#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lmh n THR 3 N 0.00 0.00 0.00 -5.08 -2.24 -1.26 -4.88 114.28 100.82 1lmh n THR 3 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1lmh n THR 3 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1lmh n THR 3 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1lmh n LYS 5 N 0.00 0.00 0.08 -0.78 2.85 -1.26 -3.51 118.16 115.54 1lmh n LYS 5 Ca 0.00 0.00 0.11 0.00 -1.05 0.00 0.00 58.31 57.37 1lmh n LYS 5 Cb 0.00 0.00 -0.02 0.00 -0.65 0.00 0.00 35.03 34.36 1lmh n LYS 5 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1lmh n ASP 6 N 0.00 0.71 -4.60 -5.58 8.00 -1.26 -4.82 116.55 108.99 1lmh n ASP 6 Ca 0.00 0.25 -0.43 0.00 0.71 0.00 0.00 54.79 55.32 1lmh n ASP 6 Cb 0.00 0.68 -0.03 0.00 -0.02 0.00 0.00 41.12 41.76 1lmh n ASP 6 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1lmh s ILE 7 N -3.37 4.35 0.48 0.53 -1.09 -1.23 -4.30 121.20 116.56 1lmh s ILE 7 Ca -0.01 1.25 -0.21 0.00 -2.23 0.00 0.00 60.65 59.45 1lmh s ILE 7 Cb 0.11 -4.51 -0.09 0.00 -1.58 0.00 0.00 42.46 36.39 1lmh s ILE 7 CO 0.81 -0.83 1.04 0.27 -1.23 0.00 0.00 174.94 174.99 1lmh s ILE 8 N 4.09 3.80 0.26 2.92 -4.36 -0.21 -4.98 121.20 122.72 1lmh s ILE 8 Ca 0.45 1.14 0.08 0.00 -0.26 0.00 0.00 60.65 62.06 1lmh s ILE 8 Cb -0.09 -3.47 -0.04 0.00 1.25 0.00 0.00 42.46 40.11 1lmh s ILE 8 CO 0.26 -0.22 0.12 -0.13 0.24 0.00 0.00 174.94 175.21 1lmh s ARG 9 N -3.17 2.64 -0.31 0.37 1.81 -1.26 -4.49 118.95 114.54 1lmh s ARG 9 Ca 0.66 -1.23 -0.44 0.00 -1.72 0.00 0.00 55.73 53.00 1lmh s ARG 9 Cb -0.17 -2.38 -0.20 0.00 -0.45 0.00 0.00 34.95 31.76 1lmh s ARG 9 CO 0.20 0.36 1.43 -3.47 -0.68 0.00 0.00 175.30 173.14 1lmh n ASP 10 N -1.07 0.89 0.00 0.23 4.64 0.21 -1.34 116.55 120.11 1lmh n ASP 10 Ca -0.07 1.17 0.00 0.00 -1.38 0.00 0.00 54.79 54.51 1lmh n ASP 10 Cb 0.59 -0.92 0.00 0.00 -1.04 0.00 0.00 41.12 39.75 1lmh n ASP 10 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1lmh n GLY 11 N 3.15 0.98 3.70 0.27 0.00 -1.26 -5.06 105.19 106.96 1lmh n GLY 11 Ca 0.27 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.87 1lmh n GLY 11 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1lmh s HIS 12 N -1.17 3.13 0.44 1.61 5.04 -0.45 -4.91 115.29 118.98 1lmh s HIS 12 Ca 0.00 1.02 0.18 0.00 -1.54 0.00 0.00 55.06 54.73 1lmh s HIS 12 Cb 0.00 -3.57 1.12 0.00 0.04 0.00 0.00 32.58 30.17 1lmh s HIS 12 CO 0.00 -1.99 1.90 -1.00 -2.34 0.00 0.00 174.74 171.31 1lmh h PRO 13 N 7.29 0.34 0.00 2.88 0.13 -1.98 -2.05 132.00 138.62 1lmh h PRO 13 Ca -0.39 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.71 1lmh h PRO 13 Cb 1.19 -0.08 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 1lmh h PRO 13 CO 0.87 0.22 -0.05 1.15 -0.23 0.00 0.00 178.00 179.96 1lmh h THR 14 N 0.35 0.77 0.00 1.56 2.02 -1.93 -1.28 112.91 114.40 1lmh h THR 14 Ca 0.41 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 67.40 1lmh h THR 14 Cb 1.06 1.11 0.00 0.00 -1.74 0.00 0.00 68.15 68.58 1lmh h THR 14 CO -0.13 0.05 0.00 -0.07 0.37 0.00 0.00 175.52 175.74 1lmh h LEU 15 N 0.00 0.00 -2.48 2.58 3.38 -1.63 -3.01 115.31 114.15 1lmh h LEU 15 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1lmh h LEU 15 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1lmh h LEU 15 CO 0.01 0.00 0.00 0.54 0.09 0.00 0.00 178.44 179.08 1lmh n ARG 16 N -2.37 2.28 -2.63 1.13 5.12 -0.49 -4.25 116.66 115.44 1lmh n ARG 16 Ca 0.02 -1.91 -0.21 0.00 -1.93 0.00 0.00 57.85 53.82 1lmh n ARG 16 Cb 0.28 -1.30 0.04 0.00 -1.16 0.00 0.00 32.46 30.31 1lmh n ARG 16 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 1lmh s GLN 17 N -1.03 2.51 -0.36 5.56 -0.21 -1.14 -4.63 119.66 120.36 1lmh s GLN 17 Ca 0.24 -0.80 -0.14 0.00 0.02 0.00 0.00 55.36 54.69 1lmh s GLN 17 Cb 0.13 -2.48 -0.01 0.00 1.00 0.00 0.00 33.01 31.66 1lmh s GLN 17 CO 0.18 -0.75 0.30 0.21 -2.12 0.00 0.00 175.29 173.12 1lmh s LYS 18 N -4.78 3.41 0.53 2.91 2.20 -1.26 -2.37 119.74 120.39 1lmh s LYS 18 Ca 0.58 -0.64 -0.21 0.00 -0.36 0.00 0.00 55.97 55.34 1lmh s LYS 18 Cb -0.10 -3.84 -0.06 0.00 -1.51 0.00 0.00 37.83 32.31 1lmh s LYS 18 CO 0.39 -0.54 1.16 0.00 -0.36 0.00 0.00 175.35 176.00 1lmh n ALA 19 N 5.23 0.86 -2.06 3.13 0.00 0.82 -4.97 120.51 123.54 1lmh n ALA 19 Ca -0.11 0.12 -0.37 0.00 0.00 0.00 0.00 53.44 53.08 1lmh n ALA 19 Cb 0.49 -2.22 -0.06 0.00 0.00 0.00 0.00 19.45 17.66 1lmh n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1lmh s ALA 20 N -1.35 3.41 0.47 0.00 0.00 -0.44 -4.63 121.76 119.22 1lmh s ALA 20 Ca 0.70 0.23 -0.25 0.00 0.00 0.00 0.00 51.96 52.65 1lmh s ALA 20 Cb -0.45 -2.87 -0.08 0.00 0.00 0.00 0.00 23.12 19.72 1lmh s ALA 20 CO 0.51 0.31 1.41 -1.21 0.00 0.00 0.00 175.76 176.78 1lmh s GLU 21 N -1.80 3.60 0.08 0.00 0.41 -1.26 -1.18 118.70 118.55 1lmh s GLU 21 Ca 0.42 2.38 -0.18 0.00 -0.41 0.00 0.00 54.97 57.18 1lmh s GLU 21 Cb -0.18 -2.59 -0.07 0.00 -1.78 0.00 0.00 34.13 29.51 1lmh s GLU 21 CO 0.22 -0.88 0.55 -0.51 -0.49 0.00 0.00 175.26 174.16 1lmh s LEU 22 N -2.85 4.48 -0.03 1.80 2.01 -1.26 -4.85 118.68 117.97 1lmh s LEU 22 Ca 0.63 1.20 -0.16 0.00 0.01 0.00 0.00 54.13 55.81 1lmh s LEU 22 Cb -0.43 -2.96 -0.05 0.00 0.01 0.00 0.00 46.19 42.76 1lmh s LEU 22 CO 0.55 0.24 0.42 -0.70 1.01 0.00 0.00 176.35 177.87 1lmh s GLU 23 N -1.30 4.05 -0.04 1.70 2.56 -1.26 -4.96 118.70 119.45 1lmh s GLU 23 Ca 0.31 0.41 -0.02 0.00 0.00 0.00 0.00 54.97 55.67 1lmh s GLU 23 Cb -0.18 -3.28 -0.04 0.00 2.00 0.00 0.00 34.13 32.63 1lmh s GLU 23 CO 0.19 0.54 0.09 -0.51 -0.56 0.00 0.00 175.26 175.01 1lmh s LEU 24 N -0.59 4.01 0.65 2.70 2.01 -1.26 -3.82 118.68 122.38 1lmh s LEU 24 Ca 0.24 0.24 -0.14 0.00 0.01 0.00 0.00 54.13 54.48 1lmh s LEU 24 Cb -0.16 -2.21 -0.01 0.00 0.01 0.00 0.00 46.19 43.81 1lmh s LEU 24 CO 0.12 0.31 1.06 -2.16 1.01 0.00 0.00 176.35 176.70 1lmh s PRO 25 N -1.49 3.08 0.62 1.29 0.04 -1.26 -5.14 135.00 132.13 1lmh s PRO 25 Ca 0.20 1.12 -0.16 0.00 0.04 0.00 0.00 61.00 62.21 1lmh s PRO 25 Cb -0.12 -2.00 -0.02 0.00 0.04 0.00 0.00 34.50 32.39 1lmh s PRO 25 CO 0.11 -1.00 1.10 -0.51 0.04 0.00 0.00 