#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 0.00 0.00 7.27 -1.26 -4.86 117.38 118.53 1b4q n GLN 2 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 1b4q n GLN 2 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 1b4q n GLN 2 CO 0.00 0.00 0.00 -0.85 0.07 0.00 0.00 177.06 176.28 1b4q n GLU 3 N -0.54 0.00 0.08 3.69 -0.00 -1.26 -2.55 120.64 120.06 1b4q n GLU 3 Ca 0.00 0.39 -0.03 0.00 -0.00 0.00 0.00 57.16 57.52 1b4q n GLU 3 Cb 0.00 -1.55 -0.02 0.00 -0.00 0.00 0.00 31.44 29.87 1b4q n GLU 3 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.13 177.87 1b4q h PHE 4 N 0.00 -0.19 -0.14 -1.84 -1.00 -1.98 -1.57 116.94 110.22 1b4q h PHE 4 Ca 0.00 -0.00 -0.23 0.00 2.81 0.00 0.00 57.97 60.55 1b4q h PHE 4 Cb 0.10 0.06 0.01 0.00 3.61 0.00 0.00 35.95 39.74 1b4q h PHE 4 CO 0.00 -0.12 -0.81 -0.39 -1.61 0.00 0.00 178.31 175.38 1b4q h VAL 5 N -0.23 1.28 -0.72 -0.55 -1.51 -1.91 -3.06 116.25 109.55 1b4q h VAL 5 Ca -0.02 -2.00 0.11 0.00 -1.23 0.00 0.00 66.70 63.56 1b4q h VAL 5 Cb 0.16 2.02 -0.05 0.00 -2.13 0.00 0.00 31.29 31.29 1b4q h VAL 5 CO 0.04 0.63 0.48 0.78 -1.23 0.00 0.00 177.57 178.27 1b4q h ASN 6 N 0.53 0.48 0.93 4.19 -0.26 -1.61 0.77 115.58 120.61 1b4q h ASN 6 Ca -0.06 0.02 0.00 0.00 -0.56 0.00 0.00 56.30 55.70 1b4q h ASN 6 Cb 1.44 -0.08 0.00 0.00 -1.06 0.00 0.00 38.32 38.61 1b4q h ASN 6 CO 0.16 0.28 0.00 -1.20 -1.06 0.00 0.00 177.43 175.61 1b4q n SER 7 N -4.49 0.43 -0.12 5.81 7.64 -0.59 -3.62 113.62 118.68 1b4q n SER 7 Ca 0.13 0.57 -0.26 0.00 1.01 0.00 0.00 58.87 60.32 1b4q n SER 7 Cb 0.40 -0.68 -0.11 0.00 -1.01 0.00 0.00 64.21 62.82 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 -1.94 0.60 -2.69 1.43 5.02 0.24 -4.90 118.16 115.93 1b4q n LYS 8 Ca 0.04 0.34 -0.42 0.00 -2.02 0.00 0.00 58.31 56.25 1b4q n LYS 8 Cb 0.29 -1.58 -0.04 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 -2.47 4.64 0.08 -0.18 -4.36 0.15 -4.93 121.20 114.13 1b4q s ILE 9 Ca -0.35 2.02 -0.15 0.00 -0.26 0.00 0.00 60.65 61.90 1b4q s ILE 9 Cb 0.11 -4.29 0.03 0.00 1.25 0.00 0.00 42.46 39.56 1b4q s ILE 9 CO 0.55 0.22 0.36 0.00 0.24 0.00 0.00 174.94 176.31 1b4q s GLN 10 N 0.56 0.94 0.14 0.37 -2.07 -1.26 -4.81 119.66 113.52 1b4q s GLN 10 Ca 0.50 -0.59 -0.35 0.00 -1.82 0.00 0.00 55.36 53.11 1b4q s GLN 10 Cb -0.23 0.41 -0.15 0.00 -1.09 0.00 0.00 33.01 31.95 1b4q s GLN 10 CO 0.29 -0.33 1.45 -2.30 -1.32 0.00 0.00 175.29 173.08 1b4q n PRO 11 N 0.20 1.72 -1.96 9.60 -0.02 -1.26 -1.57 135.00 141.71 1b4q n PRO 11 Ca -0.17 0.62 -0.07 0.00 -2.02 0.00 0.00 63.50 61.86 1b4q n PRO 11 Cb 0.61 -2.32 -0.01 0.00 -0.02 0.00 0.00 33.50 31.77 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 2.91 0.24 2.82 -1.23 0.00 -1.26 -4.96 105.19 103.70 1b4q n GLY 12 Ca 0.17 -0.64 -0.14 0.00 0.00 0.00 0.00 46.02 45.41 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 -4.01 -0.00 -0.14 1.61 2.20 -0.61 -4.71 119.74 114.08 1b4q s LYS 13 Ca 0.00 0.17 -0.07 0.00 -0.36 0.00 0.00 55.97 55.71 1b4q s LYS 13 Cb 0.00 -0.17 -0.04 0.00 -1.51 0.00 0.00 37.83 36.11 1b4q s LYS 13 CO 0.00 -0.12 0.11 0.08 -0.36 0.00 0.00 175.35 175.06 1b4q s VAL 14 N 0.79 5.25 -0.05 4.02 1.01 -1.02 -1.31 120.40 129.08 1b4q s VAL 14 Ca -0.06 0.12 -0.06 0.00 0.00 0.00 0.00 61.98 61.97 1b4q s VAL 14 Cb -0.09 -3.31 0.01 0.00 0.00 0.00 0.00 36.38 32.99 1b4q s VAL 14 CO -0.03 0.56 0.16 0.54 0.00 0.00 0.00 175.10 176.34 1b4q s VAL 15 N -0.57 0.02 -0.10 2.92 0.11 -1.23 -3.17 120.40 118.37 1b4q s VAL 15 Ca 0.12 -0.16 0.02 0.00 -2.93 0.00 0.00 61.98 59.02 1b4q s VAL 15 Cb -0.12 -0.29 0.01 0.00 -1.53 0.00 0.00 36.38 34.46 1b4q s VAL 15 CO 0.02 -0.09 -0.15 -0.69 -3.33 0.00 0.00 175.10 170.86 1b4q s VAL 16 N -0.26 1.46 -0.24 2.04 1.01 -1.14 -2.10 120.40 121.17 1b4q s VAL 16 Ca -0.04 -0.62 -0.17 0.00 0.00 0.00 0.00 61.98 61.16 1b4q s VAL 16 Cb -0.03 -1.33 -0.03 0.00 0.00 0.00 0.00 36.38 34.99 1b4q s VAL 16 CO 0.01 0.43 0.44 -0.36 0.00 0.00 0.00 175.10 175.62 1b4q s PHE 17 N 0.95 3.30 0.23 5.22 0.40 -1.10 0.24 117.98 127.23 1b4q s PHE 17 Ca -0.08 0.58 0.02 0.00 -0.60 0.00 0.00 56.93 56.86 1b4q s PHE 17 Cb -0.15 -2.62 -0.01 0.00 0.51 0.00 0.00 43.02 40.75 1b4q s PHE 17 CO -0.01 -0.17 0.09 0.44 0.70 0.00 0.00 175.22 176.27 1b4q n ILE 18 N 4.86 0.00 -3.50 0.64 -5.35 0.53 -2.58 119.36 113.96 1b4q n ILE 18 Ca -0.07 -1.38 -0.28 0.00 -0.27 0.00 0.00 62.75 60.76 1b4q n ILE 18 Cb 0.50 0.50 -0.14 0.00 -1.74 0.00 0.00 39.64 38.77 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 -2.89 0.30 -0.09 6.28 1.02 -1.26 -2.28 119.74 120.81 1b4q s LYS 19 Ca 0.12 -0.69 -0.17 0.00 0.02 0.00 0.00 55.97 55.26 1b4q s LYS 19 Cb 0.01 -1.13 -0.20 0.00 -0.52 0.00 0.00 37.83 35.99 1b4q s LYS 19 CO 0.09 -1.07 1.19 -2.30 -0.92 0.00 0.00 175.35 172.33 1b4q n PRO 20 N 4.95 0.01 0.00 -1.68 -0.02 -1.26 -2.21 135.00 134.79 1b4q n PRO 20 Ca -0.01 -0.62 0.00 0.00 -2.02 0.00 0.00 63.50 60.85 1b4q n PRO 20 Cb 0.41 -1.96 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 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 5.70 0.00 -3.64 3.45 -1.04 -1.26 -5.12 114.28 112.37 1b4q n THR 21 Ca 0.26 0.00 -0.36 0.00 -2.04 0.00 0.00 64.05 61.90 1b4q n THR 21 Cb 0.37 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.81 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 6.11 0.00 -0.12 0.00 0.11 -1.99 -2.96 132.00 133.16 1b4q h PRO 23 Ca -0.45 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.64 1b4q h PRO 23 Cb 1.18 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 1b4q h PRO 23 CO 0.71 0.01 -0.02 1.88 -0.21 0.00 0.00 178.00 180.36 1b4q h TYR 24 N 0.00 0.25 -0.40 0.65 -1.99 -1.94 -1.61 116.97 111.93 1b4q h TYR 24 Ca -0.00 -0.05 0.01 0.00 2.00 0.00 0.00 58.73 60.69 1b4q h TYR 24 Cb 0.03 -0.06 -0.02 0.00 2.00 0.00 0.00 36.73 38.68 1b4q h TYR 24 CO 0.00 0.51 0.27 0.77 -0.00 0.00 0.00 178.16 179.71 1b4q h SER 25 N -0.09 0.44 -0.70 3.88 0.02 -1.71 -0.02 113.55 115.37 1b4q h SER 25 Ca 0.03 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 60.95 1b4q h SER 25 Cb 0.43 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.83 1b4q h SER 25 CO 0.01 0.31 0.37 -0.09 -1.14 0.00 0.00 176.83 176.30 1b4q h ARG 26 N 0.51 0.98 -0.60 3.45 1.12 -1.42 -1.98 114.38 116.45 1b4q h ARG 26 Ca 0.15 -0.12 0.06 0.00 -1.11 0.00 0.00 59.98 58.97 1b4q h ARG 26 Cb -0.01 -0.19 -0.06 0.00 -0.01 0.00 0.00 29.97 29.71 1b4q h ARG 26 CO -0.03 0.74 0.29 0.00 -3.11 0.00 0.00 179.97 177.86 1b4q h ARG 27 N 0.96 0.53 -0.48 0.20 3.08 -0.03 0.21 114.38 118.85 1b4q h ARG 27 Ca 0.24 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.25 1b4q h ARG 27 Cb 0.05 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 29.96 1b4q h ARG 27 CO -0.04 0.35 0.24 0.00 -1.07 0.00 0.00 179.97 179.46 1b4q h ALA 28 N 1.34 1.53 -0.31 0.04 0.00 -1.10 0.17 119.26 120.92 1b4q h