#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 0.06 0.00 10.64 -1.26 -4.32 117.38 122.50 1b4q n GLN 2 Ca 0.00 0.11 0.04 0.00 -1.83 0.00 0.00 57.00 55.32 1b4q n GLN 2 Cb 0.00 -0.60 0.21 0.00 -0.86 0.00 0.00 30.24 28.99 1b4q n GLN 2 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 1b4q n GLU 3 N -2.34 0.05 0.00 2.61 1.02 -1.26 -2.32 120.64 118.40 1b4q n GLU 3 Ca 0.00 0.54 0.00 0.00 -0.02 0.00 0.00 57.16 57.68 1b4q n GLU 3 Cb 0.00 -1.68 0.00 0.00 -0.02 0.00 0.00 31.44 29.74 1b4q n GLU 3 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1b4q n PHE 4 N -1.76 0.00 0.01 -0.32 3.01 -1.26 -1.70 117.46 115.44 1b4q n PHE 4 Ca -0.01 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.32 1b4q n PHE 4 Cb 0.03 -0.35 -0.02 0.00 -0.01 0.00 0.00 39.48 39.14 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 1.33 -0.83 -4.37 -1.51 -1.76 -3.10 116.25 106.00 1b4q h VAL 5 Ca 0.00 -2.04 0.10 0.00 -1.23 0.00 0.00 66.70 63.53 1b4q h VAL 5 Cb 0.00 2.02 -0.06 0.00 -2.13 0.00 0.00 31.29 31.13 1b4q h VAL 5 CO 0.00 0.63 0.54 0.78 -1.23 0.00 0.00 177.57 178.29 1b4q h ASN 6 N 0.41 0.70 0.93 4.19 -0.26 -1.59 0.39 115.58 120.36 1b4q h ASN 6 Ca -0.04 0.02 0.00 0.00 -0.56 0.00 0.00 56.30 55.72 1b4q h ASN 6 Cb 1.34 -0.12 0.00 0.00 -1.06 0.00 0.00 38.32 38.48 1b4q h ASN 6 CO 0.14 0.41 0.00 -1.20 -1.06 0.00 0.00 177.43 175.72 1b4q n SER 7 N -4.52 0.45 -0.11 5.81 7.64 -0.69 -3.64 113.62 118.56 1b4q n SER 7 Ca 0.14 0.58 -0.23 0.00 1.01 0.00 0.00 58.87 60.37 1b4q n SER 7 Cb 0.34 -0.68 -0.12 0.00 -1.01 0.00 0.00 64.21 62.74 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 -1.96 0.64 -2.66 1.43 5.02 0.12 -4.92 118.16 115.83 1b4q n LYS 8 Ca 0.04 0.25 -0.41 0.00 -2.02 0.00 0.00 58.31 56.17 1b4q n LYS 8 Cb 0.29 -1.56 -0.05 0.00 -0.02 0.00 0.00 35.03 33.69 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 -2.51 4.07 -0.11 -0.18 -4.36 -0.04 -4.91 121.20 113.17 1b4q s ILE 9 Ca -0.34 1.91 -0.09 0.00 -0.26 0.00 0.00 60.65 61.87 1b4q s ILE 9 Cb 0.10 -4.22 0.03 0.00 1.25 0.00 0.00 42.46 39.63 1b4q s ILE 9 CO 0.59 0.39 0.28 -1.58 0.24 0.00 0.00 174.94 174.86 1b4q s GLN 10 N -0.73 0.31 0.10 0.37 0.74 -1.26 -4.87 119.66 114.33 1b4q s GLN 10 Ca 0.45 0.44 -0.35 0.00 0.05 0.00 0.00 55.36 55.94 1b4q s GLN 10 Cb -0.27 0.10 -0.15 0.00 1.10 0.00 0.00 33.01 33.80 1b4q s GLN 10 CO 0.33 -0.07 1.48 -2.30 -0.55 0.00 0.00 175.29 174.19 1b4q n PRO 11 N 3.21 1.64 -1.36 1.67 -0.02 -1.26 -0.52 135.00 138.35 1b4q n PRO 11 Ca -0.15 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 1b4q n PRO 11 Cb 0.57 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 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 3.06 0.40 2.91 -1.23 0.00 -1.26 -4.96 105.19 104.11 1b4q n GLY 12 Ca 0.18 -0.99 -0.13 0.00 0.00 0.00 0.00 46.02 45.09 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 -2.74 0.05 -0.12 1.61 2.20 0.32 -4.64 119.74 116.42 1b4q s LYS 13 Ca 0.00 0.12 -0.05 0.00 -0.36 0.00 0.00 55.97 55.68 1b4q s LYS 13 Cb 0.00 -0.03 -0.04 0.00 -1.51 0.00 0.00 37.83 36.25 1b4q s LYS 13 CO 0.00 -0.05 0.07 0.08 -0.36 0.00 0.00 175.35 175.09 1b4q s VAL 14 N 0.28 4.88 -0.03 4.02 1.01 -0.38 -0.93 120.40 129.25 1b4q s VAL 14 Ca -0.02 -0.02 -0.06 0.00 0.00 0.00 0.00 61.98 61.87 1b4q s VAL 14 Cb -0.03 -3.12 0.01 0.00 0.00 0.00 0.00 36.38 33.24 1b4q s VAL 14 CO -0.01 0.57 0.15 0.54 0.00 0.00 