177.00 176.74 1lmh s LEU 26 N -4.99 3.50 0.86 -3.56 1.43 -1.25 -5.02 118.68 109.64 1lmh s LEU 26 Ca 0.62 2.00 -0.12 0.00 -1.03 0.00 0.00 54.13 55.60 1lmh s LEU 26 Cb -0.16 -4.55 0.11 0.00 0.03 0.00 0.00 46.19 41.62 1lmh s LEU 26 CO 0.45 -1.43 1.13 0.42 0.23 0.00 0.00 176.35 177.15 1lmh s THR 27 N -2.22 2.33 0.19 5.49 -4.23 -1.26 -4.84 115.64 111.09 1lmh s THR 27 Ca 0.68 0.11 -0.11 0.00 -1.18 0.00 0.00 61.69 61.18 1lmh s THR 27 Cb -0.20 -2.91 0.11 0.00 1.34 0.00 0.00 72.50 70.84 1lmh s THR 27 CO 0.37 -0.14 1.82 0.50 -0.54 0.00 0.00 174.62 176.63 1lmh h LYS 28 N -1.28 0.67 -0.67 3.99 1.63 -2.00 -1.94 116.57 116.97 1lmh h LYS 28 Ca -0.49 -0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 59.26 1lmh h LYS 28 Cb 1.31 -0.15 -0.03 0.00 -0.60 0.00 0.00 32.23 32.76 1lmh h LYS 28 CO 0.62 0.45 0.37 1.49 -3.45 0.00 0.00 179.45 178.93 1lmh h GLU 29 N 0.69 0.94 -0.59 1.90 4.81 -1.99 -1.08 114.58 119.27 1lmh h GLU 29 Ca 0.25 -0.11 -0.07 0.00 -0.13 0.00 0.00 59.36 59.30 1lmh h GLU 29 Cb 0.07 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 29.24 1lmh h GLU 29 CO -0.12 0.71 0.10 0.93 -0.73 0.00 0.00 179.01 179.90 1lmh h GLU 30 N 0.92 0.95 -0.34 1.92 5.08 -1.83 -0.51 114.58 120.77 1lmh h GLU 30 Ca 0.24 -0.23 -0.05 0.00 -1.00 0.00 0.00 59.36 58.31 1lmh h GLU 30 Cb 0.04 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1lmh h GLU 30 CO -0.04 0.87 -0.00 0.87 -1.00 0.00 0.00 179.01 179.71 1lmh h LYS 31 N 0.89 0.59 -0.42 2.33 1.57 -1.02 -1.14 116.57 119.38 1lmh h LYS 31 Ca 0.18 -0.19 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 1lmh h LYS 31 Cb 0.38 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 1lmh h LYS 31 CO 0.01 0.72 0.17 0.93 -0.57 0.00 0.00 179.45 180.71 1lmh h GLU 32 N 0.40 0.59 -0.08 3.15 5.08 -0.93 -0.50 114.58 122.29 1lmh h GLU 32 Ca 0.09 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1lmh h GLU 32 Cb 0.46 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 1lmh h GLU 32 CO 0.02 0.49 -0.01 1.15 -1.00 0.00 0.00 179.01 179.66 1lmh h THR 33 N 0.59 1.27 -0.78 1.13 2.02 -0.76 -0.61 112.91 115.76 1lmh h THR 33 Ca 0.15 -0.85 -0.04 0.00 0.77 0.00 0.00 66.41 66.44 1lmh h THR 33 Cb 0.11 1.68 -0.04 0.00 -1.74 0.00 0.00 68.15 68.17 1lmh h THR 33 CO -0.02 0.24 0.34 0.25 0.37 0.00 0.00 175.52 176.70 1lmh h LEU 34 N -0.16 1.05 -0.70 2.58 5.85 -0.84 -2.24 115.31 120.85 1lmh h LEU 34 Ca 0.02 -0.14 -0.10 0.00 0.84 0.00 0.00 57.88 58.50 1lmh h LEU 34 Cb 0.38 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 1lmh h LEU 34 CO 0.01 0.91 -0.08 0.40 -0.34 0.00 0.00 178.44 179.34 1lmh h ILE 35 N 1.13 1.26 0.00 4.05 2.04 -1.04 -2.31 117.51 122.64 1lmh h ILE 35 Ca 0.27 -1.19 0.00 0.00 1.00 0.00 0.00 64.86 64.94 1lmh h ILE 35 Cb 0.17 0.95 0.00 0.00 -0.74 0.00 0.00 36.82 37.19 1lmh h ILE 35 CO -0.03 0.42 0.00 0.00 0.00 0.00 0.00 178.15 178.54 1lmh n ALA 36 N -2.49 1.93 0.00 1.87 0.00 -0.24 -1.07 120.51 120.51 1lmh n ALA 36 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1lmh n ALA 36 Cb 0.37 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.74 1lmh n ALA 36 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1lmh n ARG 38 N 0.95 0.00 -0.13 0.00 0.63 -0.87 -0.78 116.66 116.46 1lmh n ARG 38 Ca 0.00 0.00 0.04 0.00 -0.92 0.00 0.00 57.85 56.97 1lmh n ARG 38 Cb 0.18 0.00 0.34 0.00 0.45 0.00 0.00 32.46 33.43 1lmh n ARG 38 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 1lmh h GLU 39 N 0.00 0.75 -0.46 -0.14 4.57 -1.37 -0.52 114.58 117.41 1lmh h GLU 39 Ca 0.00 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.13 1lmh h GLU 39 Cb 0.00 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 28.40 1lmh h GLU 39 CO 0.00 0.50 0.25 0.35 -1.18 0.00 0.00 179.01 178.92 1lmh h PHE 40 N 0.77 0.63 -0.67 0.92 3.57 -1.22 0.21 116.94 121.15 1lmh h PHE 40 Ca 0.24 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.70 1lmh h PHE 40 Cb 0.02 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.53 1lmh h PHE 40 CO -0.00 0.48 0.29 -0.07 -2.23 0.00 0.00 178.31 176.78 1lmh h LEU 41 N 0.60 0.90 0.15 0.59 3.38 -1.49 0.14 115.31 119.58 1lmh h LEU 41 Ca 0.16 -0.15 0.01 0.00 0.09 0.00 0.00 57.88 57.99 1lmh h LEU 41 Cb 0.06 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 1lmh h LEU 41 CO -0.03 0.80 -0.19 0.58 0.09 0.00 0.00 178.44 179.69 1lmh h VAL 42 N 0.94 0.57 -0.92 1.22 2.07 -0.71 -1.71 116.25 117.70 1lmh h VAL 42 Ca 0.23 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.74 1lmh h VAL 42 Cb 0.16 0.57 -0.04 0.00 -1.52 0.00 0.00 31.29 30.46 1lmh h VAL 42 CO -0.02 0.00 0.54 0.78 0.02 0.00 0.00 177.57 178.89 1lmh h ASN 43 N -0.39 1.12 0.27 0.57 2.35 -0.67 -2.12 115.58 116.70 1lmh h ASN 43 Ca 0.01 -0.07 -0.02 0.00 -0.55 0.00 0.00 56.30 55.67 1lmh h ASN 43 Cb 0.39 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 38.48 1lmh h ASN 43 CO -0.08 0.86 -0.11 0.77 -1.65 0.00 0.00 177.43 177.22 1lmh h SER 44 N 1.27 0.00 0.19 5.81 4.64 -0.30 -2.16 113.55 123.00 1lmh h SER 44 Ca 0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 1lmh h SER 44 Cb -0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 1lmh h SER 44 CO -0.06 0.11 -0.28 0.00 -0.87 0.00 0.00 176.83 175.73 1lmh n GLN 45 N -3.80 0.93 -3.30 4.77 6.02 -0.68 -3.83 117.38 117.49 1lmh n GLN 45 Ca -0.02 -0.59 -0.42 0.00 -0.01 0.00 0.00 57.00 55.96 1lmh n GLN 45 Cb 0.21 -1.49 -0.08 0.00 1.02 0.00 0.00 30.24 29.90 1lmh n GLN 45 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1lmh s ASP 46 N -2.48 6.24 0.21 1.08 -1.08 -0.82 -4.97 116.67 114.85 1lmh s ASP 46 Ca 0.24 -0.30 -0.12 0.00 -0.52 0.00 0.00 52.55 51.84 1lmh s ASP 46 Cb 0.19 -2.24 0.25 0.00 -1.46 0.00 0.00 42.92 39.66 1lmh s ASP 46 CO 0.52 -0.50 1.65 -0.08 0.52 0.00 0.00 175.17 177.29 1lmh h GLU 47 N 8.58 0.07 0.30 4.34 4.81 -1.86 0.22 114.58 131.04 1lmh h GLU 47 Ca -0.28 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.93 1lmh h GLU 47 Cb 1.12 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.49 1lmh h GLU 47 CO 0.77 0.05 -0.14 1.49 -0.73 0.00 0.00 179.01 180.44 1lmh h GLU 48 N 0.07 -0.39 -0.51 1.92 4.81 -1.93 -1.89 114.58 116.66 1lmh h GLU 48 Ca 0.30 0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.52 1lmh h GLU 48 Cb 0.47 0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.92 1lmh h GLU 48 CO -0.54 -0.15 0.21 0.82 -0.73 0.00 0.00 179.01 178.62 1lmh h ILE 49 N -0.57 1.21 -0.95 2.32 2.04 -1.76 -1.56 117.51 118.25 1lmh h ILE 49 Ca -0.04 -0.67 0.00 0.00 1.00 0.00 0.00 64.86 65.16 1lmh h ILE 49 Cb 0.41 0.69 -0.05 0.00 -0.74 0.00 0.00 36.82 37.14 1lmh h ILE 49 CO 0.07 0.25 0.60 0.00 0.00 0.00 0.00 178.15 179.07 1lmh h ALA 50 N 1.05 1.28 -0.15 1.87 0.00 -0.53 -1.59 119.26 121.20 1lmh h ALA 50 Ca 0.17 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1lmh h ALA 50 Cb 0.20 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1lmh h ALA 50 CO -0.01 0.65 -0.01 0.87 0.00 0.00 0.00 179.25 180.74 1lmh h LYS 51 N 1.30 0.27 -0.78 0.00 1.79 -1.08 0.44 116.57 118.50 1lmh h LYS 51 Ca 0.34 -0.09 0.03 0.00 -2.18 0.00 0.00 60.65 58.75 1lmh h LYS 51 Cb -0.11 -0.02 -0.04 0.00 -1.58 0.00 0.00 32.23 30.47 1lmh h LYS 51 CO -0.07 0.52 0.51 -0.09 -1.08 0.00 0.00 179.45 179.24 1lmh h ARG 52 N 0.00 0.94 -0.35 3.15 2.43 -0.94 -2.73 114.38 116.88 1lmh h ARG 52 Ca 0.04 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1lmh h ARG 52 Cb 0.40 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 1lmh h ARG 52 CO 0.01 0.62 0.00 0.66 -1.51 0.00 0.00 179.97 179.75 1lmh n TYR 53 N -4.45 0.75 -3.80 2.20 4.01 -0.63 -4.99 117.16 110.26 1lmh n TYR 53 Ca 0.10 -0.65 -0.25 0.00 -0.16 0.00 0.00 57.90 56.94 1lmh n TYR 53 Cb 0.11 -0.16 0.02 0.00 -0.31 0.00 0.00 39.34 39.00 1lmh n TYR 53 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1lmh n GLY 54 N 0.21 -0.35 3.84 2.72 0.00 0.52 -4.97 105.19 107.17 1lmh n GLY 54 Ca 0.17 0.15 -0.37 0.00 0.00 0.00 0.00 46.02 45.97 1lmh n GLY 54 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1lmh s LEU 55 N -6.90 4.43 -0.21 0.99 1.43 0.12 -5.01 118.68 113.53 1lmh s LEU 55 Ca 0.21 1.00 -0.19 0.00 -1.03 0.00 0.00 54.13 54.12 1lmh s LEU 55 Cb -0.11 -2.86 -0.03 0.00 0.03 0.00 0.00 46.19 43.23 1lmh s LEU 55 CO 0.83 0.24 0.56 -0.60 0.23 0.00 0.00 176.35 177.61 1lmh s ARG 56 N -1.43 4.18 0.36 1.70 3.52 -1.26 -4.73 118.95 121.28 1lmh s ARG 56 Ca 0.29 0.48 -0.28 0.00 -0.13 0.00 0.00 55.73 56.09 1lmh s ARG 56 Cb -0.16 -3.58 -0.11 0.00 -1.56 0.00 0.00 34.95 29.54 1lmh s ARG 56 CO 0.16 -0.21 1.50 0.45 -0.81 0.00 0.00 175.30 176.39 1lmh s SER 57 N 1.22 6.36 0.21 -2.12 0.15 -1.25 -4.85 113.70 113.42 1lmh s SER 57 Ca 0.25 3.02 -0.22 0.00 0.70 0.00 0.00 55.95 59.70 1lmh s SER 57 Cb -0.16 -2.66 0.05 0.00 -1.71 0.00 0.00 66.02 61.54 1lmh s SER 57 CO 0.10 -0.87 0.66 -0.83 1.20 0.00 0.00 173.24 173.49 1lmh s GLY 58 N -0.02 -0.40 0.00 9.45 0.00 -1.26 -5.03 107.32 110.06 1lmh s GLY 58 Ca 0.55 0.17 0.04 0.00 0.00 0.00 0.00 44.72 45.48 1lmh s GLY 58 CO 0.60 0.06 0.68 3.33 0.00 0.00 0.00 173.10 177.77 1lmh n VAL 59 N -0.41 0.09 -3.74 1.40 0.24 -1.26 -4.73 118.33 109.91 1lmh n VAL 59 Ca -0.11 -0.55 -0.13 0.00 -2.04 0.00 0.00 64.34 61.51 1lmh n VAL 59 Cb 0.62 1.04 -0.08 0.00 -1.47 0.00 0.00 33.84 33.95 1lmh n VAL 59 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1lmh s GLY 60 N -0.43 -0.16 -0.16 7.63 0.00 -1.26 0.04 107.32 112.98 1lmh s GLY 60 Ca 0.06 0.21 -0.16 0.00 0.00 0.00 0.00 44.72 44.83 1lmh s GLY 60 CO 0.06 -0.01 0.44 -2.27 0.00 0.00 0.00 173.10 171.32 1lmh s LEU 61 N -1.70 0.30 0.03 0.66 2.96 -0.09 -4.98 118.68 115.86 1lmh s LEU 61 Ca -0.09 0.87 0.08 0.00 -0.22 0.00 0.00 54.13 54.78 1lmh s LEU 61 Cb -0.03 1.53 -0.03 0.00 0.50 0.00 0.00 46.19 48.17 1lmh s LEU 61 CO 0.01 -0.17 -0.24 0.00 -1.32 0.00 0.00 176.35 174.62 1lmh s ALA 62 N 0.17 2.32 0.29 5.97 0.00 -1.26 -0.92 121.76 128.33 1lmh s ALA 62 Ca -0.01 -1.23 0.04 0.00 0.00 0.00 0.00 51.96 50.77 1lmh s ALA 62 Cb -0.03 -0.56 0.73 0.00 0.00 0.00 0.00 23.12 23.26 1lmh s ALA 62 CO 0.01 0.54 1.69 0.00 0.00 0.00 0.00 175.76 178.00 1lmh h ALA 63 N 4.85 1.43 -0.34 0.00 0.00 -1.80 0.13 119.26 123.53 1lmh h ALA 63 Ca -0.46 0.16 0.10 0.00 0.00 0.00 0.00 54.91 54.71 1lmh h ALA 63 Cb 1.14 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1lmh h ALA 63 CO 0.45 -0.35 0.31 -1.35 0.00 0.00 0.00 179.25 178.31 1lmh h PRO 64 N 0.39 0.00 0.00 0.00 0.11 -1.54 -0.61 132.00 130.35 1lmh h PRO 64 Ca 0.56 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.67 1lmh h PRO 64 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1lmh h PRO 64 CO -0.54 0.00 0.00 1.96 -0.21 0.00 0.00 178.00 179.21 1lmh h GLN 65 N 0.00 0.00 -0.17 1.05 4.20 -1.02 -1.39 115.11 117.78 1lmh h GLN 65 Ca 0.16 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.79 1lmh h GLN 65 Cb 0.77 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.51 1lmh h GLN 65 CO -0.00 0.00 -0.25 0.44 -0.67 0.00 0.00 178.83 178.35 1lmh n ILE 66 N -2.58 2.33 -3.38 2.54 -5.35 -0.30 -1.04 119.36 111.57 1lmh n ILE 66 Ca 0.01 -2.87 -0.22 0.00 -0.27 0.00 0.00 62.75 59.40 1lmh n ILE 66 Cb 0.21 -0.28 0.06 0.00 -1.74 0.00 0.00 39.64 37.90 1lmh n ILE 66 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1lmh n ASN 67 N -1.12 -6.13 -3.94 7.28 5.15 -0.52 -4.94 115.26 111.04 1lmh n ASN 67 Ca 0.25 -0.44 -0.31 0.00 -0.60 0.00 0.00 54.58 53.48 1lmh n ASN 67 Cb 0.85 -4.81 -0.15 0.00 -0.53 0.00 0.00 39.78 35.13 1lmh n ASN 67 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1lmh s ILE 68 N -3.26 1.68 -1.44 -1.44 1.01 -0.78 -4.98 121.20 111.98 1lmh s ILE 68 Ca 0.48 -1.61 -0.13 0.00 0.00 0.00 0.00 60.65 59.39 1lmh s ILE 68 Cb -0.21 -2.07 -0.02 0.00 0.01 0.00 0.00 42.46 40.16 1lmh s ILE 68 CO 0.60 -0.34 2.46 -0.24 0.00 0.00 0.00 174.94 177.41 1lmh n SER 69 N 4.56 5.51 -4.12 3.58 2.88 -1.26 -1.68 113.62 123.09 1lmh n SER 69 Ca -0.06 -2.71 -0.18 0.00 -1.33 0.00 0.00 58.87 54.59 1lmh n SER 69 Cb 0.43 -1.56 -0.13 0.00 -0.75 0.00 0.00 64.21 62.20 1lmh n SER 69 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1lmh s LYS 70 N 2.98 0.77 -0.43 -1.46 1.02 -1.26 -1.33 119.74 120.04 1lmh s LYS 70 Ca 0.55 -0.78 -0.28 0.00 