#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b4q h GLN 2 N 0.00 -0.08 0.00 0.00 -0.00 -1.99 -3.17 115.11 109.87 1b4q h GLN 2 Ca 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.66 1b4q h GLN 2 Cb 0.00 0.02 0.00 0.00 -0.00 0.00 0.00 27.48 27.50 1b4q h GLN 2 CO 0.00 0.50 0.00 1.05 -0.00 0.00 0.00 178.83 180.38 1b4q h GLU 3 N -0.89 0.00 0.00 0.06 4.11 -2.04 -1.63 114.58 114.20 1b4q h GLU 3 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.42 1b4q h GLU 3 Cb 0.62 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.87 1b4q h GLU 3 CO 0.01 0.00 0.00 1.19 0.07 0.00 0.00 179.01 180.28 1b4q n PHE 4 N -2.92 0.00 -0.01 2.06 3.01 -1.20 -1.73 117.46 116.67 1b4q n PHE 4 Ca -0.01 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.31 1b4q n PHE 4 Cb 0.16 -0.40 -0.02 0.00 -0.01 0.00 0.00 39.48 39.21 1b4q n PHE 4 CO 0.00 0.00 0.00 -0.39 1.01 0.00 0.00 176.76 177.38 1b4q h VAL 5 N 0.00 1.31 -0.92 -4.37 -1.51 -1.59 -3.10 116.25 106.07 1b4q h VAL 5 Ca 0.00 -1.94 0.11 0.00 -1.23 0.00 0.00 66.70 63.64 1b4q h VAL 5 Cb 0.00 1.91 -0.07 0.00 -2.13 0.00 0.00 31.29 31.00 1b4q h VAL 5 CO 0.00 0.61 0.59 0.78 -1.23 0.00 0.00 177.57 178.32 1b4q h ASN 6 N 0.48 0.81 0.84 4.19 2.35 -1.41 0.70 115.58 123.55 1b4q h ASN 6 Ca -0.02 0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1b4q h ASN 6 Cb 1.28 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 39.51 1b4q h ASN 6 CO 0.13 0.46 0.00 -1.20 -1.65 0.00 0.00 177.43 175.17 1b4q n SER 7 N -4.55 0.30 -0.11 5.81 7.64 -0.71 -3.54 113.62 118.45 1b4q n SER 7 Ca 0.16 0.55 -0.23 0.00 1.01 0.00 0.00 58.87 60.36 1b4q n SER 7 Cb 0.34 -0.62 -0.11 0.00 -1.01 0.00 0.00 64.21 62.81 1b4q n SER 7 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1b4q n LYS 8 N -1.80 0.63 -2.68 1.43 5.02 0.21 -4.92 118.16 116.04 1b4q n LYS 8 Ca 0.04 0.26 -0.40 0.00 -2.02 0.00 0.00 58.31 56.19 1b4q n LYS 8 Cb 0.27 -1.56 -0.06 0.00 -0.02 0.00 0.00 35.03 33.66 1b4q n LYS 8 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 1b4q s ILE 9 N -2.50 3.95 -0.14 -0.18 -4.36 0.73 -4.91 121.20 113.79 1b4q s ILE 9 Ca -0.34 1.95 -0.11 0.00 -0.26 0.00 0.00 60.65 61.89 1b4q s ILE 9 Cb 0.11 -4.24 0.04 0.00 1.25 0.00 0.00 42.46 39.62 1b4q s ILE 9 CO 0.58 0.46 0.35 -1.58 0.24 0.00 0.00 174.94 174.99 1b4q s GLN 10 N -1.17 0.38 -0.02 0.37 2.00 -1.26 -4.85 119.66 115.10 1b4q s GLN 10 Ca 0.42 0.57 -0.36 0.00 -2.00 0.00 0.00 55.36 54.00 1b4q s GLN 10 Cb -0.27 0.10 -0.14 0.00 0.80 0.00 0.00 33.01 33.50 1b4q s GLN 10 CO 0.34 -0.09 1.67 -2.30 -0.50 0.00 0.00 175.29 174.41 1b4q n PRO 11 N 3.41 1.77 -0.59 1.67 -0.02 -1.26 -0.38 135.00 139.60 1b4q n PRO 11 Ca -0.17 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 1b4q n PRO 11 Cb 0.56 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 1b4q n PRO 11 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1b4q n GLY 12 N 3.73 0.65 2.89 -1.23 0.00 -1.26 -4.96 105.19 105.00 1b4q n GLY 12 Ca 0.21 -0.56 -0.16 0.00 0.00 0.00 0.00 46.02 45.51 1b4q n GLY 12 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1b4q s LYS 13 N -1.07 0.33 -0.17 1.61 2.20 0.49 -4.72 119.74 118.40 1b4q s LYS 13 Ca 0.00 -0.05 -0.08 0.00 -0.36 0.00 0.00 55.97 55.47 1b4q s LYS 13 Cb 0.00 -0.39 -0.05 0.00 -1.51 0.00 0.00 37.83 35.89 1b4q s LYS 13 CO 0.00 -0.01 0.11 0.08 -0.36 0.00 0.00 175.35 175.17 1b4q s VAL 14 N 0.38 5.28 -0.01 4.02 1.01 -0.84 -1.33 120.40 128.91 1b4q s VAL 14 Ca -0.04 0.14 -0.01 0.00 0.00 0.00 0.00 61.98 62.07 1b4q s VAL 14 Cb -0.07 -3.37 0.00 