0.00 175.10 176.35 1b4q s VAL 15 N -0.60 0.04 -0.10 2.92 0.11 -1.23 -2.93 120.40 118.62 1b4q s VAL 15 Ca 0.11 -0.35 0.01 0.00 -2.93 0.00 0.00 61.98 58.82 1b4q s VAL 15 Cb -0.12 -0.33 0.02 0.00 -1.53 0.00 0.00 36.38 34.42 1b4q s VAL 15 CO 0.02 -0.19 -0.09 -0.69 -3.33 0.00 0.00 175.10 170.82 1b4q s VAL 16 N -0.65 1.08 -0.22 2.04 1.01 -0.89 -2.06 120.40 120.71 1b4q s VAL 16 Ca -0.07 -0.37 -0.19 0.00 0.00 0.00 0.00 61.98 61.35 1b4q s VAL 16 Cb -0.04 -1.05 -0.03 0.00 0.00 0.00 0.00 36.38 35.25 1b4q s VAL 16 CO 0.01 0.37 0.57 -0.36 0.00 0.00 0.00 175.10 175.68 1b4q s PHE 17 N 1.33 3.34 0.03 5.22 0.40 -0.86 0.12 117.98 127.56 1b4q s PHE 17 Ca -0.02 0.80 0.00 0.00 -0.60 0.00 0.00 56.93 57.12 1b4q s PHE 17 Cb -0.14 -2.74 -0.00 0.00 0.51 0.00 0.00 43.02 40.65 1b4q s PHE 17 CO -0.04 -0.19 0.01 0.44 0.70 0.00 0.00 175.22 176.14 1b4q n ILE 18 N 4.79 0.00 -3.35 0.64 -5.35 -0.42 -1.38 119.36 114.30 1b4q n ILE 18 Ca -0.03 -0.17 -0.15 0.00 -0.27 0.00 0.00 62.75 62.13 1b4q n ILE 18 Cb 0.50 0.06 -0.07 0.00 -1.74 0.00 0.00 39.64 38.39 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 -2.11 0.63 -0.23 6.28 1.02 -1.26 -3.02 119.74 121.06 1b4q s LYS 19 Ca 0.02 -0.74 -0.10 0.00 0.02 0.00 0.00 55.97 55.16 1b4q s LYS 19 Cb 0.00 -0.63 -0.11 0.00 -0.52 0.00 0.00 37.83 36.57 1b4q s LYS 19 CO 0.01 -1.18 1.19 -2.30 -0.92 0.00 0.00 175.35 172.15 1b4q n PRO 20 N 4.35 0.02 0.00 -1.68 -0.02 -1.26 -2.16 135.00 134.25 1b4q n PRO 20 Ca 0.10 -0.51 0.00 0.00 -2.02 0.00 0.00 63.50 61.07 1b4q n PRO 20 Cb 0.46 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 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 5.58 0.00 -3.68 3.45 -1.04 -1.26 -5.12 114.28 112.21 1b4q n THR 21 Ca 0.16 0.00 -0.36 0.00 -2.04 0.00 0.00 64.05 61.81 1b4q n THR 21 Cb 0.41 0.00 -0.07 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 6.04 0.00 -0.27 0.00 0.11 -1.99 -2.03 132.00 133.86 1b4q h PRO 23 Ca -0.46 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.49 1b4q h PRO 23 Cb 1.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1b4q h PRO 23 CO 0.70 0.00 -0.49 1.88 -0.21 0.00 0.00 178.00 179.88 1b4q h TYR 24 N 0.00 0.90 -0.64 0.65 -1.99 -1.93 -1.36 116.97 112.59 1b4q h TYR 24 Ca 0.01 -0.30 -0.09 0.00 2.00 0.00 0.00 58.73 60.36 1b4q h TYR 24 Cb 0.07 -0.18 -0.02 0.00 2.00 0.00 0.00 36.73 38.60 1b4q h TYR 24 CO 0.00 1.07 0.05 0.77 -0.00 0.00 0.00 178.16 180.05 1b4q h SER 25 N 0.57 1.06 -0.84 3.88 0.02 -1.58 -2.43 113.55 114.24 1b4q h SER 25 Ca 0.03 -0.28 -0.02 0.00 -0.84 0.00 0.00 61.79 60.68 1b4q h SER 25 Cb 1.05 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 63.27 1b4q h SER 25 CO 0.10 1.08 0.46 0.03 -1.14 0.00 0.00 176.83 177.36 1b4q h ARG 26 N 1.01 1.17 -0.59 3.45 2.47 -1.32 -2.45 114.38 118.12 1b4q h ARG 26 Ca 0.19 -0.14 0.12 0.00 -1.26 0.00 0.00 59.98 58.89 1b4q h ARG 26 Cb 0.50 -0.23 -0.09 0.00 -1.65 0.00 0.00 29.97 28.50 1b4q h ARG 26 CO 0.02 0.86 0.07 -0.09 0.56 0.00 0.00 179.97 181.40 1b4q h ARG 27 N 1.16 0.19 -0.65 0.04 9.65 -0.75 0.45 114.38 124.48 1b4q h ARG 27 Ca 0.29 -0.01 0.02 0.00 -1.10 0.00 0.00 59.98 59.19 1b4q h ARG 27 Cb 0.03 -0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 28.54 1b4q h ARG 27 CO -0.05 0.12 0.43 0.00 2.80 0.00 0.00 179.97 183.28 1b4q h ALA 28 N 1.50 1.61 -0.15 2.80 0.00 -1.33 0.25 119.26 123.94 1b4q h ALA 28 Ca 0.31 