#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b4q n GLN 2 N 0.00 0.00 0.07 0.00 6.02 -1.26 0.17 117.38 122.39 1b4q n GLN 2 Ca 0.00 0.00 0.04 0.00 -0.01 0.00 0.00 57.00 57.03 1b4q n GLN 2 Cb 0.00 0.00 0.21 0.00 1.02 0.00 0.00 30.24 31.47 1b4q n GLN 2 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 1b4q n GLU 3 N 0.00 0.05 0.00 -1.09 0.28 -1.26 -2.42 120.64 116.21 1b4q n GLU 3 Ca 0.00 0.49 0.00 0.00 -0.16 0.00 0.00 57.16 57.49 1b4q n GLU 3 Cb 0.00 -1.79 0.00 0.00 1.43 0.00 0.00 31.44 31.08 1b4q n GLU 3 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 1b4q n PHE 4 N -1.74 0.00 0.00 -1.84 3.01 0.46 -2.05 117.46 115.31 1b4q n PHE 4 Ca -0.01 0.00 -0.18 0.00 1.01 0.00 0.00 57.45 58.27 1b4q n PHE 4 Cb 0.13 -0.44 -0.09 0.00 -0.01 0.00 0.00 39.48 39.07 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 1.30 -0.81 -4.37 -1.51 -1.78 -3.16 116.25 105.92 1b4q h VAL 5 Ca 0.00 -2.07 0.13 0.00 -1.23 0.00 0.00 66.70 63.53 1b4q h VAL 5 Cb 0.00 2.22 -0.06 0.00 -2.13 0.00 0.00 31.29 31.33 1b4q h VAL 5 CO 0.00 0.64 0.53 0.78 -1.23 0.00 0.00 177.57 178.29 1b4q h ASN 6 N 0.37 0.56 0.97 4.19 -0.26 -1.63 0.71 115.58 120.50 1b4q h ASN 6 Ca -0.08 0.03 0.00 0.00 -0.56 0.00 0.00 56.30 55.68 1b4q h ASN 6 Cb 1.48 -0.09 0.00 0.00 -1.06 0.00 0.00 38.32 38.65 1b4q h ASN 6 CO 0.17 0.30 0.00 -1.20 -1.06 0.00 0.00 177.43 175.64 1b4q n SER 7 N -4.52 0.45 -0.13 5.81 7.64 -0.87 -3.74 113.62 118.26 1b4q n SER 7 Ca 0.15 0.57 -0.27 0.00 1.01 0.00 0.00 58.87 60.33 1b4q n SER 7 Cb 0.45 -0.68 -0.11 0.00 -1.01 0.00 0.00 64.21 62.86 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 -1.95 0.58 -2.62 1.43 5.02 0.22 -4.89 118.16 115.96 1b4q n LYS 8 Ca 0.04 0.36 -0.42 0.00 -2.02 0.00 0.00 58.31 56.27 1b4q n LYS 8 Cb 0.30 -1.57 -0.03 0.00 -0.02 0.00 0.00 35.03 33.71 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 -2.46 4.62 0.06 -0.18 -4.36 0.24 -4.94 121.20 114.18 1b4q s ILE 9 Ca -0.36 1.90 -0.11 0.00 -0.26 0.00 0.00 60.65 61.82 1b4q s ILE 9 Cb 0.12 -4.22 0.01 0.00 1.25 0.00 0.00 42.46 39.62 1b4q s ILE 9 CO 0.52 0.05 0.23 0.00 0.24 0.00 0.00 174.94 175.99 1b4q s GLN 10 N 1.74 0.80 0.17 0.37 -2.07 -1.26 -4.81 119.66 114.60 1b4q s GLN 10 Ca 0.52 -0.72 -0.34 0.00 -1.82 0.00 0.00 55.36 53.00 1b4q s GLN 10 Cb -0.21 0.34 -0.14 0.00 -1.09 0.00 0.00 33.01 31.91 1b4q s GLN 10 CO 0.22 -0.25 1.58 -2.30 -1.32 0.00 0.00 175.29 173.21 1b4q n PRO 11 N 0.33 2.19 -1.44 9.60 -0.02 -1.26 -1.99 135.00 142.41 1b4q n PRO 11 Ca -0.17 0.79 -0.00 0.00 -2.02 0.00 0.00 63.50 62.10 1b4q n PRO 11 Cb 0.61 -2.56 -0.00 0.00 -0.02 0.00 0.00 33.50 31.53 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 3.36 0.38 2.96 -1.23 0.00 -1.26 -4.98 105.19 104.41 1b4q n GLY 12 Ca 0.16 -1.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.05 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 -2.88 0.11 -0.13 1.61 2.20 -0.84 -4.71 119.74 115.10 1b4q s LYS 13 Ca 0.00 0.26 -0.06 0.00 -0.36 0.00 0.00 55.97 55.81 1b4q s LYS 13 Cb 0.00 -0.05 -0.04 0.00 -1.51 0.00 0.00 37.83 36.23 1b4q s LYS 13 CO 0.00 -0.09 0.08 0.08 -0.36 0.00 0.00 175.35 175.07 1b4q s VAL 14 N 0.58 5.00 -0.03 4.02 1.01 -0.85 -1.52 120.40 128.62 1b4q s VAL 14 Ca -0.04 0.02 -0.05 0.00 0.00 0.00 0.00 61.98 61.91 1b4q s VAL 14 Cb -0.06 -3.18 0.01 0.00 0.00 0.00 0.00 36.38 33.15 1b4q s VAL 14 CO -0.03 0.57 0.12 0.54 0.00 0.00 0.00 175.10 176.30 1b4q s VAL 