0.00 0.00 0.00 0.00 36.38 32.95 1b4q s VAL 14 CO -0.01 0.50 0.02 0.54 0.00 0.00 0.00 175.10 176.15 1b4q s VAL 15 N -0.04 -0.00 -0.12 2.92 0.11 -1.22 -2.94 120.40 119.11 1b4q s VAL 15 Ca 0.09 0.00 0.03 0.00 -2.93 0.00 0.00 61.98 59.17 1b4q s VAL 15 Cb -0.12 -0.03 0.01 0.00 -1.53 0.00 0.00 36.38 34.71 1b4q s VAL 15 CO 0.00 0.00 -0.20 -0.69 -3.33 0.00 0.00 175.10 170.88 1b4q s VAL 16 N 0.03 1.87 -0.27 2.04 1.01 -1.15 -2.11 120.40 121.82 1b4q s VAL 16 Ca -0.00 -0.88 -0.16 0.00 0.00 0.00 0.00 61.98 60.93 1b4q s VAL 16 Cb -0.00 -1.65 -0.03 0.00 0.00 0.00 0.00 36.38 34.69 1b4q s VAL 16 CO -0.00 0.52 0.44 -0.36 0.00 0.00 0.00 175.10 175.70 1b4q s PHE 17 N 0.70 3.26 0.18 5.22 0.40 -0.65 0.18 117.98 127.26 1b4q s PHE 17 Ca -0.11 0.52 0.02 0.00 -0.60 0.00 0.00 56.93 56.76 1b4q s PHE 17 Cb -0.16 -2.64 -0.01 0.00 0.51 0.00 0.00 43.02 40.72 1b4q s PHE 17 CO 0.02 -0.25 0.08 0.44 0.70 0.00 0.00 175.22 176.20 1b4q n ILE 18 N 5.14 0.00 -3.48 0.64 -5.35 -0.16 -1.51 119.36 114.63 1b4q n ILE 18 Ca -0.06 -1.07 -0.27 0.00 -0.27 0.00 0.00 62.75 61.08 1b4q n ILE 18 Cb 0.50 0.42 -0.13 0.00 -1.74 0.00 0.00 39.64 38.69 1b4q n ILE 18 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1b4q s LYS 19 N -2.68 0.39 -0.34 6.28 1.02 -1.26 -2.60 119.74 120.55 1b4q s LYS 19 Ca 0.11 -0.84 -0.14 0.00 0.02 0.00 0.00 55.97 55.12 1b4q s LYS 19 Cb 0.01 -1.12 -0.14 0.00 -0.52 0.00 0.00 37.83 36.06 1b4q s LYS 19 CO 0.08 -1.11 1.36 -2.30 -0.92 0.00 0.00 175.35 172.46 1b4q n PRO 20 N 4.68 0.03 0.00 -1.68 -0.02 -1.26 -2.15 135.00 134.60 1b4q n PRO 20 Ca 0.03 -0.72 0.00 0.00 -2.02 0.00 0.00 63.50 60.80 1b4q n PRO 20 Cb 0.41 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 1b4q n PRO 20 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1b4q n THR 21 N 6.22 0.00 -3.55 3.45 -1.04 -1.26 -5.11 114.28 112.98 1b4q n THR 21 Ca 0.21 0.00 -0.37 0.00 -2.04 0.00 0.00 64.05 61.85 1b4q n THR 21 Cb 0.43 0.00 -0.09 0.00 -1.82 0.00 0.00 70.33 68.85 1b4q n THR 21 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1b4q h PRO 23 N 7.53 0.00 -0.14 0.00 0.11 -1.99 -2.30 132.00 135.21 1b4q h PRO 23 Ca -0.37 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.71 1b4q h PRO 23 Cb 1.17 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 1b4q h PRO 23 CO 0.67 0.00 -0.02 1.88 -0.21 0.00 0.00 178.00 180.32 1b4q h TYR 24 N 0.00 0.30 -0.51 0.65 -1.99 -1.93 0.47 116.97 113.96 1b4q h TYR 24 Ca 0.00 -0.06 -0.04 0.00 2.00 0.00 0.00 58.73 60.63 1b4q h TYR 24 Cb 0.39 -0.07 -0.02 0.00 2.00 0.00 0.00 36.73 39.02 1b4q h TYR 24 CO 0.00 0.53 0.16 0.77 -0.00 0.00 0.00 178.16 179.61 1b4q h SER 25 N -0.02 0.69 -0.90 3.88 0.02 -1.61 -1.14 113.55 114.48 1b4q h SER 25 Ca 0.04 -0.10 -0.00 0.00 -0.84 0.00 0.00 61.79 60.89 1b4q h SER 25 Cb 0.42 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 62.74 1b4q h SER 25 CO 0.01 0.66 0.56 -0.09 -1.14 0.00 0.00 176.83 176.83 1b4q h ARG 26 N 0.74 1.21 -0.38 3.45 9.65 -1.32 -1.70 114.38 126.02 1b4q h ARG 26 Ca 0.17 -0.10 0.05 0.00 -1.10 0.00 0.00 59.98 59.00 1b4q h ARG 26 Cb 0.22 -0.26 -0.05 0.00 -1.39 0.00 0.00 29.97 28.50 1b4q h ARG 26 CO -0.01 0.83 0.10 0.00 2.80 0.00 0.00 179.97 183.69 1b4q h ARG 27 N 1.23 0.24 -0.65 0.20 -0.00 0.36 0.30 114.38 116.06 1b4q h ARG 27 Ca 0.32 -0.01 0.02 0.00 -0.50 0.00 0.00 59.98 59.81 1b4q h ARG 27 Cb -0.08 -0.05 -0.03 0.00 0.00 0.00 0.00 29.97 29.80 1b4q h ARG 27 CO -0.06 0.16 0.43 0.00 0.00 0.00 0.00 179.97 180.49 1b4q h ALA 28 N 1.26 1.60 -0.34 0.04 0.00 -0.99 0.45 