ALA 28 Ca 0.28 -0.09 -0.15 0.00 0.00 0.00 0.00 54.91 54.94 1b4q h ALA 28 Cb 0.22 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1b4q h ALA 28 CO -0.21 0.39 -0.39 1.96 0.00 0.00 0.00 179.25 181.00 1b4q h GLN 29 N 0.67 0.82 -0.20 0.00 4.20 -0.26 -2.36 115.11 117.98 1b4q h GLN 29 Ca 0.17 -0.46 -0.20 0.00 0.06 0.00 0.00 58.65 58.22 1b4q h GLN 29 Cb 0.05 0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.86 1b4q h GLN 29 CO -0.03 1.10 -0.66 0.93 -0.67 0.00 0.00 178.83 179.50 1b4q h GLU 30 N 0.59 0.77 0.24 1.46 4.39 0.03 -2.28 114.58 119.79 1b4q h GLU 30 Ca 0.04 -0.56 -0.01 0.00 0.34 0.00 0.00 59.36 59.17 1b4q h GLU 30 Cb 0.99 0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.73 1b4q h GLU 30 CO 0.09 1.18 -0.12 0.97 -1.16 0.00 0.00 179.01 179.97 1b4q h ILE 31 N 0.56 0.50 0.00 3.13 -0.00 -0.73 -3.07 117.51 117.90 1b4q h ILE 31 Ca -0.02 -0.93 0.00 0.00 -0.00 0.00 0.00 64.86 63.91 1b4q h ILE 31 Cb 1.27 0.84 0.00 0.00 -0.00 0.00 0.00 36.82 38.94 1b4q h ILE 31 CO 0.14 0.13 0.00 -0.07 -0.00 0.00 0.00 178.15 178.35 1b4q h LEU 32 N -0.97 0.00 -1.50 2.19 3.38 -1.55 0.88 115.31 117.73 1b4q h LEU 32 Ca -0.03 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 1b4q h LEU 32 Cb 0.46 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1b4q h LEU 32 CO 0.05 0.00 -0.25 0.28 0.09 0.00 0.00 178.44 178.61 1b4q h SER 33 N 0.00 0.00 -0.01 -0.43 0.02 -1.31 -1.89 113.55 109.93 1b4q h SER 33 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1b4q h SER 33 Cb 0.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.58 1b4q h SER 33 CO 0.00 0.25 -0.00 0.00 -1.14 0.00 0.00 176.83 175.94 1b4q n GLN 34 N -3.91 1.75 -3.11 3.45 3.00 0.30 -4.86 117.38 114.02 1b4q n GLN 34 Ca -0.02 -1.10 -0.39 0.00 -0.01 0.00 0.00 57.00 55.47 1b4q n GLN 34 Cb 0.33 -1.48 -0.05 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 -2.01 4.30 -0.74 1.08 1.43 -0.71 -4.93 118.68 117.10 1b4q s LEU 35 Ca 0.36 1.09 -0.18 0.00 -1.03 0.00 0.00 54.13 54.38 1b4q s LEU 35 Cb 0.21 -2.99 -0.14 0.00 0.03 0.00 0.00 46.19 43.30 1b4q s LEU 35 CO 0.33 -0.10 1.92 -0.81 0.23 0.00 0.00 176.35 177.92 1b4q n PRO 36 N 3.82 1.52 -2.59 1.29 -0.04 -1.26 -4.91 135.00 132.82 1b4q n PRO 36 Ca -0.02 -1.65 -0.33 0.00 -0.04 0.00 0.00 63.50 61.45 1b4q n PRO 36 Cb 0.51 -2.74 -0.04 0.00 -0.04 0.00 0.00 33.50 31.19 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 4.70 4.05 0.00 0.52 -1.09 -1.26 -2.39 121.20 125.73 1b4q s ILE 37 Ca 0.51 1.23 0.00 0.00 -2.23 0.00 0.00 60.65 60.16 1b4q s ILE 37 Cb 0.13 -3.51 0.00 0.00 -1.58 0.00 0.00 42.46 37.49 1b4q s ILE 37 CO 0.09 -0.32 0.00 0.29 -1.23 0.00 0.00 174.94 173.77 1b4q n LYS 38 N -0.97 -0.38 0.00 2.79 4.76 -1.11 -4.77 118.16 118.46 1b4q n LYS 38 Ca 0.08 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.52 1b4q n LYS 38 Cb 0.53 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.72 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 -1.18 0.00 -0.57 1.97 6.02 -1.26 -3.98 117.38 118.37 1b4q n GLN 39 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 57.00 56.93 1b4q n GLN 39 Cb 0.00 0.00 -0.09 0.00 1.02 0.00 0.00 30.24 31.17 1b4q n GLN 39 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1b4q n GLY 40 N 0.00 2.16 0.11 1.08 0.00 -1.26 -3.90 105.19 103.38 1b4q n GLY 40 Ca 0.00 -0.64 -0.13 0.00 0.00 0.00 0.00 46.02 45.25 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 