15 N -0.62 0.03 -0.14 2.92 0.11 -1.24 -3.11 120.40 118.36 1b4q s VAL 15 Ca 0.12 -0.27 0.01 0.00 -2.93 0.00 0.00 61.98 58.90 1b4q s VAL 15 Cb -0.12 -0.26 0.02 0.00 -1.53 0.00 0.00 36.38 34.49 1b4q s VAL 15 CO 0.02 -0.15 -0.14 -0.69 -3.33 0.00 0.00 175.10 170.82 1b4q s VAL 16 N -0.47 1.50 -0.20 2.04 1.01 -0.94 -2.04 120.40 121.31 1b4q s VAL 16 Ca -0.05 -0.60 -0.20 0.00 0.00 0.00 0.00 61.98 61.13 1b4q s VAL 16 Cb -0.04 -1.41 -0.03 0.00 0.00 0.00 0.00 36.38 34.91 1b4q s VAL 16 CO 0.00 0.45 0.60 -0.36 0.00 0.00 0.00 175.10 175.79 1b4q s PHE 17 N 1.41 3.36 0.11 5.22 0.40 -0.60 0.16 117.98 128.04 1b4q s PHE 17 Ca 0.03 0.87 0.01 0.00 -0.60 0.00 0.00 56.93 57.24 1b4q s PHE 17 Cb -0.13 -2.77 -0.01 0.00 0.51 0.00 0.00 43.02 40.63 1b4q s PHE 17 CO -0.09 -0.17 0.05 0.44 0.70 0.00 0.00 175.22 176.16 1b4q n ILE 18 N 4.70 0.00 -3.44 0.64 -5.35 -0.43 -1.20 119.36 114.28 1b4q n ILE 18 Ca -0.02 -0.67 -0.23 0.00 -0.27 0.00 0.00 62.75 61.56 1b4q n ILE 18 Cb 0.50 0.27 -0.11 0.00 -1.74 0.00 0.00 39.64 38.56 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 -2.42 0.37 -0.32 6.28 1.02 -1.26 -2.80 119.74 120.62 1b4q s LYS 19 Ca 0.08 -0.58 -0.16 0.00 0.02 0.00 0.00 55.97 55.32 1b4q s LYS 19 Cb 0.00 -0.92 -0.17 0.00 -0.52 0.00 0.00 37.83 36.22 1b4q s LYS 19 CO 0.05 -1.09 1.39 -2.30 -0.92 0.00 0.00 175.35 172.48 1b4q n PRO 20 N 4.90 0.03 0.00 -1.68 -0.02 -1.26 -2.00 135.00 134.97 1b4q n PRO 20 Ca 0.01 -0.77 0.00 0.00 -2.02 0.00 0.00 63.50 60.72 1b4q n PRO 20 Cb 0.43 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 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 6.33 0.00 -3.56 3.45 -1.04 -1.26 -5.11 114.28 113.10 1b4q n THR 21 Ca 0.25 0.00 -0.37 0.00 -2.04 0.00 0.00 64.05 61.89 1b4q n THR 21 Cb 0.42 0.00 -0.08 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 n PRO 23 N 4.04 0.06 -0.04 0.00 -0.02 -1.26 -2.53 135.00 135.26 1b4q n PRO 23 Ca -0.12 0.55 -0.15 0.00 -2.02 0.00 0.00 63.50 61.76 1b4q n PRO 23 Cb 0.52 -1.70 -0.08 0.00 -0.02 0.00 0.00 33.50 32.22 1b4q n PRO 23 CO 0.00 0.00 0.00 1.88 1.98 0.00 0.00 175.50 179.36 1b4q h TYR 24 N 0.00 0.55 -0.50 6.00 -1.99 -1.93 -2.49 116.97 116.61 1b4q h TYR 24 Ca 0.00 -0.22 -0.05 0.00 2.00 0.00 0.00 58.73 60.46 1b4q h TYR 24 Cb 0.01 -0.09 -0.02 0.00 2.00 0.00 0.00 36.73 38.62 1b4q h TYR 24 CO 0.00 0.94 0.10 1.03 -0.00 0.00 0.00 178.16 180.23 1b4q h SER 25 N 0.00 0.72 -0.44 3.88 0.87 -1.69 0.80 113.55 117.69 1b4q h SER 25 Ca -0.01 -0.13 0.04 0.00 -1.23 0.00 0.00 61.79 60.46 1b4q h SER 25 Cb 0.94 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.69 1b4q h SER 25 CO 0.07 0.73 0.29 0.03 -0.53 0.00 0.00 176.83 177.42 1b4q h ARG 26 N 0.74 0.40 0.90 2.24 2.47 -1.59 -1.22 114.38 118.33 1b4q h ARG 26 Ca 0.16 -0.02 -0.04 0.00 -1.26 0.00 0.00 59.98 58.81 1b4q h ARG 26 Cb 0.31 -0.09 0.00 0.00 -1.65 0.00 0.00 29.97 28.54 1b4q h ARG 26 CO 0.00 0.27 -0.48 -0.09 0.56 0.00 0.00 179.97 180.23 1b4q h ARG 27 N 0.42 -1.22 -0.34 0.04 2.43 -0.38 -0.82 114.38 114.50 1b4q h ARG 27 Ca 0.18 0.08 0.09 0.00 -0.81 0.00 0.00 59.98 59.52 1b4q h ARG 27 Cb 0.21 0.28 -0.02 0.00 -0.42 0.00 0.00 29.97 30.02 1b4q h ARG 27 CO -0.04 -0.81 0.24 0.00 -1.51 0.00 0.00 179.97 177.85 1b4q h ALA 28 N -1.21 2.25 -0.13 2.80 0.00 -1.08 0.20 119.26 122.08 1b4q h ALA 28 Ca -0.12 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 1b4q h ALA 28 Cb 0.99 