#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u90 s LEU 14 N 0.00 2.73 -0.07 0.00 0.20 -1.26 0.67 118.68 120.95 1u90 s LEU 14 Ca 0.00 -0.31 0.04 0.00 0.69 0.00 0.00 54.13 54.55 1u90 s LEU 14 Cb 0.00 -1.61 -0.00 0.00 -0.43 0.00 0.00 46.19 44.15 1u90 s LEU 14 CO 0.00 0.19 -0.20 -1.00 -0.29 0.00 0.00 176.35 175.05 1u90 s HIS 15 N 0.22 2.05 -0.27 5.38 3.76 0.90 -4.96 115.29 122.37 1u90 s HIS 15 Ca -0.08 -0.71 -0.10 0.00 -0.15 0.00 0.00 55.06 54.01 1u90 s HIS 15 Cb -0.15 -1.39 -0.05 0.00 1.11 0.00 0.00 32.58 32.10 1u90 s HIS 15 CO 0.05 -0.28 0.17 0.15 -0.85 0.00 0.00 174.74 173.99 1u90 s LYS 16 N 0.22 3.93 -0.05 1.40 1.02 -1.26 0.54 119.74 125.54 1u90 s LYS 16 Ca -0.11 -0.33 0.04 0.00 0.02 0.00 0.00 55.97 55.60 1u90 s LYS 16 Cb -0.15 -3.60 -0.02 0.00 -0.52 0.00 0.00 37.83 33.54 1u90 s LYS 16 CO 0.05 -0.15 -0.18 0.08 -0.92 0.00 0.00 175.35 174.24 1u90 s VAL 17 N 1.65 2.77 -0.14 3.17 1.01 0.16 -1.02 120.40 128.00 1u90 s VAL 17 Ca 0.07 -0.83 -0.00 0.00 0.00 0.00 0.00 61.98 61.22 1u90 s VAL 17 Cb -0.16 -2.06 -0.01 0.00 0.00 0.00 0.00 36.38 34.15 1u90 s VAL 17 CO 0.09 0.58 -0.12 -0.63 0.00 0.00 0.00 175.10 175.02 1u90 s ILE 18 N -0.57 3.04 -0.26 2.22 -1.09 -0.49 -0.61 121.20 123.45 1u90 s ILE 18 Ca 0.08 -0.66 -0.16 0.00 -2.23 0.00 0.00 60.65 57.68 1u90 s ILE 18 Cb -0.11 -2.29 -0.03 0.00 -1.58 0.00 0.00 42.46 38.45 1u90 s ILE 18 CO 0.01 0.51 0.45 -0.04 -1.23 0.00 0.00 174.94 174.64 1u90 s MET 19 N 0.50 4.06 0.12 2.79 -1.94 -0.36 -1.53 119.30 122.95 1u90 s MET 19 Ca -0.09 0.20 0.05 0.00 -1.71 0.00 0.00 55.69 54.15 1u90 s MET 19 Cb -0.16 -3.64 -0.04 0.00 2.01 0.00 0.00 34.83 33.01 1u90 s MET 19 CO 0.04 -0.28 -0.12 0.14 -0.01 0.00 0.00 175.02 174.79 1u90 s VAL 20 N 2.09 1.21 0.00 -6.03 -7.23 -0.64 -3.24 120.40 106.55 1u90 s VAL 20 Ca 0.19 -1.79 0.00 0.00 -1.81 0.00 0.00 61.98 58.56 1u90 s VAL 20 Cb -0.16 -1.57 0.00 0.00 0.56 0.00 0.00 36.38 35.21 1u90 s VAL 20 CO 0.09 -0.53 0.00 0.61 -0.31 0.00 0.00 175.10 174.96 1u90 n GLY 21 N 0.34 3.10 3.71 2.32 0.00 -1.26 -0.67 105.19 112.73 1u90 n GLY 21 Ca -0.14 -1.25 -0.29 0.00 0.00 0.00 0.00 46.02 44.33 1u90 n GLY 21 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1u90 s SER 22 N 0.00 2.39 0.41 1.61 1.04 -1.26 -4.94 113.70 112.94 1u90 s SER 22 Ca 0.00 0.86 -0.27 0.00 0.48 0.00 0.00 55.95 57.02 1u90 s SER 22 Cb 0.00 -1.32 -0.10 0.00 0.10 0.00 0.00 66.02 64.71 1u90 s SER 22 CO 0.00 -3.24 1.46 -0.83 0.98 0.00 0.00 173.24 171.62 1u90 s GLY 23 N -3.89 2.93 -0.89 7.32 0.00 -1.26 -3.47 107.32 108.06 1u90 s GLY 23 Ca 0.67 1.53 0.00 0.00 0.00 0.00 0.00 44.72 46.93 1u90 s GLY 23 CO 0.55 2.19 0.00 0.61 0.00 0.00 0.00 173.10 176.46 1u90 n GLY 24 N 0.50 0.98 0.14 0.20 0.00 -1.26 -4.89 105.19 100.87 1u90 n GLY 24 Ca 0.03 -0.34 0.12 0.00 0.00 0.00 0.00 46.02 45.82 1u90 n GLY 24 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1u90 h VAL 25 N 0.00 0.00 0.00 1.61 -1.51 -1.93 -3.48 116.25 110.94 1u90 h VAL 25 Ca -0.17 -0.82 0.00 0.00 -1.23 0.00 0.00 66.70 64.47 1u90 h VAL 25 Cb 0.71 1.60 0.00 0.00 -2.13 0.00 0.00 31.29 31.47 1u90 h VAL 25 CO 0.25 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.20 1u90 n GLY 26 N 1.20 1.79 0.13 5.19 0.00 -1.26 -4.56 105.19 107.68 1u90 n GLY 26 Ca 0.03 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.98 1u90 n GLY 26 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1u90 h LYS 27 N 0.03 0.13 -0.26 1.61 1.57 -1.92 -0.32 116.57 117.41 1u90 h LYS 27 Ca 0.00 -0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 58.71 1u90 h LYS 27 Cb 0.00 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 1u90 h LYS 27 CO 0.00 0.08 -0.09 0.77 -0.57 0.00 0.00 179.45 179.65 1u90 h SER 28 N 0.13 0.53 -0.92 0.86 0.02 -1.96 -2.29 113.55 109.92 1u90 h SER 28 Ca 0.13 -0.38 0.02 0.00 -0.84 0.00 0.00 61.79 60.72 1u90 h SER 28 Cb 0.16 -0.15 -0.05 0.00 0.14 0.00 0.00 62.40 62.50 1u90 h SER 28 CO -0.20 0.79 0.61 0.00 -1.14 0.00 0.00 176.83 176.90 1u90 h ALA 29 N 0.76 1.37 -0.33 3.77 0.00 -1.78 0.68 119.26 123.72 1u90 h ALA 29 Ca 0.06 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 1u90 h ALA 29 Cb 0.57 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1u90 h ALA 29 CO 0.03 0.56 -0.21 -0.07 0.00 0.00 0.00 179.25 179.57 1u90 h LEU 30 N 1.21 0.76 -0.16 0.00 3.38 -1.02 -1.46 115.31 118.02 1u90 h LEU 30 Ca 0.35 -0.43 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 1u90 h LEU 30 Cb -0.08 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 1u90 h LEU 30 CO -0.09 1.02 0.09 0.74 0.09 0.00 0.00 178.44 180.30 1u90 h THR 31 N 0.50 1.09 0.00 0.22 2.02 -0.84 -1.97 112.91 113.93 1u90 h THR 31 Ca 0.07 -0.23 -0.08 0.00 0.77 0.00 0.00 66.41 66.94 1u90 h THR 31 Cb 0.76 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 68.10 1u90 h THR 31 CO 0.06 0.08 -0.38 -0.07 0.37 0.00 0.00 175.52 175.58 1u90 h LEU 32 N 0.18 0.00 -0.19 2.58 3.38 -0.88 0.61 115.31 120.99 1u90 h LEU 32 Ca 0.06 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 1u90 h LEU 32 Cb 0.05 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 1u90 h LEU 32 CO -0.01 0.38 -0.11 1.56 0.09 0.00 0.00 178.44 180.35 1u90 h GLN 33 N 0.00 0.41 -0.62 1.13 1.08 -1.03 0.30 115.11 116.38 1u90 h GLN 33 Ca -0.00 -0.19 -0.08 0.00 -1.45 0.00 0.00 58.65 56.93 1u90 h GLN 33 Cb 0.72 -0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 28.11 1u90 h GLN 33 CO 0.05 0.72 0.08 0.35 -0.95 0.00 0.00 178.83 179.08 1u90 h PHE 34 N 0.09 1.08 0.01 2.96 3.57 -1.12 0.36 116.94 123.90 1u90 h PHE 34 Ca 0.04 -0.15 -0.00 0.00 3.53 0.00 0.00 57.97 61.39 1u90 h PHE 34 Cb 0.61 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 39.06 1u90 h PHE 34 CO 0.07 0.92 -0.00 0.52 -2.23 0.00 0.00 178.31 177.59 1u90 h MET 35 N 0.95 -0.01 -0.04 1.11 2.86 -0.78 -3.40 114.93 115.62 1u90 h MET 35 Ca 0.19 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.83 1u90 h MET 35 Cb 0.44 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.10 1u90 h MET 35 CO 0.01 0.60 0.00 0.66 1.06 0.00 0.00 176.91 179.25 1u90 n TYR 36 N -4.80 0.05 -2.35 -0.22 4.02 0.10 -5.02 117.16 108.95 1u90 n TYR 36 Ca -0.09 -0.30 -0.20 0.00 -0.01 0.00 0.00 57.90 57.30 1u90 n TYR 36 Cb 0.31 -0.03 -0.01 0.00 -0.02 0.00 0.00 39.34 39.59 1u90 n TYR 36 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 1u90 n ASP 37 N -0.14 -5.74 -4.00 7.72 8.00 0.13 -4.99 116.55 117.53 1u90 n ASP 37 Ca 0.02 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.41 1u90 n ASP 37 Cb 0.19 -4.77 -0.11 0.00 -0.02 0.00 0.00 41.12 36.41 1u90 n ASP 37 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1u90 s GLU 38 N -4.95 0.37 -0.43 -1.24 2.02 -1.26 -5.03 118.70 108.19 1u90 s GLU 38 Ca 0.00 -0.61 -0.26 0.00 0.02 0.00 0.00 54.97 54.12 1u90 s GLU 38 Cb 0.00 -0.06 0.02 0.00 0.10 0.00 0.00 34.13 34.19 1u90 s GLU 38 CO 0.00 -0.00 0.92 0.12 0.02 0.00 0.00 175.26 176.32 1u90 s PHE 39 N -1.30 2.98 -0.38 1.61 5.36 -1.26 -3.74 117.98 121.25 1u90 s PHE 39 Ca -0.12 0.52 -0.12 0.00 -0.96 0.00 0.00 56.93 56.25 1u90 s PHE 39 Cb -0.09 -3.85 0.02 0.00 -0.34 0.00 0.00 43.02 38.76 1u90 s PHE 39 CO -0.00 -1.00 0.23 0.08 -1.46 0.00 0.00 175.22 173.07 1u90 s VAL 40 N 3.65 4.77 0.14 3.12 1.01 -1.26 -5.07 120.40 126.76 1u90 s VAL 40 Ca 0.37 -0.79 -0.15 0.00 0.00 0.00 0.00 61.98 61.41 1u90 s VAL 40 Cb -0.11 -3.65 -0.07 0.00 0.00 0.00 0.00 36.38 32.55 1u90 s VAL 40 CO 0.24 -0.25 0.56 -1.61 0.00 0.00 0.00 175.10 174.04 1u90 s GLU 41 N 1.59 4.02 -1.39 2.72 2.02 -1.26 -4.39 118.70 122.00 1u90 s GLU 41 Ca 0.03 0.54 -0.05 0.00 0.02 0.00 0.00 54.97 55.50 1u90 s GLU 41 Cb -0.19 -2.96 0.03 0.00 0.10 0.00 0.00 34.13 31.11 1u90 s GLU 41 CO 0.08 0.49 0.83 -0.25 0.02 0.00 0.00 175.26 176.43 1u90 n ASP 42 N 0.90 -2.75 -4.77 -0.19 8.00 -1.26 -4.96 116.55 111.53 1u90 n ASP 42 Ca -0.06 -0.79 -0.37 0.00 0.71 0.00 0.00 54.79 54.28 1u90 n ASP 42 Cb 0.52 -4.06 0.00 0.00 -0.02 0.00 0.00 41.12 37.56 1u90 n ASP 42 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1u90 s TYR 43 N -3.51 2.76 -0.49 1.24 5.04 -1.26 -4.80 117.35 116.33 1u90 s TYR 43 Ca 0.27 1.51 -0.44 0.00 -2.44 0.00 0.00 57.07 55.97 1u90 s TYR 43 Cb -0.13 -3.44 -0.19 0.00 0.35 0.00 0.00 41.96 38.54 1u90 s TYR 43 CO 0.81 -1.75 1.90 -1.91 -1.34 0.00 0.00 175.55 173.27 1u90 n GLU 44 N -0.65 0.00 0.29 4.97 4.07 -1.26 -4.80 120.64 123.26 1u90 n GLU 44 Ca 0.08 0.00 0.17 0.00 -0.06 0.00 0.00 57.16 57.35 1u90 n GLU 44 Cb 0.48 -1.46 0.91 0.00 -0.06 0.00 0.00 31.44 31.31 1u90 n GLU 44 CO 0.00 0.00 0.00 -1.00 -0.06 0.00 0.00 177.13 176.07 1u90 h PRO 45 N 7.42 0.00 -0.01 5.31 0.13 -2.03 -2.89 132.00 139.93 1u90 h PRO 45 Ca -0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 1u90 h PRO 45 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 1u90 h PRO 45 CO 1.02 0.04 -0.48 -2.37 -0.23 0.00 0.00 178.00 175.99 1u90 n THR 46 N -3.47 0.00 -2.67 1.56 5.66 -1.26 -4.75 114.28 109.35 1u90 n THR 46 Ca -0.02 -0.22 -0.43 0.00 -3.05 0.00 0.00 64.05 60.33 1u90 n THR 46 Cb 0.16 1.11 -0.02 0.00 -1.55 0.00 0.00 70.33 70.03 1u90 n THR 46 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 175.07 171.27 1u90 s LYS 47 N -2.52 4.16 -0.10 1.09 2.20 -1.09 -4.81 119.74 118.67 1u90 s LYS 47 Ca 0.19 1.18 -0.01 0.00 -0.36 0.00 0.00 55.97 56.97 1u90 s LYS 47 Cb 0.18 -3.69 -0.03 0.00 -1.51 0.00 0.00 37.83 32.79 1u90 s LYS 47 CO 0.58 -0.75 -0.06 0.00 -0.36 0.00 0.00 175.35 174.77 1u90 s ALA 48 N 3.38 2.99 0.18 3.13 0.00 -1.26 -4.72 121.76 125.46 1u90 s ALA 48 Ca 0.44 -0.86 -0.24 0.00 0.00 0.00 0.00 51.96 51.30 1u90 s ALA 48 Cb -0.14 -1.34 0.05 0.00 0.00 0.00 0.00 23.12 21.69 1u90 s ALA 48 CO 0.10 0.45 0.84 0.34 0.00 0.00 0.00 175.76 177.50 1u90 s ASP 49 N -0.42 -0.26 -0.07 0.00 2.15 -0.81 -5.00 116.67 112.26 1u90 s ASP 49 Ca 0.06 -0.38 0.01 0.00 0.43 0.00 0.00 52.55 52.67 1u90 s ASP 49 Cb -0.12 0.56 -0.03 0.00 -0.30 0.00 0.00 42.92 43.03 1u90 s ASP 49 CO 0.02 -1.02 -0.08 -0.94 -0.17 0.00 0.00 175.17 172.99 1u90 s SER 50 N -2.86 4.59 -0.08 -0.34 1.04 -1.26 -0.68 113.70 114.10 1u90 s SER 50 Ca 0.10 -0.04 0.05 0.00 0.48 0.00 0.00 55.95 56.54 1u90 s SER 50 Cb -0.03 -1.14 -0.00 0.00 0.10 0.00 0.00 66.02 64.95 1u90 s SER 50 CO 0.01 0.36 -0.23 -0.31 0.98 0.00 0.00 173.24 174.05 1u90 s TYR 51 N -0.80 2.35 -0.08 5.02 1.51 0.12 -4.93 117.35 120.53 1u90 s TYR 51 Ca 0.12 -0.84 0.02 0.00 -1.01 0.00 0.00 57.07 55.37 1u90 s TYR 51 Cb -0.11 -1.57 -0.02 0.00 -0.11 0.00 0.00 41.96 40.16 1u90 s TYR 51 CO 0.01 -0.31 -0.15 1.03 -1.11 0.00 0.00 175.55 175.02 1u90 s ARG 52 N 0.16 2.83 -0.08 -0.62 0.52 -1.26 0.16 118.95 120.68 1u90 s ARG 52 Ca -0.12 -0.71 -0.11 0.00 -0.52 0.00 0.00 55.73 54.27 1u90 s ARG 52 Cb -0.16 -2.45 0.02 0.00 0.52 0.00 0.00 34.95 32.88 1u90 s ARG 52 CO 0.06 0.45 0.28 0.21 0.02 0.00 0.00 175.30 176.32 1u90 s LYS 53 N -0.28 0.43 -0.16 3.54 2.20 -0.72 -4.99 119.74 119.76 1u90 s LYS 53 Ca 0.02 0.18 -0.08 0.00 -0.36 0.00 0.00 55.97 55.73 1u90 s LYS 53 Cb -0.13 0.20 -0.05 0.00 -1.51 0.00 0.00 37.83 36.35 1u90 s LYS 53 CO 0.03 -0.08 0.13 0.21 -0.36 0.00 0.00 175.35 175.27 1u90 s LYS 54 N -0.35 3.85 0.18 4.03 2.20 -1.26 -0.43 119.74 127.96 1u90 s LYS 54 Ca -0.05 -0.20 -0.02 0.00 -0.36 0.00 0.00 55.97 55.35 1u90 s LYS 54 Cb -0.03 -3.30 -0.04 0.00 -1.51 0.00 0.00 37.83 32.95 1u90 s LYS 54 CO 0.01 0.50 0.13 0.14 -0.36 0.00 0.00 175.35 175.77 1u90 s VAL 55 N -0.22 0.03 -0.42 4.02 -7.23 -0.05 -4.98 120.40 111.55 1u90 