2.56 1.34 -4.76 0.99 7.94 -1.26 -4.88 117.00 118.93 1b4q n LEU 41 Ca 0.23 0.12 -0.38 0.00 -1.11 0.00 0.00 56.01 54.87 1b4q n LEU 41 Cb 0.53 -0.18 -0.06 0.00 0.53 0.00 0.00 43.42 44.24 1b4q n LEU 41 CO 0.15 0.63 0.13 -0.22 -1.11 0.00 0.00 177.39 176.96 1b4q s LEU 42 N -6.15 4.35 0.27 -1.96 2.96 -1.25 -2.44 118.68 114.46 1b4q s LEU 42 Ca -0.16 0.84 -0.01 0.00 -0.22 0.00 0.00 54.13 54.58 1b4q s LEU 42 Cb 0.07 -2.62 -0.02 0.00 0.50 0.00 0.00 46.19 44.12 1b4q s LEU 42 CO 0.77 0.14 0.29 -0.70 -1.32 0.00 0.00 176.35 175.53 1b4q s GLU 43 N -0.04 1.54 -0.19 1.98 2.12 -1.19 -5.03 118.70 117.89 1b4q s GLU 43 Ca 0.24 -1.69 -0.04 0.00 0.36 0.00 0.00 54.97 53.84 1b4q s GLU 43 Cb -0.16 0.35 0.06 0.00 0.26 0.00 0.00 34.13 34.65 1b4q s GLU 43 CO 0.11 -0.58 0.06 -0.06 -0.54 0.00 0.00 175.26 174.25 1b4q s PHE 44 N -3.73 0.69 -0.47 5.30 0.08 -1.26 -2.89 117.98 115.69 1b4q s PHE 44 Ca 0.35 -0.65 -0.19 0.00 0.12 0.00 0.00 56.93 56.56 1b4q s PHE 44 Cb 0.03 -0.90 0.05 0.00 -0.57 0.00 0.00 43.02 41.63 1b4q s PHE 44 CO 0.17 -0.58 0.56 0.08 -0.10 0.00 0.00 175.22 175.36 1b4q s VAL 45 N 1.97 4.95 -0.71 -0.44 1.01 0.65 -4.93 120.40 122.90 1b4q s VAL 45 Ca 0.01 -0.43 -0.26 0.00 0.00 0.00 0.00 61.98 61.30 1b4q s VAL 45 Cb -0.17 -4.21 0.04 0.00 0.00 0.00 0.00 36.38 32.05 1b4q s VAL 45 CO -0.09 -0.67 1.18 -1.81 0.00 0.00 0.00 175.10 173.71 1b4q s ASP 46 N 2.38 6.17 0.00 3.32 1.11 -1.26 -0.35 116.67 128.04 1b4q s ASP 46 Ca 0.14 -0.61 0.07 0.00 0.18 0.00 0.00 52.55 52.33 1b4q s ASP 46 Cb -0.18 -2.52 0.39 0.00 1.07 0.00 0.00 42.92 41.68 1b4q s ASP 46 CO 0.13 -1.72 0.80 2.30 1.18 0.00 0.00 175.17 177.86 1b4q n ILE 47 N 6.24 0.00 -0.06 0.77 -5.35 -0.97 -1.77 119.36 118.23 1b4q n ILE 47 Ca 0.01 0.00 -0.10 0.00 -0.27 0.00 0.00 62.75 62.39 1b4q n ILE 47 Cb 0.48 -0.73 -0.15 0.00 -1.74 0.00 0.00 39.64 37.51 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 -0.87 1.52 0.85 7.28 -2.24 -1.26 -3.88 114.28 115.68 1b4q n THR 48 Ca 0.05 -0.81 -0.00 0.00 -2.27 0.00 0.00 64.05 61.02 1b4q n THR 48 Cb 0.02 -0.84 0.03 0.00 -2.10 0.00 0.00 70.33 67.44 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 -2.70 2.64 -0.81 6.98 0.00 -0.73 -3.18 120.51 122.70 1b4q n ALA 49 Ca -0.26 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.02 1b4q n ALA 49 Cb 1.10 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 19.53 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 0.14 0.00 -4.74 0.00 5.66 -1.26 -5.06 114.28 109.02 1b4q n THR 50 Ca 0.03 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.03 1b4q n THR 50 Cb 0.39 1.65 0.00 0.00 -1.55 0.00 0.00 70.33 70.82 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 0.00 -4.12 -1.23 1.09 4.13 -1.19 -4.79 115.26 109.15 1b4q n ASN 51 Ca 0.00 0.00 -0.11 0.00 1.68 0.00 0.00 54.58 56.15 1b4q n ASN 51 Cb 0.19 0.00 -0.05 0.00 -1.54 0.00 0.00 39.78 38.38 1b4q n ASN 51 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 1b4q n HIS 52 N -1.27 -0.39 -0.26 3.10 8.25 -1.26 -4.78 115.22 118.61 1b4q n HIS 52 Ca 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.39 1b4q n HIS 52 Cb 0.00 -2.33 -0.06 0.00 1.12 0.00 0.00 29.99 28.72 1b4q n HIS 52 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1b4q n THR 53 N -1.73 -0.42 -0.23 1.59 -1.04 -1.26 0.10 114.28 111.30 1b4q n THR 53 Ca -0.11 1.74 0.09 0.00 -2.04 0.00 0.00 64.05 63.73 1b4q n THR 53 Cb 0.38 -2.17 