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1b4q h ALA 28 CO 0.17 -0.34 -0.38 1.96 0.00 0.00 0.00 179.25 180.66 1b4q h GLN 29 N 0.06 0.29 -0.25 0.00 1.08 -0.67 -1.97 115.11 113.65 1b4q h GLN 29 Ca 0.16 -0.13 -0.18 0.00 -1.45 0.00 0.00 58.65 57.05 1b4q h GLN 29 Cb 0.57 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.99 1b4q h GLN 29 CO -0.01 0.63 -0.55 0.93 -0.95 0.00 0.00 178.83 178.88 1b4q h GLU 30 N 0.24 0.82 0.11 1.46 4.39 0.81 -2.66 114.58 119.76 1b4q h GLU 30 Ca 0.03 -0.54 -0.01 0.00 0.34 0.00 0.00 59.36 59.18 1b4q h GLU 30 Cb 0.79 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.52 1b4q h GLU 30 CO 0.06 1.17 -0.05 0.97 -1.16 0.00 0.00 179.01 180.00 1b4q h ILE 31 N 0.58 0.09 -0.07 3.13 6.09 -1.33 -3.28 117.51 122.72 1b4q h ILE 31 Ca 0.00 -0.95 0.02 0.00 -1.37 0.00 0.00 64.86 62.57 1b4q h ILE 31 Cb 1.16 0.16 -0.00 0.00 0.47 0.00 0.00 36.82 38.61 1b4q h ILE 31 CO 0.12 0.03 0.16 -0.07 -3.07 0.00 0.00 178.15 175.32 1b4q h LEU 32 N -1.03 0.00 -1.09 2.19 3.38 -1.52 0.90 115.31 118.14 1b4q h LEU 32 Ca -0.02 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 1b4q h LEU 32 Cb 0.16 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1b4q h LEU 32 CO 0.03 0.00 -0.23 0.28 0.09 0.00 0.00 178.44 178.61 1b4q h SER 33 N 0.00 0.36 -0.52 -0.43 0.02 -1.54 -2.47 113.55 108.97 1b4q h SER 33 Ca 0.04 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1b4q h SER 33 Cb 0.35 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.79 1b4q h SER 33 CO -0.00 0.60 0.00 0.00 -1.14 0.00 0.00 176.83 176.29 1b4q n GLN 34 N -4.15 2.26 -3.27 3.45 6.02 0.29 -4.90 117.38 117.07 1b4q n GLN 34 Ca -0.00 -1.95 -0.38 0.00 -0.01 0.00 0.00 57.00 54.65 1b4q n GLN 34 Cb 0.37 -1.43 -0.06 0.00 1.02 0.00 0.00 30.24 30.14 1b4q n GLN 34 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1b4q s LEU 35 N -1.06 4.40 -0.43 1.08 1.43 -0.93 -4.93 118.68 118.24 1b4q s LEU 35 Ca 0.37 1.06 -0.13 0.00 -1.03 0.00 0.00 54.13 54.40 1b4q s LEU 35 Cb 0.19 -2.83 -0.13 0.00 0.03 0.00 0.00 46.19 43.46 1b4q s LEU 35 CO 0.26 0.12 1.63 -0.81 0.23 0.00 0.00 176.35 177.77 1b4q n PRO 36 N 2.78 0.91 -3.04 1.29 -0.04 -1.26 -4.88 135.00 130.76 1b4q n PRO 36 Ca -0.08 -1.16 -0.37 0.00 -0.04 0.00 0.00 63.50 61.85 1b4q n PRO 36 Cb 0.51 -2.43 -0.06 0.00 -0.04 0.00 0.00 33.50 31.49 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 4.95 4.50 0.72 0.52 -1.09 -1.26 -2.34 121.20 127.20 1b4q s ILE 37 Ca 0.37 1.40 -0.16 0.00 -2.23 0.00 0.00 60.65 60.04 1b4q s ILE 37 Cb 0.09 -3.91 0.00 0.00 -1.58 0.00 0.00 42.46 37.07 1b4q s ILE 37 CO 0.09 0.23 0.92 0.29 -1.23 0.00 0.00 174.94 175.23 1b4q n LYS 38 N 0.79 0.47 -1.70 2.79 5.02 -1.19 -4.83 118.16 119.50 1b4q n LYS 38 Ca -0.02 0.21 -0.43 0.00 -2.02 0.00 0.00 58.31 56.05 1b4q n LYS 38 Cb 0.51 -2.18 -0.01 0.00 -0.02 0.00 0.00 35.03 33.33 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 -1.76 2.20 -1.21 1.97 1.13 -1.26 -1.79 117.38 116.66 1b4q n GLN 39 Ca 0.13 0.78 -0.07 0.00 -1.94 0.00 0.00 57.00 55.89 1b4q n GLN 39 Cb 0.49 -2.41 -0.03 0.00 0.11 0.00 0.00 30.24 28.40 1b4q n GLN 39 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1b4q n GLY 40 N 1.26 0.77 0.02 1.08 0.00 -1.26 -4.80 105.19 102.27 1b4q n GLY 40 Ca 0.07 -0.07 0.07 0.00 0.00 0.00 0.00 46.02 46.08 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 -0.84 0.00 -4.63 0.99 7.94 -0.74 -4.90 117.00 114.83 1b4q n LEU 41 Ca -0.07 