#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3lr7 s LEU 2 N 0.00 4.05 0.83 0.99 1.02 -1.26 -5.11 118.68 119.20 3lr7 s LEU 2 Ca 0.00 0.12 -0.12 0.00 0.02 0.00 0.00 54.13 54.15 3lr7 s LEU 2 Cb 0.00 -2.67 0.09 0.00 0.02 0.00 0.00 46.19 43.63 3lr7 s LEU 2 CO 0.00 0.18 1.13 -0.94 0.02 0.00 0.00 176.35 176.74 3lr7 s SER 3 N -2.39 4.26 0.21 2.29 1.04 -1.26 -4.83 113.70 113.02 3lr7 s SER 3 Ca 0.31 1.07 -0.10 0.00 0.48 0.00 0.00 55.95 57.71 3lr7 s SER 3 Cb -0.13 -1.71 0.19 0.00 0.10 0.00 0.00 66.02 64.47 3lr7 s SER 3 CO 0.24 -2.09 1.85 0.44 0.98 0.00 0.00 173.24 174.66 3lr7 h ASP 4 N -1.18 0.74 -0.99 7.02 3.32 -1.99 -1.33 116.42 122.01 3lr7 h ASP 4 Ca -0.48 -0.00 0.04 0.00 0.02 0.00 0.00 57.03 56.61 3lr7 h ASP 4 Cb 1.30 -0.16 -0.06 0.00 0.22 0.00 0.00 39.33 40.63 3lr7 h ASP 4 CO 0.62 0.52 0.65 1.23 -1.72 0.00 0.00 179.24 180.53 3lr7 h GLY 5 N 0.88 1.45 0.89 2.75 0.00 -2.00 -1.43 103.07 105.61 3lr7 h GLY 5 Ca 0.28 -0.49 -0.10 0.00 0.00 0.00 0.00 47.33 47.02 3lr7 h GLY 5 CO -0.10 0.41 -0.25 0.83 0.00 0.00 0.00 176.54 177.43 3lr7 h GLU 6 N 1.24 0.57 -0.91 4.80 5.08 -1.80 -2.13 114.58 121.44 3lr7 h GLU 6 Ca 0.40 -0.31 0.05 0.00 -1.00 0.00 0.00 59.36 58.49 3lr7 h GLU 6 Cb 0.02 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.22 3lr7 h GLU 6 CO -0.13 0.91 0.58 -1.49 -1.00 0.00 0.00 179.01 177.88 3lr7 h TRP 7 N 0.27 1.09 -0.81 4.33 4.06 -1.05 -0.42 115.95 123.42 3lr7 h TRP 7 Ca 0.03 0.03 0.02 0.00 2.06 0.00 0.00 58.89 61.03 3lr7 h TRP 7 Cb 0.82 -0.36 -0.04 0.00 -1.00 0.00 0.00 29.16 28.57 3lr7 h TRP 7 CO 0.08 0.59 0.53 0.37 -3.56 0.00 0.00 178.44 176.45 3lr7 h GLN 8 N 1.10 1.03 -0.11 0.49 4.15 -1.05 -1.19 115.11 119.54 3lr7 h GLN 8 Ca 0.38 -0.06 -0.00 0.00 0.77 0.00 0.00 58.65 59.74 3lr7 h GLN 8 Cb 0.09 -0.23 -0.01 0.00 0.21 0.00 0.00 27.48 27.54 3lr7 h GLN 8 CO -0.15 0.68 0.06 1.96 -1.93 0.00 0.00 178.83 179.46 3lr7 h GLN 9 N 1.06 0.15 -0.46 1.69 1.08 -0.73 -0.99 115.11 116.91 3lr7 h GLN 9 Ca 0.30 -0.02 0.09 0.00 -1.45 0.00 0.00 58.65 57.58 3lr7 h GLN 9 Cb -0.08 -0.03 -0.09 0.00 -0.05 0.00 0.00 27.48 27.23 3lr7 h GLN 9 CO -0.08 0.18 -0.10 0.28 -0.95 0.00 0.00 178.83 178.15 3lr7 h VAL 10 N 0.08 0.55 0.00 -0.54 2.07 -0.62 -0.69 116.25 117.10 3lr7 h VAL 10 Ca 0.04 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.55 3lr7 h VAL 10 Cb 0.07 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 30.38 3lr7 h VAL 10 CO -0.01 0.00 0.00 -0.07 0.02 0.00 0.00 177.57 177.52 3lr7 h LEU 11 N 0.01 0.00 -0.06 2.57 3.38 -1.11 -1.10 115.31 119.00 3lr7 h LEU 11 Ca 0.22 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.13 3lr7 h LEU 11 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3lr7 h LEU 11 CO -0.47 0.00 -0.20 -1.13 0.09 0.00 0.00 178.44 176.74 3lr7 h ASN 12 N 0.00 0.28 -0.95 -0.43 -0.73 -0.53 -3.02 115.58 110.21 3lr7 h ASN 12 Ca 0.00 -0.61 0.08 0.00 1.87 0.00 0.00 56.30 57.64 3lr7 h ASN 12 Cb 0.86 -0.08 -0.07 0.00 0.27 0.00 0.00 38.32 39.30 3lr7 h ASN 12 CO 0.00 0.85 0.60 0.58 -0.37 0.00 0.00 177.43 179.08 3lr7 h VAL 13 N -0.26 1.02 0.00 2.57 2.07 -0.96 -2.05 116.25 118.64 3lr7 h VAL 13 Ca -0.01 -0.36 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 3lr7 h VAL 13 Cb 0.82 -0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 30.47 3lr7 h VAL 13 CO 0.04 0.19 -0.08 -0.25 0.02 0.00 0.00 177.57 177.49 3lr7 h TRP 14 N 1.05 0.00 -0.55 1.57 2.91 -1.16 0.51 115.95 120.27 3lr7 h TRP 14 Ca 0.43 0.00 0.09 0.00 1.13 0.00 0.00 58.89 60.54 3lr7 h TRP 14 Cb 0.25 0.00 -0.03 0.00 -0.51 0.00 0.00 29.16 28.87 3lr7 h TRP 14 CO -0.02 0.08 0.37 0.78 -1.03 0.00 0.00 178.44 178.63 3lr7 h GLY 15 N 0.66 0.51 0.93 2.65 0.00 -1.24 -1.01 103.07 105.57 3lr7 h GLY 15 Ca -0.00 -0.15 -0.04 0.00 0.00 0.00 0.00 47.33 47.14 3lr7 h GLY 15 CO 0.01 0.10 0.10 0.50 0.00 0.00 0.00 176.54 177.24 3lr7 h LYS 16 N 0.37 0.61 -0.63 4.80 1.57 -1.00 -2.85 116.57 119.44 3lr7 h LYS 16 Ca 0.25 -0.14 -0.04 0.00 -1.87 0.00 0.00 60.65 58.85 3lr7 h LYS 16 Cb 0.51 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.71 3lr7 h LYS 16 CO -0.06 0.64 0.23 0.28 -0.57 0.00 0.00 179.45 179.96 3lr7 h VAL 17 N 0.47 1.24 0.00 0.50 2.07 -1.36 -2.97 116.25 116.20 3lr7 h VAL 17 Ca 0.12 -0.79 -0.01 0.00 0.82 0.00 0.00 66.70 66.84 3lr7 h VAL 17 Cb 0.30 0.56 -0.00 0.00 -1.52 0.00 0.00 31.29 30.63 3lr7 h VAL 17 CO 0.00 0.31 -0.05 -0.33 0.02 0.00 0.00 177.57 177.52 3lr7 h GLU 18 N 0.90 0.00 0.00 1.57 5.08 -1.05 -1.57 114.58 119.51 3lr7 h GLU 18 Ca 0.21 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.55 3lr7 h GLU 18 Cb 0.25 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 3lr7 h GLU 18 CO -0.01 0.05 -0.10 0.00 -1.00 0.00 0.00 179.01 177.95 3lr7 h ALA 19 N 1.95 0.98 -0.88 3.43 0.00 -1.34 -3.36 119.26 120.05 3lr7 h ALA 19 Ca -0.00 -0.09 -0.36 0.00 0.00 0.00 0.00 54.91 54.46 3lr7 h ALA 19 Cb 0.35 -0.02 -0.25 0.00 0.00 0.00 0.00 17.79 17.88 3lr7 h ALA 19 CO 0.01 0.13 -0.75 -3.47 0.00 0.00 0.00 179.25 175.16 3lr7 n ASP 20 N -3.19 -1.65 -0.23 0.00 2.03 -0.66 -5.02 116.55 107.83 3lr7 n ASP 20 Ca 0.01 -3.03 -0.07 0.00 0.52 0.00 0.00 54.79 52.23 3lr7 n ASP 20 Cb 0.42 0.80 0.04 0.00 -0.72 0.00 0.00 41.12 41.66 3lr7 n ASP 20 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 