0.02 0.00 0.00 55.97 55.48 1lmh s LYS 70 Cb 0.15 -0.73 0.03 0.00 -0.52 0.00 0.00 37.83 36.76 1lmh s LYS 70 CO -0.06 0.17 1.09 1.03 -0.92 0.00 0.00 175.35 176.66 1lmh s ARG 71 N -1.35 3.80 0.00 1.68 0.52 -0.33 -4.43 118.95 118.85 1lmh s ARG 71 Ca -0.02 0.66 0.00 0.00 -0.52 0.00 0.00 55.73 55.85 1lmh s ARG 71 Cb -0.09 -3.86 0.00 0.00 0.52 0.00 0.00 34.95 31.53 1lmh s ARG 71 CO 0.01 -1.22 0.00 0.44 0.02 0.00 0.00 175.30 174.55 1lmh n ILE 73 N 6.51 0.00 -4.53 1.52 -5.35 -0.48 -0.25 119.36 116.78 1lmh n ILE 73 Ca 0.11 0.00 -0.23 0.00 -0.27 0.00 0.00 62.75 62.36 1lmh n ILE 73 Cb 0.48 0.00 -0.16 0.00 -1.74 0.00 0.00 39.64 38.22 1lmh n ILE 73 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1lmh s ALA 74 N -2.00 1.12 -0.06 -1.28 0.00 -0.10 -0.68 121.76 118.77 1lmh s ALA 74 Ca 0.00 -0.41 0.02 0.00 0.00 0.00 0.00 51.96 51.58 1lmh s ALA 74 Cb 0.00 -0.46 0.01 0.00 0.00 0.00 0.00 23.12 22.68 1lmh s ALA 74 CO 0.00 0.15 -0.11 0.08 0.00 0.00 0.00 175.76 175.87 1lmh s VAL 75 N 0.40 1.06 -0.36 0.00 1.01 0.85 -0.91 120.40 122.45 1lmh s VAL 75 Ca -0.08 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.46 1lmh s VAL 75 Cb -0.12 -0.98 0.14 0.00 0.00 0.00 0.00 36.38 35.42 1lmh s VAL 75 CO 0.02 0.34 0.22 -0.22 0.00 0.00 0.00 175.10 175.46 1lmh s LEU 76 N 0.64 1.16 -0.30 3.92 2.96 0.11 -0.88 118.68 126.29 1lmh s LEU 76 Ca -0.13 -2.29 -0.10 0.00 -0.22 0.00 0.00 54.13 51.39 1lmh s LEU 76 Cb -0.15 -0.45 -0.02 0.00 0.50 0.00 0.00 46.19 46.07 1lmh s LEU 76 CO 0.03 -0.30 0.15 -0.63 -1.32 0.00 0.00 176.35 174.29 1lmh s ILE 77 N 0.93 4.70 0.85 6.68 1.01 0.12 -4.50 121.20 131.00 1lmh s ILE 77 Ca 0.19 -0.28 -0.11 0.00 0.00 0.00 0.00 60.65 60.45 1lmh s ILE 77 Cb -0.21 -3.34 0.10 0.00 0.01 0.00 0.00 42.46 39.02 1lmh s ILE 77 CO -0.01 0.13 1.10 -2.16 0.00 0.00 0.00 174.94 174.01 1lmh s PRO 78 N 1.64 1.60 -0.05 2.79 0.04 -1.26 -0.95 135.00 138.81 1lmh s PRO 78 Ca 0.05 1.14 -0.37 0.00 0.04 0.00 0.00 61.00 61.87 1lmh s PRO 78 Cb -0.17 -1.82 -0.15 0.00 0.04 0.00 0.00 34.50 32.40 1lmh s PRO 78 CO 0.07 -2.10 1.60 -3.47 0.04 0.00 0.00 177.00 173.14 1lmh n ASP 79 N -3.83 2.42 -1.26 6.66 -0.08 -1.26 -4.71 116.55 114.49 1lmh n ASP 79 Ca 0.09 1.07 -0.00 0.00 -1.51 0.00 0.00 54.79 54.44 1lmh n ASP 79 Cb 0.53 -1.24 0.17 0.00 2.34 0.00 0.00 41.12 42.92 1lmh n ASP 79 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1lmh n ASP 80 N 4.30 3.27 0.00 1.67 2.03 -1.10 -4.82 116.55 121.90 1lmh n ASP 80 Ca 0.22 -2.51 0.00 0.00 0.52 0.00 0.00 54.79 53.01 1lmh n ASP 80 Cb 0.20 -0.61 0.00 0.00 -0.72 0.00 0.00 41.12 40.00 1lmh n ASP 80 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1lmh n GLY 81 N 0.16 3.00 0.10 0.27 0.00 -1.26 -4.74 105.19 102.71 1lmh n GLY 81 Ca 0.17 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.33 1lmh n GLY 81 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1lmh n SER 82 N 0.00 0.40 0.00 1.61 3.41 -1.26 -4.88 113.62 112.90 1lmh n SER 82 Ca 0.00 -0.51 0.00 0.00 -0.26 0.00 0.00 58.87 58.10 1lmh n SER 82 Cb 0.00 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 63.85 1lmh n SER 82 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1lmh n GLY 83 N 1.28 1.56 3.71 5.00 0.00 -1.26 -5.02 105.19 110.46 1lmh n GLY 83 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 1lmh n GLY 83 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lmh s LYS 84 N -0.43 4.33 0.04 1.61 1.02 -1.26 -4.95 119.74 120.10 1lmh s LYS 84 Ca 0.00 0.51 -0.01 0.00 0.02 0.00 0.00 55.97 56.49 1lmh s LYS 84 Cb 0.00 -3.46 -0.03 0.00 -0.52 0.00 0.00 37.83 33.82 1lmh s LYS 84 CO 0.00 0.08 -0.03 -1.54 -0.92 0.00 0.00 175.35 172.95 1lmh s SER 85 N 0.75 0.38 -0.16 2.83 1.04 -1.26 -2.72 113.70 114.55 1lmh s SER 85 Ca 0.27 -0.79 -0.01 0.00 0.48 0.00 0.00 55.95 55.90 1lmh s SER 85 Cb -0.15 0.16 0.04 0.00 0.10 0.00 0.00 66.02 66.17 1lmh s SER 85 CO 0.11 -0.48 -0.04 -0.31 0.98 0.00 0.00 173.24 173.51 1lmh s TYR 86 N -2.90 1.54 -0.41 5.02 1.51 -0.12 -4.99 117.35 117.00 1lmh s TYR 86 Ca -0.03 -1.00 0.02 0.00 -1.01 0.00 0.00 57.07 55.06 1lmh s TYR 86 Cb 0.01 -1.24 0.12 0.00 -0.11 0.00 0.00 41.96 40.74 1lmh s TYR 86 CO -0.06 -0.60 0.19 0.34 -1.11 0.00 0.00 175.55 174.31 1lmh s ASP 87 N 1.69 3.89 0.00 2.29 -1.08 -1.25 0.16 116.67 122.36 1lmh s ASP 87 Ca 0.01 -2.40 0.00 0.00 -0.52 0.00 0.00 52.55 49.63 1lmh s ASP 87 Cb -0.15 -1.10 0.00 0.00 -1.46 0.00 0.00 42.92 40.21 1lmh s ASP 87 CO -0.07 -0.31 0.00 -1.22 0.52 0.00 0.00 175.17 174.09 1lmh n TYR 88 N 3.85 0.00 0.00 -5.34 4.02 -0.06 -5.00 117.16 114.63 1lmh n TYR 88 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.95 1lmh n TYR 88 Cb 0.36 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.68 1lmh n TYR 88 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1lmh n LEU 90 N 0.00 0.00 -4.39 7.72 4.77 0.15 -0.10 117.00 125.15 1lmh n LEU 90 Ca 0.00 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.65 1lmh n LEU 90 Cb 0.00 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 40.95 1lmh n LEU 90 CO 0.00 0.00 -0.43 -0.69 -1.33 0.00 0.00 177.39 174.94 1lmh s VAL 91 N -1.19 3.17 -1.40 4.08 1.01 0.02 -1.38 120.40 124.71 1lmh s VAL 91 Ca 0.00 -0.62 -0.05 0.00 0.00 0.00 0.00 61.98 61.31 1lmh s VAL 91 Cb 0.00 -2.34 0.03 0.00 0.00 0.00 0.00 36.38 34.07 1lmh s VAL 91 CO 0.00 0.52 0.79 0.59 0.00 0.00 0.00 175.10 177.00 1lmh n ASN 92 N 3.56 -2.44 -4.77 3.32 3.02 0.66 -1.31 115.26 117.30 1lmh n ASN 92 Ca -0.18 -0.82 -0.40 0.00 -0.03 0.00 0.00 54.58 53.15 1lmh n ASN 92 Cb 0.53 -3.94 -0.01 0.00 -0.61 0.00 0.00 39.78 35.74 1lmh n ASN 92 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1lmh s PRO 93 N -6.25 4.18 -0.11 3.52 0.04 -1.26 -4.55 135.00 130.57 1lmh s PRO 93 Ca 0.24 2.19 -0.07 0.00 0.04 0.00 0.00 61.00 63.40 1lmh s PRO 93 Cb -0.12 -2.93 0.04 0.00 0.04 0.00 0.00 34.50 31.53 1lmh s PRO 93 CO 0.82 -0.32 0.27 0.21 0.04 0.00 0.00 177.00 178.02 1lmh s LYS 94 N -2.00 0.26 -0.27 4.56 2.20 -0.34 -4.99 119.74 119.15 1lmh s LYS 94 Ca 0.52 0.52 -0.29 0.00 -0.36 0.00 0.00 55.97 56.36 1lmh s LYS 94 Cb -0.39 -0.03 