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 55.08 1b4q h ALA 28 Cb 0.48 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1b4q h ALA 28 CO -0.44 0.34 -0.31 1.96 0.00 0.00 0.00 179.25 180.79 1b4q h GLN 29 N 0.81 0.47 -0.16 0.00 4.20 -0.16 -1.92 115.11 118.34 1b4q h GLN 29 Ca 0.25 -0.31 -0.13 0.00 0.06 0.00 0.00 58.65 58.52 1b4q h GLN 29 Cb 0.02 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 1b4q h GLN 29 CO -0.07 0.92 -0.47 0.93 -0.67 0.00 0.00 178.83 179.47 1b4q h GLU 30 N 0.08 0.42 0.05 1.46 4.39 0.25 -2.34 114.58 118.89 1b4q h GLU 30 Ca 0.00 -0.23 -0.00 0.00 0.34 0.00 0.00 59.36 59.47 1b4q h GLU 30 Cb 0.91 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.57 1b4q h GLU 30 CO 0.07 0.80 -0.02 0.97 -1.16 0.00 0.00 179.01 179.67 1b4q h ILE 31 N 0.33 0.45 0.00 3.13 -0.00 -0.55 -3.29 117.51 117.58 1b4q h ILE 31 Ca 0.02 -1.26 -0.00 0.00 -0.00 0.00 0.00 64.86 63.62 1b4q h ILE 31 Cb 0.96 0.83 -0.00 0.00 -0.00 0.00 0.00 36.82 38.61 1b4q h ILE 31 CO 0.08 0.15 -0.00 -0.07 -0.00 0.00 0.00 178.15 178.31 1b4q h LEU 32 N -1.00 0.00 -1.72 2.19 3.38 -1.47 -0.05 115.31 116.63 1b4q h LEU 32 Ca -0.01 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1b4q h LEU 32 Cb 0.29 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1b4q h LEU 32 CO 0.01 0.00 -0.17 0.77 0.09 0.00 0.00 178.44 179.14 1b4q h SER 33 N 0.00 0.00 -0.19 -0.43 4.64 -1.48 -1.53 113.55 114.55 1b4q h SER 33 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1b4q h SER 33 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1b4q h SER 33 CO 0.00 0.17 0.00 0.00 -0.87 0.00 0.00 176.83 176.13 1b4q n GLN 34 N -3.82 1.79 -3.28 4.77 3.00 -0.03 -4.86 117.38 114.95 1b4q n GLN 34 Ca -0.02 -1.19 -0.38 0.00 -0.01 0.00 0.00 57.00 55.40 1b4q n GLN 34 Cb 0.27 -1.40 -0.06 0.00 0.00 0.00 0.00 30.24 29.05 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 -1.54 4.25 -0.57 1.08 1.43 -0.58 -4.95 118.68 117.80 1b4q s LEU 35 Ca 0.32 0.80 -0.15 0.00 -1.03 0.00 0.00 54.13 54.08 1b4q s LEU 35 Cb 0.18 -2.72 -0.14 0.00 0.03 0.00 0.00 46.19 43.54 1b4q s LEU 35 CO 0.26 -0.05 1.78 -0.81 0.23 0.00 0.00 176.35 177.76 1b4q n PRO 36 N 3.97 1.19 -2.38 1.29 -0.04 -1.26 -4.90 135.00 132.87 1b4q n PRO 36 Ca -0.06 -1.37 -0.32 0.00 -0.04 0.00 0.00 63.50 61.70 1b4q n PRO 36 Cb 0.51 -2.56 -0.03 0.00 -0.04 0.00 0.00 33.50 31.38 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 4.84 4.38 0.00 0.52 -1.09 -1.26 -2.47 121.20 126.11 1b4q s ILE 37 Ca 0.45 1.18 0.00 0.00 -2.23 0.00 0.00 60.65 60.05 1b4q s ILE 37 Cb 0.11 -3.64 0.00 0.00 -1.58 0.00 0.00 42.46 37.34 1b4q s ILE 37 CO 0.09 -0.61 0.00 0.29 -1.23 0.00 0.00 174.94 173.48 1b4q n LYS 38 N -1.55 -0.98 0.00 2.79 4.76 -1.19 -4.72 118.16 117.27 1b4q n LYS 38 Ca 0.07 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.51 1b4q n LYS 38 Cb 0.54 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.73 1b4q n LYS 38 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1b4q n GLN 39 N -1.47 0.00 -0.26 1.97 1.13 -1.26 -3.91 117.38 113.59 1b4q n GLN 39 Ca 0.00 0.00 -0.03 0.00 -1.94 0.00 0.00 57.00 55.03 1b4q n GLN 39 Cb 0.00 0.00 -0.04 0.00 0.11 0.00 0.00 30.24 30.31 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 0.00 1.48 0.03 1.08 0.00 -1.26 -3.76 105.19 102.77 1b4q n GLY 40 Ca 0.00 -0.29 0.11 0.00 0.00 0.00 0.00 46.02 45.84 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 