s VAL 55 Ca 0.11 -1.93 -0.14 0.00 -1.81 0.00 0.00 61.98 58.20 1u90 s VAL 55 Cb -0.11 -2.33 0.04 0.00 0.56 0.00 0.00 36.38 34.53 1u90 s VAL 55 CO 0.01 -0.15 0.31 -0.69 -0.31 0.00 0.00 175.10 174.27 1u90 s VAL 56 N -4.11 5.14 -0.31 1.32 1.01 -1.26 -1.16 120.40 121.02 1u90 s VAL 56 Ca 0.33 -0.81 -0.05 0.00 0.00 0.00 0.00 61.98 61.45 1u90 s VAL 56 Cb 0.07 -3.92 0.03 0.00 0.00 0.00 0.00 36.38 32.56 1u90 s VAL 56 CO 0.08 -0.37 0.06 -0.22 0.00 0.00 0.00 175.10 174.65 1u90 s LEU 57 N 1.65 3.93 -1.30 3.92 2.96 0.22 -4.65 118.68 125.41 1u90 s LEU 57 Ca 0.04 -0.98 -0.08 0.00 -0.22 0.00 0.00 54.13 52.90 1u90 s LEU 57 Cb -0.20 -1.82 -0.00 0.00 0.50 0.00 0.00 46.19 44.66 1u90 s LEU 57 CO 0.09 -0.24 0.58 0.47 -1.32 0.00 0.00 176.35 175.93 1u90 n ASP 58 N 4.78 -2.22 0.00 3.68 8.00 -1.26 -1.38 116.55 128.16 1u90 n ASP 58 Ca -0.14 -1.00 0.00 0.00 0.71 0.00 0.00 54.79 54.37 1u90 n ASP 58 Cb 0.46 -3.25 0.00 0.00 -0.02 0.00 0.00 41.12 38.31 1u90 n ASP 58 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1u90 n GLY 59 N -1.84 2.56 3.85 0.44 0.00 -1.26 -4.99 105.19 103.95 1u90 n GLY 59 Ca -0.23 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.46 1u90 n GLY 59 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1u90 s GLU 60 N -0.00 4.01 -0.31 1.61 2.12 -0.48 -5.03 118.70 120.63 1u90 s GLU 60 Ca 0.00 0.61 -0.14 0.00 0.36 0.00 0.00 54.97 55.79 1u90 s GLU 60 Cb 0.00 -2.62 -0.03 0.00 0.26 0.00 0.00 34.13 31.74 1u90 s GLU 60 CO 0.00 0.27 0.34 -1.21 -0.54 0.00 0.00 175.26 174.12 1u90 s GLU 61 N -2.63 3.78 0.17 4.30 2.02 -1.26 0.69 118.70 125.77 1u90 s GLU 61 Ca 0.49 -0.24 0.08 0.00 0.02 0.00 0.00 54.97 55.31 1u90 s GLU 61 Cb -0.12 -3.73 -0.04 0.00 0.10 0.00 0.00 34.13 30.34 1u90 s GLU 61 CO 0.19 -0.39 -0.17 0.14 0.02 0.00 0.00 175.26 175.06 1u90 s VAL 62 N 2.00 1.75 -0.20 2.63 -7.23 -0.31 -4.51 120.40 114.53 1u90 s VAL 62 Ca 0.12 -1.97 -0.07 0.00 -1.81 0.00 0.00 61.98 58.26 1u90 s VAL 62 Cb -0.16 -1.86 -0.03 0.00 0.56 0.00 0.00 36.38 34.89 1u90 s VAL 62 CO 0.11 -0.39 0.04 -1.10 -0.31 0.00 0.00 175.10 173.45 1u90 s GLN 63 N -2.99 3.82 -0.15 4.82 -1.52 0.21 -0.87 119.66 122.98 1u90 s GLN 63 Ca 0.17 -0.42 -0.02 0.00 -1.95 0.00 0.00 55.36 53.14 1u90 s GLN 63 Cb -0.04 -3.19 -0.02 0.00 -0.22 0.00 0.00 33.01 29.54 1u90 s GLN 63 CO 0.06 0.13 -0.10 -1.50 -0.25 0.00 0.00 175.29 173.63 1u90 s ILE 64 N 0.75 3.30 -0.29 1.08 2.07 0.43 -0.07 121.20 128.47 1u90 s ILE 64 Ca 0.02 -0.56 -0.08 0.00 -1.41 0.00 0.00 60.65 58.62 1u90 s ILE 64 Cb -0.14 -2.42 -0.01 0.00 0.13 0.00 0.00 42.46 40.03 1u90 s ILE 64 CO 0.02 0.50 0.11 -0.62 -1.91 0.00 0.00 174.94 173.04 1u90 s ASP 65 N 0.51 5.32 -0.25 4.50 2.15 0.19 -1.75 116.67 127.33 1u90 s ASP 65 Ca -0.07 -0.53 -0.06 0.00 0.43 0.00 0.00 52.55 52.32 1u90 s ASP 65 Cb -0.15 -1.94 -0.01 0.00 -0.30 0.00 0.00 42.92 40.51 1u90 s ASP 65 CO 0.04 -0.16 0.05 -0.63 -0.17 0.00 0.00 175.17 174.29 1u90 s ILE 66 N 1.57 4.00 -0.41 4.11 1.01 0.12 0.40 121.20 132.01 1u90 s ILE 66 Ca 0.04 -0.38 -0.15 0.00 0.00 0.00 0.00 60.65 60.16 1u90 s ILE 66 Cb -0.17 -2.91 0.02 0.00 0.01 0.00 0.00 42.46 39.41 1u90 s ILE 66 CO 0.04 0.29 0.31 -0.22 0.00 0.00 0.00 174.94 175.36 1u90 s LEU 67 N 1.55 5.12 -0.46 2.97 2.96 0.22 0.12 118.68 131.16 1u90 s LEU 67 Ca 0.05 -0.90 -0.22 0.00 -0.22 0.00 0.00 54.13 52.83 1u90 s LEU 67 Cb -0.15 -2.17 0.03 0.00 0.50 0.00 0.00 46.19 44.39 1u90 s LEU 67 CO 0.02 -0.46 0.76 -0.62 -1.32 0.00 0.00 176.35 174.72 1u90 s ASP 68 N 1.72 6.37 0.51 3.68 2.15 0.14 -1.22 116.67 130.02 1u90 s ASP 68 Ca 0.05 -0.25 -0.05 0.00 0.43 0.00 0.00 52.55 52.73 1u90 s ASP 68 Cb -0.19 -2.37 -0.02 0.00 -0.30 0.00 0.00 42.92 40.04 1u90 s ASP 68 CO 0.10 -0.92 0.81 0.42 -0.17 0.00 0.00 175.17 175.41 1u90 s THR 69 N 3.22 4.49 -0.01 1.71 -4.23 -1.20 -1.92 115.64 117.70 1u90 s THR 69 Ca 0.27 0.11 -0.02 0.00 -1.18 0.00 0.00 61.69 60.86 1u90 s THR 69 Cb -0.13 -3.72 -0.00 0.00 1.34 0.00 0.00 72.50 69.98 1u90 s THR 69 CO 0.21 -0.71 0.05 0.00 -0.54 0.00 0.00 174.62 173.63 1u90 s ALA 70 N -2.81 -0.11 0.32 3.99 0.00 -1.26 -4.85 121.76 117.04 1u90 s ALA 70 Ca 0.49 -0.07 0.04 0.00 0.00 0.00 0.00 51.96 52.41 1u90 s ALA 70 Cb -0.10 -0.00 0.64 0.00 0.00 0.00 0.00 23.12 23.65 1u90 s ALA 70 CO 0.45 -0.09 1.90 0.78 0.00 0.00 0.00 175.76 178.79 1u90 h GLY 71 N 5.39 1.26 0.12 0.00 0.00 -1.91 -2.42 103.07 105.51 1u90 h GLY 71 Ca -0.27 -0.37 0.26 0.00 0.00 0.00 0.00 47.33 46.95 1u90 h GLY 71 CO 0.44 0.22 0.69 -1.61 0.00 0.00 0.00 176.54 176.28 1u90 h GLN 72 N 0.90 0.00 -5.13 4.80 4.15 -1.92 -3.16 115.11 114.74 1u90 h GLN 72 Ca 0.40 0.00 -0.69 0.00 0.77 0.00 0.00 58.65 59.13 1u90 h GLN 72 Cb 0.36 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 27.98 1u90 h GLN 72 CO -0.17 0.00 2.53 -1.91 -1.93 0.00 0.00 178.83 177.36 1u90 n GLU 73 N -4.15 3.08 -0.49 1.69 4.07 -0.91 -4.70 120.64 119.24 1u90 n GLU 73 Ca 0.19 -3.05 0.08 0.00 -0.06 0.00 0.00 57.16 54.32 1u90 n GLU 73 Cb 1.01 -3.41 0.28 0.00 -0.06 0.00 0.00 31.44 29.26 1u90 n GLU 73 CO 0.00 0.00 0.00 -0.40 -0.06 0.00 0.00 177.13 176.67 1u90 n ASP 74 N 7.46 4.14 -4.58 4.31 5.75 -1.20 -4.82 116.55 127.60 1u90 n ASP 74 Ca 0.50 -2.65 -0.43 0.00 -0.01 0.00 0.00 54.79 52.20 1u90 n ASP 74 Cb 0.43 -0.50 -0.02 0.00 -1.03 0.00 0.00 41.12 39.99 1u90 n ASP 74 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1u90 s TYR 75 N -2.19 2.75 0.29 2.11 1.51 -1.26 -4.92 117.35 115.62 1u90 s TYR 75 Ca 0.42 0.53 -0.05 0.00 -1.01 0.00 0.00 57.07 56.96 1u90 s TYR 75 Cb 0.30 -4.40 0.56 0.00 -0.11 0.00 0.00 41.96 38.31 1u90 s TYR 75 CO 0.15 -1.37 1.57 0.00 -1.11 0.00 0.00 175.55 174.78 1u90 h ALA 76 N 9.34 0.84 -0.17 3.71 0.00 -1.99 -1.66 119.26 129.33 1u90 h ALA 76 Ca -0.24 