119.26 121.28 1b4q h ALA 28 Ca 0.18 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.90 1b4q h ALA 28 Cb 0.18 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1b4q h ALA 28 CO -0.21 0.35 -0.36 1.96 0.00 0.00 0.00 179.25 180.99 1b4q h GLN 29 N 0.82 0.85 -0.41 0.00 4.20 -0.17 -2.01 115.11 118.39 1b4q h GLN 29 Ca 0.25 -0.46 -0.15 0.00 0.06 0.00 0.00 58.65 58.35 1b4q h GLN 29 Cb 0.00 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 1b4q h GLN 29 CO -0.06 1.10 -0.34 0.93 -0.67 0.00 0.00 178.83 179.78 1b4q h GLU 30 N 0.64 0.95 0.09 1.46 4.39 0.41 -2.47 114.58 120.05 1b4q h GLU 30 Ca 0.05 -0.47 -0.00 0.00 0.34 0.00 0.00 59.36 59.27 1b4q h GLU 30 Cb 0.95 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.60 1b4q h GLU 30 CO 0.09 1.14 -0.04 0.97 -1.16 0.00 0.00 179.01 180.00 1b4q h ILE 31 N 0.79 0.69 -0.20 3.13 -0.00 -0.95 -3.25 117.51 117.70 1b4q h ILE 31 Ca 0.07 -1.32 0.06 0.00 -0.00 0.00 0.00 64.86 63.67 1b4q h ILE 31 Cb 0.93 1.24 -0.01 0.00 -0.00 0.00 0.00 36.82 38.98 1b4q h ILE 31 CO 0.09 0.21 0.21 -0.07 -0.00 0.00 0.00 178.15 178.59 1b4q h LEU 32 N -0.97 0.00 -1.80 2.19 3.38 -1.49 0.30 115.31 116.92 1b4q h LEU 32 Ca -0.01 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 1b4q h LEU 32 Cb 0.44 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 1b4q h LEU 32 CO 0.02 0.00 -0.15 -1.28 0.09 0.00 0.00 178.44 177.12 1b4q h SER 33 N 0.00 0.00 -0.03 -0.43 0.87 -1.48 -1.03 113.55 111.45 1b4q h SER 33 Ca 0.10 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 1b4q h SER 33 Cb 0.51 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.47 1b4q h SER 33 CO -0.00 0.15 0.00 0.00 -0.53 0.00 0.00 176.83 176.45 1b4q n GLN 34 N -3.91 1.81 -3.13 2.24 3.00 0.10 -4.87 117.38 112.62 1b4q n GLN 34 Ca -0.02 -1.17 -0.39 0.00 -0.01 0.00 0.00 57.00 55.40 1b4q n GLN 34 Cb 0.24 -1.47 -0.05 0.00 0.00 0.00 0.00 30.24 28.96 1b4q n GLN 34 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1b4q s LEU 35 N -1.97 4.39 -0.57 1.08 1.43 -0.39 -4.92 118.68 117.73 1b4q s LEU 35 Ca 0.36 1.21 -0.10 0.00 -1.03 0.00 0.00 54.13 54.57 1b4q s LEU 35 Cb 0.21 -3.01 -0.09 0.00 0.03 0.00 0.00 46.19 43.33 1b4q s LEU 35 CO 0.32 0.03 1.75 -0.81 0.23 0.00 0.00 176.35 177.87 1b4q n PRO 36 N 3.02 1.25 -2.76 1.29 -0.04 -1.26 -4.88 135.00 131.62 1b4q n PRO 36 Ca -0.05 -1.25 -0.39 0.00 -0.04 0.00 0.00 63.50 61.77 1b4q n PRO 36 Cb 0.51 -2.44 -0.06 0.00 -0.04 0.00 0.00 33.50 31.47 1b4q n PRO 36 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1b4q s ILE 37 N 4.47 4.12 0.71 0.52 -1.09 -1.26 -2.23 121.20 126.43 1b4q s ILE 37 Ca 0.36 1.98 -0.16 0.00 -2.23 0.00 0.00 60.65 60.59 1b4q s ILE 37 Cb 0.09 -4.20 -0.00 0.00 -1.58 0.00 0.00 42.46 36.77 1b4q s ILE 37 CO 0.04 0.35 0.93 0.29 -1.23 0.00 0.00 174.94 175.32 1b4q n LYS 38 N 1.11 0.54 -1.72 2.79 5.02 -1.17 -4.84 118.16 119.89 1b4q n LYS 38 Ca -0.00 0.24 -0.41 0.00 -2.02 0.00 0.00 58.31 56.11 1b4q n LYS 38 Cb 0.48 -2.18 0.00 0.00 -0.02 0.00 0.00 35.03 33.32 1b4q n LYS 38 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1b4q n GLN 39 N -1.65 2.16 -0.97 1.97 3.00 -1.26 -1.95 117.38 118.68 1b4q n GLN 39 Ca 0.13 0.76 0.00 0.00 -0.01 0.00 0.00 57.00 57.88 1b4q n GLN 39 Cb 0.49 -2.43 0.00 0.00 0.00 0.00 0.00 30.24 28.30 1b4q n GLN 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1b4q n GLY 40 N 0.72 0.14 0.10 1.08 0.00 -1.26 -4.79 105.19 101.17 1b4q n GLY 40 Ca 0.05 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.97 1b4q n GLY 40 