0.36 0.00 -1.82 0.00 0.00 70.33 67.08 1b4q n THR 53 CO 0.00 0.00 0.00 0.78 -0.64 0.00 0.00 175.07 175.21 1b4q h ASN 54 N 0.00 0.67 -0.49 8.00 4.21 -1.92 -1.86 115.58 124.20 1b4q h ASN 54 Ca 0.10 0.02 -0.01 0.00 1.21 0.00 0.00 56.30 57.61 1b4q h ASN 54 Cb 0.25 -0.12 -0.02 0.00 -1.12 0.00 0.00 38.32 37.31 1b4q h ASN 54 CO -0.57 0.40 0.26 -0.33 -1.29 0.00 0.00 177.43 175.89 1b4q h GLU 55 N 0.74 0.68 0.29 0.81 3.07 0.33 0.52 114.58 121.03 1b4q h GLU 55 Ca 0.37 -0.09 -0.01 0.00 -0.50 0.00 0.00 59.36 59.13 1b4q h GLU 55 Cb 0.45 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 28.23 1b4q h GLU 55 CO -0.14 0.55 -0.14 0.82 -1.40 0.00 0.00 179.01 178.69 1b4q h ILE 56 N 0.64 0.73 -0.59 3.13 5.03 -0.54 -0.08 117.51 125.83 1b4q h ILE 56 Ca 0.17 -0.56 0.05 0.00 -0.12 0.00 0.00 64.86 64.40 1b4q h ILE 56 Cb 0.07 1.02 -0.05 0.00 -3.03 0.00 0.00 36.82 34.84 1b4q h ILE 56 CO -0.03 0.11 0.31 1.56 -0.68 0.00 0.00 178.15 179.43 1b4q h GLN 57 N -0.71 0.57 -0.85 2.37 4.20 -1.35 0.99 115.11 120.34 1b4q h GLN 57 Ca -0.04 -0.03 0.18 0.00 0.06 0.00 0.00 58.65 58.82 1b4q h GLN 57 Cb 0.48 -0.13 -0.06 0.00 0.30 0.00 0.00 27.48 28.07 1b4q h GLN 57 CO 0.07 0.38 0.56 -0.44 -0.67 0.00 0.00 178.83 178.73 1b4q h ASP 58 N 0.59 0.41 0.05 1.46 5.19 0.19 0.30 116.42 124.61 1b4q h ASP 58 Ca 0.26 0.03 -0.10 0.00 -0.62 0.00 0.00 57.03 56.61 1b4q h ASP 58 Cb 0.16 -0.04 0.01 0.00 0.18 0.00 0.00 39.33 39.64 1b4q h ASP 58 CO -0.17 0.18 -0.41 0.22 -3.12 0.00 0.00 179.24 175.94 1b4q h TYR 59 N 0.42 0.32 -0.96 4.55 5.03 0.20 -3.10 116.97 123.43 1b4q h TYR 59 Ca 0.43 -0.21 0.17 0.00 2.58 0.00 0.00 58.73 61.70 1b4q h TYR 59 Cb 1.03 -0.02 -0.09 0.00 1.55 0.00 0.00 36.73 39.20 1b4q h TYR 59 CO -0.00 1.10 0.61 -0.07 -1.32 0.00 0.00 178.16 178.48 1b4q h LEU 60 N -0.55 0.70 0.34 2.82 3.38 0.25 0.86 115.31 123.12 1b4q h LEU 60 Ca -0.07 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1b4q h LEU 60 Cb 1.25 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.92 1b4q h LEU 60 CO 0.08 0.30 -0.29 -0.61 0.09 0.00 0.00 178.44 178.01 1b4q h GLN 61 N 0.72 -0.63 0.00 1.13 5.75 -0.51 0.45 115.11 122.01 1b4q h GLN 61 Ca 0.51 0.04 -0.07 0.00 -0.15 0.00 0.00 58.65 58.99 1b4q h GLN 61 Cb 0.85 0.14 -0.01 0.00 1.07 0.00 0.00 27.48 29.53 1b4q h GLN 61 CO -0.28 -0.42 -0.32 1.96 -2.65 0.00 0.00 178.83 177.12 1b4q h GLN 62 N -0.65 0.00 0.16 1.69 1.08 -0.95 0.66 115.11 117.10 1b4q h GLN 62 Ca -0.02 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.17 1b4q h GLN 62 Cb 0.58 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.01 1b4q h GLN 62 CO -0.03 0.32 -0.07 1.25 -0.95 0.00 0.00 178.83 179.35 1b4q h LEU 63 N 0.00 -0.18 0.00 1.46 6.46 0.15 -3.42 115.31 119.79 1b4q h LEU 63 Ca -0.00 0.01 -0.27 0.00 -0.12 0.00 0.00 57.88 57.49 1b4q h LEU 63 Cb 0.60 0.05 -0.04 0.00 -0.73 0.00 0.00 40.66 40.54 1b4q h LEU 63 CO 0.04 -0.10 -1.84 1.07 -0.62 0.00 0.00 178.44 176.99 1b4q n THR 64 N -2.68 1.31 0.00 1.05 5.66 0.06 -5.07 114.28 114.61 1b4q n THR 64 Ca -0.03 -0.17 0.00 0.00 -3.05 0.00 0.00 64.05 60.81 1b4q n THR 64 Cb 0.08 -1.93 0.00 0.00 -1.55 0.00 0.00 70.33 66.94 1b4q n THR 64 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1b4q n GLY 65 N 1.65 2.81 3.88 1.09 0.00 0.22 -5.01 105.19 109.83 1b4q n GLY 65 Ca -0.35 -0.35 -0.35 0.00 0.00 0.00 0.00 46.02 44.98 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 3.81 -0.23 