3lr7 h ILE 21 N 2.70 1.22 -0.40 5.18 6.09 -1.53 -1.81 117.51 128.96 3lr7 h ILE 21 Ca -0.05 -0.63 -0.03 0.00 -1.37 0.00 0.00 64.86 62.79 3lr7 h ILE 21 Cb 0.97 0.45 -0.02 0.00 0.47 0.00 0.00 36.82 38.69 3lr7 h ILE 21 CO 0.37 0.26 0.15 0.00 -3.07 0.00 0.00 178.15 175.86 3lr7 h ALA 22 N 1.14 0.53 -0.43 0.18 0.00 -1.88 0.16 119.26 118.95 3lr7 h ALA 22 Ca 0.22 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 3lr7 h ALA 22 Cb 0.12 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3lr7 h ALA 22 CO -0.03 0.14 -0.02 0.78 0.00 0.00 0.00 179.25 180.12 3lr7 h GLY 23 N 0.51 0.84 0.94 0.00 0.00 -1.90 0.13 103.07 103.61 3lr7 h GLY 23 Ca 0.13 -0.64 -0.05 0.00 0.00 0.00 0.00 47.33 46.78 3lr7 h GLY 23 CO -0.01 0.59 0.09 0.45 0.00 0.00 0.00 176.54 177.65 3lr7 h HIS 24 N 0.62 0.72 -0.11 5.60 -0.00 -1.26 -1.54 115.15 119.18 3lr7 h HIS 24 Ca 0.12 -0.09 0.00 0.00 -0.00 0.00 0.00 60.37 60.40 3lr7 h HIS 24 Cb 0.52 -0.20 -0.01 0.00 -0.00 0.00 0.00 27.41 27.73 3lr7 h HIS 24 CO 0.04 0.69 0.07 0.78 -0.00 0.00 0.00 177.93 179.51 3lr7 h GLY 25 N 0.54 0.16 0.52 2.45 0.00 -0.51 -0.56 103.07 105.67 3lr7 h GLY 25 Ca 0.13 -0.06 0.05 0.00 0.00 0.00 0.00 47.33 47.44 3lr7 h GLY 25 CO 0.00 0.06 -0.08 -1.61 0.00 0.00 0.00 176.54 174.92 3lr7 h GLN 26 N 0.13 -0.03 -0.66 4.80 4.15 -0.69 -1.98 115.11 120.83 3lr7 h GLN 26 Ca 0.04 0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.40 3lr7 h GLN 26 Cb 0.00 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.67 3lr7 h GLN 26 CO -0.01 -0.02 0.18 0.93 -1.93 0.00 0.00 178.83 177.98 3lr7 h GLU 27 N -0.03 1.03 -0.31 1.69 5.08 -1.05 -0.24 114.58 120.76 3lr7 h GLU 27 Ca 0.11 -0.22 0.01 0.00 -1.00 0.00 0.00 59.36 58.25 3lr7 h GLU 27 Cb 0.20 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 3lr7 h GLU 27 CO -0.24 0.90 0.19 0.28 -1.00 0.00 0.00 179.01 179.14 3lr7 h VAL 28 N 0.99 1.05 -0.50 3.13 2.07 -0.87 0.35 116.25 122.48 3lr7 h VAL 28 Ca 0.21 -0.13 -0.12 0.00 0.82 0.00 0.00 66.70 67.48 3lr7 h VAL 28 Cb 0.32 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 3lr7 h VAL 28 CO -0.00 0.07 -0.18 -0.07 0.02 0.00 0.00 177.57 177.41 3lr7 h LEU 29 N 0.39 1.00 -0.79 2.57 3.38 -1.08 -0.53 115.31 120.25 3lr7 h LEU 29 Ca 0.12 -0.36 -0.08 0.00 0.09 0.00 0.00 57.88 57.65 3lr7 h LEU 29 Cb -0.02 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 3lr7 h LEU 29 CO -0.04 1.15 0.05 0.40 0.09 0.00 0.00 178.44 180.09 3lr7 h ILE 30 N 0.86 1.25 -0.35 1.22 2.04 -0.84 0.14 117.51 121.84 3lr7 h ILE 30 Ca 0.12 -1.04 -0.00 0.00 1.00 0.00 0.00 64.86 64.94 3lr7 h ILE 30 Cb 0.74 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 3lr7 h ILE 30 CO 0.06 0.38 0.20 -0.09 0.00 0.00 0.00 178.15 178.70 3lr7 h ARG 31 N 0.90 0.47 -0.08 2.37 9.65 -0.68 -1.00 114.38 126.01 3lr7 h ARG 31 Ca 0.18 -0.05 0.02 0.00 -1.10 0.00 0.00 59.98 59.03 3lr7 h ARG 31 Cb 0.46 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 28.92 3lr7 h ARG 31 CO 0.02 0.37 -0.02 1.25 2.80 0.00 0.00 179.97 184.39 3lr7 h LEU 32 N 0.44 -0.08 -0.54 3.80 5.85 -0.73 -1.60 115.31 122.46 3lr7 h LEU 32 Ca 0.12 0.02 -0.16 0.00 0.84 0.00 0.00 57.88 58.71 3lr7 h LEU 32 Cb 0.02 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 3lr7 h LEU 32 CO -0.02 -0.03 -0.63 -0.26 -0.34 0.00 0.00 178.44 177.16 3lr7 h PHE 33 N -0.00 0.49 0.15 1.25 0.04 -0.85 -0.29 116.94 117.74 3lr7 h PHE 33 Ca 0.04 -0.19 -0.29 0.00 2.80 0.00 0.00 57.97 60.33 3lr7 h PHE 33 Cb 0.06 -0.09 0.02 0.00 2.20 0.00 0.00 35.95 38.14 3lr7 h PHE 33 CO -0.14 0.91 -1.27 1.79 -0.60 0.00 0.00 178.31 179.00 3lr7 h THR 34 N 0.28 1.41 0.00 -1.55 1.35 -1.20 -2.90 112.91 110.29 3lr7 h THR 34 Ca -0.01 -2.83 -0.15 0.00 -0.55 0.00 0.00 66.41 62.88 3lr7 h THR 34 Cb 1.17 2.88 -0.02 0.00 -1.73 0.00 0.00 68.15 70.45 3lr7 h THR 34 CO 0.11 0.84 -0.70 1.23 -0.25 0.00 0.00 175.52 176.74 3lr7 h GLY 35 N 1.02 0.00 -6.21 5.82 0.00 -1.27 -3.40 103.07 99.03 3lr7 h GLY 35 Ca -0.17 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 46.61 3lr7 h GLY 35 CO 0.22 0.00 -0.94 1.42 0.00 0.00 0.00 176.54 177.24 3lr7 n HIS 36 N -3.68 -1.17 0.23 5.60 8.25 -0.12 -5.00 115.22 119.33 3lr7 n HIS 36 Ca -0.01 -3.15 0.18 0.00 -0.26 0.00 0.00 57.72 54.49 3lr7 n HIS 36 Cb 0.69 0.34 0.86 0.00 1.12 0.00 0.00 29.99 33.00 3lr7 n HIS 36 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 3lr7 h PRO 37 N 5.46 0.00 0.00 -0.41 0.11 -1.73 0.13 132.00 135.56 3lr7 h PRO 37 Ca 0.24 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.33 3lr7 h PRO 37 Cb 0.93 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.03 3lr7 h PRO 37 CO 0.35 0.00 -0.06 1.05 -0.21 0.00 0.00 178.00 179.13 3lr7 h GLU 38 N 0.00 0.00 -0.25 1.05 9.09 -1.93 -1.76 114.58 120.79 3lr7 h GLU 38 Ca 0.07 0.00 -0.10 0.00 0.05 0.00 0.00 59.36 59.38 3lr7 h GLU 38 Cb 0.57 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.66 3lr7 h GLU 38 CO -0.00 0.06 -0.27 1.79 0.05 0.00 0.00 179.01 180.64 3lr7 h THR 39 N 0.00 1.27 -0.34 -1.06 1.35 -1.29 -2.61 112.91 110.24 3lr7 h THR 39 Ca -0.00 -1.30 0.00 0.00 -0.55 0.00 0.00 66.41 64.56 3lr7 h THR 39 Cb 0.11 1.37 -0.02 0.00 -1.73 0.00 0.00 68.15 67.89 3lr7 h THR 39 CO 0.01 0.41 0.22 0.25 -0.25 0.00 0.00 175.52 176.16 3lr7 h LEU 40 N 0.42 0.39 -1.96 3.87 