#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lwn s ASP 6 N 0.00 5.16 0.66 -3.46 -1.08 -1.26 -4.84 116.67 111.85 1lwn s ASP 6 Ca 0.00 0.95 0.44 0.00 -0.52 0.00 0.00 52.55 53.42 1lwn s ASP 6 Cb 0.00 -2.52 2.39 0.00 -1.46 0.00 0.00 42.92 41.33 1lwn s ASP 6 CO 0.00 -2.35 2.36 1.56 0.52 0.00 0.00 175.17 177.27 1lwn h GLN 7 N 15.98 0.00 0.00 4.34 1.08 -2.09 -1.39 115.11 133.03 1lwn h GLN 7 Ca -0.29 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 56.87 1lwn h GLN 7 Cb 1.20 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.63 1lwn h GLN 7 CO 1.13 0.00 -0.20 0.93 -0.95 0.00 0.00 178.83 179.74 1lwn h GLU 8 N 0.00 0.00 -0.64 1.46 4.39 -2.04 -2.67 114.58 115.09 1lwn h GLU 8 Ca -0.00 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.70 1lwn h GLU 8 Cb 0.02 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.63 1lwn h GLU 8 CO 0.00 0.20 0.38 0.87 -1.16 0.00 0.00 179.01 179.31 1lwn h LYS 9 N 0.00 0.86 0.00 2.33 1.57 -1.65 -2.28 116.57 117.40 1lwn h LYS 9 Ca -0.00 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1lwn h LYS 9 Cb 0.36 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.49 1lwn h LYS 9 CO 0.03 0.60 0.00 0.54 -0.57 0.00 0.00 179.45 180.05 1lwn n ARG 10 N -4.41 0.05 0.16 3.15 5.12 -1.01 -1.99 116.66 117.73 1lwn n ARG 10 Ca 0.06 0.43 0.12 0.00 -1.93 0.00 0.00 57.85 56.54 1lwn n ARG 10 Cb 0.07 -1.62 0.55 0.00 -1.16 0.00 0.00 32.46 30.30 1lwn n ARG 10 CO 0.00 0.00 0.00 0.87 -1.93 0.00 0.00 177.63 176.57 1lwn h LYS 11 N 0.00 0.00 0.00 5.56 1.57 -1.55 -0.62 116.57 121.53 1lwn h LYS 11 Ca 0.00 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 1lwn h LYS 11 Cb 0.13 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1lwn h LYS 11 CO 0.00 0.00 -0.27 1.96 -0.57 0.00 0.00 179.45 180.57 1lwn h GLN 12 N 0.00 0.00 -6.34 3.15 4.20 -1.62 -3.50 115.11 111.00 1lwn h GLN 12 Ca 0.00 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.14 1lwn h GLN 12 Cb 0.27 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.99 1lwn h GLN 12 CO 0.00 0.27 0.88 0.42 -0.67 0.00 0.00 178.83 179.74 1lwn s ILE 13 N -3.66 4.39 0.00 2.54 1.01 -0.24 -5.02 121.20 120.22 1lwn s ILE 13 Ca 0.00 1.59 0.00 0.00 0.00 0.00 0.00 60.65 62.24 1lwn s ILE 13 Cb 0.11 -4.35 0.00 0.00 0.01 0.00 0.00 42.46 38.23 1lwn s ILE 13 CO 0.65 -0.50 0.66 0.55 0.00 0.00 0.00 174.94 176.30 1lwn n VAL 15 N 6.00 0.36 0.13 2.92 3.14 -1.26 -5.07 118.33 124.54 1lwn n VAL 15 Ca 0.13 -0.65 0.14 0.00 -2.96 0.00 0.00 64.34 61.00 1lwn n VAL 15 Cb 0.47 0.86 0.38 0.00 -1.06 0.00 0.00 33.84 34.49 1lwn n VAL 15 CO 0.00 0.00 0.00 -0.09 -6.46 0.00 0.00 176.83 170.28 1lwn h ARG 16 N 0.00 0.00 -0.24 1.45 9.65 -1.96 -3.23 114.38 120.06 1lwn h ARG 16 Ca 0.00 0.00 -0.13 0.00 -1.10 0.00 0.00 59.98 58.75 1lwn h ARG 16 Cb 0.22 0.00 -0.14 0.00 -1.39 0.00 0.00 29.97 28.66 1lwn h ARG 16 CO 0.00 0.00 -0.31 0.41 2.80 0.00 0.00 179.97 182.87 1lwn n GLY 17 N -1.52 -0.85 0.67 2.80 0.00 -1.26 -4.45 105.19 100.59 1lwn n GLY 17 Ca 0.08 0.62 0.00 0.00 0.00 0.00 0.00 46.02 46.72 1lwn n GLY 17 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1lwn n LEU 18 N 2.03 0.00 0.17 0.99 7.94 -1.22 -4.80 117.00 122.12 1lwn n LEU 18 Ca 0.09 0.00 0.12 0.00 -1.11 0.00 0.00 56.01 55.11 1lwn n LEU 18 Cb 0.64 -0.08 0.61 0.00 0.53 0.00 0.00 43.42 45.11 1lwn n LEU 18 CO -0.04 -0.42 0.86 0.00 -1.11 0.00 0.00 177.39 176.68 1lwn h ALA 19 N -0.39 1.00 0.00 1.96 0.00 -1.94 -3.48 119.26 116.41 1lwn h ALA 19 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1lwn h ALA 19 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1lwn h ALA 19 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1lwn n GLY 20 N -0.95 -0.96 3.79 0.00 0.00 -1.26 -4.92 105.19 100.89 1lwn n GLY 20 Ca -0.01 -1.65 -0.32 0.00 0.00 0.00 0.00 46.02 44.03 1lwn n GLY 20 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lwn s VAL 21 N -1.82 3.60 -0.18 1.61 1.01 -1.26 -4.90 120.40 118.47 1lwn s VAL 21 Ca 0.00 0.70 -0.06 0.00 0.00 0.00 0.00 61.98 62.61 1lwn s VAL 21 Cb 0.00 -3.24 -0.23 0.00 0.00 0.00 0.00 36.38 32.91 1lwn s VAL 21 CO 0.00 -0.51 3.50 -0.62 0.00 0.00 0.00 175.10 177.47 1lwn n GLU 22 N -2.45 2.19 -4.08 2.72 1.02 -1.26 -4.72 120.64 114.06 1lwn n GLU 22 Ca 0.09 -1.22 -0.22 0.00 -0.02 0.00 0.00 57.16 55.79 1lwn n GLU 22 Cb 0.53 -2.08 -0.05 0.00 -0.02 0.00 0.00 31.44 29.82 1lwn n GLU 22 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1lwn s ASN 23 N 1.87 5.19 0.19 1.62 4.22 -1.26 -4.88 114.94 121.88 1lwn s ASN 23 Ca 0.66 -0.44 -0.13 0.00 -2.14 0.00 0.00 52.86 50.81 1lwn s ASN 23 Cb 0.31 -1.12 0.20 0.00 1.28 0.00 0.00 41.25 41.93 1lwn s ASN 23 CO -0.02 -0.14 1.70 0.58 -2.04 0.00 0.00 177.10 177.18 1lwn h VAL 24 N 1.51 0.65 -0.54 3.54 2.07 -1.89 -2.89 116.25 118.70 1lwn h