4.61 0.00 -1.26 -4.64 121.76 124.05 1b4q s ALA 66 Ca 0.00 -0.51 0.13 0.00 0.00 0.00 0.00 51.96 51.58 1b4q s ALA 66 Cb 0.00 -2.13 0.52 0.00 0.00 0.00 0.00 23.12 21.51 1b4q s ALA 66 CO 0.00 0.62 1.45 2.89 0.00 0.00 0.00 175.76 180.72 1b4q n ARG 67 N 1.08 2.46 -2.03 0.00 1.85 -1.26 -4.08 116.66 114.67 1b4q n ARG 67 Ca -0.10 -2.97 -0.28 0.00 -1.00 0.00 0.00 57.85 53.50 1b4q n ARG 67 Cb 0.53 -1.84 0.08 0.00 -1.05 0.00 0.00 32.46 30.18 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 -3.00 2.12 -0.12 8.89 2.01 -1.26 -5.01 115.64 119.26 1b4q s THR 68 Ca 0.43 -0.12 -0.01 0.00 0.31 0.00 0.00 61.69 62.30 1b4q s THR 68 Cb 0.37 -3.00 -0.02 0.00 0.01 0.00 0.00 72.50 69.86 1b4q s THR 68 CO 0.05 0.00 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.22 1b4q s VAL 69 N -3.43 3.55 0.00 3.82 1.01 -1.26 -4.12 120.40 119.96 1b4q s VAL 69 Ca 0.61 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 62.10 1b4q s VAL 69 Cb -0.11 -2.51 0.00 0.00 0.00 0.00 0.00 36.38 33.76 1b4q s VAL 69 CO 0.47 0.53 0.00 -0.81 0.00 0.00 0.00 175.10 175.29 1b4q n PRO 70 N 3.21 0.40 -3.39 2.72 -0.04 -1.26 -4.34 135.00 132.30 1b4q n PRO 70 Ca -0.18 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.08 1b4q n PRO 70 Cb 0.53 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.90 1b4q n PRO 70 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1b4q s ARG 71 N -2.23 0.61 0.46 0.54 6.06 -1.06 -4.24 118.95 119.09 1b4q s ARG 71 Ca 0.00 -0.97 -0.12 0.00 -2.50 0.00 0.00 55.73 52.14 1b4q s ARG 71 Cb 0.00 -0.87 -0.07 0.00 0.06 0.00 0.00 34.95 34.08 1b4q s ARG 71 CO 0.00 -1.20 0.86 0.08 -2.50 0.00 0.00 175.30 172.54 1b4q s VAL 72 N 1.35 4.71 -0.35 7.11 1.01 -0.80 -2.70 120.40 130.73 1b4q s VAL 72 Ca 0.17 0.81 0.00 0.00 0.00 0.00 0.00 61.98 62.96 1b4q s VAL 72 Cb -0.17 -3.75 0.14 0.00 0.00 0.00 0.00 36.38 32.60 1b4q s VAL 72 CO -0.03 -0.64 0.25 -0.36 0.00 0.00 0.00 175.10 174.32 1b4q s PHE 73 N -2.54 0.31 -0.27 5.22 0.40 -0.89 -3.51 117.98 116.70 1b4q s PHE 73 Ca 0.54 -1.23 -0.29 0.00 -0.60 0.00 0.00 56.93 55.35 1b4q s PHE 73 Cb -0.10 -0.74 -0.01 0.00 0.51 0.00 0.00 43.02 42.68 1b4q s PHE 73 CO 0.34 -0.87 1.51 0.42 0.70 0.00 0.00 175.22 177.31 1b4q s ILE 74 N 1.36 3.85 0.00 0.64 -1.09 -0.74 -3.49 121.20 121.73 1b4q s ILE 74 Ca 0.16 0.94 0.00 0.00 -2.23 0.00 0.00 60.65 59.52 1b4q s ILE 74 Cb -0.20 -3.89 0.00 0.00 -1.58 0.00 0.00 42.46 36.79 1b4q s ILE 74 CO -0.06 -0.40 0.00 0.61 -1.23 0.00 0.00 174.94 173.86 1b4q n GLY 75 N 4.62 0.90 0.00 6.18 0.00 -0.43 -1.12 105.19 115.34 1b4q n GLY 75 Ca 0.17 -0.82 0.12 0.00 0.00 0.00 0.00 46.02 45.50 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 0.91 -2.98 1.61 5.02 -1.26 -4.55 118.16 116.91 1b4q n LYS 76 Ca 0.00 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.86 1b4q n LYS 76 Cb 0.00 -1.41 -0.05 0.00 -0.02 0.00 0.00 35.03 33.54 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 -1.84 6.46 0.34 4.39 1.11 -0.28 -5.04 116.67 121.81 1b4q s ASP 77 Ca 0.36 0.08 -0.26 0.00 0.18 0.00 0.00 52.55 52.91 1b4q s ASP 77 Cb 0.17 -2.38 -0.09 0.00 1.07 0.00 0.00 42.92 41.68 1b4q s ASP 77 CO 0.28 -0.81 1.02 -0.55 1.18 0.00 0.00 175.17 176.29 1b4q s SER 78 N 1.99 7.12 -0.03 0.27 0.15 -1.26 -1.80 113.70 120.13 1b4q s SER 78 Ca 0.30 2.03 0.14 0.00 0.70 0.00 0.00 55.95 59.11 1b4q s SER 78 Cb -0.13 -2.60 -0.21 0.00 -1.71 0.00 0.00 66.02 61.38 1b4q s SER 78 CO 