0.01 0.00 -1.51 0.00 0.00 37.83 35.91 1lmh s LYS 94 CO 0.51 -0.13 1.18 0.42 -0.36 0.00 0.00 175.35 176.97 1lmh s ILE 95 N 0.95 4.37 -0.13 5.43 1.01 -1.26 -1.36 121.20 130.21 1lmh s ILE 95 Ca -0.07 1.60 0.19 0.00 0.00 0.00 0.00 60.65 62.37 1lmh s ILE 95 Cb -0.08 -4.25 -0.20 0.00 0.01 0.00 0.00 42.46 37.95 1lmh s ILE 95 CO -0.06 -0.38 0.59 1.33 0.00 0.00 0.00 174.94 176.41 1lmh n VAL 96 N 5.82 0.94 -3.51 2.92 0.24 0.07 -4.99 118.33 119.82 1lmh n VAL 96 Ca 0.13 -0.68 -0.12 0.00 -2.04 0.00 0.00 64.34 61.63 1lmh n VAL 96 Cb 0.46 -0.49 -0.04 0.00 -1.47 0.00 0.00 33.84 32.31 1lmh n VAL 96 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1lmh s SER 97 N -5.41 -0.45 0.12 -1.34 1.04 -1.21 -5.02 113.70 101.43 1lmh s SER 97 Ca -0.05 -0.02 -0.25 0.00 0.48 0.00 0.00 55.95 56.11 1lmh s SER 97 Cb 0.09 0.54 0.07 0.00 0.10 0.00 0.00 66.02 66.83 1lmh s SER 97 CO 0.84 -0.87 0.72 -1.38 0.98 0.00 0.00 173.24 173.52 1lmh s HIS 98 N -3.39 -0.42 0.67 5.02 -0.00 -1.26 -1.01 115.29 114.90 1lmh s HIS 98 Ca -0.00 0.20 -0.12 0.00 -0.00 0.00 0.00 55.06 55.14 1lmh s HIS 98 Cb -0.00 0.57 -0.00 0.00 -0.00 0.00 0.00 32.58 33.15 1lmh s HIS 98 CO -0.09 -0.80 1.06 -1.54 -0.00 0.00 0.00 174.74 173.36 1lmh s SER 99 N -2.70 5.47 0.04 7.38 1.04 0.07 -4.97 113.70 120.03 1lmh s SER 99 Ca 0.04 1.67 -0.05 0.00 0.48 0.00 0.00 55.95 58.09 1lmh s SER 99 Cb -0.02 -2.51 -0.29 0.00 0.10 0.00 0.00 66.02 63.31 1lmh s SER 99 CO -0.09 -1.38 1.02 0.58 0.98 0.00 0.00 173.24 174.35 1lmh h VAL 100 N -0.43 1.35 -3.77 5.02 2.07 -2.01 -3.43 116.25 115.04 1lmh h VAL 100 Ca -0.45 -2.93 -0.53 0.00 0.82 0.00 0.00 66.70 63.62 1lmh h VAL 100 Cb 1.21 2.89 0.07 0.00 -1.52 0.00 0.00 31.29 33.94 1lmh h VAL 100 CO 0.57 0.86 0.71 -1.58 0.02 0.00 0.00 177.57 178.14 1lmh s GLN 101 N -2.64 4.27 0.48 1.57 0.74 -1.26 -4.91 119.66 117.91 1lmh s GLN 101 Ca -0.06 2.34 0.07 0.00 0.05 0.00 0.00 55.36 57.75 1lmh s GLN 101 Cb 0.07 -3.05 0.03 0.00 1.10 0.00 0.00 33.01 31.16 1lmh s GLN 101 CO 0.88 -0.34 0.65 -1.21 -0.55 0.00 0.00 175.29 174.72 1lmh s GLU 102 N -1.53 2.66 0.08 1.67 2.02 -1.26 -1.36 118.70 120.97 1lmh s GLU 102 Ca 0.53 -1.23 -0.08 0.00 0.02 0.00 0.00 54.97 54.21 1lmh s GLU 102 Cb -0.42 -2.68 -0.01 0.00 0.10 0.00 0.00 34.13 31.12 1lmh s GLU 102 CO 0.53 -0.48 0.16 0.00 0.02 0.00 0.00 175.26 175.50 1lmh s ALA 103 N -2.49 -0.15 -0.06 5.21 0.00 0.11 -0.23 121.76 124.15 1lmh s ALA 103 Ca 0.57 -0.64 -0.28 0.00 0.00 0.00 0.00 51.96 51.61 1lmh s ALA 103 Cb -0.09 0.42 0.06 0.00 0.00 0.00 0.00 23.12 23.51 1lmh s ALA 103 CO 0.35 -0.47 0.63 1.52 0.00 0.00 0.00 175.76 177.79 1lmh s TYR 104 N -3.64 -0.60 -0.03 0.00 -0.85 -0.33 -1.08 117.35 110.82 1lmh s TYR 104 Ca 0.03 1.05 -0.26 0.00 -0.52 0.00 0.00 57.07 57.38 1lmh s TYR 104 Cb 0.04 0.36 -0.04 0.00 0.38 0.00 0.00 41.96 42.70 1lmh s TYR 104 CO -0.10 -0.56 0.80 -0.51 -1.52 0.00 0.00 175.55 173.66 1lmh s LEU 105 N -1.11 4.35 0.56 -3.49 1.43 -1.26 -1.48 118.68 117.67 1lmh s LEU 105 Ca -0.11 1.37 0.26 0.00 -1.03 0.00 0.00 54.13 54.63 1lmh s LEU 105 Cb -0.01 -3.26 1.47 0.00 0.03 0.00 0.00 46.19 44.43 1lmh s LEU 105 CO 0.09 -0.14 2.02 1.55 0.23 0.00 0.00 176.35 180.09 1lmh h PRO 106 N 6.60 0.00 -0.50 1.29 0.13 -1.96 -1.74 132.00 135.82 1lmh h PRO 106 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1lmh h PRO 106 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1lmh h PRO 106 CO 0.75 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.77 1lmh n THR 107 N -4.12 0.76 -2.40 1.56 -2.24 -1.26 -4.97 114.28 101.61 1lmh n THR 107 Ca 0.07 -0.88 0.00 0.00 -2.27 0.00 0.00 64.05 60.97 1lmh n THR 107 Cb 0.51 0.73 0.00 0.00 -2.10 0.00 0.00 70.33 69.47 1lmh n THR 107 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1lmh n GLY 108 N 1.36 -0.96 3.33 3.38 0.00 -0.66 -4.71 105.19 106.93 1lmh n GLY 108 Ca 0.20 -1.50 -0.17 0.00 0.00 0.00 0.00 46.02 44.55 1lmh n GLY 108 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1lmh s GLU 109 N 0.00 1.45 0.21 1.61 2.02 -1.26 -4.66 118.70 118.07 1lmh s GLU 109 Ca 0.00 -1.79 -0.00 0.00 0.02 0.00 0.00 54.97 53.20 1lmh s GLU 109 Cb 0.00 -0.33 -0.04 0.00 0.10 0.00 0.00 34.13 33.86 1lmh s GLU 109 CO 0.00 -0.29 0.11 0.20 0.02 0.00 0.00 175.26 175.30 1lmh s GLY 110 N -3.34 1.50 -0.23 -1.39 0.00 -1.26 -4.62 107.32 97.98 1lmh s GLY 110 Ca 0.37 -1.74 -0.20 0.00 0.00 0.00 0.00 44.72 43.16 1lmh s GLY 110 CO 0.14 -1.46 0.61 0.00 0.00 0.00 0.00 173.10 172.40 1lmh h LEU 112 N 5.57 0.00 -0.32 0.00 3.38 -1.95 -1.48 115.31 120.50 1lmh h LEU 112 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1lmh h LEU 112 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1lmh h LEU 112 CO 0.13 0.04 -0.08 -1.20 0.09 0.00 0.00 178.44 177.43 1lmh n SER 113 N -3.26 0.58 -3.99 -0.43 7.64 -1.26 -4.51 113.62 108.39 1lmh n SER 113 Ca -0.01 -0.81 -0.31 0.00 1.01 0.00 0.00 58.87 58.75 1lmh n SER 113 Cb 0.22 -0.04 -0.15 0.00 -1.01 0.00 0.00 64.21 63.23 1lmh n SER 113 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1lmh s VAL 114 N -2.31 2.18 0.23 0.44 1.01 -0.56 0.65 120.40 122.04 1lmh s VAL 114 Ca 0.34 -2.31 -0.06 0.00 0.00 0.00 0.00 61.98 59.95 1lmh s VAL 114 Cb 0.20 -2.61 0.20 0.00 0.00 0.00 0.00 36.38 34.18 1lmh s VAL 114 CO 0.43 -0.61 1.71 0.44 0.00 0.00 0.00 175.10 177.08 1lmh h ASP 115 N 7.61 0.15 -2.89 3.32 3.32 -1.79 -3.42 116.42 122.72 1lmh h ASP 115 Ca -0.05 0.12 -0.63 0.00 0.02 0.00 0.00 57.03 56.49 1lmh h ASP 115 Cb 1.02 0.13 -0.05 0.00 0.22 0.00 0.00 39.33 40.64 1lmh h ASP 115 CO 0.52 0.05 -0.51 -1.81 -1.72 0.00 0.00 179.24 175.78 1lmh s ASP 116 N -5.31 6.29 0.56 6.45 1.01 -1.26 -5.08 116.67 119.33 1lmh s ASP 116 Ca -0.13 0.28 -0.20 0.00 0.71 0.00 0.00 52.55 53.22 1lmh s ASP 116 Cb 0.20 -1.94 -0.05 0.00 1.01 0.00 0.00 42.92 42.14 1lmh s ASP 116 CO 0.75 0.21 1.17 0.20 0.21 0.00 0.00 175.17 177.72 1lmh s ASN 117 N -2.23 5.52 -0.09 0.27 0.01 -1.26 -4.98 114.94 112.19 1lmh s ASN 117 Ca 0.31 2.29 0.01 0.00 -0.71 0.00 0.00 52.86 54.76 1lmh s ASN 117 Cb -0.13 -2.59 0.02 0.00 0.41 0.00 0.00 41.25 38.96 1lmh s ASN 117 CO 