VAL 24 Ca -0.46 -0.06 0.09 0.00 0.82 0.00 0.00 66.70 67.09 1lwn h VAL 24 Cb 1.25 0.46 -0.07 0.00 -1.52 0.00 0.00 31.29 31.41 1lwn h VAL 24 CO 0.60 0.03 0.15 0.74 0.02 0.00 0.00 177.57 179.11 1lwn h THR 25 N 0.17 0.74 -0.25 2.57 2.02 -1.95 -2.03 112.91 114.17 1lwn h THR 25 Ca 0.26 -0.10 -0.15 0.00 0.77 0.00 0.00 66.41 67.19 1lwn h THR 25 Cb 0.38 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.19 1lwn h THR 25 CO -0.38 0.05 -0.45 -0.33 0.37 0.00 0.00 175.52 174.78 1lwn h GLU 26 N 0.30 0.65 -0.37 6.66 4.39 -1.82 -2.96 114.58 121.43 1lwn h GLU 26 Ca 0.27 -0.36 0.01 0.00 0.34 0.00 0.00 59.36 59.62 1lwn h GLU 26 Cb 0.35 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.00 1lwn h GLU 26 CO -0.32 0.97 0.24 -0.07 -1.16 0.00 0.00 179.01 178.67 1lwn h LEU 27 N 0.52 0.41 -0.83 1.33 4.07 -1.23 -1.71 115.31 117.88 1lwn h LEU 27 Ca 0.03 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.99 1lwn h LEU 27 Cb 0.99 -0.10 -0.04 0.00 1.08 0.00 0.00 40.66 42.59 1lwn h LEU 27 CO 0.09 0.30 0.53 0.11 -1.08 0.00 0.00 178.44 178.39 1lwn h LYS 28 N 0.49 1.11 -0.62 1.13 1.57 -1.37 0.15 116.57 119.02 1lwn h LYS 28 Ca 0.14 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.83 1lwn h LYS 28 Cb -0.05 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 31.99 1lwn h LYS 28 CO -0.03 0.75 0.35 0.87 -0.57 0.00 0.00 179.45 180.83 1lwn h LYS 29 N 1.13 0.86 -0.20 3.15 6.56 -1.30 -1.13 116.57 125.64 1lwn h LYS 29 Ca 0.30 -0.09 -0.17 0.00 -1.06 0.00 0.00 60.65 59.64 1lwn h LYS 29 Cb -0.10 -0.17 -0.00 0.00 -0.57 0.00 0.00 32.23 31.39 1lwn h LYS 29 CO -0.06 0.64 -0.56 -0.91 -2.06 0.00 0.00 179.45 176.49 1lwn h ASN 30 N 0.84 0.67 -0.35 0.86 -0.26 -0.84 -1.31 115.58 115.19 1lwn h ASN 30 Ca 0.22 -0.36 0.02 0.00 -0.56 0.00 0.00 56.30 55.62 1lwn h ASN 30 Cb 0.02 -0.19 -0.03 0.00 -1.06 0.00 0.00 38.32 37.06 1lwn h ASN 30 CO -0.04 1.09 0.19 0.15 -1.06 0.00 0.00 177.43 177.77 1lwn h PHE 31 N 0.46 0.36 -0.56 1.19 3.04 -0.43 -0.24 116.94 120.77 1lwn h PHE 31 Ca 0.01 0.01 0.01 0.00 3.98 0.00 0.00 57.97 61.98 1lwn h PHE 31 Cb 1.12 -0.11 -0.03 0.00 2.56 0.00 0.00 35.95 39.48 1lwn h PHE 31 CO 0.05 0.20 0.35 -0.91 -2.02 0.00 0.00 178.31 175.99 1lwn h ASN 32 N 0.39 0.59 -0.55 0.41 2.35 -1.04 -0.53 115.58 117.20 1lwn h ASN 32 Ca 0.14 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.88 1lwn h ASN 32 Cb 0.03 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.23 1lwn h ASN 32 CO -0.08 0.42 0.32 -0.09 -1.65 0.00 0.00 177.43 176.35 1lwn h ARG 33 N 0.71 0.76 -0.48 0.81 2.43 -0.59 -2.58 114.38 115.45 1lwn h ARG 33 Ca 0.21 -0.08 -0.12 0.00 -0.81 0.00 0.00 59.98 59.19 1lwn h ARG 33 Cb -0.04 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.35 1lwn h ARG 33 CO -0.07 0.57 -0.16 0.45 -1.51 0.00 0.00 179.97 179.25 1lwn h HIS 34 N 0.75 1.08 -0.94 2.20 3.86 -0.69 0.12 115.15 121.53 1lwn h HIS 34 Ca 0.20 -0.25 0.02 0.00 -1.16 0.00 0.00 60.37 59.18 1lwn h HIS 34 Cb 0.02 -0.26 -0.05 0.00 1.06 0.00 0.00 27.41 28.18 1lwn h HIS 34 CO -0.02 1.05 0.62 1.25 0.86 0.00 0.00 177.93 181.69 1lwn h LEU 35 N 0.80 1.05 0.00 2.43 5.85 -0.95 -1.37 115.31 123.11 1lwn h LEU 35 Ca 0.12 -0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.77 1lwn h LEU 35 Cb 0.72 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 1lwn h LEU 35 CO 0.06 0.74 -0.42 0.45 -0.34 0.00 0.00 178.44 178.92 1lwn h HIS 36 N 1.23 0.00 0.12 1.25 3.86 -1.35 -2.40 115.15 117.86 1lwn h HIS 36 Ca 0.36 0.00 -0.29 0.00 -1.16 0.00 0.00 60.37 59.27 1lwn h HIS 36 Cb -0.07 0.00 0.03 0.00 1.06 0.00 0.00 27.41 28.42 1lwn h HIS 36 CO -0.01 0.46 -1.24 0.74 0.86 0.00 0.00 177.93 178.75 1lwn h PHE 37 N -1.00 0.95 0.06 2.45 0.04 -0.86 -1.41 116.94 117.17 1lwn h PHE 37 Ca -0.07 -0.60 -0.10 0.00 2.80 0.00 0.00 57.97 60.00 1lwn h PHE 37 Cb 0.60 -0.07 0.01 0.00 2.20 0.00 0.00 35.95 38.68 1lwn h PHE 37 CO -0.01 1.44 -0.42 1.15 -0.60 0.00 0.00 178.31 179.88 1lwn h THR 38 N 0.25 1.62 0.00 -1.55 2.02 -1.41 -3.37 112.91 110.46 1lwn h THR 38 Ca -0.18 -2.34 0.00 0.00 0.77 0.00 0.00 66.41 64.66 1lwn h THR 38 Cb 1.91 3.16 0.00 0.00 -1.74 0.00 0.00 68.15 71.48 1lwn h THR 38 CO 0.23 0.64 -1.07 0.18 0.37 0.00 0.00 175.52 175.87 1lwn n LEU 39 N -4.37 0.60 -3.41 2.58 4.77 -0.59 -5.00 117.00 111.58 1lwn n LEU 39 Ca -0.12 0.01 -0.20 0.00 -0.03 0.00 0.00 56.01 55.68 1lwn n LEU 39 Cb 0.64 -0.09 0.06 0.00 -2.33 0.00 0.00 43.42 41.70 1lwn n LEU 39 CO 0.42 0.02 0.00 0.52 -1.33 0.00 0.00 177.39 177.02 1lwn n VAL 40 N -2.04 -7.78 -4.34 4.08 0.31 -0.53 -5.00 118.33 103.03 1lwn n VAL 40 Ca 0.01 -1.14 -0.19 0.00 -0.01 0.00 0.00 64.34 63.01 1lwn n VAL 40 Cb 0.45 -5.67 -0.09 0.00 -0.91 0.00 0.00 33.84 27.63 1lwn n VAL 40 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1lwn s LYS 41 N -4.99 1.64 