5.85 -1.45 -1.64 115.31 120.78 3lr7 h LEU 40 Ca 0.06 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.77 3lr7 h LEU 40 Cb 0.69 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.62 3lr7 h LEU 40 CO 0.05 0.28 0.00 -0.33 -0.34 0.00 0.00 178.44 178.11 3lr7 h GLU 41 N 0.46 0.00 0.00 1.25 4.39 -1.49 -1.71 114.58 117.47 3lr7 h GLU 41 Ca 0.12 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.82 3lr7 h GLU 41 Cb -0.05 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.60 3lr7 h GLU 41 CO -0.03 0.00 0.00 1.63 -1.16 0.00 0.00 179.01 179.45 3lr7 n LYS 42 N -2.88 0.23 -3.58 2.33 4.76 -0.62 -4.52 118.16 113.88 3lr7 n LYS 42 Ca -0.01 0.23 -0.40 0.00 -2.87 0.00 0.00 58.31 55.26 3lr7 n LYS 42 Cb 0.17 -1.79 -0.09 0.00 -1.84 0.00 0.00 35.03 31.48 3lr7 n LYS 42 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 3lr7 s PHE 43 N -3.13 3.36 0.36 2.13 0.40 -0.64 -4.95 117.98 115.52 3lr7 s PHE 43 Ca 0.10 -1.62 0.07 0.00 -0.60 0.00 0.00 56.93 54.88 3lr7 s PHE 43 Cb 0.12 -3.12 0.77 0.00 0.51 0.00 0.00 43.02 41.30 3lr7 s PHE 43 CO 0.55 -0.89 1.93 -0.44 0.70 0.00 0.00 175.22 177.07 3lr7 h ASP 44 N 8.43 0.66 0.16 1.36 3.32 -1.82 -1.61 116.42 126.92 3lr7 h ASP 44 Ca -0.22 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.84 3lr7 h ASP 44 Cb 1.08 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.51 3lr7 h ASP 44 CO 0.79 0.39 -0.01 2.29 -1.72 0.00 0.00 179.24 180.99 3lr7 n LYS 45 N -4.50 0.88 0.00 3.56 2.85 -1.26 -3.47 118.16 116.23 3lr7 n LYS 45 Ca 0.13 -0.08 0.00 0.00 -1.05 0.00 0.00 58.31 57.31 3lr7 n LYS 45 Cb 0.31 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.20 3lr7 n LYS 45 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 3lr7 n PHE 46 N -0.99 0.00 0.35 5.58 3.72 -0.74 -4.74 117.46 120.64 3lr7 n PHE 46 Ca 0.21 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.71 3lr7 n PHE 46 Cb 0.17 0.00 0.47 0.00 -0.94 0.00 0.00 39.48 39.18 3lr7 n PHE 46 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07 3lr7 n LYS 47 N -0.71 0.16 0.23 -1.08 2.85 -0.68 -1.16 118.16 117.76 3lr7 n LYS 47 Ca 0.00 0.45 0.11 0.00 -1.05 0.00 0.00 58.31 57.82 3lr7 n LYS 47 Cb 0.01 -1.84 0.47 0.00 -0.65 0.00 0.00 35.03 33.01 3lr7 n LYS 47 CO 0.00 0.00 0.00 1.12 -0.05 0.00 0.00 177.40 178.47 3lr7 h HIS 48 N 0.00 0.00 -2.03 5.58 2.07 -1.85 -3.43 115.15 115.49 3lr7 h HIS 48 Ca 0.00 0.00 -0.51 0.00 -2.85 0.00 0.00 60.37 57.01 3lr7 h HIS 48 Cb 0.27 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.22 3lr7 h HIS 48 CO 0.00 0.20 1.40 -0.51 -3.07 0.00 0.00 177.93 175.94 3lr7 s LEU 49 N -6.69 3.35 0.14 6.12 1.43 -0.31 -4.82 118.68 117.91 3lr7 s LEU 49 Ca 0.01 0.67 0.19 0.00 -1.03 0.00 0.00 54.13 53.97 3lr7 s LEU 49 Cb 0.10 -2.72 -0.05 0.00 0.03 0.00 0.00 46.19 43.55 3lr7 s LEU 49 CO 0.63 -2.35 0.98 0.11 0.23 0.00 0.00 176.35 175.95 3lr7 h LYS 50 N 15.47 0.00 -5.08 1.70 1.79 -1.87 -3.48 116.57 125.09 3lr7 h LYS 50 Ca -0.27 0.00 -0.34 0.00 -2.18 0.00 0.00 60.65 57.86 3lr7 h LYS 50 Cb 1.18 0.00 -0.15 0.00 -1.58 0.00 0.00 32.23 31.69 3lr7 h LYS 50 CO 1.17 0.19 -0.70 0.95 -1.08 0.00 0.00 179.45 179.97 3lr7 s THR 51 N -3.10 1.16 0.43 -0.16 -4.23 -1.26 -5.03 115.64 103.45 3lr7 s THR 51 Ca -0.01 -2.06 0.11 0.00 -1.18 0.00 0.00 61.69 58.55 3lr7 s THR 51 Cb 0.09 -1.95 0.22 0.00 1.34 0.00 0.00 72.50 72.20 3lr7 s THR 51 CO 0.79 -0.66 2.02 -0.08 -0.54 0.00 0.00 174.62 176.15 3lr7 h GLU 52 N 2.72 0.24 -0.65 3.99 4.81 -1.98 -1.09 114.58 122.61 3lr7 h GLU 52 Ca -0.37 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 58.77 3lr7 h GLU 52 Cb 1.20 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.51 3lr7 h GLU 52 CO 0.64 0.25 0.18 0.00 -0.73 0.00 0.00 179.01 179.35 3lr7 h ALA 53 N 1.78 0.86 -0.72 2.92 0.00 -1.98 0.38 119.26 122.50 3lr7 h ALA 53 Ca 0.06 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 3lr7 h ALA 53 Cb 0.15 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 3lr7 h ALA 53 CO 0.00 0.55 0.19 0.93 0.00 0.00 0.00 179.25 180.92 3lr7 h GLU 54 N 0.95 1.14 0.00 0.00 5.08 -1.82 -0.96 114.58 118.97 3lr7 h GLU 54 Ca 0.21 -0.26 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3lr7 h GLU 54 Cb 0.32 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.42 3lr7 h GLU 54 CO -0.00 0.99 -0.00 0.52 -1.00 0.00 0.00 179.01 179.52 3lr7 h MET 55 N 1.08 -0.00 -0.62 2.33 2.86 -0.55 -1.71 114.93 118.31 3lr7 h MET 55 Ca 0.23 0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.93 3lr7 h MET 55 Cb 0.35 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.98 3lr7 h MET 55 CO -0.00 0.07 0.41 0.87 1.06 0.00 0.00 176.91 179.32 3lr7 h LYS 56 N -0.08 0.58 -0.01 1.72 1.79 -0.08 -2.11 116.57 118.37 3lr7 h LYS 56 Ca -0.00 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.43 3lr7 h LYS 56 Cb 0.08 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 30.60 3lr7 h LYS 56 CO 0.00 0.38 -0.09 0.00 -1.08 0.00 0.00 179.45 178.66 3lr7 n ALA 57 N -2.48 2.75 -2.61 3.86 0.00 -0.38 -4.84 120.51 116.81 3lr7 n ALA 57 Ca 0.09 -0.45 -0.43 0.00 0.00 0.00 0.00 53.44 52.65 3lr7 n ALA 57 Cb 0.24 -1.13 -0.02 0.00 0.00 0.00 0.00 19.45 18.55 3lr7 n ALA 57 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3lr7 s SER 58 N -2.17 6.70 0.40 0.00 0.15 -0.67 -4.89 113.70 