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1b4q n LEU 41 N 0.00 0.17 -4.75 0.99 7.94 -0.82 -4.90 117.00 115.63 1b4q n LEU 41 Ca 0.00 0.02 -0.36 0.00 -1.11 0.00 0.00 56.01 54.55 1b4q n LEU 41 Cb 0.34 0.42 -0.07 0.00 0.53 0.00 0.00 43.42 44.65 1b4q n LEU 41 CO 0.00 0.51 -0.03 -0.22 -1.11 0.00 0.00 177.39 176.54 1b4q s LEU 42 N -5.56 4.27 0.23 -1.96 2.96 -1.26 -1.99 118.68 115.37 1b4q s LEU 42 Ca -0.11 0.52 -0.02 0.00 -0.22 0.00 0.00 54.13 54.30 1b4q s LEU 42 Cb 0.06 -2.34 -0.03 0.00 0.50 0.00 0.00 46.19 44.38 1b4q s LEU 42 CO 0.82 0.15 0.21 -0.70 -1.32 0.00 0.00 176.35 175.51 1b4q s GLU 43 N 0.20 1.34 -0.20 1.98 2.56 -1.15 -5.04 118.70 118.39 1b4q s GLU 43 Ca 0.16 -1.63 -0.02 0.00 0.00 0.00 0.00 54.97 53.48 1b4q s GLU 43 Cb -0.13 0.31 0.06 0.00 2.00 0.00 0.00 34.13 36.37 1b4q s GLU 43 CO 0.04 -0.47 0.02 -0.06 -0.56 0.00 0.00 175.26 174.23 1b4q s PHE 44 N -4.01 1.23 -0.54 5.30 0.08 -1.26 -2.91 117.98 115.86 1b4q s PHE 44 Ca 0.37 -0.99 -0.19 0.00 0.12 0.00 0.00 56.93 56.23 1b4q s PHE 44 Cb 0.05 -1.11 0.07 0.00 -0.57 0.00 0.00 43.02 41.47 1b4q s PHE 44 CO 0.14 -0.63 0.67 0.08 -0.10 0.00 0.00 175.22 175.38 1b4q s VAL 45 N 1.79 4.82 -0.70 -0.44 1.01 0.47 -4.93 120.40 122.41 1b4q s VAL 45 Ca -0.02 -0.65 -0.26 0.00 0.00 0.00 0.00 61.98 61.05 1b4q s VAL 45 Cb -0.17 -4.39 0.04 0.00 0.00 0.00 0.00 36.38 31.86 1b4q s VAL 45 CO -0.08 -0.95 1.20 -1.81 0.00 0.00 0.00 175.10 173.46 1b4q s ASP 46 N 3.07 6.19 0.00 3.32 1.11 -1.26 -0.99 116.67 128.11 1b4q s ASP 46 Ca 0.14 -0.51 0.03 0.00 0.18 0.00 0.00 52.55 52.40 1b4q s ASP 46 Cb -0.21 -2.53 0.19 0.00 1.07 0.00 0.00 42.92 41.44 1b4q s ASP 46 CO 0.10 -1.71 0.60 2.30 1.18 0.00 0.00 175.17 177.63 1b4q n ILE 47 N 6.31 0.00 0.00 0.77 -5.35 -1.07 -1.09 119.36 118.93 1b4q n ILE 47 Ca 0.02 0.00 0.05 0.00 -0.27 0.00 0.00 62.75 62.55 1b4q n ILE 47 Cb 0.48 -0.84 -0.12 0.00 -1.74 0.00 0.00 39.64 37.42 1b4q n ILE 47 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1b4q n THR 48 N -0.90 0.65 1.71 7.28 -2.24 -1.26 -3.36 114.28 116.15 1b4q n THR 48 Ca 0.02 -0.62 0.01 0.00 -2.27 0.00 0.00 64.05 61.19 1b4q n THR 48 Cb 0.01 -0.32 0.03 0.00 -2.10 0.00 0.00 70.33 67.95 1b4q n THR 48 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b4q n ALA 49 N -2.37 2.36 -0.20 6.98 0.00 -0.25 -2.86 120.51 124.18 1b4q n ALA 49 Ca -0.10 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1b4q n ALA 49 Cb 0.74 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 19.17 1b4q n ALA 49 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1b4q n THR 50 N -0.52 0.00 -4.52 0.00 5.66 -1.25 -5.11 114.28 108.54 1b4q n THR 50 Ca 0.01 -0.07 0.00 0.00 -3.05 0.00 0.00 64.05 60.93 1b4q n THR 50 Cb 0.00 1.20 0.00 0.00 -1.55 0.00 0.00 70.33 69.98 1b4q n THR 50 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 1b4q n ASN 51 N -0.11 -2.16 -1.59 1.09 3.02 -1.14 -4.83 115.26 109.54 1b4q n ASN 51 Ca 0.00 0.00 -0.15 0.00 -0.03 0.00 0.00 54.58 54.40 1b4q n ASN 51 Cb 0.05 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.16 1b4q n ASN 51 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1b4q n HIS 52 N -0.40 -0.42 -0.41 3.10 8.25 -1.26 -4.78 115.22 119.31 1b4q n HIS 52 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.35 1b4q n HIS 52 Cb 0.00 -2.88 -0.10 0.00 1.12 0.00 0.00 29.99 28.13 1b4q n HIS 52 CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 1b4q h THR 53 N 0.00 0.00 -0.80 1.59 1.35 -1.89 0.46 112.91 113.62 1b4q h THR 53 Ca -0.32 0.00 0.15 0.00 -0.55 0.00 0.00 66.41 