0.24 5.55 -0.14 -0.91 -5.03 119.74 116.10 1lwn s LYS 41 Ca 0.40 -1.95 0.00 0.00 -1.36 0.00 0.00 55.97 53.07 1lwn s LYS 41 Cb -0.08 -0.09 -0.03 0.00 -1.68 0.00 0.00 37.83 35.94 1lwn s LYS 41 CO 0.78 -0.48 0.19 0.16 -0.76 0.00 0.00 175.35 175.24 1lwn s ASP 42 N -3.39 0.50 0.42 2.83 3.84 -1.26 -4.05 116.67 115.55 1lwn s ASP 42 Ca 0.35 -1.45 0.29 0.00 -0.00 0.00 0.00 52.55 51.74 1lwn s ASP 42 Cb 0.04 0.44 1.48 0.00 -1.38 0.00 0.00 42.92 43.51 1lwn s ASP 42 CO 0.18 -0.92 1.88 0.08 -0.00 0.00 0.00 175.17 176.40 1lwn h ARG 43 N 2.48 0.00 0.14 2.11 0.11 -1.97 -1.64 114.38 115.61 1lwn h ARG 43 Ca -0.33 0.00 -0.30 0.00 0.10 0.00 0.00 59.98 59.46 1lwn h ARG 43 Cb 1.25 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.33 1lwn h ARG 43 CO 0.48 0.00 -1.41 -0.91 0.10 0.00 0.00 179.97 178.23 1lwn h ASN 44 N 0.00 0.47 -0.01 0.08 2.35 -2.05 -3.36 115.58 113.06 1lwn h ASN 44 Ca 0.00 -0.56 0.00 0.00 -0.55 0.00 0.00 56.30 55.19 1lwn h ASN 44 Cb 0.11 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.33 1lwn h ASN 44 CO 0.00 1.45 -0.61 1.33 -1.65 0.00 0.00 177.43 177.95 1lwn n VAL 45 N -3.52 0.00 -2.10 2.81 0.24 -1.09 -5.00 118.33 109.67 1lwn n VAL 45 Ca -0.13 -0.20 -0.41 0.00 -2.04 0.00 0.00 64.34 61.56 1lwn n VAL 45 Cb 1.04 1.08 -0.02 0.00 -1.47 0.00 0.00 33.84 34.48 1lwn n VAL 45 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1lwn s ALA 46 N -2.34 3.52 0.41 2.33 0.00 -0.64 -4.94 121.76 120.11 1lwn s ALA 46 Ca 0.10 1.27 0.07 0.00 0.00 0.00 0.00 51.96 53.40 1lwn s ALA 46 Cb 0.13 -3.49 -0.05 0.00 0.00 0.00 0.00 23.12 19.71 1lwn s ALA 46 CO 0.58 -0.66 0.22 0.95 0.00 0.00 0.00 175.76 176.85 1lwn s THR 47 N -0.90 2.39 0.36 0.00 -4.23 -1.26 -4.98 115.64 107.02 1lwn s THR 47 Ca 0.51 -1.63 0.09 0.00 -1.18 0.00 0.00 61.69 59.48 1lwn s THR 47 Cb -0.40 -3.00 0.32 0.00 1.34 0.00 0.00 72.50 70.76 1lwn s THR 47 CO 0.51 -0.01 1.90 -0.65 -0.54 0.00 0.00 174.62 175.83 1lwn h PRO 48 N 1.35 0.67 -0.77 3.99 0.11 -1.99 0.40 132.00 135.76 1lwn h PRO 48 Ca -0.43 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.66 1lwn h PRO 48 Cb 1.25 -0.15 -0.04 0.00 0.11 0.00 0.00 31.00 32.18 1lwn h PRO 48 CO 0.67 0.44 0.51 -0.09 -0.21 0.00 0.00 178.00 179.33 1lwn h ARG 49 N 0.69 1.00 -0.56 1.05 2.43 -1.96 0.61 114.38 117.64 1lwn h ARG 49 Ca 0.41 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 59.41 1lwn h ARG 49 Cb 0.61 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 1lwn h ARG 49 CO -0.17 0.66 -0.05 -0.44 -1.51 0.00 0.00 179.97 178.46 1lwn h ASP 50 N 1.03 1.02 -0.02 -3.80 3.45 -1.33 -2.12 116.42 114.66 1lwn h ASP 50 Ca 0.29 -0.33 -0.10 0.00 0.43 0.00 0.00 57.03 57.32 1lwn h ASP 50 Cb -0.09 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 38.39 1lwn h ASP 50 CO -0.07 1.10 -0.28 1.88 -1.57 0.00 0.00 179.24 180.31 1lwn h TYR 51 N 0.91 0.51 -0.41 4.55 0.05 -0.50 -1.19 116.97 120.90 1lwn h TYR 51 Ca 0.15 -0.11 -0.03 0.00 0.05 0.00 0.00 58.73 58.79 1lwn h TYR 51 Cb 0.61 -0.12 -0.02 0.00 1.01 0.00 0.00 36.73 38.21 1lwn h TYR 51 CO 0.04 0.69 0.13 -0.92 -1.05 0.00 0.00 178.16 177.06 1lwn h TYR 52 N 0.40 0.65 -0.70 4.88 5.03 -0.63 -1.91 116.97 124.68 1lwn h TYR 52 Ca 0.05 -0.06 -0.07 0.00 2.58 0.00 0.00 58.73 61.23 1lwn h TYR 52 Cb 0.70 -0.19 -0.03 0.00 1.55 0.00 0.00 36.73 38.76 1lwn h TYR 52 CO 0.02 0.59 0.16 0.74 -1.32 0.00 0.00 178.16 178.36 1lwn h PHE 53 N 0.51 1.19 -0.88 -3.82 0.04 -1.06 -0.20 116.94 112.72 1lwn h PHE 53 Ca 0.13 -0.15 -0.01 0.00 2.80 0.00 0.00 57.97 60.74 1lwn h PHE 53 Cb 0.25 -0.33 -0.04 0.00 2.20 0.00 0.00 35.95 38.02 1lwn h PHE 53 CO 0.01 0.97 0.50 0.00 -0.60 0.00 0.00 178.31 179.19 1lwn h ALA 54 N 1.08 1.23 -0.27 2.45 0.00 -1.04 -0.40 119.26 122.31 1lwn h ALA 54 Ca 0.22 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 1lwn h ALA 54 Cb 0.39 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1lwn h ALA 54 CO 0.00 0.64 -0.21 1.25 0.00 0.00 0.00 179.25 180.93 1lwn h LEU 55 N 1.22 0.66 -0.43 0.00 5.85 -0.96 -2.12 115.31 119.53 1lwn h LEU 55 Ca 0.31 -0.45 0.02 0.00 0.84 0.00 0.00 57.88 58.61 1lwn h LEU 55 Cb -0.01 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 1lwn h LEU 55 CO -0.05 0.96 0.24 0.00 -0.34 0.00 0.00 178.44 179.25 1lwn h ALA 56 N 0.71 0.54 -0.20 1.25 0.00 -0.63 -0.96 119.26 119.98 1lwn h ALA 56 Ca 0.05 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1lwn h ALA 56 Cb 0.75 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1lwn h ALA 56 CO 0.05 -0.10 -0.11 0.45 0.00 0.00 0.00 179.25 179.55 1lwn h HIS 57 N 0.48 0.33 -0.33 0.00 3.86 -1.06 0.13 115.15 118.56 1lwn h HIS 57 Ca 0.18 -0.04 -0.08 0.00 -1.16 0.00 0.00 60.37 59.27 1lwn h HIS 57 Cb 0.04 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 28.41 1lwn h HIS 57 CO -0.08 0.42 -0.12 