0.20 -0.24 0.27 2.30 1.20 0.00 0.00 173.24 176.97 1b4q n ILE 79 N 0.53 0.12 0.00 6.45 -5.35 -1.23 -4.91 119.36 114.98 1b4q n ILE 79 Ca 0.02 -0.35 0.00 0.00 -0.27 0.00 0.00 62.75 62.15 1b4q n ILE 79 Cb 0.48 0.07 0.00 0.00 -1.74 0.00 0.00 39.64 38.45 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 1.79 0.44 0.00 3.28 0.00 -1.26 -4.68 105.19 104.76 1b4q n GLY 80 Ca -0.05 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.26 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 2.38 0.19 -0.02 0.00 -1.26 -1.91 105.19 104.57 1b4q n GLY 81 Ca 0.00 -1.79 -0.06 0.00 0.00 0.00 0.00 46.02 44.17 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 -0.35 -0.27 1.61 0.87 -1.81 -2.23 113.55 111.37 1b4q h SER 82 Ca 0.00 0.01 0.08 0.00 -1.23 0.00 0.00 61.79 60.65 1b4q h SER 82 Cb 0.00 0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.04 1b4q h SER 82 CO 0.00 0.01 0.42 -1.28 -0.53 0.00 0.00 176.83 175.45 1b4q h SER 83 N -0.94 0.00 0.04 6.23 0.87 -1.95 -0.37 113.55 117.43 1b4q h SER 83 Ca -0.04 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.52 1b4q h SER 83 Cb 0.32 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.28 1b4q h SER 83 CO 0.07 0.00 -0.02 0.44 -0.53 0.00 0.00 176.83 176.79 1b4q h ASP 84 N 0.00 -0.04 0.10 6.23 5.19 -1.88 -2.98 116.42 123.04 1b4q h ASP 84 Ca 0.13 -0.65 0.01 0.00 -0.62 0.00 0.00 57.03 55.90 1b4q h ASP 84 Cb 0.97 0.01 -0.05 0.00 0.18 0.00 0.00 39.33 40.44 1b4q h ASP 84 CO -0.00 0.69 -0.52 0.25 -3.12 0.00 0.00 179.24 176.54 1b4q h LEU 85 N -0.82 -1.57 -0.43 1.55 6.46 -0.43 -2.35 115.31 117.71 1b4q h LEU 85 Ca -0.00 0.17 0.09 0.00 -0.12 0.00 0.00 57.88 58.01 1b4q h LEU 85 Cb 0.69 0.58 -0.09 0.00 -0.73 0.00 0.00 40.66 41.11 1b4q h LEU 85 CO 0.01 -0.54 -0.21 -0.37 -0.62 0.00 0.00 178.44 176.71 1b4q h VAL 86 N -0.73 0.38 -1.13 1.05 -1.51 -1.61 0.36 116.25 113.07 1b4q h VAL 86 Ca -0.00 0.00 0.36 0.00 -1.23 0.00 0.00 66.70 65.82 1b4q h VAL 86 Cb 0.74 0.38 -0.13 0.00 -2.13 0.00 0.00 31.29 30.15 1b4q h VAL 86 CO -0.29 0.00 0.70 -1.28 -1.23 0.00 0.00 177.57 175.46 1b4q h SER 87 N -0.13 0.39 0.21 4.19 0.87 -1.26 0.17 113.55 117.99 1b4q h SER 87 Ca 0.21 0.15 -0.32 0.00 -1.23 0.00 0.00 61.79 60.60 1b4q h SER 87 Cb 0.45 0.11 0.03 0.00 -0.44 0.00 0.00 62.40 62.54 1b4q h SER 87 CO -0.51 -0.12 -1.45 -0.07 -0.53 0.00 0.00 176.83 174.15 1b4q h LEU 88 N 0.23 0.70 0.75 2.23 3.38 -0.08 -3.19 115.31 119.34 1b4q h LEU 88 Ca 0.74 -0.93 -0.03 0.00 0.09 0.00 0.00 57.88 57.75 1b4q h LEU 88 Cb 2.00 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 42.52 1b4q h LEU 88 CO -0.48 1.68 -0.43 -0.61 0.09 0.00 0.00 178.44 178.69 1b4q h GLN 89 N 0.03 -1.06 0.00 1.13 5.75 0.18 0.94 115.11 122.07 1b4q h GLN 89 Ca -0.27 0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 58.30 1b4q h GLN 89 Cb 2.05 0.24 -0.00 0.00 1.07 0.00 0.00 27.48 30.84 1b4q h GLN 89 CO 0.22 -0.71 -0.03 -0.56 -2.65 0.00 0.00 178.83 175.10 1b4q h GLN 90 N -1.10 0.00 0.11 1.69 3.07 -1.54 -2.25 115.11 115.09 1b4q h GLN 90 Ca -0.10 0.00 -0.15 0.00 0.09 0.00 0.00 58.65 58.49 1b4q h GLN 90 Cb 0.88 0.00 0.02 0.00 0.08 0.00 0.00 27.48 28.45 1b4q h GLN 90 CO 0.11 0.03 -0.66 0.77 0.09 0.00 0.00 178.83 179.17 1b4q h SER 91 N 0.00 0.39 0.00 0.06 0.02 -1.35 -3.48 113.55 109.18 1b4q h SER 91 Ca -0.00 -0.96 0.00 0.00 -0.84 0.00 0.00 61.79 59.99 1b4q h SER 91 Cb 0.08 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.49 