2.72 0.28 -4.54 0.99 7.94 -1.25 -4.86 117.00 118.27 1b4q n LEU 41 Ca 0.10 0.02 -0.34 0.00 -1.11 0.00 0.00 56.01 54.69 1b4q n LEU 41 Cb 0.24 -0.02 -0.11 0.00 0.53 0.00 0.00 43.42 44.06 1b4q n LEU 41 CO 0.18 -0.01 -0.32 -0.22 -1.11 0.00 0.00 177.39 175.91 1b4q s LEU 42 N -4.52 3.43 0.16 -1.96 2.96 -1.25 -1.25 118.68 116.26 1b4q s LEU 42 Ca -0.05 -0.06 -0.03 0.00 -0.22 0.00 0.00 54.13 53.78 1b4q s LEU 42 Cb 0.13 -1.84 -0.03 0.00 0.50 0.00 0.00 46.19 44.95 1b4q s LEU 42 CO 0.88 0.17 0.13 -0.70 -1.32 0.00 0.00 176.35 175.51 1b4q s GLU 43 N 0.34 1.07 -0.23 1.98 2.56 -1.15 -5.02 118.70 118.25 1b4q s GLU 43 Ca -0.02 -1.44 -0.00 0.00 0.00 0.00 0.00 54.97 53.51 1b4q s GLU 43 Cb -0.14 0.28 0.06 0.00 2.00 0.00 0.00 34.13 36.34 1b4q s GLU 43 CO 0.02 -0.34 -0.03 -0.06 -0.56 0.00 0.00 175.26 174.29 1b4q s PHE 44 N -4.07 2.09 -0.46 5.30 0.08 -1.26 -2.09 117.98 117.58 1b4q s PHE 44 Ca 0.27 -1.57 -0.19 0.00 0.12 0.00 0.00 56.93 55.57 1b4q s PHE 44 Cb 0.06 -1.47 0.04 0.00 -0.57 0.00 0.00 43.02 41.09 1b4q s PHE 44 CO 0.05 -0.74 0.55 0.08 -0.10 0.00 0.00 175.22 175.05 1b4q s VAL 45 N 1.50 4.96 -0.68 -0.44 1.01 0.33 -4.93 120.40 122.14 1b4q s VAL 45 Ca -0.04 -0.38 -0.26 0.00 0.00 0.00 0.00 61.98 61.29 1b4q s VAL 45 Cb -0.18 -4.18 0.04 0.00 0.00 0.00 0.00 36.38 32.05 1b4q s VAL 45 CO -0.07 -0.63 1.19 -1.81 0.00 0.00 0.00 175.10 173.79 1b4q s ASP 46 N 2.26 6.24 0.00 3.32 1.01 -1.26 -1.29 116.67 126.95 1b4q s ASP 46 Ca 0.15 -0.40 0.05 0.00 0.71 0.00 0.00 52.55 53.06 1b4q s ASP 46 Cb -0.18 -2.53 0.26 0.00 1.01 0.00 0.00 42.92 41.48 1b4q s ASP 46 CO 0.13 -1.66 0.99 2.30 0.21 0.00 0.00 175.17 177.15 1b4q n ILE 47 N 6.36 0.94 0.66 0.77 -5.35 -1.17 -1.12 119.36 120.46 1b4q n ILE 47 Ca 0.03 0.23 0.11 0.00 -0.27 0.00 0.00 62.75 62.86 1b4q n ILE 47 Cb 0.48 -1.15 0.05 0.00 -1.74 0.00 0.00 39.64 37.29 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 -1.28 0.14 1.61 7.28 5.66 -1.26 -3.55 114.28 122.87 1b4q n THR 48 Ca 0.02 -0.19 0.00 0.00 -3.05 0.00 0.00 64.05 60.83 1b4q n THR 48 Cb 0.04 0.25 0.00 0.00 -1.55 0.00 0.00 70.33 69.07 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 2.34 -0.10 1.79 0.00 -0.28 -3.18 120.51 119.33 1b4q n ALA 49 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1b4q n ALA 49 Cb 0.41 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.86 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 -0.44 0.00 -2.45 0.00 5.66 -1.25 -5.11 114.28 110.69 1b4q n THR 50 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1b4q n THR 50 Cb 0.02 0.67 0.00 0.00 -1.55 0.00 0.00 70.33 69.47 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 0.00 -2.45 1.09 4.05 -1.19 -4.93 115.26 111.84 1b4q n ASN 51 Ca 0.00 0.00 -0.19 0.00 0.45 0.00 0.00 54.58 54.84 1b4q n ASN 51 Cb 0.00 0.00 -0.01 0.00 1.23 0.00 0.00 39.78 41.00 1b4q n ASN 51 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 177.26 175.62 1b4q n HIS 52 N -0.25 -1.16 -0.19 1.20 -0.00 -1.26 -4.82 115.22 108.74 1b4q n HIS 52 Ca 0.00 0.03 -0.11 0.00 -0.00 0.00 0.00 57.72 57.63 1b4q n HIS 52 Cb 0.00 -3.67 -0.07 0.00 -0.00 0.00 0.00 29.99 26.25 1b4q n HIS 52 CO 0.00 0.00 0.00 1.79 -0.00 0.00 0.00 176.34 178.13 1b4q h THR 53 N -0.07 0.03 -0.77 1.59 1.35 -1.92 0.29 112.91 113.42 1b4q h THR 53 Ca -0.44 0.00 0.16 0.00 -0.55 0.00 0.00 66.41 65.58 1b4q h THR 53 Cb 1.33 0.03 -0.05 0.00 -1.73 0.00 0.00 68.15 67.73 1b4q h THR 53 CO 0.52 0.00 0.52 0.78 -0.25 0.00 0.00 175.52 177.09 1b4q h ASN 54 N -0.30 0.35 -0.32 5.36 -0.26 -1.94 -0.88 115.58 117.60 1b4q h ASN 54 Ca 0.12 0.02 -0.02 0.00 -0.56 0.00 0.00 56.30 55.86 1b4q h ASN 54 Cb 0.57 -0.05 -0.01 0.00 -1.06 0.00 0.00 38.32 37.77 1b4q h ASN 54 CO -0.66 0.17 0.11 -0.33 -1.06 0.00 0.00 177.43 175.66 1b4q h GLU 55 N 0.37 0.48 0.17 0.81 4.39 -0.79 0.54 114.58 120.55 1b4q h GLU 55 Ca 0.38 -0.10 -0.01 0.00 0.34 0.00 0.00 59.36 59.98 1b4q h GLU 55 Cb 0.95 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.53 1b4q h GLU 55 CO -0.12 0.51 -0.08 0.82 -1.16 0.00 0.00 179.01 178.97 1b4q h ILE 56 N 0.36 0.95 -0.96 3.13 5.03 -0.60 -1.31 117.51 124.10 1b4q h ILE 56 Ca 0.10 -0.72 0.06 0.00 -0.12 0.00 0.00 64.86 64.19 1b4q h ILE 56 Cb 0.21 1.37 -0.07 0.00 -3.03 0.00 0.00 36.82 35.31 1b4q h ILE 56 CO -0.01 0.16 0.61 1.56 -0.68 0.00 0.00 178.15 179.80 1b4q h GLN 57 N -0.60 1.08 -0.60 2.37 4.20 -1.23 0.84 115.11 121.18 1b4q h GLN 57 Ca -0.02 -0.07 0.12 0.00 0.06 0.00 0.00 58.65 58.74 1b4q h GLN 57 Cb 0.44 -0.24 -0.04 0.00 0.30 0.00 0.00 27.48 27.94 1b4q h GLN 57 CO 0.04 0.72 0.41 -0.44 -0.67 0.00 0.00 178.83 178.89 1b4q h ASP 58 N 1.12 0.29 0.04 1.46 5.19 0.29 0.34 116.42 125.15 1b4q h ASP 58 Ca 0.41 0.01 -0.11 0.00 -0.62 0.00 0.00 57.03 56.73 1b4q h ASP 58 Cb 0.16 -0.05 0.01 0.00 0.18 0.00 0.00 39.33 39.63 1b4q h ASP 58 CO -0.17 0.17 -0.45 0.22 -3.12 0.00 0.00 179.24 175.89 1b4q h TYR 59 N 0.32 0.37 -0.86 4.55 5.03 0.16 -2.98 116.97 123.58 1b4q h TYR 59 Ca 0.28 -0.23 0.13 0.00 2.58 0.00 0.00 58.73 61.49 1b4q h TYR 59 Cb 0.68 -0.03 -0.06 0.00 1.55 0.00 0.00 36.73 38.87 1b4q h TYR 59 CO -0.00 1.10 0.56 -0.07 -1.32 0.00 0.00 178.16 178.43 1b4q h LEU 60 N -0.46 0.65 0.23 2.82 3.38 0.14 0.55 115.31 122.62 1b4q h LEU 60 Ca -0.07 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1b4q h LEU 60 Cb 1.26 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 1b4q h LEU 60 CO 0.09 0.35 -0.13 -0.61 0.09 0.00 0.00 178.44 178.22 1b4q h GLN 61 N 0.70 -0.33 -0.30 1.13 5.75 -0.39 0.60 115.11 122.27 1b4q h GLN 61 Ca 0.42 0.02 -0.07 0.00 -0.15 0.00 0.00 58.65 58.87 1b4q h GLN 61 Cb 0.64 0.07 -0.01 0.00 1.07 0.00 0.00 27.48 29.25 1b4q h GLN 61 CO -0.18 -0.22 -0.10 0.37 -2.65 0.00 0.00 178.83 176.05 1b4q h GLN 62 N -0.34 0.60 -0.58 1.69 4.15 -0.95 0.23 115.11 119.91 1b4q h GLN 62 Ca -0.02 -0.24 -0.05 0.00 0.77 0.00 0.00 58.65 59.11 1b4q h GLN 62 Cb 0.28 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.92 1b4q h GLN 62 CO 0.03 0.80 0.18 1.25 -1.93 0.00 0.00 178.83 179.16 1b4q h LEU 63 N 0.37 0.85 0.00 -2.39 5.85 0.18 -3.41 115.31 116.76 1b4q h LEU 63 Ca 0.07 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.58 1b4q h LEU 63 Cb 0.60 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.40 1b4q h LEU 63 CO 0.03 0.84 0.00 0.35 -0.34 0.00 0.00 178.44 179.32 1b4q n THR 64 N -4.41 0.00 0.00 1.05 -2.24 0.21 -5.04 114.28 103.85 1b4q n THR 64 Ca 0.03 0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 1b4q n THR 64 Cb 0.21 -0.95 0.00 0.00 -2.10 0.00 0.00 70.33 67.49 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 3.17 2.19 3.77 3.38 0.00 0.82 -4.96 105.19 113.56 1b4q n GLY 65 Ca 0.00 -0.21 -0.36 0.00 0.00 0.00 0.00 46.02 45.44 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 