0.23 -1.36 -0.09 -0.69 -1.51 0.00 0.00 177.10 173.68 1lmh s VAL 118 N -1.66 0.99 0.37 1.60 1.01 -1.26 -5.13 120.40 116.31 1lmh s VAL 118 Ca 0.74 -0.33 -0.20 0.00 0.00 0.00 0.00 61.98 62.20 1lmh s VAL 118 Cb -0.27 -0.97 -0.10 0.00 0.00 0.00 0.00 36.38 35.04 1lmh s VAL 118 CO 0.31 0.34 0.88 0.00 0.00 0.00 0.00 175.10 176.62 1lmh s ALA 119 N 1.23 3.16 0.00 5.51 0.00 -1.26 -4.63 121.76 125.77 1lmh s ALA 119 Ca -0.04 0.30 0.00 0.00 0.00 0.00 0.00 51.96 52.22 1lmh s ALA 119 Cb -0.14 -3.03 0.00 0.00 0.00 0.00 0.00 23.12 19.95 1lmh s ALA 119 CO -0.03 0.20 0.00 0.41 0.00 0.00 0.00 175.76 176.35 1lmh n GLY 120 N -0.34 4.68 3.76 0.00 0.00 -1.26 -4.97 105.19 107.06 1lmh n GLY 120 Ca 0.05 -1.11 -0.39 0.00 0.00 0.00 0.00 46.02 44.57 1lmh n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1lmh s LEU 121 N 0.00 4.55 -0.33 0.99 1.43 0.97 -4.14 118.68 122.14 1lmh s LEU 121 Ca 0.00 1.87 0.03 0.00 -1.03 0.00 0.00 54.13 55.00 1lmh s LEU 121 Cb 0.00 -3.70 0.09 0.00 0.03 0.00 0.00 46.19 42.62 1lmh s LEU 121 CO 0.00 0.10 0.04 -0.69 0.23 0.00 0.00 176.35 176.02 1lmh s VAL 122 N -1.31 2.41 -0.02 -1.59 1.01 -1.26 -4.26 120.40 115.37 1lmh s VAL 122 Ca 0.43 -2.15 -0.27 0.00 0.00 0.00 0.00 61.98 59.99 1lmh s VAL 122 Cb -0.23 -2.68 -0.03 0.00 0.00 0.00 0.00 36.38 33.43 1lmh s VAL 122 CO 0.29 -0.49 0.86 -1.00 0.00 0.00 0.00 175.10 174.76 1lmh s HIS 123 N 0.98 3.63 0.38 5.22 3.76 -1.26 -4.47 115.29 123.52 1lmh s HIS 123 Ca 0.07 1.52 0.06 0.00 -0.15 0.00 0.00 55.06 56.55 1lmh s HIS 123 Cb -0.20 -2.99 -0.02 0.00 1.11 0.00 0.00 32.58 30.48 1lmh s HIS 123 CO -0.07 0.04 0.21 1.03 -0.85 0.00 0.00 174.74 175.10 1lmh s ARG 124 N 0.89 1.86 0.22 1.40 0.52 -0.24 -4.93 118.95 118.66 1lmh s ARG 124 Ca 0.46 -2.12 -0.30 0.00 -0.52 0.00 0.00 55.73 53.25 1lmh s ARG 124 Cb -0.20 -0.14 -0.08 0.00 0.52 0.00 0.00 34.95 35.05 1lmh s ARG 124 CO 0.24 -0.58 1.16 -1.01 0.02 0.00 0.00 175.30 175.13 1lmh s HIS 125 N -3.32 3.48 0.20 -0.53 3.76 -1.26 0.07 115.29 117.69 1lmh s HIS 125 Ca 0.31 1.53 -0.04 0.00 -0.15 0.00 0.00 55.06 56.72 1lmh s HIS 125 Cb 0.02 -3.37 0.14 0.00 1.11 0.00 0.00 32.58 30.48 1lmh s HIS 125 CO 0.21 -0.93 1.55 -0.97 -0.85 0.00 0.00 174.74 173.74 1lmh h ASN 126 N 4.73 0.68 -4.08 1.40 -1.24 -1.43 -3.42 115.58 112.22 1lmh h ASN 126 Ca -0.45 -0.32 -0.49 0.00 0.71 0.00 0.00 56.30 55.75 1lmh h ASN 126 Cb 1.21 -0.19 -0.30 0.00 0.73 0.00 0.00 38.32 39.77 1lmh h ASN 126 CO 0.72 1.02 -0.81 -0.54 -1.29 0.00 0.00 177.43 176.53 1lmh s LYS 127 N -4.21 1.22 0.05 6.67 1.02 -1.26 -1.01 119.74 122.21 1lmh s LYS 127 Ca -0.08 -0.48 -0.06 0.00 0.02 0.00 0.00 55.97 55.37 1lmh s LYS 127 Cb 0.12 -1.14 -0.01 0.00 -0.52 0.00 0.00 37.83 36.27 1lmh s LYS 127 CO 0.84 0.26 0.10 0.96 -0.92 0.00 0.00 175.35 176.58 1lmh s ILE 128 N -0.17 0.15 -0.14 2.17 -4.36 -0.65 -0.75 121.20 117.45 1lmh s ILE 128 Ca 0.02 -1.23 0.01 0.00 -0.26 0.00 0.00 60.65 59.19 1lmh s ILE 128 Cb -0.07 -1.11 0.02 0.00 1.25 0.00 0.00 42.46 42.55 1lmh s ILE 128 CO 0.00 -0.68 -0.16 -0.89 0.24 0.00 0.00 174.94 173.45 1lmh s THR 129 N -3.13 1.66 -0.02 8.37 2.01 -0.18 -1.13 115.64 123.22 1lmh s THR 129 Ca -0.01 -0.71 0.04 0.00 0.31 0.00 0.00 61.69 61.33 1lmh s THR 129 Cb 0.02 -1.53 -0.03 0.00 0.01 0.00 0.00 72.50 70.97 1lmh s THR 129 CO -0.07 0.47 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.56 1lmh s ILE 130 N 1.26 3.09 -0.04 1.82 1.01 0.36 -0.75 121.20 127.96 1lmh s ILE 130 Ca 0.01 -0.84 0.07 0.00 0.00 0.00 0.00 60.65 59.88 1lmh s ILE 130 Cb -0.14 -2.25 -0.02 0.00 0.01 0.00 0.00 42.46 40.06 1lmh s ILE 130 CO -0.08 0.50 -0.25 -0.54 0.00 0.00 0.00 174.94 174.57 1lmh s LYS 131 N -1.01 2.32 0.37 2.79 1.02 -0.47 -0.28 119.74 124.49 1lmh s LYS 131 Ca 0.13 -0.92 -0.15 0.00 0.02 0.00 0.00 55.97 55.06 1lmh s LYS 131 Cb -0.11 -2.10 0.06 0.00 -0.52 0.00 0.00 37.83 35.16 1lmh s LYS 131 CO 0.03 0.48 0.79 0.00 -0.92 0.00 0.00 175.35 175.72 1lmh n ALA 132 N 2.67 -1.79 -2.56 5.17 0.00 -0.23 -1.20 120.51 122.57 1lmh n ALA 132 Ca -0.17 -1.22 -0.27 0.00 0.00 0.00 0.00 53.44 51.78 1lmh n ALA 132 Cb 0.51 0.96 -0.09 0.00 0.00 0.00 0.00 19.45 20.83 1lmh n ALA 132 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1lmh s LYS 133 N -2.08 2.02 0.39 0.00 -0.14 -0.43 -1.22 119.74 118.29 1lmh s LYS 133 Ca 0.16 -1.28 0.01 0.00 -1.36 0.00 0.00 55.97 53.50 1lmh s LYS 133 Cb -0.05 -2.14 0.08 0.00 -1.68 0.00 0.00 37.83 34.04 1lmh s LYS 133 CO 0.11 0.43 0.54 -0.40 -0.76 0.00 0.00 175.35 175.28 1lmh n ASP 134 N 0.09 0.86 0.20 2.83 3.85 0.53 -0.80 116.55 124.11 1lmh n ASP 134 Ca -0.11 -1.70 0.17 0.00 -0.71 0.00 0.00 54.79 52.44 1lmh n ASP 134 Cb 0.55 -0.34 0.81 0.00 -1.35 0.00 0.00 41.12 40.80 1lmh n ASP 134 CO 0.00 0.00 0.00 -0.29 -1.01 0.00 0.00 177.20 175.90 1lmh h ILE 135 N -0.38 0.51 -0.48 2.12 2.10 -1.96 -0.26 117.51 119.17 1lmh h ILE 135 Ca -0.18 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.76 1lmh h ILE 135 Cb 0.69 0.84 0.00 0.00 -1.09 0.00 0.00 36.82 37.27 1lmh h ILE 135 CO 0.20 0.00 0.00 -0.62 -1.08 0.00 0.00 178.15 176.65 1lmh n GLU 136 N -3.87 2.37 -0.73 2.19 -0.58 -1.26 -4.64 120.64 114.12 1lmh n GLU 136 Ca 0.02 -2.11 0.00 0.00 -0.42 0.00 0.00 57.16 54.65 1lmh n GLU 136 Cb 0.33 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.71 1lmh n GLU 136 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1lmh n GLY 137 N 1.45 0.73 3.89 0.62 0.00 -0.11 -4.98 105.19 106.80 1lmh n GLY 137 Ca 0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 1lmh n GLY 137 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1lmh s ASN 138 N -2.40 5.67 0.06 1.61 0.01 -1.26 -4.69 114.94 113.94 1lmh s ASN 138 Ca 0.00 1.03 -0.23 0.00 -0.71 0.00 0.00 52.86 52.95 1lmh s ASN 138 Cb 0.00 -1.97 -0.06 0.00 0.41 0.00 0.00 41.25 39.63 1lmh s ASN 138 CO 0.00 -1.13 0.68 -1.81 -1.51 0.00 0.00 177.10 173.34 1lmh s ASP 139 N -4.30 7.15 -0.03 -1.22 1.01 -1.26 -0.34 116.67 117.67 1lmh s ASP 139 Ca 0.56 1.37 0.02 0.00 0.71 0.00 0.00 52.55 55.21 1lmh s ASP 139 Cb -0.11 -2.42 0.01 0.00 1.01 0.00 0.00 42.92 41.40 1lmh s ASP 139 CO 0.50 0.12 -0.09 -0.63 0.21 0.00 0.00 175.17 175.28 1lmh s ILE 140 N -0.49 0.80 -0.11 0.77 -1.09 -0.35 -4.89 121.20 115.83 1lmh s ILE 140 Ca 0.34 -0.35 -0.01 0.00 -2.23 0.00 0.00 60.65 58.40 1lmh s ILE 140 Cb -0.20 -0.73 0.03 0.00 -1.58 0.00 0.00 42.46 39.99 1lmh s ILE 140 CO 0.21 0.26 -0.02 -1.58 -1.23 0.00 0.00 174.94 172.58 1lmh s GLN 141 N 0.34 0.95 -0.01 2.79 0.74 -1.26 -1.07 119.66 122.14 1lmh s GLN 141 Ca -0.06 -0.15 0.03 0.00 0.05 0.00 0.00 55.36 55.23 1lmh s GLN 141 Cb -0.10 -1.45 -0.03 0.00 1.10 0.00 0.00 33.01 32.53 1lmh s GLN 141 CO 0.01 -0.37 -0.07 -0.51 -0.55 0.00 0.00 175.29 173.80 1lmh s LEU 142 N 1.84 3.15 -0.28 3.68 1.02 0.62 -4.94 118.68 123.77 1lmh s LEU 142 Ca 0.03 -0.13 -0.00 0.00 0.02 0.00 0.00 54.13 54.05 1lmh s LEU 142 Cb -0.14 -1.79 0.05 0.00 0.02 0.00 0.00 46.19 44.34 1lmh s LEU 142 CO -0.07 0.30 -0.04 -0.13 0.02 0.00 0.00 176.35 176.42 1lmh s ARG 143 N -1.31 2.43 0.18 1.70 0.52 -1.26 -0.49 118.95 120.72 1lmh s ARG 143 Ca 0.16 -1.25 0.11 0.00 -0.52 0.00 0.00 55.73 54.23 1lmh s ARG 143 Cb -0.11 -3.06 -0.04 0.00 0.52 0.00 0.00 34.95 32.26 1lmh s ARG 143 CO 0.06 -0.57 -0.22 -0.51 0.02 0.00 0.00 175.30 174.08 1lmh s LEU 144 N 1.22 2.52 -0.03 2.53 1.43 -0.28 -5.00 118.68 121.06 1lmh s LEU 144 Ca -0.06 -0.80 -0.09 0.00 -1.03 0.00 0.00 54.13 52.15 1lmh s LEU 144 Cb -0.19 -1.26 0.01 0.00 0.03 0.00 0.00 46.19 44.78 1lmh s LEU 144 CO -0.03 0.12 0.19 -0.75 0.23 0.00 0.00 176.35 176.12 1lmh s LYS 145 N -2.63 0.43 6.72 1.70 2.20 -1.26 -1.63 119.74 125.27 1lmh s LYS 145 Ca 0.21 -0.13 0.00 0.00 -0.36 0.00 0.00 55.97 55.69 1lmh s LYS 145 Cb -0.08 0.19 0.00 0.00 -1.51 0.00 0.00 37.83 36.43 1lmh s LYS 145 CO 0.10 -0.10 0.00 0.41 -0.36 0.00 0.00 175.35 175.41 1lmh n GLY 146 N 1.94 2.93 0.41 5.54 0.00 -0.18 -3.75 105.19 112.07 1lmh n GLY 146 Ca -0.19 -0.31 -0.10 0.00 0.00 0.00 0.00 46.02 45.42 1lmh n GLY 146 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1lmh h TYR 147 N 0.00 -1.36 -0.40 1.61 3.20 -1.95 -0.05 116.97 118.02 1lmh h TYR 147 Ca 0.00 0.07 -0.00 0.00 3.14 0.00 0.00 58.73 61.94 1lmh h TYR 147 Cb 0.00 0.65 -0.02 0.00 1.54 0.00 0.00 36.73 38.90 1lmh h TYR 147 CO 0.00 -0.45 0.25 -1.00 -1.64 0.00 0.00 178.16 175.32 1lmh h PRO 148 N -0.32 0.54 -0.63 1.82 0.13 -1.98 -0.60 132.00 130.95 1lmh h PRO 148 Ca 0.13 -0.04 -0.06 0.00 -0.87 0.00 0.00 66.00 65.16 1lmh h PRO 148 Cb 0.58 -0.12 -0.03 0.00 0.13 0.00 0.00 31.00 31.57 1lmh h PRO 148 CO -0.60 0.37 0.16 0.00 -0.23 0.00 0.00 178.00 177.70 1lmh h ALA 149 N 1.72 1.09 -0.41 -0.56 0.00 -1.26 -1.68 119.26 118.17 1lmh h ALA 149 Ca 0.15 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1lmh h ALA 149 Cb -0.03 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1lmh h ALA 149 CO -0.03 0.61 -0.04 0.82 0.00 0.00 0.00 179.25 180.61 1lmh h ILE 150 N 0.95 1.27 -0.28 0.00 2.04 0.09 -2.21 117.51 119.36 1lmh h ILE 150 Ca 0.20 -1.10 -0.00 0.00 1.00 0.00 0.00 64.86 64.96 1lmh h ILE 150 Cb 0.33 1.16 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 1lmh h ILE 150 CO -0.00 0.37 0.16 0.58 0.00 0.00 0.00 178.15 179.26 1lmh h VAL 151 N 0.57 1.12 -0.47 1.67 2.07 -0.82 -1.24 116.25 119.15 1lmh h VAL 151 Ca 0.11 -0.29 -0.07 0.00 0.82 0.00 0.00 66.70 67.27 1lmh h VAL 151 Cb 0.55 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 1lmh h VAL 151 CO 0.03 0.12 0.01 -0.26 0.02 0.00 0.00 177.57 177.49 1lmh h PHE 152 N 0.35 0.80 -0.40 1.57 -1.00 -1.29 -1.52 116.94 115.45 1lmh h PHE 152 Ca 0.10 -0.10 -0.10 0.00 2.81 0.00 0.00 57.97 60.67 1lmh h PHE 152 Cb 0.04 -0.22 -0.02 0.00 3.61 0.00 0.00 35.95 39.36 1lmh h PHE 152 CO -0.04 0.74 -0.17 1.96 -1.61 0.00 0.00 178.31 179.20 1lmh h GLN 153 N 0.71 0.74 -0.35 1.51 4.20 -1.15 0.11 115.11 120.89 1lmh h GLN 153 Ca 0.14 -0.27 -0.01 0.00 0.06 0.00 0.00 58.65 58.57 1lmh h GLN 153 Cb 0.42 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.14 1lmh h GLN 153 CO 0.02 0.87 0.17 1.25 -0.67 0.00 0.00 178.83 180.47 1lmh h HIS 154 N 0.66 0.49 -0.44 2.96 2.76 -0.85 -0.08 115.15 120.65 1lmh h HIS 154 Ca 0.10 -0.02 -0.11 0.00 -2.20 0.00 0.00 60.37 58.14 1lmh h HIS 154 Cb 0.65 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.45 1lmh h HIS 154 CO 0.03 0.41 -0.17 0.93 -1.30 0.00 0.00 177.93 177.83 1lmh h GLU 155 N 0.43 0.90 -0.51 5.26 4.39 -1.00 -2.84 114.58 121.21 1lmh h GLU 155 Ca 0.12 -0.37 -0.07 0.00 0.34 0.00 0.00 59.36 59.38 1lmh h GLU 155 Cb 0.10 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.69 1lmh h GLU 155 CO -0.02 1.02 0.05 0.82 -1.16 0.00 0.00 179.01 179.73 1lmh h ILE 156 N 0.73 1.24 -1.00 3.13 2.04 -0.85 -2.06 117.51 120.75 1lmh h ILE 156 Ca 0.10 -0.95 0.14 0.00 1.00 0.00 0.00 64.86 65.15 1lmh h ILE 156 Cb 0.73 0.80 -0.09 0.00 -0.74 0.00 0.00 36.82 37.52 1lmh h ILE 156 CO 0.06 0.34 0.62 0.44 0.00 0.00 0.00 178.15 179.61 1lmh h ASP 157 N 0.78 0.88 -0.59 1.72 5.19 -0.78 0.92 116.42 124.55 1lmh h ASP 157 Ca 0.16 0.06 0.08 0.00 -0.62 0.00 0.00 57.03 56.71 1lmh h ASP 157 Cb 0.40 -0.11 -0.04 0.00 0.18 0.00 0.00 39.33 39.77 1lmh h ASP 157 CO 0.01 0.43 0.39 0.45 -3.12 0.00 0.00 179.24 177.41 1lmh h HIS 158 N 0.93 0.49 0.00 4.55 3.86 -1.18 0.18 115.15 123.99 1lmh h HIS 158 Ca 0.51 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.74 1lmh h HIS 158 Cb 0.59 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 28.89 1lmh h HIS 158 CO -0.01 0.25 0.00 -0.07 0.86 0.00 0.00 177.93 178.96 1lmh h LEU 159 N 0.48 0.00 -2.93 2.43 3.38 -0.81 -2.68 115.31 115.17 1lmh h LEU 159 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1lmh h LEU 159 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1lmh h LEU 159 CO -0.08 0.00 0.00 0.59 0.09 0.00 0.00 178.44 179.04 1lmh n ASN 160 N -2.68 3.39 -1.03 -0.43 3.02 -0.10 -0.12 115.26 117.30 1lmh n ASN 160 Ca 0.02 -2.16 -0.09 0.00 -0.03 0.00 0.00 54.58 52.32 1lmh n ASN 160 Cb 0.29 -0.34 -0.00 0.00 -0.61 0.00 0.00 39.78 39.11 1lmh n ASN 160 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1lmh n GLY 161 N 0.65 0.03 2.42 7.41 0.00 -1.00 -4.66 105.19 110.03 1lmh n GLY 161 Ca 0.16 -0.51 -0.17 0.00 0.00 0.00 0.00 46.02 45.50 1lmh n GLY 161 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1lmh n VAL 162 N -3.98 0.00 -0.08 1.61 0.31 -0.31 -4.62 118.33 111.26 1lmh n VAL 162 Ca -0.10 -1.41 -0.16 0.00 -0.01 0.00 0.00 64.34 62.67 1lmh n VAL 162 Cb 0.57 -0.15 -0.14 0.00 -0.91 0.00 0.00 33.84 33.22 1lmh n VAL 162 CO 0.00 0.00 0.00 2.22 -1.32 0.00 0.00 176.83 177.73 1lmh n PHE 164 N -1.27 0.39 0.59 3.52 1.16 -1.26 -3.50 117.46 117.09 1lmh n PHE 164 Ca -0.03 0.10 0.08 0.00 -1.87 0.00 0.00 57.45 55.73 1lmh n PHE 164 Cb 0.40 -1.06 0.36 0.00 -1.61 0.00 0.00 39.48 37.57 1lmh n PHE 164 CO 0.00 0.00 0.00 2.48 -1.87 0.00 0.00 176.76 177.37 1lmh n TYR 165 N -3.15 0.00 0.25 2.97 0.18 -1.26 -2.27 117.16 113.87 1lmh n TYR 165 Ca -0.36 0.00 0.12 0.00 1.88 0.00 0.00 57.90 59.54 1lmh n TYR 165 Cb 1.05 -0.47 0.62 0.00 -0.38 0.00 0.00 39.34 40.16 1lmh n TYR 165 CO 0.00 0.00 0.00 -0.44 -2.08 0.00 0.00 176.86 174.34 1lmh h ASP 166 N 0.00 0.00 0.48 9.48 3.32 -2.00 -2.82 116.42 124.88 1lmh h ASP 166 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1lmh h ASP 166 Cb 0.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.81 1lmh h ASP 166 CO 0.00 0.15 -0.38 1.41 -1.72 0.00 0.00 179.24 178.70 1lmh n HIS 167 N -3.46 0.00 -2.68 4.55 8.25 -0.96 -4.90 115.22 116.01 1lmh n HIS 167 Ca -0.01 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.03 1lmh n HIS 167 Cb 0.32 -0.24 -0.03 0.00 1.12 0.00 0.00 29.99 31.16 1lmh n HIS 167 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1lmh s ILE 168 N -2.87 4.78 0.15 1.59 1.01 -1.07 -4.69 121.20 120.10 1lmh s ILE 168 Ca 0.15 2.03 -0.31 0.00 0.00 0.00 0.00 60.65 62.52 1lmh s ILE 168 Cb 0.18 -4.30 -0.08 0.00 0.01 0.00 0.00 42.46 38.27 1lmh s ILE 168 CO 0.64 0.05 1.35 -0.62 0.00 0.00 0.00 174.94 176.36 1lmh s ASP 169 N 1.08 6.86 0.02 3.58 -1.08 -1.26 -4.95 116.67 120.92 1lmh s ASP 169 Ca 0.50 2.34 -0.25 0.00 -0.52 0.00 0.00 52.55 54.62 1lmh s ASP 169 Cb -0.19 -2.60 -0.19 0.00 -1.46 0.00 0.00 42.92 38.48 1lmh s ASP 169 CO 0.21 -0.59 1.43 0.50 0.52 0.00 0.00 175.17 177.23 1lmh h LYS 170 N 6.22 -0.00 -0.14 4.34 3.64 -1.97 -2.46 116.57 126.20 1lmh h LYS 170 Ca -0.43 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 58.78 1lmh h LYS 170 Cb 1.21 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.04 1lmh h LYS 170 CO 0.82 0.32 -0.59 -0.44 -2.27 0.00 0.00 179.45 177.30 1lmh h ASP 171 N -0.33 0.75 -2.12 4.20 3.32 -2.05 -3.38 116.42 116.81 1lmh h ASP 171 Ca -0.00 -0.62 -0.56 0.00 0.02 0.00 0.00 57.03 55.86 1lmh h ASP 171 Cb 0.32 -0.22 -0.41 0.00 0.22 0.00 0.00 39.33 39.25 1lmh h ASP 171 CO 0.00 1.25 -0.88 1.41 -1.72 0.00 0.00 179.24 179.30 1lmh n HIS 172 N -4.13 1.87 -0.08 4.55 8.25 -1.25 -4.96 115.22 119.47 1lmh n HIS 172 Ca -0.07 -3.88 0.15 0.00 -0.26 0.00 0.00 57.72 53.65 1lmh n HIS 172 Cb 0.64 -0.46 0.55 0.00 1.12 0.00 0.00 29.99 31.85 1lmh n HIS 172 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1lmh h PRO 173 N 3.59 0.30 -0.31 -0.41 0.13 -1.63 -2.52 132.00 131.15 1lmh h PRO 173 Ca 0.13 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1lmh h PRO 173 Cb 0.75 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.82 1lmh h PRO 173 CO 0.65 0.20 0.00 1.28 -0.23 0.00 0.00 178.00 179.90 1lmh n LEU 174 N -4.45 2.99 -4.59 1.56 4.77 -1.26 -0.02 117.00 116.00 1lmh n LEU 174 Ca 0.11 -1.26 -0.43 0.00 -0.03 0.00 0.00 56.01 54.40 1lmh n LEU 174 Cb 0.46 -0.20 -0.04 0.00 -2.33 0.00 0.00 43.42 41.32 1lmh n LEU 174 CO 0.34 0.63 0.72 -1.58 -1.33 0.00 0.00 177.39 176.17 1lmh s GLN 175 N -1.61 3.77 0.44 3.23 0.74 -0.95 -4.91 119.66 120.37 1lmh s GLN 175 Ca 0.36 0.45 -0.24 0.00 0.05 0.00 0.00 55.36 55.98 1lmh s GLN 175 Cb 0.21 -3.82 -0.08 0.00 1.10 0.00 0.00 33.01 30.42 1lmh s GLN 175 CO 0.30 -0.97 1.25 -2.14 -0.55 0.00 0.00 175.29 173.18 1lmh s PRO 176 N 3.43 3.82 0.34 1.67 0.02 -1.26 -4.97 135.00 138.05 1lmh s PRO 176 Ca 0.36 2.00 -0.27 0.00 0.02 0.00 0.00 61.00 63.12 1lmh s PRO 176 Cb -0.12 -2.59 -0.09 0.00 0.02 0.00 0.00 34.50 31.72 1lmh s PRO 176 CO 0.19 -0.56 1.14 -1.01 -0.33 0.00 0.00 177.00 176.43 1lmh s HIS 177 N -1.37 3.30 0.26 6.54 3.76 -1.26 -4.94 115.29 121.58 1lmh s HIS 177 Ca 0.61 1.61 -0.31 0.00 -0.15 0.00 0.00 55.06 56.82 1lmh s HIS 177 Cb -0.34 -3.34 -0.12 0.00 1.11 0.00 0.00 32.58 29.88 1lmh s HIS 177 CO 0.43 -0.97 1.61 0.25 -0.85 0.00 0.00 174.74 175.21 1lmh n THR 178 N 0.59 0.69 -0.91 1.30 -2.24 -1.26 -1.73 114.28 110.72 1lmh n THR 178 Ca 0.02 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 1lmh n THR 178 Cb 0.46 -1.89 0.00 0.00 -2.10 0.00 0.00 70.33 66.80 1lmh n THR 178 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1lmh n ASP 179 N 2.71 -0.56 -4.77 3.42 10.43 -1.26 -5.01 116.55 121.50 1lmh n ASP 179 Ca 0.11 0.00 -0.38 0.00 2.57 0.00 0.00 54.79 57.10 1lmh n ASP 179 Cb 0.35 -0.63 -0.04 0.00 1.84 0.00 0.00 41.12 42.64 1lmh n ASP 179 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1lmh s ALA 180 N -3.12 3.17 -0.20 2.24 0.00 -0.70 -4.66 121.76 118.49 1lmh s ALA 180 Ca 0.00 0.76 -0.26 0.00 0.00 0.00 0.00 51.96 52.46 1lmh s ALA 180 Cb 0.00 -3.29 -0.01 0.00 0.00 0.00 0.00 23.12 19.82 1lmh s ALA 180 CO 0.00 -0.21 0.88 0.08 0.00 0.00 0.00 175.76 176.51 1lmh s VAL 181 N -1.52 4.82 -0.38 0.00 1.01 0.68 -4.93 120.40 120.08 1lmh s VAL 181 Ca 0.54 1.71 -0.27 0.00 0.00 0.00 0.00 61.98 63.96 1lmh s VAL 181 Cb -0.25 -4.17 0.02 0.00 0.00 0.00 0.00 36.38 31.98 1lmh s VAL 181 CO 0.31 -0.05 1.01 -0.70 0.00 0.00 0.00 175.10 175.67 1lmh s GLU 182 N 2.60 3.86 -0.32 2.72 2.12 -1.26 -1.18 118.70 127.23 1lmh s GLU 182 Ca 0.39 0.68 -0.28 0.00 0.36 0.00 0.00 54.97 56.12 1lmh s GLU 182 Cb -0.16 -3.81 0.01 0.00 0.26 0.00 0.00 34.13 30.43 1lmh s GLU 182 CO 0.10 -1.04 1.02 0.08 -0.54 0.00 0.00 175.26 174.88 1lmh s VAL 183 N 3.74 4.56 -2.78 3.70 1.01 -0.55 -4.95 120.40 125.12 1lmh s VAL 183 Ca 0.42 1.63 0.26 0.00 0.00 0.00 0.00 61.98 64.28 1lmh s VAL 183 Cb -0.11 -4.37 0.35 0.00 0.00 0.00 0.00 36.38 32.25 1lmh s VAL 183 CO 0.21 -0.44 1.47 1.41 0.00 0.00 0.00 175.10 177.75