0.00 0.00 46.02 45.02 3d89 n GLY 61 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3d89 s GLY 62 N -2.64 1.64 -0.96 -0.02 0.00 -1.25 -4.24 107.32 99.85 3d89 s GLY 62 Ca 0.00 0.17 -0.22 0.00 0.00 0.00 0.00 44.72 44.67 3d89 s GLY 62 CO 0.00 0.64 1.31 2.56 0.00 0.00 0.00 173.10 177.61 3d89 s PRO 63 N -4.80 3.54 0.53 2.90 0.04 -1.26 -0.36 135.00 135.60 3d89 s PRO 63 Ca 0.64 -1.25 0.24 0.00 0.04 0.00 0.00 61.00 60.67 3d89 s PRO 63 Cb -0.20 -5.09 1.48 0.00 0.04 0.00 0.00 34.50 30.73 3d89 s PRO 63 CO 0.58 -2.05 2.14 -0.07 0.04 0.00 0.00 177.00 177.64 3d89 h LEU 64 N 11.98 0.00 -0.31 -3.56 3.38 -1.74 -1.56 115.31 123.52 3d89 h LEU 64 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3d89 h LEU 64 Cb 1.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.77 3d89 h LEU 64 CO 1.31 0.07 0.00 0.00 0.09 0.00 0.00 178.44 179.91 3d89 n HIS 65 N -3.97 0.25 0.06 1.13 1.44 -1.26 -0.90 115.22 111.97 3d89 n HIS 65 Ca -0.03 0.11 0.09 0.00 -2.01 0.00 0.00 57.72 55.88 3d89 n HIS 65 Cb 0.16 -0.68 0.19 0.00 0.12 0.00 0.00 29.99 29.79 3d89 n HIS 65 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 3d89 n LEU 66 N -1.74 3.17 -4.95 2.39 4.77 -0.59 -5.02 117.00 115.04 3d89 n LEU 66 Ca 0.02 -1.66 -0.25 0.00 -0.03 0.00 0.00 56.01 54.08 3d89 n LEU 66 Cb 0.13 -0.25 0.09 0.00 -2.33 0.00 0.00 43.42 41.05 3d89 n LEU 66 CO 0.11 0.73 0.60 -0.83 -1.33 0.00 0.00 177.39 176.67 3d89 s GLY 67 N -1.17 1.73 0.11 -0.72 0.00 -0.08 -4.69 107.32 102.51 3d89 s GLY 67 Ca 0.32 -1.16 -0.07 0.00 0.00 0.00 0.00 44.72 43.81 3d89 s GLY 67 CO 0.25 -0.70 0.38 1.85 0.00 0.00 0.00 173.10 174.88 3d89 s GLU 68 N -5.24 3.67 -0.18 2.90 2.12 -1.15 -4.86 118.70 115.96 3d89 s GLU 68 Ca 0.63 0.02 -0.12 0.00 0.36 0.00 0.00 54.97 55.85 3d89 s GLU 68 Cb -0.09 -2.91 -0.05 0.00 0.26 0.00 0.00 34.13 31.35 3d89 s GLU 68 CO 0.45 0.51 0.23 0.42 -0.54 0.00 0.00 175.26 176.33 3d89 s ILE 69 N -1.54 5.34 0.05 -3.70 1.01 -1.26 -0.65 121.20 120.44 3d89 s ILE 69 Ca 0.37 0.41 -0.07 0.00 0.00 0.00 0.00 60.65 61.36 3d89 s ILE 69 Cb -0.13 -3.57 -0.01 0.00 0.01 0.00 0.00 42.46 38.76 3d89 s ILE 69 CO 0.21 0.39 0.15 -1.61 0.00 0.00 0.00 174.94 174.08 3d89 s GLU 70 N 0.53 0.68 -0.04 2.79 2.02 -0.31 -4.96 118.70 119.41 3d89 s GLU 70 Ca 0.13 -0.78 -0.23 0.00 0.02 0.00 0.00 54.97 54.12 3d89 s GLU 70 Cb -0.12 0.27 -0.04 0.00 0.10 0.00 0.00 34.13 34.34 3d89 s GLU 70 CO 0.02 -0.19 0.67 -0.51 0.02 0.00 0.00 175.26 175.27 3d89 s ASP 71 N -2.31 7.00 -0.02 -0.19 1.11 -1.26 -0.79 116.67 120.20 3d89 s ASP 71 Ca -0.02 1.20 0.02 0.00 0.18 0.00 0.00 52.55 53.92 3d89 s ASP 71 Cb 0.01 -2.40 0.01 0.00 1.07 0.00 0.00 42.92 41.60 3d89 s ASP 71 CO -0.06 -0.04 -0.06 -0.36 1.18 0.00 0.00 175.17 175.84 3d89 s PHE 72 N 0.44 0.66 -1.38 4.23 0.08 -0.15 -4.81 117.98 117.05 3d89 s PHE 72 Ca 0.35 -0.15 -0.09 0.00 0.12 0.00 0.00 56.93 