0.00 -0.35 0.00 -1.11 0.00 0.00 56.01 54.47 1b4q n LEU 41 Cb 0.49 0.08 -0.10 0.00 0.53 0.00 0.00 43.42 44.42 1b4q n LEU 41 CO 0.11 0.08 -0.23 -0.22 -1.11 0.00 0.00 177.39 176.02 1b4q s LEU 42 N -4.55 3.88 0.13 -1.96 2.96 -1.26 -2.01 118.68 115.88 1b4q s LEU 42 Ca -0.08 0.07 -0.04 0.00 -0.22 0.00 0.00 54.13 53.87 1b4q s LEU 42 Cb 0.11 -2.00 -0.03 0.00 0.50 0.00 0.00 46.19 44.77 1b4q s LEU 42 CO 0.81 0.13 0.13 -0.70 -1.32 0.00 0.00 176.35 175.40 1b4q s GLU 43 N 0.65 0.97 -0.19 1.98 2.56 -1.18 -5.05 118.70 118.44 1b4q s GLU 43 Ca 0.05 -1.32 0.00 0.00 0.00 0.00 0.00 54.97 53.71 1b4q s GLU 43 Cb -0.13 0.29 0.04 0.00 2.00 0.00 0.00 34.13 36.33 1b4q s GLU 43 CO 0.01 -0.30 -0.08 -0.06 -0.56 0.00 0.00 175.26 174.27 1b4q s PHE 44 N -4.00 2.15 -0.54 5.30 0.08 -1.26 -2.20 117.98 117.50 1b4q s PHE 44 Ca 0.20 -1.42 -0.18 0.00 0.12 0.00 0.00 56.93 55.64 1b4q s PHE 44 Cb 0.06 -1.51 0.09 0.00 -0.57 0.00 0.00 43.02 41.08 1b4q s PHE 44 CO -0.00 -0.70 0.62 0.08 -0.10 0.00 0.00 175.22 175.12 1b4q s VAL 45 N 1.48 4.92 -0.66 -0.44 1.01 0.43 -4.91 120.40 122.23 1b4q s VAL 45 Ca -0.01 -0.86 -0.27 0.00 0.00 0.00 0.00 61.98 60.83 1b4q s VAL 45 Cb -0.16 -4.37 0.03 0.00 0.00 0.00 0.00 36.38 31.88 1b4q s VAL 45 CO -0.08 -0.93 1.23 -1.81 0.00 0.00 0.00 175.10 173.51 1b4q s ASP 46 N 3.17 6.30 0.00 3.32 1.11 -1.26 -1.31 116.67 127.99 1b4q s ASP 46 Ca 0.11 -0.19 0.03 0.00 0.18 0.00 0.00 52.55 52.67 1b4q s ASP 46 Cb -0.23 -2.55 0.16 0.00 1.07 0.00 0.00 42.92 41.37 1b4q s ASP 46 CO 0.08 -1.66 0.70 2.30 1.18 0.00 0.00 175.17 177.78 1b4q n ILE 47 N 6.51 0.22 0.67 0.77 -5.35 -1.12 -1.02 119.36 120.04 1b4q n ILE 47 Ca 0.05 0.05 0.11 0.00 -0.27 0.00 0.00 62.75 62.70 1b4q n ILE 47 Cb 0.49 -1.01 0.07 0.00 -1.74 0.00 0.00 39.64 37.45 1b4q n ILE 47 CO 0.00 0.00 0.00 1.07 -1.76 0.00 0.00 176.55 175.86 1b4q n THR 48 N -1.06 0.15 1.74 7.28 5.66 -1.26 -3.45 114.28 123.34 1b4q n THR 48 Ca 0.02 -0.19 0.04 0.00 -3.05 0.00 0.00 64.05 60.87 1b4q n THR 48 Cb 0.01 0.23 0.24 0.00 -1.55 0.00 0.00 70.33 69.26 1b4q n THR 48 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1b4q n ALA 49 N -1.75 2.42 -1.16 1.79 0.00 -0.19 -3.22 120.51 118.40 1b4q n ALA 49 Ca 0.03 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1b4q n ALA 49 Cb 0.41 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.73 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 -0.64 0.00 -4.57 0.00 5.66 -1.25 -5.12 114.28 108.35 1b4q n THR 50 Ca 0.06 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.06 1b4q n THR 50 Cb 0.03 1.58 0.00 0.00 -1.55 0.00 0.00 70.33 70.39 1b4q n THR 50 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 1b4q n ASN 51 N 0.00 -1.57 -1.01 1.09 5.15 -1.20 -4.82 115.26 112.90 1b4q n ASN 51 Ca 0.00 0.00 -0.11 0.00 -0.60 0.00 0.00 54.58 53.87 1b4q n ASN 51 Cb 0.24 0.00 -0.05 0.00 -0.53 0.00 0.00 39.78 39.44 1b4q n ASN 51 CO 0.00 0.00 0.00 1.41 1.40 0.00 0.00 177.26 180.07 1b4q n HIS 52 N 0.00 -0.16 -0.33 1.20 8.25 -1.26 -4.77 115.22 118.15 1b4q n HIS 52 Ca 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.36 1b4q n HIS 52 Cb 0.00 -2.53 -0.08 0.00 1.12 0.00 0.00 29.99 28.50 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 0.01 -0.88 1.59 1.35 -1.88 0.41 112.91 113.51 1b4q h THR 53 Ca -0.23 0.00 0.16 0.00 -0.55 0.00 0.00 66.41 65.79 1b4q h THR 53 Cb 0.97 0.01 -0.07 0.00 -1.73 0.00 0.00 68.15 67.32 1b4q h THR 53 CO 