0.36 0.05 0.00 0.00 0.00 0.00 54.91 55.08 1u90 h ALA 76 Cb 1.06 0.68 -0.05 0.00 0.00 0.00 0.00 17.79 19.49 1u90 h ALA 76 CO 1.14 -0.45 -0.13 0.00 0.00 0.00 0.00 179.25 179.80 1u90 h ALA 77 N 1.97 -0.01 0.08 0.00 0.00 -1.99 0.65 119.26 119.95 1u90 h ALA 77 Ca 0.51 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.49 1u90 h ALA 77 Cb 0.90 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1u90 h ALA 77 CO -0.97 -0.57 -0.04 0.82 0.00 0.00 0.00 179.25 178.49 1u90 h ILE 78 N -0.14 1.03 -0.06 0.00 2.04 -1.75 -2.27 117.51 116.35 1u90 h ILE 78 Ca 0.10 -0.38 0.03 0.00 1.00 0.00 0.00 64.86 65.62 1u90 h ILE 78 Cb 0.30 1.28 -0.04 0.00 -0.74 0.00 0.00 36.82 37.62 1u90 h ILE 78 CO -0.25 0.09 -0.13 -0.09 0.00 0.00 0.00 178.15 177.77 1u90 h ARG 79 N -0.27 -0.19 -0.66 2.37 2.43 -1.06 -1.93 114.38 115.07 1u90 h ARG 79 Ca -0.01 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.18 1u90 h ARG 79 Cb 0.23 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.79 1u90 h ARG 79 CO 0.02 -0.13 0.43 -0.44 -1.51 0.00 0.00 179.97 178.35 1u90 h ASP 80 N -0.20 0.75 -0.64 -3.80 5.19 -0.89 -1.66 116.42 115.17 1u90 h ASP 80 Ca 0.07 -0.02 -0.05 0.00 -0.62 0.00 0.00 57.03 56.41 1u90 h ASP 80 Cb 0.29 -0.19 -0.03 0.00 0.18 0.00 0.00 39.33 39.58 1u90 h ASP 80 CO -0.18 0.54 0.23 0.78 -3.12 0.00 0.00 179.24 177.50 1u90 h ASN 81 N 0.89 0.93 -0.19 6.45 4.21 -0.89 0.57 115.58 127.55 1u90 h ASN 81 Ca 0.24 -0.15 -0.04 0.00 1.21 0.00 0.00 56.30 57.56 1u90 h ASN 81 Cb -0.10 -0.24 -0.01 0.00 -1.12 0.00 0.00 38.32 36.85 1u90 h ASN 81 CO -0.05 0.86 -0.03 1.88 -1.29 0.00 0.00 177.43 178.79 1u90 h TYR 82 N 0.98 0.40 -0.32 1.19 0.05 -0.57 -2.21 116.97 116.48 1u90 h TYR 82 Ca 0.22 -0.08 -0.07 0.00 0.05 0.00 0.00 58.73 58.85 1u90 h TYR 82 Cb 0.24 -0.10 -0.02 0.00 1.01 0.00 0.00 36.73 37.87 1u90 h TYR 82 CO 0.02 0.60 -0.09 0.74 -1.05 0.00 0.00 178.16 178.38 1u90 h PHE 83 N 0.09 0.57 -0.46 4.88 0.05 -1.18 -1.37 116.94 119.52 1u90 h PHE 83 Ca 0.05 -0.08 -0.06 0.00 3.82 0.00 0.00 57.97 61.69 1u90 h PHE 83 Cb 0.46 -0.16 -0.02 0.00 2.00 0.00 0.00 35.95 38.23 1u90 h PHE 83 CO 0.05 0.62 0.02 -0.09 -0.18 0.00 0.00 178.31 178.73 1u90 h ARG 84 N 0.50 0.75 0.00 1.51 1.12 -0.76 -2.58 114.38 114.92 1u90 h ARG 84 Ca 0.10 -0.18 0.00 0.00 -1.11 0.00 0.00 59.98 58.78 1u90 h ARG 84 Cb 0.46 -0.10 0.00 0.00 -0.01 0.00 0.00 29.97 30.33 1u90 h ARG 84 CO 0.03 0.74 -0.35 -1.13 -3.11 0.00 0.00 179.97 176.15 1u90 n SER 85 N -4.24 0.58 -4.77 -3.80 3.41 -0.84 -4.88 113.62 99.09 1u90 n SER 85 Ca 0.03 0.22 -0.40 0.00 -0.26 0.00 0.00 58.87 58.46 1u90 n SER 85 Cb 0.28 -0.16 -0.03 0.00 -0.26 0.00 0.00 64.21 64.04 1u90 n SER 85 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1u90 s GLY 86 N -3.41 3.00 -0.09 5.00 0.00 -0.55 -4.82 107.32 106.45 1u90 s GLY 86 Ca 0.09 1.07 0.18 0.00 0.00 0.00 0.00 44.72 46.06 1u90 s GLY 86 CO 0.66 1.67 0.28 1.18 0.00 0.00 0.00 173.10 176.89 1u90 n GLU 87 N 0.81 0.78 -3.75 2.90 1.02 -0.19 -5.00 120.64 117.21 1u90 n GLU 87 Ca 0.00 -0.11 -0.12 0.00 -0.02 0.00 0.00 57.16 56.91 1u90 n GLU 87 Cb 0.44 -1.46 -0.08 0.00 -0.02 0.00 0.00 31.44 30.32 1u90 n GLU 87 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1u90 s GLY 88 N -4.65 -0.15 -0.02 0.62 0.00 -1.11 -4.20 107.32 97.82 1u90 s GLY 88 Ca -0.08 0.12 0.04 0.00 0.00 0.00 0.00 44.72 44.80 1u90 s GLY 88 CO 0.78 -0.09 -0.13 -1.36 0.00 0.00 0.00 173.10 172.30 1u90 s PHE 89 N -2.22 1.22 -0.32 1.90 0.40 -0.78 -1.40 117.98 116.79 1u90 s PHE 89 Ca -0.07 -0.26 -0.07 0.00 -0.60 0.00 0.00 56.93 55.93 1u90 s PHE 89 Cb -0.02 -0.81 0.03 0.00 0.51 0.00 0.00 43.02 42.73 1u90 s PHE 89 CO -0.01 -0.06 0.10 -0.51 0.70 0.00 0.00 175.22 175.44 1u90 s LEU 90 N -0.17 4.12 -0.52 -0.37 1.43 -0.58 -1.65 118.68 120.94 1u90 s LEU 90 Ca 0.02 -0.94 -0.18 0.00 -1.03 0.00 0.00 54.13 52.00 1u90 s LEU 90 Cb -0.07 -1.88 0.08 0.00 0.03 0.00 0.00 46.19 44.36 1u90 s LEU 90 CO 0.00 -0.27 0.56 0.00 0.23 0.00 0.00 176.35 176.87 1u90 s VAL 92 N 2.22 5.46 0.16 0.00 1.01 0.15 -0.42 120.40 128.99 1u90 s VAL 92 Ca 0.09 0.26 -0.00 0.00 0.00 0.00 0.00 61.98 62.34 1u90 s VAL 92 Cb -0.23 -3.43 -0.04 0.00 0.00 0.00 0.00 36.38 32.67 1u90 s VAL 92 CO 0.08 0.60 0.05 0.72 0.00 0.00 0.00 175.10 176.56 1u90 s PHE 93 N -0.94 1.07 -0.16 5.22 -0.71 -0.40 -4.15 117.98 117.90 1u90 s PHE 93 Ca 0.15 -1.19 -0.06 0.00 -1.04 0.00 0.00 56.93 54.80 1u90 s PHE 93 Cb -0.12 -0.59 -0.04 0.00 -1.21 0.00 0.00 43.02 41.06 1u90 s PHE 93 CO 0.04 -0.43 0.02 0.45 -1.34 0.00 0.00 175.22 173.97 1u90 s SER 94 N -3.12 5.33 0.20 1.98 0.15 -1.26 -0.63 113.70 116.34 1u90 s SER 94 Ca 0.27 0.03 0.19 0.00 0.70 0.00 0.00 55.95 57.14 1u90 s SER 94 Cb 0.07 -1.86 0.85 0.00 -1.71 0.00 0.00 66.02 63.37 1u90 s SER 94 CO 0.05 0.20 1.58 2.30 1.20 0.00 0.00 173.24 178.57 1u90 n ILE 95 N 3.36 1.03 1.10 6.45 -5.35 -0.87 -1.83 119.36 123.24 1u90 n ILE 95 Ca -0.17 0.37 0.12 0.00 -0.27 0.00 0.00 62.75 62.80 1u90 n ILE 95 Cb 0.52 -1.29 0.34 0.00 -1.74 0.00 0.00 39.64 37.47 1u90 n ILE 95 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1u90 n THR 96 N -2.02 0.17 -3.57 7.28 -2.24 -1.26 0.37 114.28 113.01 1u90 n THR 96 Ca 0.01 -0.42 -0.29 0.00 -2.27 0.00 0.00 64.05 61.08 1u90 n THR 96 Cb 0.15 0.71 -0.15 0.00 -2.10 0.00 0.00 70.33 68.94 1u90 n THR 96 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1u90 s GLU 97 N -1.83 0.28 0.35 -0.78 2.12 -0.76 -4.59 118.70 113.50 1u90 s GLU 97 Ca 0.34 -0.64 0.10 0.00 0.36 0.00 0.00 54.97 55.13 1u90 s GLU 97 Cb 0.20 -1.30 0.84 0.00 0.26 0.00 0.00 34.13 34.13 1u90 s GLU 97 CO 0.30 -1.02 1.84 1.98 -0.54 0.00 0.00 175.26 177.82 1u90 h MET 98 N 8.33 0.65 -0.37 4.30 1.85 -1.84 -1.59 114.93 126.25 1u90 h MET 98 Ca -0.18 -0.04 -0.05 0.00 -0.61 0.00 0.00 59.70 58.81 1u90 h MET 98 Cb 1.01 -0.15 -0.02 0.00 0.43 0.00 0.00 31.60 32.88 1u90 h MET 98 CO 0.44 0.43 0.01 0.93 -0.40 0.00 0.00 176.91 178.32 1u90 h GLU 99 N 0.67 0.58 0.00 0.39 3.07 -1.95 -0.96 114.58 116.37 1u90 h GLU 99 Ca 0.49 -0.13 -0.06 0.00 -0.50 0.00 0.00 59.36 59.16 1u90 h GLU 99 Cb 0.85 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.67 1u90 h GLU 99 CO -0.24 0.60 -0.29 0.66 -1.40 0.00 0.00 179.01 178.33 1u90 h SER 100 N 0.55 0.00 -0.03 1.42 4.64 -1.61 -0.89 113.55 117.63 1u90 h SER 100 Ca 0.12 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.27 1u90 h SER 100 Cb 0.34 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.45 1u90 h SER 100 CO 0.01 0.29 -0.65 0.15 -0.87 0.00 0.00 176.83 175.76 1u90 h PHE 101 N 0.00 0.72 -0.86 4.77 3.57 -1.18 -3.19 116.94 120.76 1u90 h PHE 101 Ca -0.00 -0.37 0.00 0.00 3.53 0.00 0.00 57.97 61.13 1u90 h PHE 101 Cb 0.73 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 39.34 1u90 h PHE 101 CO 0.00 1.18 0.54 0.00 -2.23 0.00 0.00 178.31 177.80 1u90 h ALA 102 N 0.38 1.34 0.00 2.41 0.00 -0.91 -2.44 119.26 120.04 1u90 h ALA 102 Ca -0.07 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1u90 h ALA 102 Cb 1.33 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1u90 h ALA 102 CO 0.13 0.59 0.00 0.00 0.00 0.00 0.00 179.25 179.97 1u90 h ALA 103 N 1.42 1.00 0.00 0.00 0.00 -1.16 -2.76 119.26 117.76 1u90 h ALA 103 Ca 0.31 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 1u90 h ALA 103 Cb -0.09 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1u90 h ALA 103 CO -0.06 0.00 -0.06 1.79 0.00 0.00 0.00 179.25 180.92 1u90 h THR 104 N 0.00 0.71 -0.44 0.00 1.35 -1.43 0.03 112.91 113.13 1u90 h THR 104 Ca 0.00 -0.24 -0.07 0.00 -0.55 0.00 0.00 66.41 65.54 1u90 h THR 104 Cb 0.15 1.15 -0.02 0.00 -1.73 0.00 0.00 68.15 67.69 1u90 h THR 104 CO 0.00 0.06 -0.02 0.00 -0.25 0.00 0.00 175.52 175.31 1u90 h ALA 105 N 1.94 1.13 -0.06 6.62 0.00 -1.68 -0.92 119.26 126.28 1u90 h ALA 105 Ca -0.00 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 1u90 h ALA 105 Cb 0.14 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1u90 h ALA 105 CO 0.01 0.56 0.02 -0.44 0.00 0.00 0.00 179.25 179.40 1u90 h ASP 106 N 0.69 0.09 0.21 0.00 3.45 -1.17 -2.00 116.42 117.69 1u90 h ASP 106 Ca 0.13 -0.19 -0.09 0.00 0.43 0.00 0.00 57.03 57.32 1u90 h ASP 106 Cb 0.46 -0.02 -0.01 0.00 -0.56 0.00 0.00 39.33 39.19 1u90 h ASP 106 CO 0.02 0.26 -0.34 -0.26 -1.57 0.00 0.00 179.24 177.35 1u90 h PHE 107 N -0.08 0.22 -0.23 4.55 -1.00 -1.36 -2.26 116.94 116.78 1u90 h PHE 107 Ca 0.02 -0.05 -0.01 0.00 2.81 0.00 0.00 57.97 60.74 1u90 h PHE 107 Cb 0.20 -0.05 -0.01 0.00 3.61 0.00 0.00 35.95 39.69 1u90 h PHE 107 CO -0.01 0.51 0.11 -0.09 -1.61 0.00 0.00 178.31 177.22 1u90 h ARG 108 N 0.17 0.33 -0.85 1.51 9.65 -1.03 -1.53 114.38 122.63 1u90 h ARG 108 Ca 0.02 -0.05 0.02 0.00 -1.10 0.00 0.00 59.98 58.87 1u90 h ARG 108 Cb 0.68 -0.06 -0.04 0.00 -1.39 0.00 0.00 29.97 29.16 1u90 h ARG 108 CO 0.05 0.34 0.56 1.49 2.80 0.00 0.00 179.97 185.21 1u90 h GLU 109 N 0.23 1.09 -0.47 0.20 4.22 -1.10 -1.22 114.58 117.52 1u90 h GLU 109 Ca 0.08 -0.07 -0.02 0.00 0.08 0.00 0.00 59.36 59.43 1u90 h GLU 109 Cb 0.12 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 1u90 h GLU 109 CO -0.01 0.72 0.22 1.96 -2.18 0.00 0.00 179.01 179.72 1u90 h GLN 110 N 1.12 0.69 -0.52 1.92 4.20 -1.14 -1.06 115.11 120.31 1u90 h GLN 110 Ca 0.32 -0.10 -0.04 0.00 0.06 0.00 0.00 58.65 58.88 1u90 h GLN 110 Cb -0.09 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.55 1u90 h GLN 110 CO -0.08 0.58 0.16 0.82 -0.67 0.00 0.00 178.83 179.64 1u90 h ILE 111 N 0.62 1.23 -0.12 2.54 2.04 -0.90 -2.52 117.51 120.41 1u90 h ILE 111 Ca 0.16 -0.79 -0.12 0.00 1.00 0.00 0.00 64.86 65.11 1u90 h ILE 111 Cb 0.13 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 1u90 h ILE 111 CO -0.02 0.29 -0.48 -0.07 0.00 0.00 0.00 178.15 177.88 1u90 h LEU 112 N 0.72 0.32 -0.36 1.44 3.38 -1.09 0.08 115.31 119.80 1u90 h LEU 112 Ca 0.17 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 1u90 h LEU 112 Cb 0.28 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1u90 h LEU 112 CO -0.00 0.75 0.11 -0.09 0.09 0.00 0.00 178.44 179.29 1u90 h ARG 113 N 0.24 0.56 -0.13 1.13 2.43 -1.07 0.45 114.38 117.98 1u90 h ARG 113 Ca 0.01 -0.12 -0.22 0.00 -0.81 0.00 0.00 59.98 58.84 1u90 h ARG 113 Cb 0.93 -0.08 0.01 0.00 -0.42 0.00 0.00 29.97 30.41 1u90 h ARG 113 CO 0.08 0.59 -0.76 0.28 -1.51 0.00 0.00 179.97 178.65 1u90 h VAL 114 N 0.43 1.29 0.00 0.20 2.07 -1.33 -3.35 116.25 115.56 1u90 h VAL 114 Ca 0.11 -1.97 -0.27 0.00 0.82 0.00 0.00 66.70 65.40 1u90 h VAL 114 Cb 0.27 2.05 -0.05 0.00 -1.52 0.00 0.00 31.29 32.04 1u90 h VAL 114 CO -0.00 0.62 -1.74 0.29 0.02 0.00 0.00 177.57 176.75 1u90 n LYS 115 N -3.98 0.64 -3.93 1.57 4.76 0.00 -4.93 118.16 112.30 1u90 n LYS 115 Ca -0.08 0.23 -0.30 0.00 -2.87 0.00 0.00 58.31 55.28 1u90 n LYS 115 Cb 0.74 -1.75 0.02 0.00 -1.84 0.00 0.00 35.03 32.20 1u90 n LYS 115 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1u90 n GLU 116 N -2.95 -5.35 -3.58 1.97 1.02 0.16 -4.95 120.64 106.96 1u90 n GLU 116 Ca -0.17 0.58 -0.27 0.00 -0.02 0.00 0.00 57.16 57.28 1u90 n GLU 116 Cb 1.01 -5.44 -0.16 0.00 -0.02 0.00 0.00 31.44 26.82 1u90 n GLU 116 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1u90 s ASP 117 N -3.37 2.94 0.15 1.62 -1.08 -1.26 -5.00 116.67 110.67 1u90 s ASP 117 Ca 0.63 -0.95 0.17 0.00 -0.52 0.00 0.00 52.55 51.88 1u90 s ASP 117 Cb -0.32 -0.30 0.75 0.00 -1.46 0.00 0.00 42.92 41.59 1u90 s ASP 117 CO 0.84 -0.39 1.52 -0.62 0.52 0.00 0.00 175.17 177.03 1u90 n GLU 118 N 5.26 0.10 -0.62 4.34 -0.58 -1.26 -2.31 120.64 125.57 1u90 n GLU 118 Ca -0.07 0.42 0.08 0.00 -0.42 0.00 0.00 57.16 57.18 1u90 n GLU 118 Cb 0.46 -1.72 0.33 0.00 -0.57 0.00 0.00 31.44 29.93 1u90 n GLU 118 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1u90 n ASN 119 N -1.91 4.66 -4.76 1.62 3.02 -1.26 -5.00 115.26 111.63 1u90 n ASN 119 Ca 0.02 -2.75 -0.41 0.00 -0.03 0.00 0.00 54.58 51.40 1u90 n ASN 119 Cb 0.14 -0.57 -0.02 0.00 -0.61 0.00 0.00 39.78 38.72 1u90 n ASN 119 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1u90 s VAL 120 N -2.39 2.45 0.02 2.41 0.11 -0.98 -4.87 120.40 117.16 1u90 s VAL 120 Ca 0.47 0.42 -0.36 0.00 -2.93 0.00 0.00 61.98 59.58 1u90 s VAL 120 Cb 0.34 -3.27 -0.15 0.00 -1.53 0.00 0.00 36.38 31.78 1u90 s VAL 120 CO 0.16 0.08 1.53 -2.65 -3.33 0.00 0.00 175.10 170.90 1u90 n PRO 121 N 1.42 1.53 -3.64 1.54 -0.02 -1.26 -4.94 135.00 129.64 1u90 n PRO 121 Ca 0.04 0.55 -0.10 0.00 -2.02 0.00 0.00 63.50 61.97 1u90 n PRO 121 Cb 0.40 -2.26 -0.07 0.00 -0.02 0.00 0.00 33.50 31.55 1u90 n PRO 121 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1u90 s PHE 122 N 1.53 -0.94 -0.02 6.00 5.36 -1.26 -1.86 117.98 126.79 1u90 s PHE 122 Ca 0.86 2.02 0.04 0.00 -0.96 0.00 0.00 56.93 58.90 1u90 s PHE 122 Cb -0.87 0.49 -0.00 0.00 -0.34 0.00 0.00 43.02 42.29 1u90 s PHE 122 CO 0.48 -0.46 -0.14 -0.51 -1.46 0.00 0.00 175.22 173.13 1u90 s LEU 123 N 1.13 1.93 -0.21 6.12 1.43 -0.66 -4.29 118.68 124.13 1u90 s LEU 123 Ca -0.06 -0.27 -0.19 0.00 -1.03 0.00 0.00 54.13 52.59 1u90 s LEU 123 Cb -0.05 -0.75 -0.03 0.00 0.03 0.00 0.00 46.19 45.39 1u90 s LEU 123 CO -0.12 0.14 0.53 -0.22 0.23 0.00 0.00 176.35 176.91 1u90 s LEU 124 N -0.08 4.13 -0.21 1.79 2.96 -0.63 -1.05 118.68 125.60 1u90 s LEU 124 Ca 0.00 0.66 -0.00 0.00 -0.22 0.00 0.00 54.13 54.57 1u90 s LEU 124 Cb -0.08 -2.72 0.02 0.00 0.50 0.00 0.00 46.19 43.91 1u90 s LEU 124 CO 0.01 -0.21 -0.14 -0.69 -1.32 0.00 0.00 176.35 173.99 1u90 s VAL 125 N 1.81 2.46 -0.53 1.68 1.01 0.44 -1.54 120.40 125.74 1u90 s VAL 125 Ca 0.24 -0.93 -0.19 0.00 0.00 0.00 0.00 61.98 61.11 1u90 s VAL 125 Cb -0.15 -2.13 0.07 0.00 0.00 0.00 0.00 36.38 34.17 1u90 s VAL 125 CO 0.09 0.41 0.62 -0.83 0.00 0.00 0.00 175.10 175.39 1u90 s GLY 126 N 1.32 1.82 0.44 4.51 0.00 0.15 -1.28 107.32 114.27 1u90 s GLY 126 Ca 0.03 -1.95 0.02 0.00 0.00 0.00 0.00 44.72 42.82 1u90 s GLY 126 CO -0.09 1.45 0.64 0.21 0.00 0.00 0.00 173.10 175.31 1u90 s ASN 127 N 2.97 5.80 -0.32 1.64 2.47 0.20 -0.20 114.94 127.49 1u90 s ASN 127 Ca 0.12 0.17 -0.02 0.00 0.42 0.00 0.00 52.86 53.55 1u90 s ASN 127 Cb -0.22 -1.41 0.00 0.00 -1.45 0.00 0.00 41.25 38.18 1u90 s ASN 127 CO 0.09 -0.70 0.23 0.29 -3.72 0.00 0.00 177.10 173.30 1u90 n LYS 128 N -2.03 -1.62 0.05 0.43 5.02 -0.46 -2.06 118.16 117.50 1u90 n LYS 128 Ca 0.02 0.19 0.07 0.00 -2.02 0.00 0.00 58.31 56.57 1u90 n LYS 128 Cb 0.58 -3.35 0.31 0.00 -0.02 0.00 0.00 35.03 32.55 1u90 n LYS 128 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1u90 n SER 129 N 0.56 0.23 0.18 4.39 3.41 0.28 -1.66 113.62 121.00 1u90 n SER 129 Ca -0.01 0.57 0.14 0.00 -0.26 0.00 0.00 58.87 59.31 1u90 n SER 129 Cb 0.52 -0.61 0.44 0.00 -0.26 0.00 0.00 64.21 64.29 1u90 n SER 129 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 1u90 h ASP 130 N 0.00 0.00 -1.14 4.04 2.03 -1.92 -3.21 116.42 116.22 1u90 h ASP 130 Ca 0.00 0.00 -0.63 0.00 -0.73 0.00 0.00 57.03 55.67 1u90 h ASP 130 Cb 0.18 0.00 -0.26 0.00 -0.83 0.00 0.00 39.33 38.42 1u90 h ASP 130 CO 0.00 0.00 0.82 0.18 -1.03 0.00 0.00 179.24 179.21 1u90 n LEU 131 N -2.65 7.41 -0.26 0.15 4.77 -0.66 -4.72 117.00 121.03 1u90 n LEU 131 Ca 0.03 -4.24 0.27 0.00 -0.03 0.00 0.00 56.01 52.04 1u90 n LEU 131 Cb 0.38 -1.03 0.63 0.00 -2.33 0.00 0.00 43.42 41.07 1u90 n LEU 131 CO 0.28 1.51 1.26 -0.08 -1.33 0.00 0.00 177.39 179.03 1u90 h GLU 132 N 2.20 0.18 0.00 3.23 4.57 -1.77 0.91 114.58 123.90 1u90 h GLU 132 Ca 0.54 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.71 1u90 h GLU 132 Cb 0.65 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.20 1u90 h GLU 132 CO 1.39 0.12 0.00 -0.40 -1.18 0.00 0.00 179.01 178.94 1u90 n ASP 133 N -4.39 0.05 -0.37 1.04 3.85 -1.26 -2.77 116.55 112.71 1u90 n ASP 133 Ca 0.22 0.51 0.04 0.00 -0.71 0.00 0.00 54.79 54.85 1u90 n ASP 133 Cb 0.96 -0.52 0.10 0.00 -1.35 0.00 0.00 41.12 40.31 1u90 n ASP 133 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 1u90 n LYS 134 N -1.55 2.78 -1.70 0.11 5.02 0.31 -5.04 118.16 118.08 1u90 n LYS 134 Ca 0.05 -1.97 -0.43 0.00 -2.02 0.00 0.00 58.31 53.94 1u90 n LYS 134 Cb 0.25 -1.25 -0.03 0.00 -0.02 0.00 0.00 35.03 33.98 1u90 n LYS 134 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1u90 n ARG 135 N -0.16 2.65 -0.00 1.97 0.63 -1.11 -4.43 116.66 116.20 1u90 n ARG 135 Ca 0.09 0.96 0.04 0.00 -0.92 0.00 0.00 57.85 58.01 1u90 n ARG 135 Cb 0.43 -2.80 -0.05 0.00 0.45 0.00 0.00 32.46 30.48 1u90 n ARG 135 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 1u90 n GLN 136 N 4.31 2.58 -4.01 -0.14 6.02 0.16 -4.94 117.38 121.36 1u90 n GLN 136 Ca 0.17 -0.03 -0.34 0.00 -0.01 0.00 0.00 57.00 56.79 1u90 n GLN 136 Cb 0.34 -1.01 -0.15 0.00 1.02 0.00 0.00 30.24 30.44 1u90 n GLN 136 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1u90 s VAL 137 N -2.10 2.72 0.64 5.09 1.01 -0.84 -4.78 120.40 122.15 1u90 s VAL 137 Ca 0.00 -0.72 -0.14 0.00 0.00 0.00 0.00 61.98 61.12 1u90 s VAL 137 Cb 0.06 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.22 1u90 s VAL 137 CO 0.33 0.47 1.07 -0.94 0.00 0.00 0.00 175.10 176.03 1u90 s SER 138 N 1.38 5.51 0.24 3.32 1.04 -1.26 -4.94 113.70 118.99 1u90 s SER 138 Ca 0.05 1.78 -0.05 0.00 0.48 0.00 0.00 55.95 58.21 1u90 s SER 138 Cb -0.14 -2.52 0.24 0.00 0.10 