57.16 3d89 s PHE 72 Cb -0.18 -0.51 0.06 0.00 -0.57 0.00 0.00 43.02 41.82 3d89 s PHE 72 CO 0.18 -0.09 0.58 -1.71 -0.10 0.00 0.00 175.22 174.08 3d89 n ASN 73 N 3.45 -4.37 -0.21 1.36 5.15 -1.26 -0.56 115.26 118.83 3d89 n ASN 73 Ca -0.19 -0.43 -0.03 0.00 -0.60 0.00 0.00 54.58 53.34 3d89 n ASN 73 Cb 0.54 -3.57 -0.01 0.00 -0.53 0.00 0.00 39.78 36.21 3d89 n ASN 73 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3d89 n GLY 74 N -1.32 0.43 3.40 8.20 0.00 -1.26 -5.00 105.19 109.64 3d89 n GLY 74 Ca -0.03 -0.08 -0.33 0.00 0.00 0.00 0.00 46.02 45.58 3d89 n GLY 74 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3d89 s GLN 75 N -1.63 3.37 0.12 1.61 -0.21 0.28 -5.09 119.66 118.11 3d89 s GLN 75 Ca 0.00 -0.66 -0.31 0.00 0.02 0.00 0.00 55.36 54.41 3d89 s GLN 75 Cb 0.00 -2.66 -0.08 0.00 1.00 0.00 0.00 33.01 31.26 3d89 s GLN 75 CO 0.00 0.25 1.45 -1.12 -2.12 0.00 0.00 175.29 173.75 3d89 s SER 76 N 0.27 6.75 0.03 5.90 0.01 -1.26 -0.97 113.70 124.42 3d89 s SER 76 Ca -0.08 2.40 0.04 0.00 1.31 0.00 0.00 55.95 59.61 3d89 s SER 76 Cb -0.15 -2.59 -0.02 0.00 0.21 0.00 0.00 66.02 63.47 3d89 s SER 76 CO 0.05 -0.71 -0.11 0.00 0.41 0.00 0.00 173.24 172.88 3d89 s ILE 78 N -0.78 4.65 -0.29 0.00 1.10 -0.14 -1.17 121.20 124.57 3d89 s ILE 78 Ca -0.00 1.76 -0.07 0.00 -0.51 0.00 0.00 60.65 61.83 3d89 s ILE 78 Cb -0.07 -4.18 0.01 0.00 0.15 0.00 0.00 42.46 38.37 3d89 s ILE 78 CO 0.01 0.36 0.09 -0.69 -2.11 0.00 0.00 174.94 172.59 3d89 s VAL 79 N -0.09 4.04 0.20 4.00 1.01 0.17 -0.99 120.40 128.74 3d89 s VAL 79 Ca 0.41 -0.65 -0.33 0.00 0.00 0.00 0.00 61.98 61.41 3d89 s VAL 79 Cb -0.21 -3.07 -0.13 0.00 0.00 0.00 0.00 36.38 32.96 3d89 s VAL 79 CO 0.25 0.09 1.52 0.00 0.00 0.00 0.00 175.10 176.96 3d89 h PRO 81 N 5.27 0.00 0.00 0.00 0.13 -1.83 -1.43 132.00 134.13 3d89 h PRO 81 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3d89 h PRO 81 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 3d89 h PRO 81 CO 0.84 0.00 -0.10 -1.49 -0.23 0.00 0.00 178.00 177.02 3d89 h TRP 82 N 0.00 0.00 0.00 1.56 4.06 -1.93 -3.41 115.95 116.23 3d89 h TRP 82 Ca 0.00 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.95 3d89 h TRP 82 Cb 0.40 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.56 3d89 h TRP 82 CO 0.00 0.00 -0.07 0.72 -3.56 0.00 0.00 178.44 175.53 3d89 n HIS 83 N -3.86 0.00 -2.22 0.49 8.25 -1.25 -4.97 115.22 111.66 3d89 n HIS 83 Ca -0.01 -1.01 -0.20 0.00 -0.26 0.00 0.00 57.72 56.24 3d89 n HIS 83 Cb 0.05 -0.16 -0.02 0.00 1.12 0.00 0.00 29.99 30.98 3d89 n HIS 83 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3d89 n LYS 84 N -1.35 -1.55 -2.15 -0.41 4.76 -0.54 -4.96 118.16 111.96 3d89 n LYS 84 Ca 0.16 1.01 -0.38 0.00 -2.87 0.00 0.00 58.31 56.23 3d89 n LYS 84 Cb 0.65 -5.57 -0.00 0.00 -1.84 0.00 0.00 35.03 28.27 3d89 n LYS 84 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 