0.33 0.00 0.57 0.78 -0.25 0.00 0.00 175.52 176.96 1b4q h ASN 54 N -0.11 0.58 -0.31 5.36 2.35 -1.94 -1.36 115.58 120.15 1b4q h ASN 54 Ca 0.16 0.04 -0.04 0.00 -0.55 0.00 0.00 56.30 55.92 1b4q h ASN 54 Cb 0.49 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.77 1b4q h ASN 54 CO -0.84 0.28 0.05 -0.33 -1.65 0.00 0.00 177.43 174.93 1b4q h GLU 55 N 0.60 0.52 0.45 0.81 4.39 -0.57 0.20 114.58 120.98 1b4q h GLU 55 Ca 0.45 -0.14 -0.02 0.00 0.34 0.00 0.00 59.36 59.99 1b4q h GLU 55 Cb 0.84 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.44 1b4q h GLU 55 CO -0.20 0.62 -0.22 0.82 -1.16 0.00 0.00 179.01 178.87 1b4q h ILE 56 N 0.35 0.48 -0.75 3.13 5.03 -0.43 0.90 117.51 126.21 1b4q h ILE 56 Ca 0.09 -0.42 0.08 0.00 -0.12 0.00 0.00 64.86 64.49 1b4q h ILE 56 Cb 0.35 0.65 -0.07 0.00 -3.03 0.00 0.00 36.82 34.72 1b4q h ILE 56 CO 0.01 0.07 0.42 1.56 -0.68 0.00 0.00 178.15 179.52 1b4q h GLN 57 N -0.88 0.72 -0.69 2.37 4.20 -1.36 1.40 115.11 120.87 1b4q h GLN 57 Ca -0.06 -0.04 0.11 0.00 0.06 0.00 0.00 58.65 58.71 1b4q h GLN 57 Cb 0.57 -0.16 -0.04 0.00 0.30 0.00 0.00 27.48 28.15 1b4q h GLN 57 CO 0.10 0.47 0.46 -0.44 -0.67 0.00 0.00 178.83 178.75 1b4q h ASP 58 N 0.74 0.46 0.03 1.46 5.19 -0.44 0.35 116.42 124.21 1b4q h ASP 58 Ca 0.35 0.01 -0.11 0.00 -0.62 0.00 0.00 57.03 56.66 1b4q h ASP 58 Cb 0.28 -0.08 0.01 0.00 0.18 0.00 0.00 39.33 39.72 1b4q h ASP 58 CO -0.22 0.27 -0.46 0.22 -3.12 0.00 0.00 179.24 175.93 1b4q h TYR 59 N 0.51 0.41 -0.87 4.55 3.20 0.32 -2.82 116.97 122.27 1b4q h TYR 59 Ca 0.32 -0.24 0.16 0.00 3.14 0.00 0.00 58.73 62.11 1b4q h TYR 59 Cb 0.57 -0.04 -0.07 0.00 1.54 0.00 0.00 36.73 38.73 1b4q h TYR 59 CO -0.00 1.09 0.57 -0.07 -1.64 0.00 0.00 178.16 178.10 1b4q h LEU 60 N -0.39 0.56 0.68 2.82 3.38 0.29 0.92 115.31 123.57 1b4q h LEU 60 Ca -0.07 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 1b4q h LEU 60 Cb 1.24 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 41.93 1b4q h LEU 60 CO 0.09 0.27 -0.33 -0.61 0.09 0.00 0.00 178.44 177.95 1b4q h GLN 61 N 0.58 -0.88 -0.29 1.13 5.75 -0.32 0.12 115.11 121.20 1b4q h GLN 61 Ca 0.44 0.06 -0.08 0.00 -0.15 0.00 0.00 58.65 58.93 1b4q h GLN 61 Cb 0.84 0.20 -0.02 0.00 1.07 0.00 0.00 27.48 29.57 1b4q h GLN 61 CO -0.19 -0.57 -0.15 0.37 -2.65 0.00 0.00 178.83 175.64 1b4q h GLN 62 N -0.97 0.50 0.21 1.69 -0.00 -0.92 0.56 115.11 116.18 1b4q h GLN 62 Ca -0.09 -0.15 -0.01 0.00 -0.00 0.00 0.00 58.65 58.40 1b4q h GLN 62 Cb 0.72 -0.05 0.00 0.00 0.00 0.00 0.00 27.48 28.15 1b4q h GLN 62 CO 0.15 0.64 -0.10 1.25 0.00 0.00 0.00 178.83 180.77 1b4q h LEU 63 N 0.46 -0.24 0.00 -2.39 5.85 0.10 -3.41 115.31 115.68 1b4q h LEU 63 Ca 0.08 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.62 1b4q h LEU 63 Cb 0.53 0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.62 1b4q h LEU 63 CO 0.03 0.05 -0.41 0.35 -0.34 0.00 0.00 178.44 178.13 1b4q n THR 64 N -5.10 1.11 0.00 1.05 -2.24 0.40 -5.07 114.28 104.44 1b4q n THR 64 Ca -0.09 0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.96 1b4q n THR 64 Cb 0.22 -1.84 0.00 0.00 -2.10 0.00 0.00 70.33 66.61 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 2.47 2.72 3.70 3.38 0.00 0.20 -4.99 105.19 112.66 1b4q n GLY 65 Ca -0.06 -0.33 -0.35 0.00 0.00 0.00 0.00 46.02 45.28 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 3.58 -0.57 4.61 0.00 -1.26 -4.70 121.76 123.41 1b4q s ALA 66 Ca 0.00 -0.71 -0.00 0.00 0.00 0.00 0.00 51.96 51.25 1b4q s ALA 66 Cb 0.00 -2.05 0.48 0.00 0.00 0.00 0.00 23.12 21.55 1b4q s ALA 66 CO 0.00 0.20 1.99 2.89 0.00 0.00 0.00 175.76 180.83 1b4q n ARG 67 N 3.43 2.47 -2.13 0.00 -4.01 -1.26 -4.35 116.66 110.82 1b4q n ARG 67 Ca -0.16 -3.01 -0.27 0.00 -1.04 0.00 0.00 57.85 53.37 1b4q n ARG 67 Cb 0.52 -2.18 0.07 0.00 -3.04 0.00 0.00 32.46 27.83 1b4q n ARG 67 CO 0.00 0.00 0.00 0.95 -3.04 0.00 0.00 177.63 175.54 1b4q s THR 68 N -4.12 2.47 -0.10 8.89 -4.23 -1.26 -5.03 115.64 112.26 1b4q s THR 68 Ca 0.59 -0.11 0.04 0.00 -1.18 0.00 0.00 61.69 61.02 1b4q s THR 68 Cb 0.47 -3.09 0.00 0.00 1.34 0.00 0.00 72.50 71.22 1b4q s THR 68 CO 0.02 -0.11 -0.23 -0.69 -0.54 0.00 0.00 174.62 173.08 1b4q s VAL 69 N -3.31 1.98 0.00 2.29 1.01 -1.26 -4.04 120.40 117.07 1b4q s VAL 69 Ca 0.60 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 61.61 1b4q s VAL 69 Cb -0.11 -1.72 0.00 0.00 0.00 0.00 0.00 36.38 34.55 1b4q s VAL 69 CO 0.46 0.54 0.00 -0.81 0.00 0.00 0.00 175.10 175.29 1b4q n PRO 70 N 3.63 0.03 -3.35 2.72 -0.04 -1.26 -4.36 135.00 132.38 1b4q n PRO 70 Ca -0.19 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.11 1b4q n PRO 70 Cb 0.53 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.91 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 -2.06 0.67 0.43 0.54 1.81 -0.34 -4.40 118.95 115.60 1b4q s ARG 71 Ca 0.00 -0.88 -0.11 0.00 -1.72 0.00 0.00 55.73 53.02 1b4q s ARG 71 Cb 0.00 -0.69 -0.06 0.00 -0.45 0.00 0.00 34.95 33.75 1b4q s ARG 71 CO 0.00 -1.21 0.82 0.08 -0.68 0.00 0.00 175.30 174.31 1b4q s VAL 72 N 1.39 4.75 -0.36 3.52 1.01 -1.08 -1.55 120.40 128.07 1b4q s VAL 72 Ca 0.17 0.70 0.02 0.00 0.00 0.00 0.00 61.98 62.88 1b4q s VAL 72 Cb -0.14 -3.74 0.15 0.00 0.00 0.00 0.00 36.38 32.64 1b4q s VAL 72 CO -0.03 -0.59 0.32 -0.36 0.00 0.00 0.00 175.10 174.44 1b4q s PHE 73 N -2.46 0.01 -0.31 5.22 0.40 -0.86 -3.55 117.98 116.43 1b4q s PHE 73 Ca 0.52 -1.04 -0.29 0.00 -0.60 0.00 0.00 56.93 55.52 1b4q s PHE 73 Cb -0.10 -0.57 -0.01 0.00 0.51 0.00 0.00 43.02 42.85 1b4q s PHE 73 CO 0.33 -0.92 1.53 0.42 0.70 0.00 0.00 175.22 177.28 1b4q s ILE 74 N 1.37 3.80 0.00 0.64 1.09 -0.92 -3.61 121.20 123.56 1b4q s ILE 74 Ca 0.17 0.86 0.00 0.00 -1.10 0.00 0.00 60.65 60.58 1b4q s ILE 74 Cb -0.18 -3.92 0.00 0.00 -1.06 0.00 0.00 42.46 37.31 1b4q s ILE 74 CO -0.04 -0.48 0.00 0.61 -0.10 0.00 0.00 174.94 174.93 1b4q n GLY 75 N 4.86 0.77 0.15 6.18 0.00 -0.57 -1.83 105.19 114.74 1b4q n GLY 75 Ca 0.18 -0.73 0.15 0.00 0.00 0.00 0.00 46.02 45.62 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 0.00 1.15 -3.04 1.61 5.02 -1.26 -4.40 118.16 117.23 1b4q n LYS 76 Ca 0.00 -0.31 -0.42 0.00 -2.02 0.00 0.00 58.31 55.56 1b4q n LYS 76 Cb 0.00 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.46 1b4q n LYS 76 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1b4q s ASP 77 N -2.07 6.52 0.52 4.39 1.11 -0.76 -5.05 116.67 121.33 1b4q s ASP 77 Ca 0.42 0.37 -0.19 0.00 0.18 0.00 0.00 52.55 53.33 1b4q s ASP 77 Cb 0.21 -2.36 -0.07 0.00 1.07 0.00 0.00 42.92 41.77 1b4q s ASP 77 CO 0.37 -0.60 1.06 -0.55 1.18 0.00 0.00 175.17 176.63 1b4q s SER 78 N 1.73 6.11 -0.02 0.27 0.15 -1.26 -2.18 113.70 118.50 1b4q s SER 78 Ca 0.28 1.96 0.03 0.00 0.70 0.00 0.00 55.95 58.91 1b4q s SER 78 Cb -0.14 -2.56 -0.04 0.00 -1.71 0.00 0.00 66.02 61.57 1b4q s SER 78 CO 0.14 -0.95 0.03 2.30 1.20 0.00 0.00 173.24 175.96 