113.23 3lr7 s SER 58 Ca 0.33 0.60 0.21 0.00 0.70 0.00 0.00 55.95 57.79 3lr7 s SER 58 Cb 0.20 -2.53 0.70 0.00 -1.71 0.00 0.00 66.02 62.68 3lr7 s SER 58 CO 0.40 -1.09 1.73 -0.33 1.20 0.00 0.00 173.24 175.14 3lr7 h GLU 59 N 8.83 0.00 0.00 5.44 4.39 -1.88 -2.83 114.58 128.54 3lr7 h GLU 59 Ca -0.22 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.32 3lr7 h GLU 59 Cb 1.06 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.69 3lr7 h GLU 59 CO 1.08 0.29 -0.75 0.22 -1.16 0.00 0.00 179.01 178.69 3lr7 h ASP 60 N 0.00 0.00 -0.38 1.42 3.58 -1.96 -1.64 116.42 117.44 3lr7 h ASP 60 Ca -0.00 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 57.32 3lr7 h ASP 60 Cb 0.90 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.94 3lr7 h ASP 60 CO 0.04 0.75 -0.22 0.25 -2.88 0.00 0.00 179.24 177.18 3lr7 h LEU 61 N 0.00 0.90 -0.53 2.28 6.46 -1.83 -0.58 115.31 122.01 3lr7 h LEU 61 Ca -0.01 -0.34 -0.09 0.00 -0.12 0.00 0.00 57.88 57.33 3lr7 h LEU 61 Cb 1.35 -0.25 -0.02 0.00 -0.73 0.00 0.00 40.66 41.01 3lr7 h LEU 61 CO 0.10 1.09 -0.02 0.50 -0.62 0.00 0.00 178.44 179.49 3lr7 h LYS 62 N 0.76 0.94 -0.29 1.25 3.64 -1.42 -0.81 116.57 120.65 3lr7 h LYS 62 Ca 0.10 -0.31 0.03 0.00 -1.27 0.00 0.00 60.65 59.20 3lr7 h LYS 62 Cb 0.77 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.48 3lr7 h LYS 62 CO 0.06 0.97 0.10 -0.22 -2.27 0.00 0.00 179.45 178.09 3lr7 h LYS 63 N 0.81 0.22 -0.52 1.90 3.64 -1.03 -1.26 116.57 120.33 3lr7 h LYS 63 Ca 0.15 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.46 3lr7 h LYS 63 Cb 0.56 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.31 3lr7 h LYS 63 CO 0.03 0.14 0.11 1.25 -2.27 0.00 0.00 179.45 178.71 3lr7 h HIS 64 N 0.22 0.83 -1.01 1.91 2.76 -0.94 -2.14 115.15 116.79 3lr7 h HIS 64 Ca 0.13 -0.08 0.07 0.00 -2.20 0.00 0.00 60.37 58.29 3lr7 h HIS 64 Cb 0.10 -0.24 -0.07 0.00 1.55 0.00 0.00 27.41 28.75 3lr7 h HIS 64 CO -0.14 0.71 0.65 0.78 -1.30 0.00 0.00 177.93 178.64 3lr7 h GLY 65 N 0.96 1.54 1.02 5.26 0.00 -0.57 0.38 103.07 111.66 3lr7 h GLY 65 Ca 0.17 -0.47 -0.06 0.00 0.00 0.00 0.00 47.33 46.96 3lr7 h GLY 65 CO 0.00 0.33 0.13 -0.84 0.00 0.00 0.00 176.54 176.15 3lr7 h THR 66 N 1.17 1.25 -0.34 4.70 2.02 -0.81 -2.03 112.91 118.87 3lr7 h THR 66 Ca 0.44 -0.93 -0.02 0.00 0.77 0.00 0.00 66.41 66.66 3lr7 h THR 66 Cb 0.19 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 3lr7 h THR 66 CO -0.18 0.35 0.13 0.58 0.37 0.00 0.00 175.52 176.77 3lr7 h VAL 67 N 0.86 1.19 0.04 3.16 2.07 -0.64 -1.68 116.25 121.25 3lr7 h VAL 67 Ca 0.18 -0.59 -0.00 0.00 0.82 0.00 0.00 66.70 67.11 3lr7 h VAL 67 Cb 0.37 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 3lr7 h VAL 67 CO 0.01 0.21 -0.02 0.58 0.02 0.00 0.00 177.57 178.36 3lr7 h VAL 68 N 0.41 1.11 0.00 2.57 2.07 -0.89 -1.94 116.25 119.58 3lr7 h VAL 68 Ca 0.11 -0.47 -0.09 0.00 0.82 0.00 0.00 66.70 67.07 3lr7 h VAL 68 Cb 0.20 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 3lr7 h VAL 68 CO -0.01 0.12 -0.42 -0.07 0.02 0.00 0.00 177.57 177.21 3lr7 h LEU 69 N -0.25 0.00 -0.41 2.57 3.38 -1.41 -1.50 115.31 117.68 3lr7 h LEU 69 Ca -0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 3lr7 h LEU 69 Cb 0.23 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 3lr7 h LEU 69 CO 0.01 0.42 0.09 0.74 0.09 0.00 0.00 178.44 179.79 3lr7 h THR 70 N 0.00 1.23 -0.20 0.22 2.02 -1.21 0.25 112.91 115.23 3lr7 h THR 70 Ca -0.00 -0.81 -0.01 0.00 0.77 0.00 0.00 66.41 66.36 3lr7 h THR 70 Cb 0.91 0.97 -0.01 0.00 -1.74 0.00 0.00 68.15 68.28 3lr7 h THR 70 CO 0.06 0.28 0.10 0.00 0.37 0.00 0.00 175.52 176.33 3lr7 h ALA 71 N 0.95 0.25 -0.59 6.16 0.00 -1.06 -1.99 119.26 122.98 3lr7 h ALA 71 Ca 0.13 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.99 3lr7 h ALA 71 Cb 0.33 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 3lr7 h ALA 71 CO 0.00 -0.20 0.35 1.25 0.00 0.00 0.00 179.25 180.66 3lr7 h LEU 72 N 0.20 0.57 -1.01 0.00 5.85 -1.22 -2.23 115.31 117.47 3lr7 h LEU 72 Ca 0.07 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.82 3lr7 h LEU 72 Cb 0.10 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 40.96 3lr7 h LEU 72 CO -0.01 0.40 0.66 1.23 -0.34 0.00 0.00 178.44 180.38 3lr7 h GLY 73 N 0.70 1.46 1.01 3.75 0.00 -0.74 0.17 103.07 109.42 3lr7 h GLY 73 Ca 0.24 -0.51 0.00 0.00 0.00 0.00 0.00 47.33 47.06 3lr7 h GLY 73 CO -0.11 0.45 0.46 -1.33 0.00 0.00 0.00 176.54 176.01 3lr7 h GLY 74 N 1.30 1.02 0.89 4.60 0.00 -0.96 -1.81 103.07 108.11 3lr7 h GLY 74 Ca 0.39 -0.40 -0.06 0.00 0.00 0.00 0.00 47.33 47.27 3lr7 h GLY 74 CO -0.12 0.39 -0.04 -2.22 0.00 0.00 0.00 176.54 174.55 3lr7 h ILE 75 N 0.97 1.27 -0.58 2.60 2.04 -0.76 -3.03 117.51 120.03 3lr7 h ILE 75 Ca 0.26 -1.04 -0.02 0.00 1.00 0.00 0.00 64.86 65.05 3lr7 h ILE 75 Cb -0.08 1.35 -0.03 0.00 -0.74 0.00 0.00 36.82 37.32 3lr7 h ILE 75 CO -0.05 0.33 0.26 -0.07 0.00 0.00 0.00 178.15 178.62 3lr7 h LEU 76 N 0.33 0.74 0.00 1.44 3.38 -0.75 -1.65 115.31 118.80 3lr7 h LEU 76 Ca 0.08 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3lr7 h LEU 76 Cb 0.51 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.07 3lr7 h LEU 76 CO 0.02 0.65 0.00 0.29 0.09 0.00 0.00 178.44 179.49 3lr7 n LYS 77 N -4.35 0.15 0.00 1.13 5.02 -0.70 -1.30 118.16 118.11 