3d89 s TYR 85 N -2.94 2.83 -0.21 2.13 1.51 -1.26 -4.67 117.35 114.73 3d89 s TYR 85 Ca 0.00 1.48 -0.06 0.00 -1.01 0.00 0.00 57.07 57.48 3d89 s TYR 85 Cb 0.00 -3.52 -0.03 0.00 -0.11 0.00 0.00 41.96 38.30 3d89 s TYR 85 CO 0.00 -1.80 0.03 0.15 -1.11 0.00 0.00 175.55 172.82 3d89 s LYS 86 N -2.50 3.69 -0.12 -0.62 1.02 -1.26 -1.36 119.74 118.60 3d89 s LYS 86 Ca 0.61 -0.48 0.02 0.00 0.02 0.00 0.00 55.97 56.15 3d89 s LYS 86 Cb -0.33 -3.18 0.01 0.00 -0.52 0.00 0.00 37.83 33.81 3d89 s LYS 86 CO 0.41 -0.01 -0.18 0.42 -0.92 0.00 0.00 175.35 175.07 3d89 s ILE 87 N 1.10 1.74 0.32 2.17 1.01 -0.16 -1.30 121.20 126.07 3d89 s ILE 87 Ca 0.03 -0.80 -0.29 0.00 0.00 0.00 0.00 60.65 59.60 3d89 s ILE 87 Cb -0.14 -1.56 -0.10 0.00 0.01 0.00 0.00 42.46 40.67 3d89 s ILE 87 CO 0.02 0.49 1.30 0.42 0.00 0.00 0.00 174.94 177.17 3d89 s THR 88 N 0.82 2.77 0.19 2.92 -4.23 -0.17 -0.97 115.64 116.98 3d89 s THR 88 Ca -0.09 0.77 -0.07 0.00 -1.18 0.00 0.00 61.69 61.11 3d89 s THR 88 Cb -0.16 -3.49 0.05 0.00 1.34 0.00 0.00 72.50 70.25 3d89 s THR 88 CO 0.00 0.18 1.63 -0.07 -0.54 0.00 0.00 174.62 175.82 3d89 h LEU 89 N 3.52 0.95 0.14 4.79 3.38 -1.57 -1.39 115.31 125.14 3d89 h LEU 89 Ca -0.49 -0.30 -0.28 0.00 0.09 0.00 0.00 57.88 56.90 3d89 h LEU 89 Cb 1.22 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 41.72 3d89 h LEU 89 CO 0.66 1.07 -1.29 0.00 0.09 0.00 0.00 178.44 178.97 3d89 h ALA 90 N 1.02 0.07 0.00 1.53 0.00 -1.91 -3.40 119.26 116.57 3d89 h ALA 90 Ca 0.14 -0.89 0.00 0.00 0.00 0.00 0.00 54.91 54.15 3d89 h ALA 90 Cb 0.64 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3d89 h ALA 90 CO 0.04 0.95 0.00 0.25 0.00 0.00 0.00 179.25 180.49 3d89 n THR 91 N -3.55 0.00 -1.79 0.00 -2.24 -1.24 -5.02 114.28 100.43 3d89 n THR 91 Ca -0.10 -0.37 -0.09 0.00 -2.27 0.00 0.00 64.05 61.23 3d89 n THR 91 Cb 1.04 1.12 -0.02 0.00 -2.10 0.00 0.00 70.33 70.36 3d89 n THR 91 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d89 n GLY 92 N 0.41 0.43 3.72 3.38 0.00 -0.52 -4.72 105.19 107.89 3d89 n GLY 92 Ca 0.00 -0.58 -0.39 0.00 0.00 0.00 0.00 46.02 45.05 3d89 n GLY 92 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3d89 s GLU 93 N -3.74 4.41 0.02 1.61 2.02 -1.26 0.01 118.70 121.77 3d89 s GLU 93 Ca 0.00 0.79 -0.30 0.00 0.02 0.00 0.00 54.97 55.48 3d89 s GLU 93 Cb 0.00 -3.43 -0.08 0.00 0.10 0.00 0.00 34.13 30.72 3d89 s GLU 93 CO 0.00 0.12 1.80 0.20 0.02 0.00 0.00 175.26 177.40 3d89 s GLY 94 N 0.64 1.49 0.03 -1.39 0.00 -1.24 -1.00 107.32 105.85 3d89 s GLY 94 Ca 0.35 1.19 0.05 0.00 0.00 0.00 0.00 44.72 46.31 3d89 s GLY 94 CO 0.17 3.20 -0.12 1.08 0.00 0.00 0.00 173.10 177.43 3d89 s LEU 95 N 3.86 2.91 0.10 0.66 1.43 -0.42 -2.95 118.68 124.27 3d89 s LEU 95 Ca 0.80 -0.29 -0.13 0.00 -1.03 0.00 0.00 54.13 53.48 3d89 s LEU 95 Cb -0.39 -1.69 0.02 0.00 0.03 0.00 0.00 46.19 