65.69 1b4q h THR 53 Cb 1.04 0.00 -0.06 0.00 -1.73 0.00 0.00 68.15 67.41 1b4q h THR 53 CO 0.46 0.00 0.53 0.78 -0.25 0.00 0.00 175.52 177.03 1b4q h ASN 54 N -0.02 0.46 -0.30 5.36 4.21 -1.93 -1.55 115.58 121.82 1b4q h ASN 54 Ca 0.16 0.03 -0.02 0.00 1.21 0.00 0.00 56.30 57.68 1b4q h ASN 54 Cb 0.42 -0.06 -0.01 0.00 -1.12 0.00 0.00 38.32 37.54 1b4q h ASN 54 CO -0.92 0.24 0.13 -0.33 -1.29 0.00 0.00 177.43 175.25 1b4q h GLU 55 N 0.49 0.44 0.23 0.81 5.08 -0.46 0.48 114.58 121.65 1b4q h GLU 55 Ca 0.39 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.67 1b4q h GLU 55 Cb 0.82 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.00 1b4q h GLU 55 CO -0.14 0.45 -0.11 0.82 -1.00 0.00 0.00 179.01 179.02 1b4q h ILE 56 N 0.34 0.85 -0.64 3.13 5.03 -0.82 -0.24 117.51 125.16 1b4q h ILE 56 Ca 0.10 -0.58 0.06 0.00 -0.12 0.00 0.00 64.86 64.32 1b4q h ILE 56 Cb 0.16 1.17 -0.05 0.00 -3.03 0.00 0.00 36.82 35.07 1b4q h ILE 56 CO -0.01 0.12 0.34 1.56 -0.68 0.00 0.00 178.15 179.49 1b4q h GLN 57 N -0.61 0.61 -0.75 2.37 4.20 -1.32 1.08 115.11 120.70 1b4q h GLN 57 Ca -0.03 -0.04 0.17 0.00 0.06 0.00 0.00 58.65 58.81 1b4q h GLN 57 Cb 0.44 -0.14 -0.05 0.00 0.30 0.00 0.00 27.48 28.04 1b4q h GLN 57 CO 0.05 0.40 0.51 -0.44 -0.67 0.00 0.00 178.83 178.69 1b4q h ASP 58 N 0.63 0.27 0.03 1.46 3.32 0.15 0.47 116.42 122.75 1b4q h ASP 58 Ca 0.29 0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.31 1b4q h ASP 58 Cb 0.20 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1b4q h ASP 58 CO -0.19 0.13 -0.19 0.22 -1.72 0.00 0.00 179.24 177.49 1b4q h TYR 59 N 0.28 0.15 -0.93 4.55 3.20 0.25 -2.65 116.97 121.82 1b4q h TYR 59 Ca 0.37 -0.10 0.19 0.00 3.14 0.00 0.00 58.73 62.34 1b4q h TYR 59 Cb 1.04 -0.01 -0.08 0.00 1.54 0.00 0.00 36.73 39.22 1b4q h TYR 59 CO -0.00 1.02 0.60 -0.07 -1.64 0.00 0.00 178.16 178.07 1b4q h LEU 60 N -0.76 0.53 0.49 2.82 3.38 0.25 1.38 115.31 123.40 1b4q h LEU 60 Ca -0.03 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1b4q h LEU 60 Cb 1.09 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1b4q h LEU 60 CO 0.04 0.21 -0.23 -0.61 0.09 0.00 0.00 178.44 177.93 1b4q h GLN 61 N 0.53 -0.63 -0.53 1.13 5.75 -0.13 0.43 115.11 121.65 1b4q h GLN 61 Ca 0.50 0.04 -0.11 0.00 -0.15 0.00 0.00 58.65 58.93 1b4q h GLN 61 Cb 1.06 0.14 -0.02 0.00 1.07 0.00 0.00 27.48 29.74 1b4q h GLN 61 CO -0.23 -0.38 -0.09 0.37 -2.65 0.00 0.00 178.83 175.86 1b4q h GLN 62 N -0.75 0.98 -0.33 1.69 5.75 -0.56 0.27 115.11 122.16 1b4q h GLN 62 Ca -0.07 -0.34 -0.03 0.00 -0.15 0.00 0.00 58.65 58.06 1b4q h GLN 62 Cb 0.55 -0.07 -0.01 0.00 1.07 0.00 0.00 27.48 29.01 1b4q h GLN 62 CO 0.11 1.01 0.10 1.25 -2.65 0.00 0.00 178.83 178.66 1b4q h LEU 63 N 0.88 0.48 0.00 -2.39 5.85 0.19 -3.42 115.31 116.89 1b4q h LEU 63 Ca 0.14 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.65 1b4q h LEU 63 Cb 0.64 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.54 1b4q h LEU 63 CO 0.04 0.56 0.00 0.35 -0.34 0.00 0.00 178.44 179.05 1b4q n THR 64 N -4.66 0.00 0.00 1.05 -2.24 0.15 -5.06 114.28 103.52 1b4q n THR 64 Ca -0.02 0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1b4q n THR 64 Cb 0.17 -0.97 0.00 0.00 -2.10 0.00 0.00 70.33 67.43 1b4q n THR 64 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1b4q n GLY 65 N 3.36 1.31 3.82 3.38 0.00 0.94 -4.95 105.19 113.04 1b4q n GLY 65 Ca 0.00 -0.09 -0.37 0.00 0.00 0.00 0.00 46.02 45.55 1b4q n GLY 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b4q s ALA 66 N 0.00 3.72 -0.32 4.61 0.00 -1.26 -4.70 121.76 123.81 1b4q s ALA 66 Ca 0.00 -0.40 0.08 0.00 0.00 0.00 0.00 51.96 51.64 1b4q s ALA 66 Cb 0.00 -2.28 0.53 0.00 0.00 0.00 0.00 23.12 21.38 1b4q s ALA 66 CO 0.00 0.41 1.54 2.89 0.00 0.00 0.00 175.76 180.60 1b4q n ARG 67 N 2.37 1.92 -2.25 0.00 -4.01 -1.26 -4.06 116.66 109.36 1b4q n ARG 67 Ca -0.15 -3.18 -0.25 0.00 -1.04 0.00 0.00 57.85 53.22 1b4q n ARG 67 Cb 0.53 -1.88 0.08 0.00 -3.04 0.00 0.00 32.46 28.14 1b4q n ARG 67 CO 0.00 0.00 0.00 0.99 -3.04 0.00 0.00 177.63 175.58 1b4q s THR 68 N -3.29 2.28 -0.11 8.89 2.01 -1.26 -5.01 115.64 119.15 1b4q s THR 68 Ca 0.47 -0.32 0.01 0.00 0.31 0.00 0.00 61.69 62.17 1b4q s THR 68 Cb 0.42 -2.97 -0.01 0.00 0.01 0.00 0.00 72.50 69.95 1b4q s THR 68 CO 0.01 0.00 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.10 1b4q s VAL 69 N -3.23 2.86 0.00 3.82 1.01 -1.26 -4.15 120.40 119.45 1b4q s VAL 69 Ca 0.61 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.84 1b4q s VAL 69 Cb -0.10 -2.16 0.00 0.00 0.00 0.00 0.00 36.38 34.12 1b4q s VAL 69 CO 0.45 0.54 0.00 -0.81 0.00 0.00 0.00 175.10 175.28 1b4q n PRO 70 N 3.27 0.60 -3.33 2.72 -0.04 -1.26 -4.34 135.00 132.62 1b4q n PRO 70 Ca -0.18 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.16 1b4q n PRO 70 Cb 0.53 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.92 1b4q n PRO 70 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1b4q s ARG 71 N -1.35 0.59 0.45 0.54 1.81 -0.57 -4.27 118.95 116.16 1b4q s ARG 71 Ca 0.00 -0.49 -0.09 0.00 -1.72 0.00 0.00 55.73 53.43 1b4q s ARG 71 Cb 0.00 -0.49 -0.05 0.00 -0.45 0.00 0.00 34.95 33.95 1b4q s ARG 71 CO 0.00 -1.15 0.81 0.08 -0.68 0.00 0.00 175.30 174.36 1b4q s VAL 72 N 1.82 4.80 -0.34 3.52 1.01 -0.86 -1.64 120.40 128.71 1b4q s VAL 72 Ca 0.15 0.56 0.01 0.00 0.00 0.00 0.00 61.98 62.69 1b4q s VAL 72 Cb -0.13 -3.78 0.14 0.00 0.00 0.00 0.00 36.38 32.61 1b4q s VAL 72 CO -0.12 -0.68 0.30 -0.36 0.00 0.00 0.00 175.10 174.24 1b4q s PHE 73 N -2.56 -0.05 -0.29 5.22 0.40 -0.90 -3.71 117.98 116.09 1b4q s PHE 73 Ca 0.51 -0.89 -0.29 0.00 -0.60 0.00 0.00 56.93 55.66 1b4q s PHE 73 Cb -0.10 -0.57 -0.01 0.00 0.51 0.00 0.00 43.02 42.84 1b4q s PHE 73 CO 0.37 -0.92 1.49 0.42 0.70 0.00 0.00 175.22 177.29 1b4q s ILE 74 N 1.58 3.86 0.00 0.64 -1.09 -0.91 -3.42 121.20 121.86 1b4q s ILE 74 Ca 0.15 0.95 0.00 0.00 -2.23 0.00 0.00 60.65 59.52 1b4q s ILE 74 Cb -0.17 -3.93 0.00 0.00 -1.58 0.00 0.00 42.46 36.78 1b4q s ILE 74 CO -0.11 -0.44 0.00 0.61 -1.23 0.00 0.00 174.94 173.77 1b4q n GLY 75 N 4.68 1.84 0.24 6.18 0.00 -0.44 -1.43 105.19 116.26 1b4q n GLY 75 Ca 0.17 -0.49 0.14 0.00 0.00 0.00 0.00 46.02 45.84 1b4q n GLY 75 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1b4q n LYS 76 N 6.13 0.98 -2.97 1.61 4.76 -1.26 -4.49 118.16 122.92 1b4q n LYS 76 Ca 0.00 -0.48 -0.42 0.00 -2.87 0.00 0.00 58.31 54.55 1b4q n LYS 76 Cb 0.00 -1.49 -0.05 0.00 -1.84 0.00 0.00 35.03 31.65 1b4q n LYS 76 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1b4q s ASP 77 N -2.35 6.61 0.35 4.39 1.01 -0.51 -5.04 116.67 121.13 1b4q s ASP 77 Ca 0.30 0.55 -0.26 0.00 0.71 0.00 0.00 52.55 53.85 1b4q s ASP 77 Cb 0.20 -2.39 -0.09 0.00 1.01 0.00 0.00 42.92 41.65 1b4q s ASP 77 CO 0.45 -0.63 1.04 -0.55 0.21 0.00 0.00 175.17 175.70 1b4q s SER 78 N 1.68 7.00 -0.01 0.27 0.15 -1.26 -2.13 113.70 119.40 1b4q s SER 78 Ca 0.31 2.07 0.07 0.00 0.70 0.00 0.00 55.95 59.10 1b4q s SER 78 Cb -0.14 -2.60 -0.11 0.00 -1.71 0.00 0.00 66.02 61.47 1b4q s SER 78 CO 0.14 -0.32 0.18 2.30 1.20 0.00 0.00 173.24 176.73 