1b4q n ILE 79 N -1.24 0.13 0.00 6.45 -5.35 -1.23 -4.89 119.36 113.23 1b4q n ILE 79 Ca 0.10 -0.10 0.00 0.00 -0.27 0.00 0.00 62.75 62.47 1b4q n ILE 79 Cb 0.52 -0.49 0.00 0.00 -1.74 0.00 0.00 39.64 37.93 1b4q n ILE 79 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1b4q n GLY 80 N 2.67 0.57 0.00 3.28 0.00 -1.26 -4.76 105.19 105.69 1b4q n GLY 80 Ca -0.03 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.47 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 3.25 0.21 -0.02 0.00 -1.26 -2.64 105.19 104.73 1b4q n GLY 81 Ca 0.00 -1.76 -0.07 0.00 0.00 0.00 0.00 46.02 44.19 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 -0.41 -0.36 1.61 0.87 -1.81 -1.86 113.55 111.60 1b4q h SER 82 Ca 0.00 0.01 0.10 0.00 -1.23 0.00 0.00 61.79 60.68 1b4q h SER 82 Cb 0.00 0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 1b4q h SER 82 CO 0.00 -0.08 0.40 -1.28 -0.53 0.00 0.00 176.83 175.35 1b4q h SER 83 N -0.91 0.00 -0.03 6.23 0.87 -1.95 0.23 113.55 117.99 1b4q h SER 83 Ca -0.05 0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.43 1b4q h SER 83 Cb 0.37 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.33 1b4q h SER 83 CO 0.08 0.00 -0.28 0.44 -0.53 0.00 0.00 176.83 176.54 1b4q h ASP 84 N 0.00 0.30 0.45 6.23 3.32 -1.89 -2.95 116.42 121.88 1b4q h ASP 84 Ca 0.17 -0.70 -0.01 0.00 0.02 0.00 0.00 57.03 56.51 1b4q h ASP 84 Cb 0.98 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 40.41 1b4q h ASP 84 CO -0.00 0.96 -0.50 0.25 -1.72 0.00 0.00 179.24 178.22 1b4q h LEU 85 N -0.34 -1.40 -0.52 1.55 6.46 -0.09 -2.52 115.31 118.45 1b4q h LEU 85 Ca -0.03 0.12 0.10 0.00 -0.12 0.00 0.00 57.88 57.96 1b4q h LEU 85 Cb 0.97 0.47 -0.09 0.00 -0.73 0.00 0.00 40.66 41.28 1b4q h LEU 85 CO 0.06 -0.65 -0.02 -0.37 -0.62 0.00 0.00 178.44 176.84 1b4q h VAL 86 N -0.97 0.57 -0.83 1.05 -1.51 -1.57 0.10 116.25 113.09 1b4q h VAL 86 Ca -0.05 -0.03 0.17 0.00 -1.23 0.00 0.00 66.70 65.56 1b4q h VAL 86 Cb 0.86 0.46 -0.11 0.00 -2.13 0.00 0.00 31.29 30.37 1b4q h VAL 86 CO -0.09 0.02 0.35 -1.28 -1.23 0.00 0.00 177.57 175.34 1b4q h SER 87 N 0.10 0.33 0.25 4.19 0.87 -1.30 -0.45 113.55 117.54 1b4q h SER 87 Ca 0.26 0.13 -0.20 0.00 -1.23 0.00 0.00 61.79 60.75 1b4q h SER 87 Cb 0.41 0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 62.46 1b4q h SER 87 CO -0.46 0.08 -0.80 -0.07 -0.53 0.00 0.00 176.83 175.06 1b4q h LEU 88 N 0.45 0.53 0.86 2.23 3.38 -0.54 -2.95 115.31 119.26 1b4q h LEU 88 Ca 0.48 -0.37 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 1b4q h LEU 88 Cb 0.81 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 41.41 1b4q h LEU 88 CO -0.45 1.13 -0.42 -0.61 0.09 0.00 0.00 178.44 178.18 1b4q h GLN 89 N 0.28 -1.12 0.00 1.13 -0.00 0.79 0.34 115.11 116.53 1b4q h GLN 89 Ca -0.05 0.08 -0.00 0.00 -0.00 0.00 0.00 58.65 58.68 1b4q h GLN 89 Cb 1.39 0.25 -0.00 0.00 0.00 0.00 0.00 27.48 29.13 1b4q h GLN 89 CO 0.14 -0.74 -0.00 -0.56 0.00 0.00 0.00 178.83 177.66 1b4q h GLN 90 N -1.16 0.00 0.00 1.69 -0.00 -1.58 -0.54 115.11 113.52 1b4q h GLN 90 Ca -0.12 0.00 -0.06 0.00 -0.00 0.00 0.00 58.65 58.47 1b4q h GLN 90 Cb 0.89 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.36 1b4q h GLN 90 CO 0.19 0.00 -0.50 0.77 -0.00 0.00 0.00 178.83 179.29 1b4q h SER 91 N 0.00 0.00 0.00 0.06 0.02 -1.24 -3.47 113.55 108.92 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 0.10 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.64 