44.16 3d89 s LEU 95 CO 0.36 0.26 0.32 -0.72 0.23 0.00 0.00 176.35 176.80 3d89 s TYR 96 N -0.98 -0.08 -0.14 0.29 1.13 -0.45 -4.35 117.35 112.77 3d89 s TYR 96 Ca 0.16 -0.24 -0.15 0.00 -1.41 0.00 0.00 57.07 55.44 3d89 s TYR 96 Cb -0.11 0.14 -0.05 0.00 -1.10 0.00 0.00 41.96 40.84 3d89 s TYR 96 CO 0.07 -0.62 0.33 -0.65 -2.51 0.00 0.00 175.55 172.17 3d89 s GLN 97 N -3.62 4.21 -0.25 -3.49 -0.21 -1.26 0.83 119.66 115.87 3d89 s GLN 97 Ca 0.02 0.19 -0.14 0.00 0.02 0.00 0.00 55.36 55.45 3d89 s GLN 97 Cb 0.02 -3.40 -0.04 0.00 1.00 0.00 0.00 33.01 30.59 3d89 s GLN 97 CO -0.10 0.28 0.34 0.45 -2.12 0.00 0.00 175.29 174.14 3d89 s SER 98 N 0.30 6.27 -0.08 5.90 0.15 0.63 -4.91 113.70 121.96 3d89 s SER 98 Ca 0.19 0.31 0.03 0.00 0.70 0.00 0.00 55.95 57.18 3d89 s SER 98 Cb -0.14 -2.19 -0.02 0.00 -1.71 0.00 0.00 66.02 61.96 3d89 s SER 98 CO 0.06 -0.11 -0.18 -0.63 1.20 0.00 0.00 173.24 173.59 3d89 s ILE 99 N 1.67 2.72 -0.63 6.45 1.01 -1.26 -2.48 121.20 128.68 3d89 s ILE 99 Ca 0.14 -0.82 -0.07 0.00 0.00 0.00 0.00 60.65 59.91 3d89 s ILE 99 Cb -0.15 -2.07 0.16 0.00 0.01 0.00 0.00 42.46 40.41 3d89 s ILE 99 CO 0.09 0.56 0.48 0.21 0.00 0.00 0.00 174.94 176.28 3d89 s ASN 100 N -0.20 5.70 0.00 3.58 3.84 -1.26 -5.11 114.94 121.50 3d89 s ASN 100 Ca -0.01 -2.56 0.00 0.00 0.21 0.00 0.00 52.86 50.50 3d89 s ASN 100 Cb -0.13 -1.97 0.00 0.00 -0.55 0.00 0.00 41.25 38.60 3d89 s ASN 100 CO 0.03 -0.50 0.27 -0.81 -2.79 0.00 0.00 177.10 173.30 3d89 n PRO 101 N 3.98 0.00 -1.31 0.43 -0.04 -1.26 -5.12 135.00 131.68 3d89 n PRO 101 Ca 0.05 -0.13 -0.57 0.00 -0.04 0.00 0.00 63.50 62.81 3d89 n PRO 101 Cb 0.41 -1.26 -0.11 0.00 -0.04 0.00 0.00 33.50 32.49 3d89 n PRO 101 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 3d89 n LYS 107 N 3.16 0.25 -1.65 0.54 4.81 -1.26 -5.36 118.16 118.65 3d89 n LYS 107 Ca 0.00 0.06 -0.45 0.00 -0.87 0.00 0.00 58.31 57.05 3d89 n LYS 107 Cb 0.00 -1.73 -0.03 0.00 0.02 0.00 0.00 35.03 33.30 3d89 n LYS 107 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 3d89 n PRO 108 N 7.71 1.83 -5.13 1.64 -0.04 -1.26 -4.99 135.00 134.76 3d89 n PRO 108 Ca 0.52 0.65 -0.32 0.00 -0.04 0.00 0.00 63.50 64.31 3d89 n PRO 108 Cb 0.03 -2.24 -0.15 0.00 -0.04 0.00 0.00 33.50 31.09 3d89 n PRO 108 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 3d89 s LYS 109 N -0.71 2.54 0.20 0.54 -0.14 -1.04 -4.95 119.74 116.19 3d89 s LYS 109 Ca 0.66 -0.83 -0.29 0.00 -1.36 0.00 0.00 55.97 54.15 3d89 s LYS 109 Cb -0.68 -2.24 -0.08 0.00 -1.68 0.00 0.00 37.83 33.15 3d89 s LYS 109 CO 0.53 0.46 0.91 -1.58 -0.76 0.00 0.00 175.35 174.91 3d89 s TRP 110 N -0.34 3.94 0.04 3.18 0.52 -1.26 -0.27 118.94 124.75 3d89 s TRP 110 Ca 0.02 1.84 -0.01 0.00 0.02 0.00 0.00 56.10 57.97 3d89 s TRP 110 Cb -0.12 -2.95 -0.03 0.00 -1.15 0.00 0.00 33.47 29.21 3d89 s TRP 110 CO 0.02 0.42 -0.02 0.00 0.02 0.00 0.00 