1.15 0.86 0.00 0.00 177.93 180.16 1lwn h THR 58 N 0.30 1.28 -0.18 2.45 2.02 -0.65 -2.57 112.91 115.56 1lwn h THR 58 Ca 0.06 -1.20 -0.15 0.00 0.77 0.00 0.00 66.41 65.89 1lwn h THR 58 Cb 0.38 1.38 -0.01 0.00 -1.74 0.00 0.00 68.15 68.16 1lwn h THR 58 CO 0.02 0.39 -0.52 0.58 0.37 0.00 0.00 175.52 176.36 1lwn h VAL 59 N 0.43 1.32 -0.99 3.16 2.07 -0.84 -3.09 116.25 118.31 1lwn h VAL 59 Ca 0.08 -1.76 0.05 0.00 0.82 0.00 0.00 66.70 65.89 1lwn h VAL 59 Cb 0.63 1.75 -0.06 0.00 -1.52 0.00 0.00 31.29 32.09 1lwn h VAL 59 CO 0.04 0.55 0.65 -0.09 0.02 0.00 0.00 177.57 178.73 1lwn h ARG 60 N 0.40 1.17 -0.29 1.57 2.43 -0.63 -2.26 114.38 116.77 1lwn h ARG 60 Ca 0.01 -0.07 0.07 0.00 -0.81 0.00 0.00 59.98 59.18 1lwn h ARG 60 Cb 1.05 -0.26 -0.07 0.00 -0.42 0.00 0.00 29.97 30.27 1lwn h ARG 60 CO 0.10 0.77 -0.15 -0.44 -1.51 0.00 0.00 179.97 178.74 1lwn h ASP 61 N 1.20 -0.49 -0.40 -3.80 3.32 -1.37 0.40 116.42 115.28 1lwn h ASP 61 Ca 0.41 0.12 -0.05 0.00 0.02 0.00 0.00 57.03 57.53 1lwn h ASP 61 Cb 0.10 0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 1lwn h ASP 61 CO -0.15 -0.18 0.09 0.45 -1.72 0.00 0.00 179.24 177.73 1lwn h HIS 62 N -0.11 0.74 -0.36 4.55 3.86 -1.55 -2.12 115.15 120.16 1lwn h HIS 62 Ca 0.15 -0.07 -0.08 0.00 -1.16 0.00 0.00 60.37 59.21 1lwn h HIS 62 Cb 0.34 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.58 1lwn h HIS 62 CO -0.34 0.64 -0.10 1.25 0.86 0.00 0.00 177.93 180.24 1lwn h LEU 63 N 0.70 0.70 -0.84 2.43 5.85 -0.68 -3.20 115.31 120.27 1lwn h LEU 63 Ca 0.15 -0.37 -0.07 0.00 0.84 0.00 0.00 57.88 58.44 1lwn h LEU 63 Cb 0.29 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 1lwn h LEU 63 CO 0.00 0.91 0.12 0.58 -0.34 0.00 0.00 178.44 179.71 1lwn h VAL 64 N 0.49 1.25 -1.00 1.05 2.07 0.04 -1.82 116.25 118.32 1lwn h VAL 64 Ca 0.09 -0.95 0.07 0.00 0.82 0.00 0.00 66.70 66.73 1lwn h VAL 64 Cb 0.61 0.65 -0.07 0.00 -1.52 0.00 0.00 31.29 30.96 1lwn h VAL 64 CO 0.04 0.36 0.65 1.23 0.02 0.00 0.00 177.57 179.86 1lwn h GLY 65 N 1.03 1.54 1.91 2.17 0.00 -1.39 -1.25 103.07 107.08 1lwn h GLY 65 Ca 0.19 -0.47 -0.19 0.00 0.00 0.00 0.00 47.33 46.87 1lwn h GLY 65 CO 0.01 0.32 -0.87 3.21 0.00 0.00 0.00 176.54 179.20 1lwn h ARG 66 N 1.16 0.08 0.34 4.80 3.08 -1.53 -3.00 114.38 119.30 1lwn h ARG 66 Ca 0.44 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.39 1lwn h ARG 66 Cb 0.20 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.28 1lwn h ARG 66 CO -0.18 0.90 -0.19 2.35 -1.07 0.00 0.00 179.97 181.77 1lwn h TRP 67 N 0.04 -0.50 -0.71 3.04 7.01 -0.44 -0.26 115.95 124.13 1lwn h TRP 67 Ca -0.03 -0.01 0.07 0.00 2.11 0.00 0.00 58.89 61.03 1lwn h TRP 67 Cb 1.52 0.18 -0.06 0.00 -2.10 0.00 0.00 29.16 28.70 1lwn h TRP 67 CO 0.01 -0.30 0.40 0.82 -2.79 0.00 0.00 178.44 176.57 1lwn h ILE 68 N -0.50 0.96 -0.62 2.65 2.04 -1.32 -1.65 117.51 119.07 1lwn h ILE 68 Ca -0.04 -0.25 -0.07 0.00 1.00 0.00 0.00 64.86 65.50 1lwn h ILE 68 Cb 0.41 0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 36.64 1lwn h ILE 68 CO 0.05 0.13 0.10 0.03 0.00 0.00 0.00 178.15 178.46 1lwn h ARG 69 N 0.72 1.01 -0.45 2.37 2.47 -1.35 -1.74 114.38 117.40 1lwn h ARG 69 Ca 0.32 -0.26 -0.06 0.00 -1.26 0.00 0.00 59.98 58.72 1lwn h ARG 69 Cb 0.22 -0.13 -0.02 0.00 -1.65 0.00 0.00 29.97 28.39 1lwn h ARG 69 CO -0.19 0.93 0.04 1.15 0.56 0.00 0.00 179.97 182.45 1lwn h THR 70 N 0.95 1.25 -0.01 2.04 2.02 -0.46 -0.54 112.91 118.16 1lwn h THR 70 Ca 0.19 -0.97 -0.08 0.00 0.77 0.00 0.00 66.41 66.31 1lwn h THR 70 Cb 0.41 1.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.82 1lwn h THR 70 CO 0.01 0.34 -0.39 1.56 0.37 0.00 0.00 175.52 177.41 1lwn h GLN 71 N 0.62 0.02 -0.19 6.66 1.08 -1.19 -1.54 115.11 120.58 1lwn h GLN 71 Ca 0.13 -0.01 -0.10 0.00 -1.45 0.00 0.00 58.65 57.22 1lwn h GLN 71 Cb 0.44 -0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.87 1lwn h GLN 71 CO 0.02 0.41 -0.27 1.96 -0.95 0.00 0.00 178.83 180.00 1lwn h GLN 72 N 0.02 0.53 -0.58 1.46 4.20 -1.00 -2.59 115.11 117.14 1lwn h GLN 72 Ca -0.00 -0.31 0.06 0.00 0.06 0.00 0.00 58.65 58.46 1lwn h GLN 72 Cb 0.70 0.03 -0.06 0.00 0.30 0.00 0.00 27.48 28.45 1lwn h GLN 72 CO 0.05 0.90 0.28 1.25 -0.67 0.00 0.00 178.83 180.65 1lwn h HIS 73 N 0.19 0.51 -0.40 2.96 2.76 -0.69 -1.62 115.15 118.86 1lwn h HIS 73 Ca 0.02 0.02 -0.08 0.00 -2.20 0.00 0.00 60.37 58.14 1lwn h HIS 73 Cb 0.84 -0.14 -0.02 0.00 1.55 0.00 0.00 27.41 29.64 1lwn h HIS 73 CO 0.09 0.22 -0.08 1.88 -1.30 0.00 0.00 177.93 178.73 1lwn h TYR 74 N 0.53 0.74 -0.50 5.26 0.05 -1.27 -0.03 116.97 121.75 1lwn h TYR 74 Ca 0.27 -0.12 -0.03 0.00 0.05 0.00 0.00 58.73 58.90 1lwn h TYR 74 Cb 0.22 -0.20 -0.02 0.00 1.01 0.00 0.00 36.73 37.74 1lwn h TYR 74 CO -0.11 0.75 0.20 -0.92 -1.05 0.00 0.00 178.16 177.02 1lwn h TYR 75 N 