1b4q h SER 91 CO 0.00 1.32 0.00 0.61 -1.14 0.00 0.00 176.83 177.62 1b4q n GLY 92 N 1.64 0.91 0.22 -3.77 0.00 0.32 -4.94 105.19 99.57 1b4q n GLY 92 Ca -0.13 0.00 0.09 0.00 0.00 0.00 0.00 46.02 45.98 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 1.57 0.00 0.65 1.61 4.57 -1.80 -3.13 114.58 118.04 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 0.01 0.00 -0.16 0.00 0.00 28.75 28.60 1b4q h GLU 93 CO 0.00 0.25 -0.31 1.25 -1.18 0.00 0.00 179.01 179.02 1b4q h LEU 94 N 0.00 -0.74 -2.02 1.64 5.85 -1.86 -1.27 115.31 116.91 1b4q h LEU 94 Ca -0.00 0.03 0.14 0.00 0.84 0.00 0.00 57.88 58.88 1b4q h LEU 94 Cb 0.67 0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.88 1b4q h LEU 94 CO 0.03 -0.53 0.40 0.17 -0.34 0.00 0.00 178.44 178.17 1b4q h LEU 95 N -0.87 0.00 0.00 2.25 8.10 -1.85 0.87 115.31 123.81 1b4q h LEU 95 Ca -0.09 0.00 -0.00 0.00 0.11 0.00 0.00 57.88 57.90 1b4q h LEU 95 Cb 0.67 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.89 1b4q h LEU 95 CO 0.15 0.00 -0.00 0.74 -4.11 0.00 0.00 178.44 175.21 1b4q h THR 96 N 0.00 1.21 -0.20 0.15 2.02 -1.39 0.55 112.91 115.25 1b4q h THR 96 Ca 0.23 -0.63 0.03 0.00 0.77 0.00 0.00 66.41 66.81 1b4q h THR 96 Cb 1.02 1.64 -0.01 0.00 -1.74 0.00 0.00 68.15 69.06 1b4q h THR 96 CO -0.00 0.16 0.14 0.03 0.37 0.00 0.00 175.52 176.22 1b4q h ARG 97 N -0.28 0.13 -0.21 6.66 3.08 0.32 0.23 114.38 124.31 1b4q h ARG 97 Ca -0.00 -0.01 -0.20 0.00 0.07 0.00 0.00 59.98 59.85 1b4q h ARG 97 Cb 0.27 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.30 1b4q h ARG 97 CO 0.00 0.09 -0.63 -0.07 -1.07 0.00 0.00 179.97 178.29 1b4q h LEU 98 N 0.14 0.93 0.18 3.04 4.07 -0.72 -3.28 115.31 119.66 1b4q h LEU 98 Ca 0.09 -0.58 -0.01 0.00 0.08 0.00 0.00 57.88 57.46 1b4q h LEU 98 Cb 0.18 -0.27 0.00 0.00 1.08 0.00 0.00 40.66 41.66 1b4q h LEU 98 CO -0.01 1.35 -0.09 0.50 -1.08 0.00 0.00 178.44 179.11 1b4q h LYS 99 N 0.55 -0.23 -0.93 1.13 3.64 0.31 0.96 116.57 122.00 1b4q h LYS 99 Ca -0.02 0.02 0.24 0.00 -1.27 0.00 0.00 60.65 59.62 1b4q h LYS 99 Cb 1.25 0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 33.07 1b4q h LYS 99 CO 0.14 0.04 0.63 -0.56 -2.27 0.00 0.00 179.45 177.43 1b4q h GLN 100 N -0.48 0.23 0.00 1.90 3.07 -0.90 0.16 115.11 119.08 1b4q h GLN 100 Ca -0.02 -0.01 0.00 0.00 0.09 0.00 0.00 58.65 58.70 1b4q h GLN 100 Cb 0.37 -0.05 0.00 0.00 0.08 0.00 0.00 27.48 27.88 1b4q h GLN 100 CO 0.04 0.16 -1.61 0.44 0.09 0.00 0.00 178.83 177.94 1b4q n ILE 101 N -4.43 0.01 -2.15 1.86 -5.35 -1.15 -4.99 119.36 103.16 1b4q n ILE 101 Ca 0.20 -0.32 0.00 0.00 -0.27 0.00 0.00 62.75 62.36 1b4q n ILE 101 Cb 0.84 0.35 0.00 0.00 -1.74 0.00 0.00 39.64 39.10 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 1.35 0.74 0.06 3.28 0.00 0.27 -4.65 105.19 106.23 1b4q n GLY 102 Ca -0.01 -0.56 0.12 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 -1.75 2.80 -2.65 4.61 0.00 0.23 -4.88 120.51 118.88 1b4q n ALA 103 Ca 0.00 -0.20 -0.14 0.00 0.00 0.00 0.00 53.44 53.11 1b4q n ALA 103 Cb 0.47 -1.26 0.06 0.00 0.00 0.00 0.00 19.45 18.72 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 -2.02 0.00 0.00 0.00 -0.00 -1.26 -2.77 117.00 110.96 1b4q n LEU 104 Ca 0.04 -1.30 0.14 0.00 -0.00 0.00 0.00 56.01 54.90 1b4q n LEU 104 Cb 0.42 -0.33 0.84 0.00 -0.00 0.00 0.00 43.42 44.34 1b4q n LEU 104 CO 0.34 -0.73 1.01 0.00 -0.00 0.00 0.00 177.39 178.01