176.95 177.38 3d89 s SER 112 N -2.47 1.34 -0.22 0.00 0.15 -1.26 -1.34 113.70 109.90 3d89 s SER 112 Ca -0.00 -0.64 0.15 0.00 0.70 0.00 0.00 55.95 56.16 3d89 s SER 112 Cb 0.02 -0.01 0.64 0.00 -1.71 0.00 0.00 66.02 64.97 3d89 s SER 112 CO -0.07 -0.17 1.56 0.29 1.20 0.00 0.00 173.24 176.06 3d89 n LYS 113 N 1.16 3.59 0.00 5.44 5.02 -1.15 -5.05 118.16 127.16 3d89 n LYS 113 Ca -0.20 -2.99 0.00 0.00 -2.02 0.00 0.00 58.31 53.10 3d89 n LYS 113 Cb 0.55 -2.02 0.00 0.00 -0.02 0.00 0.00 35.03 33.55 3d89 n LYS 113 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3d89 n GLY 114 N -0.15 -1.83 3.67 0.72 0.00 -1.26 -4.85 105.19 101.49 3d89 n GLY 114 Ca 0.26 -1.80 -0.43 0.00 0.00 0.00 0.00 46.02 44.05 3d89 n GLY 114 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d89 s VAL 115 N 0.00 4.17 -0.11 1.61 1.01 -1.26 -3.65 120.40 122.17 3d89 s VAL 115 Ca 0.00 1.47 0.03 0.00 0.00 0.00 0.00 61.98 63.48 3d89 s VAL 115 Cb 0.00 -3.95 -0.09 0.00 0.00 0.00 0.00 36.38 32.35 3d89 s VAL 115 CO 0.00 -0.06 -0.07 0.29 0.00 0.00 0.00 175.10 175.25 3d89 n LYS 116 N 5.94 0.80 -3.85 2.72 4.76 0.10 -4.58 118.16 124.05 3d89 n LYS 116 Ca 0.13 0.05 -0.36 0.00 -2.87 0.00 0.00 58.31 55.26 3d89 n LYS 116 Cb 0.45 -1.24 -0.13 0.00 -1.84 0.00 0.00 35.03 32.27 3d89 n LYS 116 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 3d89 s GLN 117 N -2.23 3.40 0.03 1.97 2.00 0.41 -1.50 119.66 123.74 3d89 s GLN 117 Ca -0.13 -0.62 -0.30 0.00 -2.00 0.00 0.00 55.36 52.30 3d89 s GLN 117 Cb 0.04 -3.15 -0.08 0.00 0.80 0.00 0.00 33.01 30.62 3d89 s GLN 117 CO 0.30 -0.23 1.80 0.50 -0.50 0.00 0.00 175.29 177.16 3d89 s ARG 118 N 1.52 4.16 -0.21 1.67 3.52 -1.26 -4.13 118.95 124.22 3d89 s ARG 118 Ca 0.05 2.44 -0.14 0.00 -0.13 0.00 0.00 55.73 57.95 3d89 s ARG 118 Cb -0.15 -3.93 -0.04 0.00 -1.56 0.00 0.00 34.95 29.26 3d89 s ARG 118 CO -0.01 -0.87 0.31 0.42 -0.81 0.00 0.00 175.30 174.35 3d89 s ILE 119 N 3.78 5.26 0.47 4.11 -1.09 -1.26 -1.90 121.20 130.58 3d89 s ILE 119 Ca 0.80 0.53 0.05 0.00 -2.23 0.00 0.00 60.65 59.81 3d89 s ILE 119 Cb -0.40 -3.65 0.02 0.00 -1.58 0.00 0.00 42.46 36.86 3d89 s ILE 119 CO 0.36 0.30 0.65 -1.00 -1.23 0.00 0.00 174.94 174.02 3d89 s HIS 120 N 1.10 2.79 -0.10 3.97 3.76 0.41 -4.53 115.29 122.69 3d89 s HIS 120 Ca 0.15 -0.26 -0.18 0.00 -0.15 0.00 0.00 55.06 54.62 3d89 s HIS 120 Cb -0.14 -2.52 -0.04 0.00 1.11 0.00 0.00 32.58 30.99 3d89 s HIS 120 CO 0.06 -0.61 0.48 0.99 -0.85 0.00 0.00 174.74 174.81 3d89 s THR 121 N -2.51 5.16 -0.07 1.30 2.01 -0.50 -4.06 115.64 116.96 3d89 s THR 121 Ca 0.56 0.97 0.05 0.00 0.31 0.00 0.00 61.69 63.58 3d89 s THR 121 Cb -0.10 -3.82 -0.00 0.00 0.01 0.00 0.00 72.50 68.59 3d89 s THR 121 CO 0.35 0.35 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.72 3d89 s VAL 122 N 0.43 1.87 0.02 3.82 1.01 -1.26 -1.04 120.40 125.25 3d89 s VAL 122 Ca 0.26 -0.94 0.03 0.00 0.00 0.00 0.00 61.98 61.33 3d89 s VAL 122 Cb -0.15 -1.60 -0.02 0.00 0.00 0.00 0.00 36.38 34.61 3d89 s VAL 122 CO 0.11 0.52 -0.10 -0.54 0.00 0.00 0.00 175.10 175.09 3d89 s LYS 123 N 0.10 0.70 -0.00 2.72 1.02 -0.90 -4.99 119.74 118.39 3d89 s LYS 123 Ca -0.09 -0.54 0.02 0.00 0.02 0.00 0.00 55.97 55.38 3d89 s LYS 123 Cb -0.15 -0.65 -0.03 0.00 -0.52 0.00 0.00 37.83 36.48 3d89 s LYS 123 CO 0.05 0.16 -0.03 0.14 -0.92 0.00 0.00 175.35 174.75 3d89 s VAL 124 N -0.67 3.91 -0.23 3.17 -7.23 -1.26 -0.65 120.40 117.44 3d89 s VAL 124 Ca -0.00 -0.68 -0.11 0.00 -1.81 0.00 0.00 61.98 59.38 3d89 s VAL 124 Cb -0.06 -2.72 0.08 0.00 0.56 0.00 0.00 36.38 34.24 3d89 s VAL 124 CO 0.00 0.39 0.54 -0.62 -0.31 0.00 0.00 175.10 175.11 3d89 s ASP 125 N -1.47 -0.71 -1.76 4.85 2.15 -0.92 -4.91 116.67 113.90 3d89 s ASP 125 Ca 0.18 1.23 0.00 0.00 0.43 0.00 0.00 52.55 54.39 3d89 s ASP 125 Cb -0.11 1.33 0.00 0.00 -0.30 0.00 0.00 42.92 43.84 3d89 s ASP 125 CO 0.09 -0.22 0.00 0.59 -0.17 0.00 0.00 175.17 175.46 3d89 n ASN 126 N 4.68 -5.80 -1.52 -0.34 4.13 -1.26 -1.25 115.26 113.90 3d89 n ASN 126 Ca -0.18 -0.00 -0.15 0.00 1.68 0.00 0.00 54.58 55.93 3d89 n ASN 126 Cb 0.54 -4.82 -0.03 0.00 -1.54 0.00 0.00 39.78 33.93 3d89 n ASN 126 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3d89 n GLY 127 N -1.00 0.45 3.48 7.41 0.00 -1.26 -5.00 105.19 109.27 3d89 n GLY 127 Ca -0.24 -0.27 -0.32 0.00 0.00 0.00 0.00 46.02 45.19 3d89 n GLY 127 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3d89 s ASN 128 N -2.52 4.02 -0.18 1.61 0.01 -0.38 -0.76 114.94 116.74 3d89 s ASN 128 Ca 0.00 -0.26 -0.16 0.00 -0.71 0.00 0.00 52.86 51.73 3d89 s ASN 128 Cb 0.00 -0.80 -0.04 0.00 0.41 0.00 0.00 41.25 40.82 3d89 s ASN 128 CO 0.00 0.31 0.40 -0.63 -1.51 0.00 0.00 177.10 175.67 3d89 s ILE 129 N -0.82 5.21 -0.09 0.60 1.01 0.78 -2.16 121.20 125.74 3d89 s ILE 129 Ca 0.13 0.73 0.03 0.00 0.00 0.00 0.00 60.65 61.55 3d89 s ILE 129 Cb -0.11 -3.73 -0.01 0.00 0.01 0.00 0.00 42.46 38.62 3d89 s ILE 129 CO 0.03 0.29 -0.19 -0.31 0.00 0.00 0.00 174.94 174.76 3d89 s TYR 130 N 1.02 2.64 -0.06 3.97 2.02 0.18 -0.69 117.35 126.42 3d89 s TYR 130 Ca 0.20 -0.64 0.03 0.00 -0.37 0.00 0.00 57.07 56.30 3d89 s TYR 130 Cb -0.14 -1.71 -0.02 0.00 -0.40 0.00 0.00 41.96 39.69 3d89 s TYR 130 CO 0.08 -0.17 -0.15 0.08 -1.57 0.00 0.00 175.55 173.82 3d89 s VAL 131 N -0.02 2.99 -0.12 0.71 1.01 0.23 -2.12 120.40 123.09 3d89 s VAL 131 Ca -0.06 -0.74 0.02 0.00 0.00 0.00 0.00 61.98 61.20 3d89 s VAL 131 Cb -0.15 -2.18 0.01 0.00 0.00 0.00 0.00 36.38 34.07 3d89 s VAL 131 CO 0.05 0.58 -0.17 -0.89 0.00 0.00 0.00 175.10 174.67 3d89 s THR 132 N -0.51 1.63 0.41 3.92 2.01 -0.21 -1.10 115.64 121.80 3d89 s THR 132 Ca 0.07 -0.72 -0.26 0.00 0.31 0.00 0.00 61.69 61.09 3d89 s THR 132 Cb -0.12 -1.48 -0.09 0.00 0.01 0.00 0.00 72.50 70.82 