0.63 0.76 0.43 4.88 3.20 -0.96 0.50 116.97 126.41 1lwn h TYR 75 Ca 0.12 -0.06 -0.02 0.00 3.14 0.00 0.00 58.73 61.91 1lwn h TYR 75 Cb 0.52 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.57 1lwn h TYR 75 CO 0.02 0.63 -0.21 0.93 -1.64 0.00 0.00 178.16 177.90 1lwn h GLU 76 N 0.66 -0.56 -0.10 1.82 4.39 -1.07 -3.30 114.58 116.42 1lwn h GLU 76 Ca 0.17 0.04 -0.12 0.00 0.34 0.00 0.00 59.36 59.78 1lwn h GLU 76 Cb 0.19 0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.96 1lwn h GLU 76 CO -0.01 -0.25 -0.48 0.87 -1.16 0.00 0.00 179.01 177.98 1lwn h LYS 77 N -0.88 0.26 -6.01 2.33 1.57 -0.98 -3.48 116.57 109.36 1lwn h LYS 77 Ca -0.06 -0.14 -0.39 0.00 -1.87 0.00 0.00 60.65 58.19 1lwn h LYS 77 Cb 0.56 0.01 0.10 0.00 0.08 0.00 0.00 32.23 32.98 1lwn h LYS 77 CO 0.10 0.69 -0.89 -3.47 -0.57 0.00 0.00 179.45 175.30 1lwn n ASP 78 N -3.97 -4.31 -4.84 0.86 4.64 0.17 -4.98 116.55 104.11 1lwn n ASP 78 Ca -0.02 -0.89 -0.29 0.00 -1.38 0.00 0.00 54.79 52.21 1lwn n ASP 78 Cb 0.53 -3.99 0.09 0.00 -1.04 0.00 0.00 41.12 36.72 1lwn n ASP 78 CO 0.00 0.00 0.00 -2.16 -0.82 0.00 0.00 177.20 174.22 1lwn s PRO 79 N -5.63 1.94 0.29 -0.67 0.04 -1.26 -4.97 135.00 124.73 1lwn s PRO 79 Ca 0.33 0.35 -0.29 0.00 0.04 0.00 0.00 61.00 61.42 1lwn s PRO 79 Cb -0.09 -1.93 -0.10 0.00 0.04 0.00 0.00 34.50 32.42 1lwn s PRO 79 CO 0.82 -1.66 1.43 0.21 0.04 0.00 0.00 177.00 177.84 1lwn s LYS 80 N -5.36 4.25 -0.10 4.56 2.20 -1.26 -4.97 119.74 119.06 1lwn s LYS 80 Ca 0.61 2.34 -0.03 0.00 -0.36 0.00 0.00 55.97 58.54 1lwn s LYS 80 Cb -0.13 -3.07 -0.03 0.00 -1.51 0.00 0.00 37.83 33.08 1lwn s LYS 80 CO 0.52 -0.40 0.03 1.03 -0.36 0.00 0.00 175.35 176.17 1lwn s ARG 81 N -0.91 3.14 -0.21 4.03 0.52 -0.37 -4.52 118.95 120.63 1lwn s ARG 81 Ca 0.57 -0.35 -0.06 0.00 -0.52 0.00 0.00 55.73 55.37 1lwn s ARG 81 Cb -0.43 -2.90 -0.03 0.00 0.52 0.00 0.00 34.95 32.12 1lwn s ARG 81 CO 0.48 0.69 0.02 0.42 0.02 0.00 0.00 175.30 176.94 1lwn s ILE 82 N -0.83 4.17 -0.29 1.52 1.01 -0.39 -2.04 121.20 124.35 1lwn s ILE 82 Ca 0.13 -0.24 -0.04 0.00 0.00 0.00 0.00 60.65 60.50 1lwn s ILE 82 Cb -0.12 -2.90 0.03 0.00 0.01 0.00 0.00 42.46 39.49 1lwn s ILE 82 CO 0.03 0.42 0.02 -0.31 0.00 0.00 0.00 174.94 175.10 1lwn s TYR 83 N 0.99 3.18 -0.52 3.97 2.02 -0.18 -0.66 117.35 126.15 1lwn s TYR 83 Ca 0.02 -1.50 -0.17 0.00 -0.37 0.00 0.00 57.07 55.06 1lwn s TYR 83 Cb -0.14 -2.16 0.09 0.00 -0.40 0.00 0.00 41.96 39.34 1lwn s TYR 83 CO 0.02 -0.72 0.52 -0.47 -1.57 0.00 0.00 175.55 173.33 1lwn s TYR 84 N 1.36 3.17 -0.20 2.71 5.04 -0.33 -0.78 117.35 128.31 1lwn s TYR 84 Ca -0.01 -0.94 -0.20 0.00 -2.44 0.00 0.00 57.07 53.47 1lwn s TYR 84 Cb -0.18 -3.54 -0.03 0.00 0.35 0.00 0.00 41.96 38.56 1lwn s TYR 84 CO -0.00 -0.98 0.61 -0.51 -1.34 0.00 0.00 175.55 173.32 1lwn s LEU 85 N 2.00 4.14 -0.07 6.97 1.02 -0.69 -1.69 118.68 130.36 1lwn s LEU 85 Ca 0.07 0.79 -0.13 0.00 0.02 0.00 0.00 54.13 54.88 1lwn s LEU 85 Cb -0.25 -2.85 0.03 0.00 0.02 0.00 0.00 46.19 43.14 1lwn s LEU 85 CO 0.07 -0.26 0.32 -0.55 0.02 0.00 0.00 176.35 175.94 1lwn s SER 86 N 1.22 -0.26 0.00 2.29 0.15 -0.99 -1.83 113.70 114.29 1lwn s SER 86 Ca 0.28 0.37 0.28 0.00 0.70 0.00 0.00 55.95 57.57 1lwn s SER 86 Cb -0.16 0.49 1.08 0.00 -1.71 0.00 0.00 66.02 65.72 1lwn s SER 86 CO 0.10 -0.28 1.76 0.18 1.20 0.00 0.00 173.24 176.20 1lwn n LEU 87 N 2.08 1.07 -3.91 3.45 4.32 -1.26 -4.13 117.00 118.61 1lwn n LEU 87 Ca -0.17 -0.31 -0.14 0.00 -0.02 0.00 0.00 56.01 55.36 1lwn n LEU 87 Cb 0.57 -0.06 -0.14 0.00 -1.62 0.00 0.00 43.42 42.16 1lwn n LEU 87 CO 0.19 0.19 -0.38 -1.61 -1.22 0.00 0.00 177.39 174.55 1lwn s GLU 88 N -2.21 0.24 -0.30 3.23 2.02 -1.26 -4.65 118.70 115.77 1lwn s GLU 88 Ca 0.34 -0.09 -0.02 0.00 0.02 0.00 0.00 54.97 55.22 1lwn s GLU 88 Cb 0.20 -0.25 0.12 0.00 0.10 0.00 0.00 34.13 34.31 1lwn s GLU 88 CO 0.41 0.05 0.24 -0.06 0.02 0.00 0.00 175.26 175.91 1lwn s PHE 89 N 0.02 -0.12 -1.04 1.61 0.40 0.04 -4.62 117.98 114.27 1lwn s PHE 89 Ca 0.00 -0.52 -0.16 0.00 -0.60 0.00 0.00 56.93 55.65 1lwn s PHE 89 Cb -0.02 -0.64 0.16 0.00 0.51 0.00 0.00 43.02 43.03 1lwn s PHE 89 CO -0.00 -0.89 1.22 -0.47 0.70 0.00 0.00 175.22 175.78 1lwn s TYR 90 N 2.17 3.35 0.13 0.36 6.14 -0.35 -3.53 117.35 125.62 1lwn s TYR 90 Ca 0.10 -1.77 -0.02 0.00 0.64 0.00 0.00 57.07 56.02 1lwn s TYR 90 Cb -0.15 -4.25 -0.11 0.00 0.42 0.00 0.00 41.96 37.87 1lwn s TYR 90 CO -0.32 -1.40 1.29 0.52 0.64 0.00 0.00 175.55 176.29 1lwn h MET 91 N 8.04 0.31 0.00 4.97 2.86 -1.80 -3.41 114.93 125.90 1lwn h MET 91 Ca 0.22 -0.37 0.00 0.00 -2.06 0.00 0.00 59.70 57.49 1lwn h MET 91 Cb 0.96 0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.73 1lwn h MET 91 CO 1.13 1.08 0.00 0.41 1.06 0.00 0.00 176.91 180.59 1lwn n GLY 92 N 1.04 -0.70 3.81 8.32 0.00 -0.87 -4.82 105.19 111.97 1lwn n GLY 92 Ca -0.06 -1.15 -0.34 0.00 0.00 0.00 0.00 46.02 44.47 1lwn n GLY 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1lwn s ARG 93 N 0.00 4.13 -0.08 1.61 0.52 -1.26 -2.40 118.95 121.48 1lwn s ARG 93 Ca 0.00 1.25 0.09 0.00 -0.52 0.00 0.00 55.73 56.56 1lwn s ARG 93 Cb 0.00 -2.25 -0.14 0.00 0.52 0.00 0.00 34.95 33.08 1lwn s ARG 93 CO 0.00 -0.13 0.09 2.41 0.02 0.00 0.00 175.30 177.69 1lwn n THR 94 N -0.56 0.49 0.14 0.02 -1.04 -1.26 -4.66 114.28 107.41 1lwn n THR 94 Ca 0.07 -0.38 -0.14 0.00 -2.04 0.00 0.00 64.05 61.56 1lwn n THR 94 Cb 0.53 -0.45 -0.07 0.00 -1.82 0.00 0.00 70.33 68.51 1lwn n THR 94 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1lwn h LEU 95 N 0.00 -1.13 -0.51 -4.42 5.85 -1.96 -1.32 115.31 111.83 1lwn h LEU 95 Ca -0.20 0.12 -0.05 0.00 0.84 0.00 0.00 57.88 58.60 1lwn h LEU 95 Cb 1.30 0.42 -0.02 0.00 0.37 0.00 0.00 40.66 42.73 1lwn h LEU 95 CO 0.01 -0.48 0.14 -0.61 -0.34 0.00 0.00 178.44 177.16 1lwn h GLN 96 N -0.66 0.80 -0.90 1.25 4.15 -1.96 -1.45 115.11 116.34 1lwn h GLN 96 Ca 0.01 -0.18 0.05 0.00 0.77 0.00 0.00 58.65 59.30 1lwn h GLN 96 Cb 0.67 -0.11 -0.05 0.00 0.21 0.00 0.00 27.48 28.19 1lwn h GLN 96 CO -0.19 0.76 0.59 -0.97 -1.93 0.00 0.00 178.83 177.09 1lwn h ASN 97 N 0.69 0.94 -0.20 -0.69 -1.24 -1.81 -0.25 115.58 113.03 1lwn h ASN 97 Ca 0.16 -0.00 -0.05 0.00 0.71 0.00 0.00 56.30 57.12 1lwn h ASN 97 Cb 0.31 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 39.15 1lwn h ASN 97 CO -0.00 0.63 -0.08 0.74 -1.29 0.00 0.00 177.43 177.42 1lwn h THR 98 N 1.08 1.30 -0.60 -3.57 2.02 -0.89 -1.82 112.91 110.44 1lwn h THR 98 Ca 0.37 -1.12 0.02 0.00 0.77 0.00 0.00 66.41 66.44 1lwn h THR 98 Cb 0.10 1.63 -0.03 0.00 -1.74 0.00 0.00 68.15 68.11 1lwn h THR 98 CO -0.12 0.34 0.38 0.24 0.37 0.00 0.00 175.52 176.73 1lwn h MET 99 N 0.10 0.74 -0.11 6.66 2.86 -0.67 -1.76 114.93 122.74 1lwn h MET 99 Ca 0.04 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1lwn h MET 99 Cb 0.56 -0.17 -0.00 0.00 0.06 0.00 0.00 31.60 32.05 1lwn h MET 99 CO 0.03 0.49 0.03 0.28 1.06 0.00 0.00 176.91 178.80 1lwn h VAL 100 N 0.77 1.19 0.00 -2.22 2.07 -1.02 0.34 116.25 117.38 1lwn h VAL 100 Ca 0.23 -0.59 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 1lwn h VAL 100 Cb -0.03 1.37 -0.00 0.00 -1.52 0.00 0.00 31.29 31.10 1lwn h VAL 100 CO -0.07 0.17 -0.11 0.78 0.02 0.00 0.00 177.57 178.36 1lwn h ASN 101 N -0.02 0.00 -0.02 0.57 4.21 -1.18 -2.04 115.58 117.10 1lwn h ASN 101 Ca 0.04 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.55 1lwn h ASN 101 Cb 0.24 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.44 1lwn h ASN 101 CO -0.00 0.11 -0.26 0.18 -1.29 0.00 0.00 177.43 176.16 1lwn n LEU 102 N -3.40 2.43 -3.34 1.61 4.32 -0.68 -0.60 117.00 117.34 1lwn n LEU 102 Ca -0.01 -0.85 -0.19 0.00 -0.02 0.00 0.00 56.01 54.94 1lwn n LEU 102 Cb 0.28 -0.00 0.08 0.00 -1.62 0.00 0.00 43.42 42.16 1lwn n LEU 102 CO 0.29 0.43 0.16 0.00 -1.22 0.00 0.00 177.39 177.05 1lwn n ALA 103 N 0.56 -1.58 0.39 -1.18 0.00 -0.20 -4.94 120.51 113.56 1lwn n ALA 103 Ca 0.11 0.15 0.04 0.00 0.00 0.00 0.00 53.44 53.75 1lwn n ALA 103 Cb 0.52 -3.68 -0.02 0.00 0.00 0.00 0.00 19.45 16.27 1lwn n ALA 103 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1lwn n LEU 104 N -4.31 0.77 0.20 0.00 4.77 0.10 -4.74 117.00 113.79 1lwn n LEU 104 Ca -0.14 -0.64 0.07 0.00 -0.03 0.00 0.00 56.01 55.27 1lwn n LEU 104 Cb 0.61 0.00 0.57 0.00 -2.33 0.00 0.00 43.42 42.27 1lwn n LEU 104 CO 0.59 0.17 1.05 1.05 -1.33 0.00 0.00 177.39 178.91 1lwn h GLU 105 N 0.50 0.10 0.05 3.23 4.11 -1.91 -1.68 114.58 118.99 1lwn h GLU 105 Ca 0.00 -0.01 -0.00 0.00 0.07 0.00 0.00 59.36 59.42 1lwn h GLU 105 Cb 0.25 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1lwn h GLU 105 CO 0.00 0.11 -0.03 -0.91 0.07 0.00 0.00 179.01 178.26 1lwn h ASN 106 N 0.11 -0.06 -0.52 3.06 -0.26 -1.93 -0.97 115.58 115.01 1lwn h ASN 106 Ca 0.03 -0.43 -0.01 0.00 -0.56 0.00 0.00 56.30 55.33 1lwn h ASN 106 Cb 0.06 0.02 -0.03 0.00 -1.06 0.00 0.00 38.32 37.31 1lwn h ASN 106 CO -0.00 0.42 0.31 0.00 -1.06 0.00 0.00 177.43 177.09 1lwn h ALA 107 N 0.34 1.53 -0.22 -0.83 0.00 -1.85 -0.35 119.26 117.88 1lwn h ALA 107 Ca -0.01 -0.08 -0.20 0.00 0.00 0.00 0.00 54.91 54.63 1lwn h ALA 107 Cb 0.49 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1lwn h ALA 107 CO 0.01 0.40 -0.63 0.00 0.00 0.00 0.00 179.25 179.03 1lwn h ASP 109 N 0.58 0.03 -0.23 0.00 -0.00 -0.50 -1.34 116.42 114.96 1lwn h ASP 109 Ca -0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 57.03 57.01 1lwn h ASP 109 Cb 1.24 -0.00 -0.01 0.00 -0.00 0.00 0.00 39.33 40.56 1lwn h ASP 109 CO 0.13 0.03 0.09 -0.08 -0.00 0.00 0.00 179.24 179.41 1lwn h GLU 110 N 0.06 0.35 -0.60 0.28 4.57 -1.01 -1.56 114.58 