3lr7 n LYS 77 Ca 0.05 0.15 0.13 0.00 -2.02 0.00 0.00 58.31 56.62 3lr7 n LYS 77 Cb 0.14 -1.50 0.44 0.00 -0.02 0.00 0.00 35.03 34.09 3lr7 n LYS 77 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3lr7 n LYS 78 N -1.37 0.10 -3.85 1.97 4.76 -0.62 -4.95 118.16 114.20 3lr7 n LYS 78 Ca 0.07 -0.04 -0.24 0.00 -2.87 0.00 0.00 58.31 55.22 3lr7 n LYS 78 Cb 0.17 -1.50 0.01 0.00 -1.84 0.00 0.00 35.03 31.87 3lr7 n LYS 78 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 3lr7 n LYS 79 N -1.41 -4.24 0.00 1.97 5.02 -0.42 -1.81 118.16 117.27 3lr7 n LYS 79 Ca 0.07 0.52 0.00 0.00 -2.02 0.00 0.00 58.31 56.88 3lr7 n LYS 79 Cb 0.33 -4.94 0.00 0.00 -0.02 0.00 0.00 35.03 30.40 3lr7 n LYS 79 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3lr7 n GLY 80 N -1.74 2.28 2.54 0.72 0.00 -1.26 -4.93 105.19 102.79 3lr7 n GLY 80 Ca -0.26 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.36 3lr7 n GLY 80 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3lr7 n HIS 81 N -2.00 2.64 -1.23 1.61 8.25 -0.75 -4.64 115.22 119.09 3lr7 n HIS 81 Ca 0.00 -2.81 0.08 0.00 -0.26 0.00 0.00 57.72 54.74 3lr7 n HIS 81 Cb 0.00 -1.82 0.13 0.00 1.12 0.00 0.00 29.99 29.42 3lr7 n HIS 81 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 3lr7 n HIS 82 N 1.93 0.00 -0.17 4.41 1.44 -1.26 -4.80 115.22 116.77 3lr7 n HIS 82 Ca 0.59 -0.93 -0.02 0.00 -2.01 0.00 0.00 57.72 55.36 3lr7 n HIS 82 Cb 0.26 -0.15 0.06 0.00 0.12 0.00 0.00 29.99 30.29 3lr7 n HIS 82 CO 0.00 0.00 0.00 1.49 -2.81 0.00 0.00 176.34 175.02 3lr7 h GLU 83 N 0.10 0.06 -0.40 -1.40 4.57 -1.99 0.12 114.58 115.63 3lr7 h GLU 83 Ca -0.00 -0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.09 3lr7 h GLU 83 Cb 1.05 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.61 3lr7 h GLU 83 CO 0.00 0.04 -0.08 0.00 -1.18 0.00 0.00 179.01 177.79 3lr7 h ALA 84 N 1.51 1.10 0.06 2.92 0.00 -2.00 -0.76 119.26 122.08 3lr7 h ALA 84 Ca 0.27 -0.29 -0.24 0.00 0.00 0.00 0.00 54.91 54.65 3lr7 h ALA 84 Cb 0.42 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 3lr7 h ALA 84 CO -0.50 0.56 -1.06 0.93 0.00 0.00 0.00 179.25 179.19 3lr7 h GLU 85 N 0.64 0.26 0.12 0.00 3.07 -1.79 -3.35 114.58 113.54 3lr7 h GLU 85 Ca 0.12 -0.36 -0.30 0.00 -0.50 0.00 0.00 59.36 58.31 3lr7 h GLU 85 Cb 0.52 0.12 -0.00 0.00 -0.84 0.00 0.00 28.75 28.54 3lr7 h GLU 85 CO 0.03 1.11 -1.51 1.25 -1.40 0.00 0.00 179.01 178.49 3lr7 h LEU 86 N 0.11 0.40 -0.33 1.33 6.46 -0.58 -3.38 115.31 119.33 3lr7 h LEU 86 Ca -0.09 -0.54 0.07 0.00 -0.12 0.00 0.00 57.88 57.20 3lr7 h LEU 86 Cb 1.74 -0.13 -0.08 0.00 -0.73 0.00 0.00 40.66 41.46 3lr7 h LEU 86 CO 0.17 1.45 -0.26 0.50 -0.62 0.00 0.00 178.44 179.68 3lr7 h LYS 87 N 0.07 -0.21 -0.26 1.25 3.64 -1.27 -0.72 116.57 119.07 3lr7 h LYS 87 Ca -0.23 0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.11 3lr7 h LYS 87 Cb 2.02 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 33.87 3lr7 h LYS 87 CO 0.17 -0.14 -0.06 -1.00 -2.27 0.00 0.00 179.45 176.15 3lr7 h PRO 88 N -0.22 0.41 -0.21 1.90 0.13 -1.75 -0.92 132.00 131.34 3lr7 h PRO 88 Ca 0.16 -0.09 -0.08 0.00 -0.87 0.00 0.00 66.00 65.12 3lr7 h PRO 88 Cb 0.48 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 31.55 3lr7 h PRO 88 CO -0.46 0.49 -0.18 -0.07 -0.23 0.00 0.00 178.00 177.55 3lr7 h LEU 89 N 0.39 0.52 -0.68 1.56 3.38 -1.55 0.20 115.31 119.13 3lr7 h LEU 89 Ca 0.08 -0.46 0.07 0.00 0.09 0.00 0.00 57.88 57.66 3lr7 h LEU 89 Cb 0.36 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 40.90 3lr7 h LEU 89 CO 0.02 0.88 0.37 0.00 0.09 0.00 0.00 178.44 179.79 3lr7 h ALA 90 N 0.66 0.93 -0.22 1.53 0.00 -0.89 -0.71 119.26 120.56 3lr7 h ALA 90 Ca 0.04 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 3lr7 h ALA 90 Cb 0.72 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 3lr7 h ALA 90 CO 0.05 0.02 -0.13 1.96 0.00 0.00 0.00 179.25 181.15 3lr7 h GLN 91 N 0.66 0.47 -0.36 0.00 4.20 -1.01 -1.60 115.11 117.48 3lr7 h GLN 91 Ca 0.32 -0.22 -0.12 0.00 0.06 0.00 0.00 58.65 58.69 3lr7 h GLN 91 Cb 0.24 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 3lr7 h GLN 91 CO -0.21 0.77 -0.25 0.66 -0.67 0.00 0.00 178.83 179.12 3lr7 h SER 92 N 0.17 0.74 0.85 1.46 4.64 -0.82 -0.55 113.55 120.04 3lr7 h SER 92 Ca 0.05 -0.27 -0.19 0.00 -0.47 0.00 0.00 61.79 60.90 3lr7 h SER 92 Cb 0.64 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.50 3lr7 h SER 92 CO 0.04 0.96 -0.90 0.45 -0.87 0.00 0.00 176.83 176.50 3lr7 h HIS 93 N 0.62 0.05 0.03 4.77 3.86 -1.11 -0.42 115.15 122.96 3lr7 h HIS 93 Ca 0.08 -0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.20 3lr7 h HIS 93 Cb 0.75 -0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.23 3lr7 h HIS 93 CO 0.04 0.91 -0.25 0.00 0.86 0.00 0.00 177.93 179.49 3lr7 h ALA 94 N 1.08 -0.01 0.14 2.45 0.00 -1.23 0.21 119.26 121.91 3lr7 h ALA 94 Ca -0.02 -0.52 -0.36 0.00 0.00 0.00 0.00 54.91 54.01 3lr7 h ALA 94 Cb 1.58 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.39 3lr7 h ALA 94 CO 0.12 0.10 -1.92 1.15 0.00 0.00 0.00 179.25 178.70 3lr7 h THR 95 N -0.69 0.72 0.00 0.00 2.02 -1.15 -3.26 112.91 110.55 3lr7 h THR 95 Ca -0.04 -2.40 -0.25 0.00 0.77 0.00 0.00 66.41 64.49 3lr7 h THR 95 Cb 1.12 2.59 -0.04 0.00 -1.74 0.00 0.00 68.15 70.08 3lr7 