3d89 s THR 132 CO 0.02 0.47 1.36 -0.76 -0.69 0.00 0.00 174.62 175.01 3d89 s LEU 133 N 1.01 4.20 0.18 4.42 1.43 -1.26 -1.42 118.68 127.25 3d89 s LEU 133 Ca -0.05 2.78 -0.12 0.00 -1.03 0.00 0.00 54.13 55.71 3d89 s LEU 133 Cb -0.15 -3.88 -0.07 0.00 0.03 0.00 0.00 46.19 42.13 3d89 s LEU 133 CO -0.03 -0.94 0.54 -0.94 0.23 0.00 0.00 176.35 175.22 3d89 s SER 134 N -0.60 6.72 -0.06 2.29 1.04 -1.26 -4.81 113.70 117.01 3d89 s SER 134 Ca 0.57 0.99 0.20 0.00 0.48 0.00 0.00 55.95 58.19 3d89 s SER 134 Cb -0.41 -2.25 -0.31 0.00 0.10 0.00 0.00 66.02 63.16 3d89 s SER 134 CO 0.53 0.02 0.38 0.29 0.98 0.00 0.00 173.24 175.43 3d89 n LYS 135 N 0.34 0.67 -3.64 4.02 5.02 -1.26 -4.96 118.16 118.35 3d89 n LYS 135 Ca -0.03 -0.15 -0.37 0.00 -2.02 0.00 0.00 58.31 55.74 3d89 n LYS 135 Cb 0.52 -1.49 -0.07 0.00 -0.02 0.00 0.00 35.03 33.97 3d89 n LYS 135 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 3d89 s GLU 136 N -3.25 3.92 0.79 1.97 2.56 -1.26 -3.98 118.70 119.45 3d89 s GLU 136 Ca -0.08 0.10 -0.12 0.00 0.00 0.00 0.00 54.97 54.87 3d89 s GLU 136 Cb 0.12 -3.30 0.07 0.00 2.00 0.00 0.00 34.13 33.01 3d89 s GLU 136 CO 0.85 0.52 1.12 -1.25 -0.56 0.00 0.00 175.26 175.94 3d89 s PRO 137 N -0.40 2.13 0.21 4.30 0.04 -1.26 -4.81 135.00 135.21 3d89 s PRO 137 Ca 0.17 0.42 -0.10 0.00 0.04 0.00 0.00 61.00 61.54 3d89 s PRO 137 Cb -0.14 -1.94 0.25 0.00 0.04 0.00 0.00 34.50 32.72 3d89 s PRO 137 CO 0.06 -1.54 1.77 0.35 0.04 0.00 0.00 177.00 177.68 3d89 h PHE 138 N -1.02 0.49 -3.81 0.56 3.57 -2.01 -3.41 116.94 111.31 3d89 h PHE 138 Ca -0.47 0.03 -0.40 0.00 3.53 0.00 0.00 57.97 60.66 3d89 h PHE 138 Cb 1.29 -0.13 -0.31 0.00 2.79 0.00 0.00 35.95 39.59 3d89 h PHE 138 CO 0.42 0.18 -0.78 0.21 -2.23 0.00 0.00 178.31 176.11 3d89 s LYS 139 N -6.09 0.78 0.07 1.11 2.20 -1.26 -5.12 119.74 111.43 3d89 s LYS 139 Ca -0.13 -0.25 0.10 0.00 -0.36 0.00 0.00 55.97 55.33 3d89 s LYS 139 Cb 0.16 -0.75 -0.03 0.00 -1.51 0.00 0.00 37.83 35.70 3d89 s LYS 139 CO 0.75 0.09 -0.26 0.00 -0.36 0.00 0.00 175.35 175.57 3d89 h ASP 141 N 4.47 0.09 0.67 0.00 5.19 -1.76 -2.35 116.42 122.72 3d89 h ASP 141 Ca -0.48 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.93 3d89 h ASP 141 Cb 1.15 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 40.64 3d89 h ASP 141 CO 0.43 0.06 0.00 0.77 -3.12 0.00 0.00 179.24 177.37 3d89 h SER 142 N 0.10 0.00 -0.86 6.45 4.64 -1.54 -3.16 113.55 119.18 3d89 h SER 142 Ca 0.12 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.49 3d89 h SER 142 Cb 0.35 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.38 3d89 h SER 142 CO -0.01 0.00 0.56 0.44 -0.87 0.00 0.00 176.83 176.95 3d89 h ASP 143 N 0.00 0.88 -0.98 4.97 3.32 -1.72 -2.04 116.42 120.84 3d89 h ASP 143 Ca 0.00 0.00 0.14 0.00 0.02 0.00 0.00 57.03 57.19 3d89 h ASP 143 Cb 0.33 -0.19 -0.09 0.00 0.22 0.00 0.00 39.33 39.61 