1b4q h SER 91 CO 0.00 0.28 0.00 0.61 -1.14 0.00 0.00 176.83 176.58 1b4q n GLY 92 N 1.20 2.00 0.20 -3.77 0.00 0.06 -4.86 105.19 100.01 1b4q n GLY 92 Ca 0.01 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.08 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 2.72 0.00 0.52 1.61 4.57 -1.77 -2.90 114.58 119.33 1b4q h GLU 93 Ca 0.00 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.15 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 0.33 -0.26 1.25 -1.18 0.00 0.00 179.01 179.15 1b4q h LEU 94 N 0.00 -0.63 -2.00 1.64 5.85 -1.76 -0.95 115.31 117.45 1b4q h LEU 94 Ca -0.00 0.02 0.18 0.00 0.84 0.00 0.00 57.88 58.92 1b4q h LEU 94 Cb 0.68 0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.85 1b4q h LEU 94 CO 0.04 -0.44 0.44 0.17 -0.34 0.00 0.00 178.44 178.32 1b4q h LEU 95 N -0.72 0.00 -0.23 2.25 8.10 -1.83 0.22 115.31 123.10 1b4q h LEU 95 Ca -0.07 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 57.90 1b4q h LEU 95 Cb 0.56 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.77 1b4q h LEU 95 CO 0.11 0.00 0.09 0.74 -4.11 0.00 0.00 178.44 175.27 1b4q h THR 96 N 0.00 1.18 -0.77 0.15 2.02 -1.23 1.01 112.91 115.27 1b4q h THR 96 Ca 0.29 -0.54 0.02 0.00 0.77 0.00 0.00 66.41 66.95 1b4q h THR 96 Cb 1.17 1.10 -0.04 0.00 -1.74 0.00 0.00 68.15 68.65 1b4q h THR 96 CO -0.00 0.18 0.51 0.03 0.37 0.00 0.00 175.52 176.60 1b4q h ARG 97 N 0.22 0.96 -0.11 6.66 2.47 0.77 0.52 114.38 125.87 1b4q h ARG 97 Ca 0.08 -0.06 -0.16 0.00 -1.26 0.00 0.00 59.98 58.58 1b4q h ARG 97 Cb 0.20 -0.22 -0.01 0.00 -1.65 0.00 0.00 29.97 28.29 1b4q h ARG 97 CO -0.01 0.64 -0.62 -0.07 0.56 0.00 0.00 179.97 180.48 1b4q h LEU 98 N 0.99 0.44 0.58 3.04 4.07 -0.62 -3.30 115.31 120.52 1b4q h LEU 98 Ca 0.29 -0.25 -0.03 0.00 0.08 0.00 0.00 57.88 57.97 1b4q h LEU 98 Cb -0.04 -0.13 0.01 0.00 1.08 0.00 0.00 40.66 41.57 1b4q h LEU 98 CO -0.07 0.95 -0.28 0.50 -1.08 0.00 0.00 178.44 178.45 1b4q h LYS 99 N 0.28 -0.76 -1.14 1.13 3.64 0.31 1.43 116.57 121.47 1b4q h LYS 99 Ca -0.01 0.05 0.32 0.00 -1.27 0.00 0.00 60.65 59.74 1b4q h LYS 99 Cb 1.15 0.17 -0.08 0.00 -0.41 0.00 0.00 32.23 33.06 1b4q h LYS 99 CO 0.10 -0.45 0.76 -0.56 -2.27 0.00 0.00 179.45 177.04 1b4q h GLN 100 N -1.03 0.21 0.00 1.90 3.07 -1.21 0.47 115.11 118.52 1b4q h GLN 100 Ca -0.08 -0.01 0.00 0.00 0.09 0.00 0.00 58.65 58.65 1b4q h GLN 100 Cb 0.66 -0.05 0.00 0.00 0.08 0.00 0.00 27.48 28.17 1b4q h GLN 100 CO 0.13 0.14 -1.15 0.44 0.09 0.00 0.00 178.83 178.48 1b4q n ILE 101 N -4.48 0.00 -2.60 1.86 -5.35 -1.17 -4.98 119.36 102.64 1b4q n ILE 101 Ca 0.27 -0.09 -0.04 0.00 -0.27 0.00 0.00 62.75 62.63 1b4q n ILE 101 Cb 1.09 0.84 0.01 0.00 -1.74 0.00 0.00 39.64 39.83 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 1.46 0.66 0.05 3.28 0.00 0.25 -4.58 105.19 106.32 1b4q n GLY 102 Ca 0.03 -0.51 0.13 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.67 2.67 -2.82 4.61 0.00 0.42 -4.84 120.51 117.88 1b4q n ALA 103 Ca -0.01 -0.15 -0.10 0.00 0.00 0.00 0.00 53.44 53.18 1b4q n ALA 103 Cb 0.51 -1.33 0.04 0.00 0.00 0.00 0.00 19.45 18.67 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 -1.94 0.00 0.00 0.00 -0.00 -1.25 -3.16 117.00 110.66 1b4q n LEU 104 Ca 0.05 -1.04 0.14 0.00 -0.00 0.00 0.00 56.01 55.17 1b4q n LEU 104 Cb 0.40 -0.22 0.85 0.00 -0.00 0.00 0.00 43.42 44.45 1b4q n LEU 104 CO 0.32 -0.63 1.02 0.00 -0.00 0.00 0.00 177.39 178.10