h THR 95 CO 0.05 0.89 -1.57 1.17 0.37 0.00 0.00 175.52 176.43 3lr7 n LYS 96 N -3.51 0.55 0.10 6.66 4.81 -0.35 -4.56 118.16 121.87 3lr7 n LYS 96 Ca -0.30 0.41 0.12 0.00 -0.87 0.00 0.00 58.31 57.67 3lr7 n LYS 96 Cb 1.06 -1.61 0.16 0.00 0.02 0.00 0.00 35.03 34.66 3lr7 n LYS 96 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 3lr7 h HIS 97 N -1.00 0.00 -5.78 5.64 3.86 -1.24 -3.49 115.15 113.14 3lr7 h HIS 97 Ca -0.37 0.00 -0.34 0.00 -1.16 0.00 0.00 60.37 58.49 3lr7 h HIS 97 Cb 1.25 0.00 0.14 0.00 1.06 0.00 0.00 27.41 29.86 3lr7 h HIS 97 CO -0.09 0.00 -0.83 1.63 0.86 0.00 0.00 177.93 179.50 3lr7 n LYS 98 N -2.42 -4.33 -3.47 2.45 4.76 -0.36 -4.96 118.16 109.83 3lr7 n LYS 98 Ca 0.03 0.75 -0.42 0.00 -2.87 0.00 0.00 58.31 55.80 3lr7 n LYS 98 Cb 0.48 -5.48 -0.10 0.00 -1.84 0.00 0.00 35.03 28.09 3lr7 n LYS 98 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3lr7 s ILE 99 N -3.47 5.25 0.61 -0.18 -1.09 0.59 -5.01 121.20 117.91 3lr7 s ILE 99 Ca 0.18 -0.44 -0.19 0.00 -2.23 0.00 0.00 60.65 57.97 3lr7 s ILE 99 Cb -0.04 -3.86 -0.03 0.00 -1.58 0.00 0.00 42.46 36.96 3lr7 s ILE 99 CO 0.77 -0.20 1.28 -2.84 -1.23 0.00 0.00 174.94 172.72 3lr7 s PRO 100 N 1.74 2.78 0.56 2.79 0.02 -1.26 -4.66 135.00 136.98 3lr7 s PRO 100 Ca 0.06 2.04 0.24 0.00 0.02 0.00 0.00 61.00 63.36 3lr7 s PRO 100 Cb -0.18 -1.95 1.56 0.00 0.02 0.00 0.00 34.50 33.95 3lr7 s PRO 100 CO 0.11 -1.41 2.18 0.97 -0.33 0.00 0.00 177.00 178.52 3lr7 h ILE 101 N 0.82 0.72 -0.79 2.83 6.09 -1.97 0.10 117.51 125.32 3lr7 h ILE 101 Ca -0.51 0.00 0.14 0.00 -1.37 0.00 0.00 64.86 63.12 3lr7 h ILE 101 Cb 1.32 0.97 -0.05 0.00 0.47 0.00 0.00 36.82 39.52 3lr7 h ILE 101 CO 0.54 0.00 0.52 0.50 -3.07 0.00 0.00 178.15 176.64 3lr7 h LYS 102 N 0.00 0.49 0.00 2.19 1.63 -2.00 -0.63 116.57 118.26 3lr7 h LYS 102 Ca 0.02 -0.03 -0.10 0.00 -0.85 0.00 0.00 60.65 59.69 3lr7 h LYS 102 Cb 0.11 -0.11 -0.01 0.00 -0.60 0.00 0.00 32.23 31.61 3lr7 h LYS 102 CO -0.00 0.33 -0.47 1.88 -3.45 0.00 0.00 179.45 177.73 3lr7 h TYR 103 N 0.51 0.00 -0.03 1.91 -1.99 -1.32 -0.83 116.97 115.22 3lr7 h TYR 103 Ca 0.39 0.00 -0.16 0.00 2.00 0.00 0.00 58.73 60.96 3lr7 h TYR 103 Cb 0.78 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.49 3lr7 h TYR 103 CO -0.00 0.47 -0.69 -0.07 -0.00 0.00 0.00 178.16 177.87 3lr7 h LEU 104 N 0.00 0.20 -0.14 3.88 3.38 -1.19 -1.45 115.31 120.00 3lr7 h LEU 104 Ca -0.00 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 3lr7 h LEU 104 Cb 1.00 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.68 3lr7 h LEU 104 CO 0.06 0.83 0.07 -0.08 0.09 0.00 0.00 178.44 179.41 3lr7 h GLU 105 N 0.12 0.21 -0.47 1.13 4.81 -0.82 -2.07 114.58 117.49 3lr7 h GLU 105 Ca -0.02 -0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.25 3lr7 h GLU 105 Cb 1.23 -0.04 -0.06 0.00 0.63 0.00 0.00 28.75 30.51 3lr7 h GLU 105 CO 0.10 0.26 0.14 0.74 -0.73 0.00 0.00 179.01 179.51 3lr7 h PHE 106 N 0.10 0.23 -0.04 0.92 0.04 -0.92 -1.37 116.94 115.91 3lr7 h PHE 106 Ca 0.05 0.03 -0.12 0.00 2.80 0.00 0.00 57.97 60.72 3lr7 h PHE 106 Cb 0.12 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 38.22 3lr7 h PHE 106 CO -0.03 0.06 -0.53 0.97 -0.60 0.00 0.00 178.31 178.18 3lr7 h ILE 107 N 0.29 1.37 -0.30 -0.55 2.10 -1.22 -0.95 117.51 118.25 3lr7 h ILE 107 Ca 0.23 -1.81 0.00 0.00 1.08 0.00 0.00 64.86 64.36 3lr7 h ILE 107 Cb 0.26 1.93 -0.01 0.00 -1.09 0.00 0.00 36.82 37.90 3lr7 h ILE 107 CO -0.26 0.53 0.19 0.28 -1.08 0.00 0.00 178.15 177.80 3lr7 h SER 108 N 0.09 0.35 -0.59 2.19 0.02 -0.77 -0.92 113.55 113.92 3lr7 h SER 108 Ca -0.00 -0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 60.89 3lr7 h SER 108 Cb 0.96 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 63.38 3lr7 h SER 108 CO 0.07 0.28 0.27 0.44 -1.14 0.00 0.00 176.83 176.75 3lr7 h ASP 109 N 0.39 0.82 -0.70 3.07 3.32 -1.01 -2.47 116.42 119.85 3lr7 h ASP 109 Ca 0.11 -0.10 -0.06 0.00 0.02 0.00 0.00 57.03 57.00 3lr7 h ASP 109 Cb -0.01 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.30 3lr7 h ASP 109 CO -0.02 0.72 0.19 0.00 -1.72 0.00 0.00 179.24 178.42 3lr7 h ALA 110 N 1.40 0.92 -0.72 3.45 0.00 -0.70 -1.03 119.26 122.58 3lr7 h ALA 110 Ca 0.21 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3lr7 h ALA 110 Cb 0.15 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3lr7 h ALA 110 CO -0.02 0.63 0.40 0.82 0.00 0.00 0.00 179.25 181.07 3lr7 h ILE 111 N 1.05 1.22 -0.46 0.00 2.04 -0.84 0.72 117.51 121.23 3lr7 h ILE 111 Ca 0.22 -0.54 -0.05 0.00 1.00 0.00 0.00 64.86 65.49 3lr7 h ILE 111 Cb 0.34 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 3lr7 h ILE 111 CO -0.00 0.24 0.10 0.40 0.00 0.00 0.00 178.15 178.89 3lr7 h ILE 112 N 0.99 1.24 -0.22 -0.67 1.08 -1.12 -1.81 117.51 116.99 3lr7 h ILE 112 Ca 0.25 -0.85 -0.01 0.00 -0.39 0.00 0.00 64.86 63.87 3lr7 h ILE 112 Cb 0.03 0.91 -0.01 0.00 -3.07 0.00 0.00 36.82 34.68 3lr7 h ILE 112 CO -0.04 0.30 0.11 -0.74 -0.69 0.00 0.00 178.15 177.09 3lr7 h HIS 113 N 0.62 0.31 -0.75 1.37 2.76 -0.81 -2.57 115.15 116.09 3lr7 h HIS 113 Ca 0.14 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.29 3lr7 h HIS 113 Cb 0.34 -0.10 -0.04 0.00 1.55 0.00 0.00 27.41 29.17 3lr7 h HIS 113 CO 0.02 0.31 0.43 0.28 -1.30 0.00 0.00 177.93 177.67 