3d89 h ASP 143 CO 0.00 0.58 0.62 0.22 -1.72 0.00 0.00 179.24 178.93 3d89 h TYR 144 N 1.00 1.06 -0.01 4.55 3.20 -1.75 -1.63 116.97 123.39 3d89 h TYR 144 Ca 0.36 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.26 3d89 h TYR 144 Cb 0.15 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 38.09 3d89 h TYR 144 CO -0.00 0.37 -0.11 0.66 -1.64 0.00 0.00 178.16 177.44 3d89 n TYR 145 N -4.64 0.00 0.37 -3.82 4.01 -0.80 -3.88 117.16 108.40 3d89 n TYR 145 Ca 0.20 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 58.05 3d89 n TYR 145 Cb 0.43 -0.08 -0.07 0.00 -0.31 0.00 0.00 39.34 39.31 3d89 n TYR 145 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3d89 n ALA 146 N -0.42 3.29 -3.22 -0.72 0.00 -0.62 -4.81 120.51 114.00 3d89 n ALA 146 Ca 0.16 -0.45 -0.13 0.00 0.00 0.00 0.00 53.44 53.02 3d89 n ALA 146 Cb 0.32 -0.88 -0.13 0.00 0.00 0.00 0.00 19.45 18.76 3d89 n ALA 146 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3d89 s THR 147 N -3.30 -0.01 0.00 0.00 -4.23 -1.17 -4.75 115.64 102.17 3d89 s THR 147 Ca -0.00 0.05 0.00 0.00 -1.18 0.00 0.00 61.69 60.56 3d89 s THR 147 Cb 0.14 -0.22 0.00 0.00 1.34 0.00 0.00 72.50 73.76 3d89 s THR 147 CO 0.85 0.02 0.00 0.61 -0.54 0.00 0.00 174.62 175.56 3d89 n GLY 148 N 3.34 1.95 3.61 3.99 0.00 -1.26 -4.68 105.19 112.14 3d89 n GLY 148 Ca -0.16 -0.54 -0.43 0.00 0.00 0.00 0.00 46.02 44.89 3d89 n GLY 148 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3d89 s GLU 149 N 0.00 3.60 0.09 1.61 0.41 -1.26 -5.01 118.70 118.14 3d89 s GLU 149 Ca 0.00 1.19 -0.08 0.00 -0.41 0.00 0.00 54.97 55.67 3d89 s GLU 149 Cb 0.00 -4.04 -0.01 0.00 -1.78 0.00 0.00 34.13 28.30 3d89 s GLU 149 CO 0.00 -1.53 0.18 -0.59 -0.49 0.00 0.00 175.26 172.83 3d89 s PHE 150 N 5.56 0.22 0.09 1.61 -0.12 -1.26 -5.07 117.98 119.01 3d89 s PHE 150 Ca 0.66 -0.65 0.10 0.00 -0.05 0.00 0.00 56.93 56.99 3d89 s PHE 150 Cb -0.18 -0.09 -0.03 0.00 -0.63 0.00 0.00 43.02 42.09 3d89 s PHE 150 CO 0.31 -0.55 -0.25 0.15 -0.05 0.00 0.00 175.22 174.83 3d89 s LYS 151 N -3.88 1.66 -0.01 1.99 1.02 -1.26 -5.15 119.74 114.10 3d89 s LYS 151 Ca 0.07 -1.21 -0.00 0.00 0.02 0.00 0.00 55.97 54.85 3d89 s LYS 151 Cb 0.05 -1.97 -0.04 0.00 -0.52 0.00 0.00 37.83 35.35 3d89 s LYS 151 CO -0.10 0.49 0.06 0.14 -0.92 0.00 0.00 175.35 175.02 3d89 s VAL 152 N -0.95 4.60 -0.13 3.17 -7.23 -1.26 -4.92 120.40 113.68 3d89 s VAL 152 Ca 0.13 -0.42 0.02 0.00 -1.81 0.00 0.00 61.98 59.91 3d89 s VAL 152 Cb -0.10 -3.07 0.01 0.00 0.56 0.00 0.00 36.38 33.78 3d89 s VAL 152 CO 0.05 0.38 -0.19 -0.63 -0.31 0.00 0.00 175.10 174.40 3d89 s ILE 153 N -1.14 1.84 -1.34 -0.62 1.01 -0.60 -5.06 121.20 115.30 3d89 s ILE 153 Ca 0.21 -0.85 0.11 0.00 0.00 0.00 0.00 60.65 60.12 3d89 s ILE 153 Cb -0.12 -1.65 0.08 0.00 0.01 0.00 0.00 42.46 40.79 3d89 s ILE 153 CO 0.12 0.51 0.84 1.67 0.00 0.00 0.00 174.94 178.08