116.66 1lwn h GLU 110 Ca 0.02 -0.07 0.03 0.00 -1.18 0.00 0.00 59.36 58.17 1lwn h GLU 110 Cb 0.01 -0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 28.50 1lwn h GLU 110 CO -0.02 0.40 0.37 0.00 -1.18 0.00 0.00 179.01 178.58 1lwn h ALA 111 N 0.93 0.78 -0.42 2.92 0.00 -0.73 -1.43 119.26 121.31 1lwn h ALA 111 Ca 0.08 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 1lwn h ALA 111 Cb 0.18 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1lwn h ALA 111 CO -0.01 0.10 -0.26 1.79 0.00 0.00 0.00 179.25 180.87 1lwn h THR 112 N 0.72 1.27 -0.39 0.00 1.35 -1.19 -2.85 112.91 111.82 1lwn h THR 112 Ca 0.24 -1.42 0.02 0.00 -0.55 0.00 0.00 66.41 64.71 1lwn h THR 112 Cb 0.03 1.22 -0.03 0.00 -1.73 0.00 0.00 68.15 67.64 1lwn h THR 112 CO -0.11 0.48 0.21 0.22 -0.25 0.00 0.00 175.52 176.07 1lwn h TYR 113 N 0.77 0.39 0.00 4.73 3.20 -0.91 0.01 116.97 125.16 1lwn h TYR 113 Ca 0.09 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.98 1lwn h TYR 113 Cb 0.82 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.97 1lwn h TYR 113 CO 0.05 0.21 0.00 1.96 -1.64 0.00 0.00 178.16 178.74 1lwn h GLN 114 N 0.43 0.00 -0.02 1.82 4.20 -1.14 -0.97 115.11 119.43 1lwn h GLN 114 Ca 0.16 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.87 1lwn h GLN 114 Cb 0.05 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.83 1lwn h GLN 114 CO -0.10 0.00 -0.16 1.28 -0.67 0.00 0.00 178.83 179.18 1lwn n LEU 115 N -2.57 2.12 0.00 1.46 4.77 -0.56 -4.94 117.00 117.27 1lwn n LEU 115 Ca -0.00 -0.71 0.00 0.00 -0.03 0.00 0.00 56.01 55.27 1lwn n LEU 115 Cb 0.16 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 1lwn n LEU 115 CO 0.18 0.37 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 1lwn n GLY 116 N 1.33 0.71 3.34 -0.72 0.00 -0.37 -5.07 105.19 104.41 1lwn n GLY 116 Ca 0.14 -0.71 -0.22 0.00 0.00 0.00 0.00 46.02 45.23 1lwn n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1lwn s LEU 117 N 0.00 2.46 -0.27 0.99 1.43 -0.12 -5.02 118.68 118.16 1lwn s LEU 117 Ca 0.00 -0.89 -0.06 0.00 -1.03 0.00 0.00 54.13 52.15 1lwn s LEU 117 Cb 0.00 -0.84 -0.00 0.00 0.03 0.00 0.00 46.19 45.38 1lwn s LEU 117 CO 0.00 -0.04 0.05 -0.62 0.23 0.00 0.00 176.35 175.97 1lwn s ASP 118 N -2.78 4.95 0.28 2.29 3.68 -1.26 -3.37 116.67 120.47 1lwn s ASP 118 Ca 0.17 -0.52 -0.00 0.00 2.13 0.00 0.00 52.55 54.33 1lwn s ASP 118 Cb -0.05 -1.86 0.42 0.00 -1.45 0.00 0.00 42.92 39.97 1lwn s ASP 118 CO 0.07 -0.12 1.80 -0.03 0.13 0.00 0.00 175.17 177.03 1lwn h MET 119 N 8.21 0.73 -0.38 4.34 1.85 -1.92 -2.82 114.93 124.94 1lwn h MET 119 Ca -0.35 -0.18 -0.06 0.00 -0.61 0.00 0.00 59.70 58.50 1lwn h MET 119 Cb 1.14 -0.10 -0.02 0.00 0.43 0.00 0.00 31.60 33.06 1lwn h MET 119 CO 0.60 0.72 -0.03 1.49 -0.40 0.00 0.00 176.91 179.29 1lwn h GLU 120 N 0.69 0.62 -0.36 0.39 4.81 -2.00 -1.36 114.58 117.37 1lwn h GLU 120 Ca 0.14 -0.16 -0.13 0.00 -0.13 0.00 0.00 59.36 59.09 1lwn h GLU 120 Cb 0.39 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 1lwn h GLU 120 CO 0.01 0.67 -0.29 1.49 -0.73 0.00 0.00 179.01 180.16 1lwn h GLU 121 N 0.58 0.77 -0.62 1.92 4.81 -1.97 -3.00 114.58 117.08 1lwn h GLU 121 Ca 0.12 -0.35 -0.07 0.00 -0.13 0.00 0.00 59.36 58.93 1lwn h GLU 121 Cb 0.42 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.76 1lwn h GLU 121 CO 0.02 0.97 0.11 -0.07 -0.73 0.00 0.00 179.01 179.31 1lwn h LEU 122 N 0.66 0.97 -1.51 1.64 3.38 -1.20 -3.05 115.31 116.19 1lwn h LEU 122 Ca 0.08 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 1lwn h LEU 122 Cb 0.82 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 1lwn h LEU 122 CO 0.07 0.98 0.20 -0.33 0.09 0.00 0.00 178.44 179.44 1lwn h GLU 123 N 0.92 0.53 0.00 1.13 5.08 -1.15 -2.06 114.58 119.03 1lwn h GLU 123 Ca 0.19 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 1lwn h GLU 123 Cb 0.41 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1lwn h GLU 123 CO 0.01 0.40 0.00 0.39 -1.00 0.00 0.00 179.01 178.81 1lwn n GLU 124 N -4.43 0.13 0.11 2.33 -0.58 -1.15 -2.59 120.64 114.47 1lwn n GLU 124 Ca 0.03 0.17 0.03 0.00 -0.42 0.00 0.00 57.16 56.97 1lwn n GLU 124 Cb 0.10 -1.50 -0.00 0.00 -0.57 0.00 0.00 31.44 29.47 1lwn n GLU 124 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 1lwn h ILE 125 N 0.00 0.61 -3.46 -3.67 2.04 -1.46 -3.47 117.51 108.10 1lwn h ILE 125 Ca 0.00 -1.95 -0.53 0.00 1.00 0.00 0.00 64.86 63.38 1lwn h ILE 125 Cb 0.21 2.19 0.07 0.00 -0.74 0.00 0.00 36.82 38.54 1lwn h ILE 125 CO 0.00 0.35 0.78 -0.70 0.00 0.00 0.00 178.15 178.58 1lwn s GLU 126 N -3.00 4.22 0.37 2.37 2.12 -1.07 -4.99 118.70 118.72 1lwn s GLU 126 Ca 0.02 2.39 -0.24 0.00 0.36 0.00 0.00 54.97 57.50 1lwn s GLU 126 Cb 0.08 -3.07 -0.10 0.00 0.26 0.00 0.00 34.13 31.30 1lwn s GLU 126 CO 0.77 -0.46 0.95 -1.21 -0.54 0.00 