3lr7 h VAL 114 N 0.23 1.22 -0.35 5.26 2.07 -0.77 0.25 116.25 124.15 3lr7 h VAL 114 Ca 0.08 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 67.08 3lr7 h VAL 114 Cb 0.11 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.05 3lr7 h VAL 114 CO -0.01 0.23 0.18 -0.07 0.02 0.00 0.00 177.57 177.93 3lr7 h LEU 115 N 1.04 0.44 -0.77 2.57 3.38 -1.12 0.93 115.31 121.78 3lr7 h LEU 115 Ca 0.27 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.09 3lr7 h LEU 115 Cb -0.01 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 3lr7 h LEU 115 CO -0.05 0.42 0.31 0.45 0.09 0.00 0.00 178.44 179.66 3lr7 h HIS 116 N 0.43 1.17 -0.39 1.13 3.86 -1.07 -1.23 115.15 119.06 3lr7 h HIS 116 Ca 0.12 -0.09 -0.14 0.00 -1.16 0.00 0.00 60.37 59.11 3lr7 h HIS 116 Cb 0.08 -0.35 -0.01 0.00 1.06 0.00 0.00 27.41 28.19 3lr7 h HIS 116 CO -0.02 0.89 -0.30 1.03 0.86 0.00 0.00 177.93 180.38 3lr7 h SER 117 N 1.12 0.88 1.40 2.45 0.87 -0.33 -1.71 113.55 118.24 3lr7 h SER 117 Ca 0.26 -0.36 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 3lr7 h SER 117 Cb 0.21 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 61.92 3lr7 h SER 117 CO -0.02 1.11 -0.57 0.11 -0.53 0.00 0.00 176.83 176.94 3lr7 h LYS 118 N 0.72 0.00 -1.66 2.24 1.57 -0.83 -3.38 116.57 115.23 3lr7 h LYS 118 Ca 0.08 0.00 -0.46 0.00 -1.87 0.00 0.00 60.65 58.40 3lr7 h LYS 118 Cb 0.85 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 32.76 3lr7 h LYS 118 CO 0.07 0.00 -1.09 0.72 -0.57 0.00 0.00 179.45 178.59 3lr7 n HIS 119 N -2.82 1.29 -1.72 -1.35 8.25 -0.47 -5.09 115.22 113.32 3lr7 n HIS 119 Ca 0.02 -3.43 -0.42 0.00 -0.26 0.00 0.00 57.72 53.62 3lr7 n HIS 119 Cb 0.54 -0.38 -0.03 0.00 1.12 0.00 0.00 29.99 31.23 3lr7 n HIS 119 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 3lr7 s PRO 120 N -2.90 4.13 0.00 -0.41 0.04 -0.66 -0.96 135.00 134.25 3lr7 s PRO 120 Ca 0.38 2.60 0.00 0.00 0.04 0.00 0.00 61.00 64.01 3lr7 s PRO 120 Cb 0.38 -3.38 0.00 0.00 0.04 0.00 0.00 34.50 31.54 3lr7 s PRO 120 CO -0.06 -0.80 0.00 0.41 0.04 0.00 0.00 177.00 176.59 3lr7 n GLY 121 N 4.12 1.47 0.07 0.56 0.00 -1.26 -4.84 105.19 105.31 3lr7 n GLY 121 Ca 0.17 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.24 3lr7 n GLY 121 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3lr7 n ASP 122 N 0.00 2.22 -3.80 1.61 2.03 -0.14 -4.81 116.55 113.67 3lr7 n ASP 122 Ca 0.00 -2.51 -0.29 0.00 0.52 0.00 0.00 54.79 52.51 3lr7 n ASP 122 Cb 0.00 -0.21 -0.12 0.00 -0.72 0.00 0.00 41.12 40.07 3lr7 n ASP 122 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 3lr7 s PHE 123 N -1.88 2.77 0.97 -0.67 5.36 -1.21 -5.04 117.98 118.28 3lr7 s PHE 123 Ca 0.16 -2.94 -0.12 0.00 -0.96 0.00 0.00 56.93 53.06 3lr7 s PHE 123 Cb 0.14 -2.30 0.17 0.00 -0.34 0.00 0.00 43.02 40.69 3lr7 s PHE 123 CO 0.02 -0.69 1.09 0.20 -1.46 0.00 0.00 175.22 174.38 3lr7 s GLY 124 N -0.54 1.58 0.23 13.12 0.00 -1.26 -4.66 107.32 115.79 3lr7 s GLY 124 Ca 0.22 -0.26 -0.08 0.00 0.00 0.00 0.00 44.72 44.60 3lr7 s GLY 124 CO -0.09 0.32 1.88 0.00 0.00 0.00 0.00 173.10 175.20 3lr7 h ALA 125 N -1.82 1.07 -0.51 3.20 0.00 -1.99 0.59 119.26 119.81 3lr7 h ALA 125 Ca -0.53 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.30 3lr7 h ALA 125 Cb 1.32 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 3lr7 h ALA 125 CO 0.56 0.38 0.16 0.38 0.00 0.00 0.00 179.25 180.73 3lr7 h ASP 126 N 1.05 0.74 -0.43 0.00 3.04 -1.99 -1.37 116.42 117.45 3lr7 h ASP 126 Ca 0.32 -0.21 0.01 0.00 -3.24 0.00 0.00 57.03 53.91 3lr7 h ASP 126 Cb -0.03 -0.19 -0.02 0.00 -1.04 0.00 0.00 39.33 38.05 3lr7 h ASP 126 CO -0.10 0.75 0.27 0.00 -2.04 0.00 0.00 179.24 178.12 3lr7 h ALA 127 N 1.02 0.54 -0.71 4.15 0.00 -1.73 -0.97 119.26 121.56 3lr7 h ALA 127 Ca 0.16 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 3lr7 h ALA 127 Cb 0.28 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 3lr7 h ALA 127 CO -0.00 -0.03 0.31 0.37 0.00 0.00 0.00 179.25 179.89 3lr7 h GLN 128 N 0.55 1.05 -0.34 0.00 4.15 -0.78 -0.87 115.11 118.87 3lr7 h GLN 128 Ca 0.16 -0.18 0.05 0.00 0.77 0.00 0.00 58.65 59.46 3lr7 h GLN 128 Cb -0.03 -0.18 -0.05 0.00 0.21 0.00 0.00 27.48 27.43 3lr7 h GLN 128 CO -0.05 0.85 0.07 0.78 -1.93 0.00 0.00 178.83 178.54 3lr7 h GLY 129 N 1.01 0.39 0.76 2.39 0.00 -0.81 -0.03 103.07 106.78 3lr7 h GLY 129 Ca 0.24 -0.02 -0.06 0.00 0.00 0.00 0.00 47.33 47.49 3lr7 h GLY 129 CO -0.02 -0.02 -0.12 0.00 0.00 0.00 0.00 176.54 176.37 3lr7 h ALA 130 N 1.26 0.23 -0.56 3.60 0.00 -0.91 -1.46 119.26 121.41 3lr7 h ALA 130 Ca 0.16 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 3lr7 h ALA 130 Cb 0.18 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 3lr7 h ALA 130 CO -0.21 0.08 0.18 1.98 0.00 0.00 0.00 179.25 181.28 3lr7 h MET 131 N 0.01 0.84 -0.34 0.00 1.85 -1.09 -0.47 114.93 115.73 3lr7 h MET 131 Ca 0.03 -0.15 -0.04 0.00 -0.61 0.00 0.00 59.70 58.93 3lr7 h MET 131 Cb 0.63 -0.14 -0.01 0.00 0.43 0.00 0.00 31.60 32.51 3lr7 h MET 131 CO 0.03 0.72 0.05 1.15 -0.40 0.00 0.00 176.91 178.47 3lr7 h THR 132 N 0.82 1.24 -0.88 -0.77 2.02 -0.89 -0.92 112.91 113.53 3lr7 h THR 132 Ca 0.19 -0.85 0.06 0.00 0.77 0.00 0.00 66.41 66.58 3lr7 h THR 132 Cb 0.23 1.13 -0.06 0.00 -1.74 0.00 0.00 68.15 67.71 3lr7 h THR 132 CO -0.01 