3.69 -0.26 4.61 0.00 -1.26 -4.70 121.76 123.83 1b4q s ALA 66 Ca 0.00 -0.51 0.13 0.00 0.00 0.00 0.00 51.96 51.57 1b4q s ALA 66 Cb 0.00 -2.25 0.76 0.00 0.00 0.00 0.00 23.12 21.62 1b4q s ALA 66 CO 0.00 0.27 1.73 2.89 0.00 0.00 0.00 175.76 180.64 1b4q n ARG 67 N 3.00 4.20 -1.82 0.00 1.85 -1.26 -4.29 116.66 118.34 1b4q n ARG 67 Ca -0.15 -3.11 -0.29 0.00 -1.00 0.00 0.00 57.85 53.30 1b4q n ARG 67 Cb 0.53 -2.19 0.12 0.00 -1.05 0.00 0.00 32.46 29.86 1b4q n ARG 67 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1b4q s THR 68 N -2.87 1.99 -0.05 8.89 2.01 -1.26 -5.01 115.64 119.34 1b4q s THR 68 Ca 0.53 0.00 0.05 0.00 0.31 0.00 0.00 61.69 62.58 1b4q s THR 68 Cb 0.42 -2.94 -0.02 0.00 0.01 0.00 0.00 72.50 69.96 1b4q s THR 68 CO 0.14 0.00 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.20 1b4q s VAL 69 N -3.57 2.70 0.00 3.82 1.01 -1.26 -4.24 120.40 118.86 1b4q s VAL 69 Ca 0.65 -0.85 0.00 0.00 0.00 0.00 0.00 61.98 61.77 1b4q s VAL 69 Cb -0.10 -2.03 0.00 0.00 0.00 0.00 0.00 36.38 34.25 1b4q s VAL 69 CO 0.51 0.58 0.00 -0.81 0.00 0.00 0.00 175.10 175.38 1b4q n PRO 70 N 2.54 0.33 -3.47 2.72 -0.04 -1.26 -4.40 135.00 131.42 1b4q n PRO 70 Ca -0.17 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.02 1b4q n PRO 70 Cb 0.52 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.86 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 -2.20 0.45 0.45 0.54 1.81 -0.48 -4.29 118.95 115.22 1b4q s ARG 71 Ca 0.00 -1.03 -0.12 0.00 -1.72 0.00 0.00 55.73 52.86 1b4q s ARG 71 Cb 0.00 -1.18 -0.07 0.00 -0.45 0.00 0.00 34.95 33.25 1b4q s ARG 71 CO 0.00 -1.15 0.84 0.08 -0.68 0.00 0.00 175.30 174.39 1b4q s VAL 72 N 1.42 4.72 -0.37 3.52 1.01 -1.16 -2.03 120.40 127.51 1b4q s VAL 72 Ca 0.15 0.78 0.02 0.00 0.00 0.00 0.00 61.98 62.93 1b4q s VAL 72 Cb -0.20 -3.74 0.15 0.00 0.00 0.00 0.00 36.38 32.59 1b4q s VAL 72 CO -0.10 -0.61 0.29 -0.36 0.00 0.00 0.00 175.10 174.32 1b4q s PHE 73 N -2.49 0.38 -0.39 5.22 0.08 -0.88 -3.62 117.98 116.28 1b4q s PHE 73 Ca 0.53 -1.44 -0.28 0.00 0.12 0.00 0.00 56.93 55.86 1b4q s PHE 73 Cb -0.10 -0.72 -0.01 0.00 -0.57 0.00 0.00 43.02 41.63 1b4q s PHE 73 CO 0.33 -0.89 1.63 0.42 -0.10 0.00 0.00 175.22 176.61 1b4q s ILE 74 N 1.05 3.65 0.00 0.64 1.09 -1.04 -3.54 121.20 123.05 1b4q s ILE 74 Ca 0.20 0.65 0.00 0.00 -1.10 0.00 0.00 60.65 60.40 1b4q s ILE 74 Cb -0.17 -3.92 0.00 0.00 -1.06 0.00 0.00 42.46 37.31 1b4q s ILE 74 CO -0.03 -0.62 0.00 0.61 -0.10 0.00 0.00 174.94 174.80 1b4q n GLY 75 N 5.29 0.70 0.14 6.18 0.00 -0.11 -2.27 105.19 115.13 1b4q n GLY 75 Ca 0.20 -0.73 0.14 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 0.32 0.66 -3.05 1.61 5.02 -1.26 -4.49 118.16 116.97 1b4q n LYS 76 Ca 0.00 -0.28 -0.42 0.00 -2.02 0.00 0.00 58.31 55.60 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 -2.53 6.53 0.58 4.39 1.11 -0.96 -5.04 116.67 120.74 1b4q s ASP 77 Ca 0.26 0.43 -0.17 0.00 0.18 0.00 0.00 52.55 53.25 1b4q s ASP 77 Cb 0.20 -2.36 -0.04 0.00 1.07 0.00 0.00 42.92 41.79 1b4q s ASP 77 CO 0.50 -0.57 1.08 -0.55 1.18 0.00 0.00 175.17 176.81 1b4q s SER 78 N 1.69 5.72 -0.02 0.27 0.15 -1.26 -2.51 113.70 117.74 1b4q s SER 78 Ca 0.28 1.96 0.06 0.00 0.70 0.00 0.00 55.95 58.95 1b4q s SER 78 Cb -0.14 -2.55 -0.09 0.00 -1.71 0.00 0.00 66.02 61.52 1b4q s SER 78 CO 0.13 -1.21 0.10 2.30 1.20 0.00 0.00 173.24 175.76 1b4q n ILE 79 N -1.74 0.13 0.00 6.45 -5.35 -1.24 -4.88 119.36 112.74 1b4q n ILE 79 Ca 0.10 -0.18 0.00 0.00 -0.27 0.00 0.00 62.75 62.40 1b4q n ILE 79 Cb 0.52 -0.05 0.00 0.00 -1.74 0.00 0.00 39.64 38.37 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 2.32 0.56 0.00 3.28 0.00 -1.26 -4.74 105.19 105.34 1b4q n GLY 80 Ca -0.04 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.28 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 2.24 0.24 -0.02 0.00 -1.26 -2.97 105.19 103.42 1b4q n GLY 81 Ca 0.00 -1.87 -0.10 0.00 0.00 0.00 0.00 46.02 44.05 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 -0.45 -0.49 1.61 0.87 -1.79 -1.59 113.55 111.71 1b4q h SER 82 Ca 0.00 -0.08 0.14 0.00 -1.23 0.00 0.00 61.79 60.62 1b4q h SER 82 Cb 0.00 0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.06 1b4q h SER 82 CO 0.00 -0.01 0.45 -1.28 -0.53 0.00 0.00 176.83 175.46 1b4q h SER 83 N -1.06 0.00 -0.06 6.23 0.87 -1.95 0.13 113.55 117.71 1b4q h SER 83 Ca -0.05 0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 60.41 1b4q h SER 83 Cb 0.50 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.46 1b4q h SER 83 CO 0.09 0.00 -0.34 0.44 -0.53 0.00 0.00 176.83 176.48 1b4q h ASP 84 N 0.00 0.41 0.58 6.23 5.19 -1.87 -2.91 116.42 124.05 1b4q h ASP 84 Ca 0.23 -0.66 -0.02 0.00 -0.62 0.00 0.00 57.03 55.96 1b4q h ASP 84 Cb 1.13 -0.12 -0.01 0.00 0.18 0.00 0.00 39.33 40.50 1b4q h ASP 84 CO -0.00 1.01 -0.46 0.25 -3.12 0.00 0.00 179.24 176.91 1b4q h LEU 85 N -0.16 -1.23 -0.61 1.55 6.46 0.26 -2.66 115.31 118.92 1b4q h LEU 85 Ca -0.03 0.09 0.13 0.00 -0.12 0.00 0.00 57.88 57.95 1b4q h LEU 85 Cb 1.01 0.39 -0.10 0.00 -0.73 0.00 0.00 40.66 41.22 1b4q h LEU 85 CO 0.07 -0.65 0.02 -0.37 -0.62 0.00 0.00 178.44 176.88 1b4q h VAL 86 N -1.01 0.51 -0.71 1.05 -1.51 -1.51 0.82 116.25 113.88 1b4q h VAL 86 Ca -0.08 -0.04 0.15 0.00 -1.23 0.00 0.00 66.70 65.50 1b4q h VAL 86 Cb 0.85 0.37 -0.11 0.00 -2.13 0.00 0.00 31.29 30.27 1b4q h VAL 86 CO 0.01 0.02 0.17 0.28 -1.23 0.00 0.00 177.57 176.82 1b4q h SER 87 N 0.13 0.01 -0.22 4.19 0.02 -1.29 -0.01 113.55 116.39 1b4q h SER 87 Ca 0.32 0.14 -0.17 0.00 -0.84 0.00 0.00 61.79 61.24 1b4q h SER 87 Cb 0.52 0.19 -0.00 0.00 0.14 0.00 0.00 62.40 63.24 1b4q h SER 87 CO -0.51 -0.03 -0.48 -0.07 -1.14 0.00 0.00 176.83 174.60 1b4q h LEU 88 N 0.27 0.87 0.85 5.07 3.38 -0.60 -2.45 115.31 122.70 1b4q h LEU 88 Ca 0.40 -0.43 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 1b4q h LEU 88 Cb 0.66 -0.25 0.01 0.00 0.09 0.00 0.00 40.66 41.18 1b4q h LEU 88 CO -0.49 1.20 -0.41 -0.61 0.09 0.00 0.00 178.44 178.22 1b4q h GLN 89 N 0.63 -1.10 0.00 1.13 5.75 0.84 0.33 115.11 122.68 1b4q h GLN 89 Ca 0.03 0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 58.59 1b4q h GLN 89 Cb 1.06 0.25 -0.00 0.00 1.07 0.00 0.00 27.48 29.86 1b4q h GLN 89 CO 0.11 -0.73 -0.06 -0.56 -2.65 0.00 0.00 178.83 174.94 1b4q h GLN 90 N -1.16 0.00 0.00 1.69 3.07 -1.28 0.45 115.11 117.88 1b4q h GLN 90 Ca -0.12 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.62 1b4q h GLN 90 Cb 0.88 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.44 1b4q h GLN 90 CO 0.19 0.06 -0.21 0.77 0.09 0.00 0.00 178.83 179.72 1b4q h SER 91 N 0.00 0.00 0.00 0.06 0.02 -0.92 -3.47 113.55 109.24 1b4q h SER 91 Ca -0.00 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1b4q h SER 91 Cb 0.14 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.68 