1b4q n ILE 79 N 0.40 0.00 0.00 6.45 -6.64 -1.24 -4.92 119.36 113.41 1b4q n ILE 79 Ca 0.03 -0.19 0.00 0.00 -1.77 0.00 0.00 62.75 60.82 1b4q n ILE 79 Cb 0.48 0.42 0.00 0.00 -1.44 0.00 0.00 39.64 39.11 1b4q n ILE 79 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1b4q n GLY 80 N 1.97 0.65 0.00 3.28 0.00 -1.26 -4.66 105.19 105.17 1b4q n GLY 80 Ca -0.01 -2.16 0.00 0.00 0.00 0.00 0.00 46.02 43.85 1b4q n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b4q n GLY 81 N 0.00 1.53 0.19 -0.02 0.00 -1.26 -2.03 105.19 103.60 1b4q n GLY 81 Ca 0.00 -1.65 -0.07 0.00 0.00 0.00 0.00 46.02 44.30 1b4q n GLY 81 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1b4q h SER 82 N 0.00 -0.37 -0.45 1.61 0.87 -1.81 -1.78 113.55 111.62 1b4q h SER 82 Ca 0.00 0.01 0.13 0.00 -1.23 0.00 0.00 61.79 60.70 1b4q h SER 82 Cb 0.00 0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.04 1b4q h SER 82 CO 0.00 -0.06 0.55 -1.28 -0.53 0.00 0.00 176.83 175.51 1b4q h SER 83 N -0.86 0.00 0.00 6.23 0.87 -1.95 0.25 113.55 118.10 1b4q h SER 83 Ca -0.04 0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.39 1b4q h SER 83 Cb 0.34 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.31 1b4q h SER 83 CO 0.07 0.00 -0.48 0.44 -0.53 0.00 0.00 176.83 176.34 1b4q h ASP 84 N 0.00 0.41 0.39 6.23 5.19 -1.87 -3.00 116.42 123.77 1b4q h ASP 84 Ca 0.21 -0.78 -0.00 0.00 -0.62 0.00 0.00 57.03 55.84 1b4q h ASP 84 Cb 1.31 -0.13 -0.03 0.00 0.18 0.00 0.00 39.33 40.67 1b4q h ASP 84 CO -0.00 1.14 -0.44 0.25 -3.12 0.00 0.00 179.24 177.06 1b4q h LEU 85 N -0.27 -1.22 -0.26 1.55 6.46 0.41 -2.91 115.31 119.07 1b4q h LEU 85 Ca -0.06 0.11 0.06 0.00 -0.12 0.00 0.00 57.88 57.87 1b4q h LEU 85 Cb 1.21 0.42 -0.07 0.00 -0.73 0.00 0.00 40.66 41.49 1b4q h LEU 85 CO 0.09 -0.58 -0.20 -0.37 -0.62 0.00 0.00 178.44 176.76 1b4q h VAL 86 N -0.86 0.46 -1.05 1.05 -1.51 -1.57 0.89 116.25 113.66 1b4q h VAL 86 Ca -0.04 0.00 0.33 0.00 -1.23 0.00 0.00 66.70 65.77 1b4q h VAL 86 Cb 0.78 0.46 -0.14 0.00 -2.13 0.00 0.00 31.29 30.26 1b4q h VAL 86 CO -0.09 0.00 0.62 -1.28 -1.23 0.00 0.00 177.57 175.59 1b4q h SER 87 N -0.19 0.47 0.21 4.19 0.87 -1.37 0.93 113.55 118.66 1b4q h SER 87 Ca 0.14 0.17 -0.29 0.00 -1.23 0.00 0.00 61.79 60.58 1b4q h SER 87 Cb 0.41 0.12 0.03 0.00 -0.44 0.00 0.00 62.40 62.52 1b4q h SER 87 CO -0.37 -0.12 -1.32 -0.07 -0.53 0.00 0.00 176.83 174.43 1b4q h LEU 88 N 0.30 0.70 0.56 2.23 3.38 -0.87 -3.15 115.31 118.46 1b4q h LEU 88 Ca 0.73 -0.93 -0.03 0.00 0.09 0.00 0.00 57.88 57.75 1b4q h LEU 88 Cb 1.79 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 42.32 1b4q h LEU 88 CO -0.54 1.63 -0.29 -0.61 0.09 0.00 0.00 178.44 178.72 1b4q h GLN 89 N -0.03 -0.75 0.00 1.13 -0.00 0.14 0.59 115.11 116.19 1b4q h GLN 89 Ca -0.24 0.05 -0.01 0.00 -0.00 0.00 0.00 58.65 58.45 1b4q h GLN 89 Cb 2.00 0.17 -0.00 0.00 0.00 0.00 0.00 27.48 29.65 1b4q h GLN 89 CO 0.22 -0.50 -0.06 -0.56 0.00 0.00 0.00 178.83 177.93 1b4q h GLN 90 N -0.78 0.00 0.08 1.69 3.07 -1.48 -3.05 115.11 114.63 1b4q h GLN 90 Ca -0.07 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.66 1b4q h GLN 90 Cb 0.61 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.17 1b4q h GLN 90 CO 0.11 0.06 -0.04 0.77 0.09 0.00 0.00 178.83 179.82 1b4q h SER 91 N 0.00 -0.09 0.00 0.06 0.02 -1.33 -3.49 113.55 108.72 1b4q h SER 91 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1b4q h SER 91 Cb 0.15 0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.71 1b4q h SER 91 CO 0.01 0.28 0.00 0.61 -1.14 0.00 