0.28 0.55 0.11 0.37 0.00 0.00 175.52 176.83 3lr7 h LYS 133 N 0.41 0.98 -0.65 6.66 1.57 -0.75 -0.31 116.57 124.48 3lr7 h LYS 133 Ca 0.10 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.74 3lr7 h LYS 133 Cb 0.36 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.43 3lr7 h LYS 133 CO 0.01 0.65 0.08 0.00 -0.57 0.00 0.00 179.45 179.62 3lr7 h ALA 134 N 1.41 0.91 -0.10 3.86 0.00 -0.83 -1.30 119.26 123.22 3lr7 h ALA 134 Ca 0.38 -0.28 -0.15 0.00 0.00 0.00 0.00 54.91 54.86 3lr7 h ALA 134 Cb 0.16 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3lr7 h ALA 134 CO -0.17 0.67 -0.61 -0.07 0.00 0.00 0.00 179.25 179.07 3lr7 h LEU 135 N 1.02 0.37 -0.52 0.00 3.38 -0.86 -1.70 115.31 117.00 3lr7 h LEU 135 Ca 0.20 -0.21 -0.12 0.00 0.09 0.00 0.00 57.88 57.83 3lr7 h LEU 135 Cb 0.47 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 3lr7 h LEU 135 CO 0.02 0.89 -0.15 -0.33 0.09 0.00 0.00 178.44 178.96 3lr7 h GLU 136 N 0.24 1.03 -0.36 1.13 5.08 -0.92 -0.65 114.58 120.14 3lr7 h GLU 136 Ca -0.01 -0.41 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 3lr7 h GLU 136 Cb 1.13 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.31 3lr7 h GLU 136 CO 0.10 1.10 0.22 1.25 -1.00 0.00 0.00 179.01 180.68 3lr7 h LEU 137 N 0.90 0.42 0.02 1.33 5.85 -1.06 0.30 115.31 123.07 3lr7 h LEU 137 Ca 0.13 -0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.84 3lr7 h LEU 137 Cb 0.73 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.61 3lr7 h LEU 137 CO 0.06 0.33 -0.26 0.15 -0.34 0.00 0.00 178.44 178.37 3lr7 h PHE 138 N 0.47 -0.71 -0.88 1.25 3.57 -1.22 -0.46 116.94 118.96 3lr7 h PHE 138 Ca 0.13 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.64 3lr7 h PHE 138 Cb -0.02 0.31 -0.04 0.00 2.79 0.00 0.00 35.95 38.99 3lr7 h PHE 138 CO -0.04 -0.36 0.51 -0.09 -2.23 0.00 0.00 178.31 176.10 3lr7 h ARG 139 N -0.42 1.20 -0.38 1.11 2.43 -0.89 -1.30 114.38 116.13 3lr7 h ARG 139 Ca 0.06 -0.12 -0.15 0.00 -0.81 0.00 0.00 59.98 58.96 3lr7 h ARG 139 Cb 0.49 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 3lr7 h ARG 139 CO -0.22 0.85 -0.35 -0.97 -1.51 0.00 0.00 179.97 177.77 3lr7 h ASN 140 N 1.22 0.95 -0.10 -3.80 -1.24 -0.10 0.08 115.58 112.59 3lr7 h ASN 140 Ca 0.31 -0.42 -0.18 0.00 0.71 0.00 0.00 56.30 56.72 3lr7 h ASN 140 Cb -0.03 -0.27 -0.00 0.00 0.73 0.00 0.00 38.32 38.76 3lr7 h ASN 140 CO -0.06 1.20 -0.59 0.44 -1.29 0.00 0.00 177.43 177.13 3lr7 h ASP 141 N 0.74 0.79 -0.61 1.15 3.32 -0.90 -1.97 116.42 118.96 3lr7 h ASP 141 Ca 0.07 -0.44 -0.01 0.00 0.02 0.00 0.00 57.03 56.67 3lr7 h ASP 141 Cb 0.93 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 40.23 3lr7 h ASP 141 CO 0.09 1.21 0.35 0.40 -1.72 0.00 0.00 179.24 179.56 3lr7 h ILE 142 N 0.53 1.19 -0.77 0.35 2.04 -1.16 -2.75 117.51 116.94 3lr7 h ILE 142 Ca 0.00 -0.45 0.01 0.00 1.00 0.00 0.00 64.86 65.42 3lr7 h ILE 142 Cb 1.17 0.38 -0.04 0.00 -0.74 0.00 0.00 36.82 37.60 3lr7 h ILE 142 CO 0.12 0.20 0.51 0.00 0.00 0.00 0.00 178.15 178.98 3lr7 h ALA 143 N 1.17 1.45 -0.71 1.87 0.00 -0.74 0.33 119.26 122.63 3lr7 h ALA 143 Ca 0.22 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3lr7 h ALA 143 Cb 0.01 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 3lr7 h ALA 143 CO -0.04 0.51 0.42 0.00 0.00 0.00 0.00 179.25 180.14 3lr7 h ALA 144 N 1.52 0.90 -0.28 0.00 0.00 -1.08 -0.30 119.26 120.03 3lr7 h ALA 144 Ca 0.28 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 3lr7 h ALA 144 Cb -0.12 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.37 3lr7 h ALA 144 CO -0.06 0.38 -0.22 0.87 0.00 0.00 0.00 179.25 180.22 3lr7 h LYS 145 N 0.97 0.52 -0.54 0.00 1.79 -1.03 -2.12 116.57 116.16 3lr7 h LYS 145 Ca 0.25 -0.19 -0.02 0.00 -2.18 0.00 0.00 60.65 58.51 3lr7 h LYS 145 Cb -0.02 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.57 3lr7 h LYS 145 CO -0.05 0.71 0.24 1.88 -1.08 0.00 0.00 179.45 181.15 3lr7 h TYR 146 N 0.46 0.79 -0.68 -1.35 -1.99 -0.39 -2.23 116.97 111.58 3lr7 h TYR 146 Ca 0.07 -0.05 -0.07 0.00 2.00 0.00 0.00 58.73 60.68 3lr7 h TYR 146 Cb 0.64 -0.24 -0.03 0.00 2.00 0.00 0.00 36.73 39.10 3lr7 h TYR 146 CO 0.02 0.63 0.13 -0.22 -0.00 0.00 0.00 178.16 178.72 3lr7 h LYS 147 N 0.72 1.11 -0.81 4.88 3.64 -0.81 0.12 116.57 125.43 3lr7 h LYS 147 Ca 0.18 -0.29 0.11 0.00 -1.27 0.00 0.00 60.65 59.38 3lr7 h LYS 147 Cb 0.15 -0.14 -0.08 0.00 -0.41 0.00 0.00 32.23 31.75 3lr7 h LYS 147 CO -0.02 1.00 0.44 1.49 -2.27 0.00 0.00 179.45 180.09 3lr7 h GLU 148 N 1.04 0.69 -0.00 1.90 4.81 -1.21 -1.11 114.58 120.70 3lr7 h GLU 148 Ca 0.21 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 3lr7 h GLU 148 Cb 0.41 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.64 3lr7 h GLU 148 CO 0.01 0.46 -0.02 1.28 -0.73 0.00 0.00 179.01 180.00 3lr7 n LEU 149 N -4.80 0.05 -0.96 1.64 4.77 -0.67 -4.91 117.00 112.12 3lr7 n LEU 149 Ca 0.14 0.34 -0.08 0.00 -0.03 0.00 0.00 56.01 56.38 3lr7 n LEU 149 Cb 0.31 -0.36 -0.00 0.00 -2.33 0.00 0.00 43.42 41.04 3lr7 n LEU 149 CO 0.25 0.01 -0.09 0.61 -1.33 0.00 0.00 177.39 176.85 3lr7 n GLY 150 N 1.37 0.07 0.45 -0.72 0.00 -0.12 -5.08 105.19 101.17 3lr7 n GLY 150 Ca 0.11 -0.54 0.06 0.00 0.00 0.00 0.00 46.02 45.65 3lr7 n GLY 150 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65