1b4q h SER 91 CO 0.01 0.03 0.00 0.61 -1.14 0.00 0.00 176.83 176.34 1b4q n GLY 92 N 1.30 2.28 0.20 -3.77 0.00 0.11 -4.84 105.19 100.47 1b4q n GLY 92 Ca 0.05 0.00 0.05 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 2.43 0.00 0.59 1.61 4.81 -1.53 -2.98 114.58 119.51 1b4q h GLU 93 Ca 0.00 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 1b4q h GLU 93 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1b4q h GLU 93 CO 0.00 0.35 -0.31 1.25 -0.73 0.00 0.00 179.01 179.57 1b4q h LEU 94 N 0.00 -0.75 -1.98 1.64 5.85 -1.68 -0.81 115.31 117.58 1b4q h LEU 94 Ca -0.00 0.03 0.17 0.00 0.84 0.00 0.00 57.88 58.92 1b4q h LEU 94 Cb 0.71 0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.92 1b4q h LEU 94 CO 0.05 -0.50 0.44 0.17 -0.34 0.00 0.00 178.44 178.25 1b4q h LEU 95 N -0.82 0.02 -0.52 2.25 8.10 -1.83 0.44 115.31 122.95 1b4q h LEU 95 Ca -0.08 0.00 -0.03 0.00 0.11 0.00 0.00 57.88 57.88 1b4q h LEU 95 Cb 0.64 -0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.83 1b4q h LEU 95 CO 0.11 0.01 0.19 0.74 -4.11 0.00 0.00 178.44 175.38 1b4q h THR 96 N 0.02 1.22 -0.55 0.15 2.02 -1.26 0.35 112.91 114.87 1b4q h THR 96 Ca 0.29 -0.71 -0.02 0.00 0.77 0.00 0.00 66.41 66.75 1b4q h THR 96 Cb 1.14 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 68.24 1b4q h THR 96 CO -0.01 0.27 0.28 -0.09 0.37 0.00 0.00 175.52 176.33 1b4q h ARG 97 N 0.70 0.76 -0.21 6.66 9.65 0.13 -1.35 114.38 130.71 1b4q h ARG 97 Ca 0.17 -0.08 -0.18 0.00 -1.10 0.00 0.00 59.98 58.79 1b4q h ARG 97 Cb 0.23 -0.15 -0.00 0.00 -1.39 0.00 0.00 29.97 28.66 1b4q h ARG 97 CO -0.01 0.58 -0.58 -0.07 2.80 0.00 0.00 179.97 182.68 1b4q h LEU 98 N 0.76 0.78 0.55 3.80 4.07 -0.54 -3.32 115.31 121.42 1b4q h LEU 98 Ca 0.19 -0.43 -0.03 0.00 0.08 0.00 0.00 57.88 57.70 1b4q h LEU 98 Cb 0.06 -0.22 0.01 0.00 1.08 0.00 0.00 40.66 41.58 1b4q h LEU 98 CO -0.03 1.19 -0.26 0.50 -1.08 0.00 0.00 178.44 178.76 1b4q h LYS 99 N 0.52 -0.71 -0.99 1.13 3.64 0.70 0.92 116.57 121.78 1b4q h LYS 99 Ca 0.00 0.05 0.29 0.00 -1.27 0.00 0.00 60.65 59.72 1b4q h LYS 99 Cb 1.16 0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 33.10 1b4q h LYS 99 CO 0.12 -0.41 0.88 -0.56 -2.27 0.00 0.00 179.45 177.21 1b4q h GLN 100 N -0.95 0.00 0.00 1.90 3.07 -1.40 0.41 115.11 118.14 1b4q h GLN 100 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.66 1b4q h GLN 100 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.19 1b4q h GLN 100 CO 0.12 0.00 -1.50 0.44 0.09 0.00 0.00 178.83 177.99 1b4q n ILE 101 N -3.78 0.00 -2.36 1.86 -5.35 -1.09 -5.01 119.36 103.63 1b4q n ILE 101 Ca 0.21 -0.31 0.00 0.00 -0.27 0.00 0.00 62.75 62.38 1b4q n ILE 101 Cb 1.20 0.33 0.00 0.00 -1.74 0.00 0.00 39.64 39.43 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 1.56 0.93 0.00 3.28 0.00 0.28 -4.73 105.19 106.51 1b4q n GLY 102 Ca -0.02 -0.66 0.13 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.30 2.80 -2.70 4.61 0.00 0.10 -4.86 120.51 118.15 1b4q n ALA 103 Ca 0.00 -0.19 -0.17 0.00 0.00 0.00 0.00 53.44 53.08 1b4q n ALA 103 Cb 0.48 -1.33 0.07 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 -1.53 0.00 -0.03 0.00 -0.00 -1.26 -3.18 117.00 111.00 1b4q n LEU 104 Ca 0.06 -1.63 0.16 0.00 -0.00 0.00 0.00 56.01 54.61 1b4q n LEU 104 Cb 0.34 -0.41 0.92 0.00 -0.00 0.00 0.00 43.42 44.28 1b4q n LEU 104 CO 0.30 -0.78 1.09 0.00 -0.00 0.00 0.00 177.39 178.01