0.00 176.83 176.59 1b4q n GLY 92 N 1.49 0.84 0.23 -3.77 0.00 0.20 -4.97 105.19 99.21 1b4q n GLY 92 Ca -0.01 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.11 1b4q n GLY 92 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1b4q h GLU 93 N 0.00 0.00 0.26 1.61 4.57 -1.85 -3.03 114.58 116.14 1b4q h GLU 93 Ca 0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 1b4q h GLU 93 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 1b4q h GLU 93 CO 0.00 0.20 -0.12 1.25 -1.18 0.00 0.00 179.01 179.16 1b4q h LEU 94 N 0.00 -0.29 -1.97 1.64 5.85 -1.88 -0.54 115.31 118.12 1b4q h LEU 94 Ca -0.00 0.01 0.22 0.00 0.84 0.00 0.00 57.88 58.95 1b4q h LEU 94 Cb 0.62 0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.69 1b4q h LEU 94 CO 0.03 -0.20 0.59 0.17 -0.34 0.00 0.00 178.44 178.68 1b4q h LEU 95 N -0.37 0.00 -0.06 2.25 8.10 -1.85 0.51 115.31 123.89 1b4q h LEU 95 Ca -0.04 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 57.95 1b4q h LEU 95 Cb 0.27 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.48 1b4q h LEU 95 CO 0.06 0.00 0.01 0.74 -4.11 0.00 0.00 178.44 175.14 1b4q h THR 96 N 0.00 1.21 -0.65 0.15 2.02 -1.36 0.66 112.91 114.95 1b4q h THR 96 Ca 0.36 -0.65 0.09 0.00 0.77 0.00 0.00 66.41 66.98 1b4q h THR 96 Cb 1.53 1.54 -0.04 0.00 -1.74 0.00 0.00 68.15 69.44 1b4q h THR 96 CO -0.00 0.18 0.43 0.03 0.37 0.00 0.00 175.52 176.52 1b4q h ARG 97 N -0.15 0.52 -0.16 6.66 2.47 0.16 0.24 114.38 124.11 1b4q h ARG 97 Ca 0.02 -0.03 -0.20 0.00 -1.26 0.00 0.00 59.98 58.50 1b4q h ARG 97 Cb 0.28 -0.12 0.00 0.00 -1.65 0.00 0.00 29.97 28.48 1b4q h ARG 97 CO 0.00 0.34 -0.71 -0.07 0.56 0.00 0.00 179.97 180.09 1b4q h LEU 98 N 0.53 0.82 0.29 3.04 4.07 -0.58 -3.28 115.31 120.20 1b4q h LEU 98 Ca 0.29 -0.51 -0.01 0.00 0.08 0.00 0.00 57.88 57.73 1b4q h LEU 98 Cb 0.45 -0.24 0.00 0.00 1.08 0.00 0.00 40.66 41.95 1b4q h LEU 98 CO -0.09 1.29 -0.14 0.50 -1.08 0.00 0.00 178.44 178.92 1b4q h LYS 99 N 0.50 -0.37 -1.00 1.13 3.64 0.34 1.21 116.57 122.02 1b4q h LYS 99 Ca -0.03 0.03 0.25 0.00 -1.27 0.00 0.00 60.65 59.62 1b4q h LYS 99 Cb 1.32 0.08 -0.08 0.00 -0.41 0.00 0.00 32.23 33.15 1b4q h LYS 99 CO 0.14 -0.11 0.66 -0.56 -2.27 0.00 0.00 179.45 177.32 1b4q h GLN 100 N -0.61 0.33 0.00 1.90 3.07 -1.00 0.14 115.11 118.93 1b4q h GLN 100 Ca -0.04 -0.02 0.00 0.00 0.09 0.00 0.00 58.65 58.68 1b4q h GLN 100 Cb 0.44 -0.07 0.00 0.00 0.08 0.00 0.00 27.48 27.93 1b4q h GLN 100 CO 0.06 0.22 -1.50 0.44 0.09 0.00 0.00 178.83 178.14 1b4q n ILE 101 N -4.52 0.01 -2.21 1.86 -5.35 -1.15 -4.99 119.36 103.02 1b4q n ILE 101 Ca 0.23 -0.27 0.00 0.00 -0.27 0.00 0.00 62.75 62.44 1b4q n ILE 101 Cb 0.85 0.45 0.00 0.00 -1.74 0.00 0.00 39.64 39.20 1b4q n ILE 101 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1b4q n GLY 102 N 1.37 0.73 0.01 3.28 0.00 0.35 -4.71 105.19 106.23 1b4q n GLY 102 Ca -0.00 -0.57 0.13 0.00 0.00 0.00 0.00 46.02 45.57 1b4q n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b4q n ALA 103 N -1.78 3.02 -2.75 4.61 0.00 0.25 -4.87 120.51 118.98 1b4q n ALA 103 Ca 0.00 -0.24 -0.18 0.00 0.00 0.00 0.00 53.44 53.01 1b4q n ALA 103 Cb 0.48 -1.26 0.08 0.00 0.00 0.00 0.00 19.45 18.75 1b4q n ALA 103 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1b4q n LEU 104 N -1.56 0.00 0.00 0.00 -0.00 -1.26 -3.02 117.00 111.16 1b4q n LEU 104 Ca 0.06 -1.78 0.15 0.00 -0.00 0.00 0.00 56.01 54.44 1b4q n LEU 104 Cb 0.35 -0.43 0.90 0.00 -0.00 0.00 0.00 43.42 44.24 1b4q n LEU 104 CO 0.32 -0.79 1.07 0.00 -0.00 0.00 0.00 177.39 177.99