0.00 0.00 66.02 63.70 1u90 s SER 138 CO -0.08 -1.35 1.78 0.58 0.98 0.00 0.00 173.24 175.15 1u90 h VAL 139 N -0.02 1.25 -0.04 5.02 2.07 -1.99 -2.79 116.25 119.75 1u90 h VAL 139 Ca -0.46 -0.86 0.01 0.00 0.82 0.00 0.00 66.70 66.22 1u90 h VAL 139 Cb 1.22 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 1u90 h VAL 139 CO 0.56 0.33 -0.04 -0.33 0.02 0.00 0.00 177.57 178.11 1u90 h GLU 140 N 1.01 -0.06 -0.08 1.57 3.07 -1.99 -0.30 114.58 117.81 1u90 h GLU 140 Ca 0.22 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 58.99 1u90 h GLU 140 Cb 0.28 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.19 1u90 h GLU 140 CO -0.01 -0.04 -0.40 1.05 -1.40 0.00 0.00 179.01 178.22 1u90 h GLU 141 N -0.06 0.16 -0.21 2.33 4.11 -1.93 -0.79 114.58 118.19 1u90 h GLU 141 Ca 0.03 -0.07 -0.09 0.00 0.07 0.00 0.00 59.36 59.30 1u90 h GLU 141 Cb 0.11 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 1u90 h GLU 141 CO -0.08 0.54 -0.22 0.00 0.07 0.00 0.00 179.01 179.32 1u90 h ALA 142 N 1.46 0.31 -0.41 1.06 0.00 -1.25 -2.58 119.26 117.85 1u90 h ALA 142 Ca 0.01 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.49 1u90 h ALA 142 Cb 0.77 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1u90 h ALA 142 CO 0.06 0.26 -0.03 -0.22 0.00 0.00 0.00 179.25 179.32 1u90 h LYS 143 N 0.21 0.68 -0.68 0.00 3.64 -0.86 -1.73 116.57 117.83 1u90 h LYS 143 Ca 0.03 -0.18 -0.05 0.00 -1.27 0.00 0.00 60.65 59.18 1u90 h LYS 143 Cb 0.77 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.48 1u90 h LYS 143 CO 0.05 0.72 0.23 -0.91 -2.27 0.00 0.00 179.45 177.27 1u90 h ASN 144 N 0.64 0.97 -0.35 4.20 2.35 -1.08 0.18 115.58 122.48 1u90 h ASN 144 Ca 0.12 -0.20 -0.05 0.00 -0.55 0.00 0.00 56.30 55.63 1u90 h ASN 144 Cb 0.44 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.55 1u90 h ASN 144 CO 0.02 0.91 0.02 -0.09 -1.65 0.00 0.00 177.43 176.65 1u90 h ARG 145 N 0.98 0.60 -0.36 0.81 2.43 -1.20 -0.95 114.38 116.70 1u90 h ARG 145 Ca 0.22 -0.18 0.01 0.00 -0.81 0.00 0.00 59.98 59.22 1u90 h ARG 145 Cb 0.28 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.74 1u90 h ARG 145 CO -0.01 0.70 0.21 0.00 -1.51 0.00 0.00 179.97 179.37 1u90 h ALA 146 N 0.88 0.45 -0.56 2.80 0.00 -1.03 -1.02 119.26 120.78 1u90 h ALA 146 Ca 0.10 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.03 1u90 h ALA 146 Cb 0.41 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 1u90 h ALA 146 CO 0.01 -0.13 0.33 -0.44 0.00 0.00 0.00 179.25 179.03 1u90 h ASP 147 N 0.44 0.53 0.21 0.00 3.32 -0.47 -0.78 116.42 119.66 1u90 h ASP 147 Ca 0.14 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.17 1u90 h ASP 147 Cb -0.00 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.44 1u90 h ASP 147 CO -0.06 0.37 -0.14 1.56 -1.72 0.00 0.00 179.24 179.25 1u90 h GLN 148 N 0.65 0.00 -0.03 3.56 4.20 -0.61 -1.35 115.11 121.53 1u90 h GLN 148 Ca 0.23 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.94 1u90 h GLN 148 Cb 0.04 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.82 1u90 h GLN 148 CO -0.11 0.14 0.00 0.91 -0.67 0.00 0.00 178.83 179.10 1u90 n TRP 149 N -4.08 0.01 -3.59 2.96 8.01 -0.44 -4.95 117.44 115.37 1u90 n TRP 149 Ca -0.02 -0.01 -0.23 0.00 -1.31 0.00 0.00 57.50 55.93 1u90 n TRP 149 Cb 0.22 0.00 0.08 0.00 -2.01 0.00 0.00 31.31 29.60 1u90 n TRP 149 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.69 174.97 1u90 n ASN 150 N 0.43 -5.16 -4.33 -0.99 4.05 -0.44 -5.01 115.26 103.81 1u90 n ASN 150 Ca 0.18 -0.58 -0.17 0.00 0.45 0.00 0.00 54.58 54.45 1u90 n ASN 150 Cb 0.41 -4.94 -0.10 0.00 1.23 0.00 0.00 39.78 36.37 1u90 n ASN 150 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 177.26 174.89 1u90 s VAL 151 N -3.34 0.93 0.20 3.44 -7.23 -0.43 -5.03 120.40 108.95 1u90 s VAL 151 Ca 0.45 -2.02 -0.08 0.00 -1.81 0.00 0.00 61.98 58.51 1u90 s VAL 151 Cb -0.20 -2.44 -0.07 0.00 0.56 0.00 0.00 36.38 34.24 1u90 s VAL 151 CO 0.74 -0.24 0.50 0.20 -0.31 0.00 0.00 175.10 175.99 1u90 s ASN 152 N -3.32 6.59 -0.12 4.85 0.01 -1.26 -4.11 114.94 117.59 1u90 s ASN 152 Ca 0.31 0.83 0.01 0.00 -0.71 0.00 0.00 52.86 53.30 1u90 s ASN 152 Cb 0.06 -2.19 -0.02 0.00 0.41 0.00 0.00 41.25 39.52 1u90 s ASN 152 CO 0.10 -0.03 -0.14 -0.47 -1.51 0.00 0.00 177.10 175.05 1u90 s TYR 153 N -1.76 2.78 -0.01 2.20 5.04 -1.26 -1.60 117.35 122.74 1u90 s TYR 153 Ca 0.45 -0.59 0.01 0.00 -2.44 0.00 0.00 57.07 54.50 1u90 s TYR 153 Cb -0.12 -1.80 0.01 0.00 0.35 0.00 0.00 41.96 40.40 1u90 s TYR 153 CO 0.22 -0.16 -0.03 0.08 -1.34 0.00 0.00 175.55 174.31 1u90 s VAL 154 N 0.19 0.30 -0.13 3.14 1.01 -0.59 -5.00 120.40 119.32 1u90 s VAL 154 Ca -0.08 -0.11 -0.06 0.00 0.00 0.00 0.00 61.98 61.73 1u90 s VAL 154 Cb -0.15 -0.29 -0.04 0.00 0.00 0.00 0.00 36.38 35.90 1u90 s VAL 154 CO 0.05 0.11 0.08 -1.61 0.00 0.00 0.00 175.10 173.74 1u90 s GLU 155 N 0.23 3.53 0.35 2.72 2.02 -1.26 -0.67 118.70 125.62 1u90 s GLU 155 Ca -0.02 -0.26 0.03 0.00 0.02 0.00 0.00 54.97 54.74 1u90 s GLU 155 Cb -0.05 -3.12 -0.04 0.00 0.10 0.00 0.00 34.13 31.02 1u90 s GLU 155 CO -0.00 0.59 0.11 0.95 0.02 0.00 0.00 175.26 176.92 1u90 s THR 156 N -0.51 0.72 -0.18 3.63 -4.23 0.71 -4.63 115.64 111.15 1u90 s THR 156 Ca 0.11 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.57 1u90 s THR 156 Cb -0.12 -2.53 0.09 0.00 1.34 0.00 0.00 72.50 71.28 1u90 s THR 156 CO 0.02 0.00 0.30 -0.55 -0.54 0.00 0.00 174.62 173.85 1u90 s SER 157 N -3.51 0.50 0.23 3.99 0.15 -1.05 -0.56 113.70 113.46 1u90 s SER 157 Ca 0.31 0.37 0.24 0.00 0.70 0.00 0.00 55.95 57.56 1u90 s SER 157 Cb 0.05 0.79 0.93 0.00 -1.71 0.00 0.00 66.02 66.08 1u90 s SER 157 CO 0.15 -0.27 1.72 0.00 1.20 0.00 0.00 173.24 176.04 1u90 n ALA 158 N 5.35 1.81 -0.08 5.45 0.00 -1.26 -0.63 120.51 131.15 1u90 n ALA 158 Ca -0.06 0.05 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 1u90 n ALA 158 Cb 0.50 -1.40 -0.09 0.00 0.00 0.00 0.00 19.45 18.46 1u90 n ALA 158 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1u90 h LYS 159 N 0.00 0.00 0.00 0.00 3.64 -1.94 -3.38 116.57 114.89 1u90 h LYS 159 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1u90 h LYS 159 Cb 0.44 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 1u90 h LYS 159 CO 0.00 0.71 -0.44 0.25 -2.27 0.00 0.00 179.45 177.70 1u90 n THR 160 N -4.59 0.10 -0.99 1.00 -2.24 -1.23 -4.79 114.28 101.55 1u90 n THR 160 Ca -0.15 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 1u90 n THR 160 Cb 0.43 0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.68 1u90 n THR 160 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1u90 n ARG 161 N -1.67 -0.07 -1.68 -0.78 0.63 0.20 -4.98 116.66 108.31 1u90 n ARG 161 Ca 0.05 0.02 -0.47 0.00 -0.92 0.00 0.00 57.85 56.53 1u90 n ARG 161 Cb 0.36 -2.93 -0.04 0.00 0.45 0.00 0.00 32.46 30.30 1u90 n ARG 161 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1u90 n ALA 162 N 1.00 1.11 -1.56 5.13 0.00 -1.15 -2.29 120.51 122.74 1u90 n ALA 162 Ca 0.00 0.31 -0.19 0.00 0.00 0.00 0.00 53.44 53.56 1u90 n ALA 162 Cb 0.02 -2.49 -0.08 0.00 0.00 0.00 0.00 19.45 16.89 1u90 n ALA 162 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1u90 n ASN 163 N 6.08 -5.30 -0.02 0.00 3.02 -1.26 -2.52 115.26 115.25 1u90 n ASN 163 Ca 0.21 0.48 -0.13 0.00 -0.03 0.00 0.00 54.58 55.11 1u90 n ASN 163 Cb 0.31 -4.63 -0.10 0.00 -0.61 0.00 0.00 39.78 34.75 1u90 n ASN 163 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1u90 h VAL 164 N 0.00 1.42 -0.85 2.41 2.07 -1.77 -2.88 116.25 116.65 1u90 h VAL 164 Ca -0.39 -1.29 -0.03 0.00 0.82 0.00 0.00 66.70 65.80 1u90 h VAL 164 Cb 1.30 2.26 -0.04 0.00 -1.52 0.00 0.00 31.29 33.29 1u90 h VAL 164 CO 0.58 0.34 0.41 0.44 0.02 0.00 0.00 177.57 179.36 1u90 h ASP 165 N -0.48 1.11 -0.46 0.57 3.32 -1.90 -3.10 116.42 115.48 1u90 h ASP 165 Ca 0.00 -0.13 0.07 0.00 0.02 0.00 0.00 57.03 56.99 1u90 h ASP 165 Cb 0.57 -0.28 -0.06 0.00 0.22 0.00 0.00 39.33 39.77 1u90 h ASP 165 CO 0.01 0.93 0.11 0.50 -1.72 0.00 0.00 179.24 179.06 1u90 h LYS 166 N 1.21 0.24 -0.74 3.56 3.64 -1.94 0.70 116.57 123.24 1u90 h LYS 166 Ca 0.29 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.62 1u90 h LYS 166 Cb 0.12 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 1u90 h LYS 166 CO -0.04 0.16 0.33 -0.39 -2.27 0.00 0.00 179.45 177.24 1u90 h VAL 167 N 0.25 1.24 -0.23 2.00 -1.51 -1.43 0.31 116.25 116.89 1u90 h VAL 167 Ca 0.23 -0.73 -0.11 0.00 -1.23 0.00 0.00 66.70 64.86 1u90 h VAL 167 Cb 0.28 0.35 -0.00 0.00 -2.13 0.00 0.00 31.29 29.79 1u90 h VAL 167 CO -0.28 0.30 -0.28 -0.26 -1.23 0.00 0.00 177.57 175.81 1u90 h PHE 168 N 1.04 0.72 -0.55 5.19 0.04 -1.52 -2.03 116.94 119.85 1u90 h PHE 168 Ca 0.25 -0.23 -0.09 0.00 2.80 0.00 0.00 57.97 60.70 1u90 h PHE 168 Cb 0.16 -0.15 -0.02 0.00 2.20 0.00 0.00 35.95 38.14 1u90 h PHE 168 CO 0.01 0.95 -0.02 0.74 -0.60 0.00 0.00 178.31 179.39 1u90 h PHE 169 N 0.29 1.08 -0.42 -0.55 0.05 -0.68 -2.03 116.94 114.68 1u90 h PHE 169 Ca 0.03 -0.20 -0.10 0.00 3.82 0.00 0.00 57.97 61.52 1u90 h PHE 169 Cb 0.85 -0.28 -0.02 0.00 2.00 0.00 0.00 35.95 38.51 1u90 h PHE 169 CO 0.08 0.98 -0.16 -0.44 -0.18 0.00 0.00 178.31 178.59 1u90 h ASP 170 N 0.86 0.79 -0.03 2.17 3.32 -0.41 -2.24 116.42 120.88 1u90 h ASP 170 Ca 0.15 -0.26 -0.00 0.00 0.02 0.00 0.00 57.03 56.94 1u90 h ASP 170 Cb 0.57 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.90 1u90 h ASP 170 CO 0.03 0.95 0.00 0.25 -1.72 0.00 0.00 179.24 178.76 1u90 h LEU 171 N 0.70 0.05 -1.36 1.55 5.85 -1.21 -2.41 115.31 118.47 1u90 h LEU 171 Ca 0.11 -0.26 0.09 0.00 0.84 0.00 0.00 57.88 58.66 1u90 h LEU 171 Cb 0.66 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.63 1u90 h LEU 171 CO 0.05 0.29 0.51 0.24 -0.34 0.00 0.00 178.44 179.19 1u90 h MET 172 N -0.20 0.71 -0.78 1.25 2.86 -1.31 -0.43 114.93 117.01 1u90 h MET 172 Ca 0.01 -0.04 -0.05 0.00 -2.06 0.00 0.00 59.70 57.56 1u90 h MET 172 Cb 0.27 -0.16 -0.03 0.00 0.06 0.00 0.00 31.60 31.73 1u90 h MET 172 CO 0.00 0.47 0.29 0.00 1.06 0.00 0.00 176.91 178.73 1u90 h ARG 173 N 0.73 1.19 -0.44 1.72 3.08 -1.15 0.27 114.38 119.77 1u90 h ARG 173 Ca 0.35 -0.23 -0.11 0.00 0.07 0.00 0.00 59.98 60.07 1u90 h ARG 173 Cb 0.40 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 1u90 h ARG 173 CO -0.13 0.97 -0.15 0.93 -1.07 0.00 0.00 179.97 180.52 1u90 h GLU 174 N 1.15 0.83 -0.43 0.04 5.08 -0.65 -2.19 114.58 118.41 1u90 h GLU 174 Ca 0.26 -0.30 -0.08 0.00 -1.00 0.00 0.00 59.36 58.23 1u90 h GLU 174 Cb 0.24 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 1u90 h GLU 174 CO -0.02 0.93 -0.04 0.82 -1.00 0.00 0.00 179.01 179.70 1u90 h ILE 175 N 0.74 1.27 -0.33 3.13 2.04 -0.63 -2.64 117.51 121.09 1u90 h ILE 175 Ca 0.11 -1.11 0.05 0.00 1.00 0.00 0.00 64.86 64.92 1u90 h ILE 175 Cb 0.66 1.11 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 1u90 h ILE 175 CO 0.05 0.38 0.23 -0.09 0.00 0.00 0.00 178.15 178.71 1u90 h ARG 176 N 0.63 0.21 -0.58 2.37 2.43 -0.22 0.40 114.38 119.62 1u90 h ARG 176 Ca 0.12 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1u90 h ARG 176 Cb 0.55 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.06 1u90 h ARG 176 CO 0.03 0.14 0.00 0.00 -1.51 0.00 0.00 179.97 178.63 1u90 n ALA 177 N -2.54 2.78 -0.94 2.80 0.00 -0.85 -5.09 120.51 116.68 1u90 n ALA 177 Ca 0.04 -0.69 0.00 0.00 0.00 0.00 0.00 53.44 52.79 1u90 n ALA 177 Cb 0.25 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.68 1u90 n ALA 177 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04