0.00 175.26 174.77 1lwn s GLU 127 N -0.70 4.42 0.15 4.30 0.41 -1.26 -4.95 118.70 121.07 1lwn s GLU 127 Ca 0.59 1.27 -0.30 0.00 -0.41 0.00 0.00 54.97 56.12 1lwn s GLU 127 Cb -0.44 -2.55 -0.07 0.00 -1.78 0.00 0.00 34.13 29.29 1lwn s GLU 127 CO 0.47 0.13 1.00 0.34 -0.49 0.00 0.00 175.26 176.71 1lwn s ASP 128 N -1.82 7.46 -0.69 -0.19 2.15 -1.26 -4.46 116.67 117.86 1lwn s ASP 128 Ca 0.55 1.91 -0.22 0.00 0.43 0.00 0.00 52.55 55.22 1lwn s ASP 128 Cb -0.15 -2.60 0.08 0.00 -0.30 0.00 0.00 42.92 39.95 1lwn s ASP 128 CO 0.20 -0.07 0.97 0.00 -0.17 0.00 0.00 175.17 176.09 1lwn s ALA 129 N -0.27 3.16 -0.98 3.66 0.00 -1.01 -4.87 121.76 121.46 1lwn s ALA 129 Ca 0.47 -1.98 -0.02 0.00 0.00 0.00 0.00 51.96 50.43 1lwn s ALA 129 Cb -0.26 -3.86 0.30 0.00 0.00 0.00 0.00 23.12 19.31 1lwn s ALA 129 CO 0.32 -2.77 1.97 0.41 0.00 0.00 0.00 175.76 175.69 1lwn n GLY 130 N 5.36 5.82 2.16 0.00 0.00 -1.26 -2.05 105.19 115.22 1lwn n GLY 130 Ca -0.01 -2.48 -0.20 0.00 0.00 0.00 0.00 46.02 43.33 1lwn n GLY 130 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1lwn n LEU 131 N -0.02 6.26 -3.54 0.99 4.77 -1.23 -1.00 117.00 123.23 1lwn n LEU 131 Ca 0.50 -3.58 -0.11 0.00 -0.03 0.00 0.00 56.01 52.79 1lwn n LEU 131 Cb 0.26 -1.19 -0.02 0.00 -2.33 0.00 0.00 43.42 40.15 1lwn n LEU 131 CO 0.52 1.50 0.43 -0.83 -1.33 0.00 0.00 177.39 177.68 1lwn s GLY 132 N 0.59 -0.48 -0.18 -0.72 0.00 -1.26 -0.78 107.32 104.49 1lwn s GLY 132 Ca 0.46 0.30 0.01 0.00 0.00 0.00 0.00 44.72 45.49 1lwn s GLY 132 CO -0.10 0.10 0.13 0.70 0.00 0.00 0.00 173.10 173.92 1lwn n ASN 133 N -0.40 1.74 0.00 1.64 3.02 -1.26 -4.44 115.26 115.56 1lwn n ASN 133 Ca -0.13 0.07 0.00 0.00 -0.03 0.00 0.00 54.58 54.49 1lwn n ASN 133 Cb 0.63 -0.42 0.00 0.00 -0.61 0.00 0.00 39.78 39.38 1lwn n ASN 133 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1lwn n GLY 134 N 2.04 0.25 0.17 7.41 0.00 -1.26 -4.94 105.19 108.86 1lwn n GLY 134 Ca -0.36 0.52 -0.06 0.00 0.00 0.00 0.00 46.02 46.12 1lwn n GLY 134 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1lwn h GLY 135 N 0.00 0.53 0.97 -0.02 0.00 -1.98 -0.47 103.07 102.10 1lwn h GLY 135 Ca 0.00 -0.12 -0.00 0.00 0.00 0.00 0.00 47.33 47.20 1lwn h GLY 135 CO 0.00 0.08 0.17 -2.00 0.00 0.00 0.00 176.54 174.78 1lwn h LEU 136 N 0.37 0.35 -0.65 3.11 6.46 -1.99 0.29 115.31 123.25 1lwn h LEU 136 Ca 0.17 -0.07 -0.12 0.00 -0.12 0.00 0.00 57.88 57.74 1lwn h LEU 136 Cb 0.10 -0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 39.93 1lwn h LEU 136 CO -0.14 0.32 -0.29 1.23 -0.62 0.00 0.00 178.44 178.94 1lwn h GLY 137 N 0.36 0.81 1.70 3.75 0.00 -1.79 -2.92 103.07 104.97 1lwn h GLY 137 Ca 0.10 -0.73 -0.14 0.00 0.00 0.00 0.00 47.33 46.56 1lwn h GLY 137 CO -0.02 0.66 -0.55 -0.09 0.00 0.00 0.00 176.54 176.55 1lwn h ARG 138 N 0.64 0.31 -0.80 4.80 9.65 -0.90 -0.86 114.38 127.22 1lwn h ARG 138 Ca 0.08 -0.20 -0.01 0.00 -1.10 0.00 0.00 59.98 58.75 1lwn h ARG 138 Cb 0.80 0.02 -0.04 0.00 -1.39 0.00 0.00 29.97 29.37 1lwn h ARG 138 CO 0.07 0.78 0.45 1.25 2.80 0.00 0.00 179.97 185.31 1lwn h LEU 139 N 0.24 0.98 -1.03 3.80 5.85 -0.81 -1.42 115.31 122.93 1lwn h LEU 139 Ca 0.00 -0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.63 1lwn h LEU 139 Cb 1.04 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.77 1lwn h LEU 139 CO 0.09 0.79 0.57 0.00 -0.34 0.00 0.00 178.44 179.54 1lwn h ALA 140 N 1.24 1.28 -0.37 1.25 0.00 -1.34 0.35 119.26 121.66 1lwn h ALA 140 Ca 0.28 -0.09 -0.15 0.00 0.00 0.00 0.00 54.91 54.95 1lwn h ALA 140 Cb 0.01 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 1lwn h ALA 140 CO -0.05 0.63 -0.36 0.00 0.00 0.00 0.00 179.25 179.48 1lwn h ALA 141 N 1.37 0.66 -0.46 0.00 0.00 -1.25 -1.75 119.26 117.84 1lwn h ALA 141 Ca 0.33 -0.44 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1lwn h ALA 141 Cb -0.08 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1lwn h ALA 141 CO -0.06 0.67 -0.00 0.00 0.00 0.00 0.00 179.25 179.85 1lwn h PHE 143 N 0.66 1.16 -0.68 0.00 0.05 -0.84 -1.46 116.94 115.84 1lwn h PHE 143 Ca 0.13 0.00 0.01 0.00 3.82 0.00 0.00 57.97 61.93 1lwn h PHE 143 Cb 0.50 -0.38 -0.03 0.00 2.00 0.00 0.00 35.95 38.04 1lwn h PHE 143 CO 0.04 0.77 0.45 -0.07 -0.18 0.00 0.00 178.31 179.31 1lwn h LEU 144 N 1.22 0.79 -0.61 1.54 4.07 -1.16 0.16 115.31 121.32 1lwn h LEU 144 Ca 0.32 -0.03 -0.04 0.00 0.08 0.00 0.00 57.88 58.21 1lwn h LEU 144 Cb -0.07 -0.20 -0.03 0.00 1.08 0.00 0.00 40.66 41.45 1lwn h LEU 144 CO -0.06 0.58 0.23 -0.78 -1.08 0.00 0.00 178.44 177.33 1lwn h ASP 145 N 0.93 0.85 -0.40 -0.43 1.82 -1.14 -2.56 116.42 115.50 1lwn h ASP 145 Ca 0.25 -0.18 -0.16 0.00 -0.39 0.00 0.00 57.03 56.55 1lwn h ASP 145 Cb -0.10 -0.22 -0.01 0.00 0.68 0.00 0.00 39.33 39.69 1lwn h ASP 145 CO -0.05 0.80 -0.36 0.28 -1.61 0.00 0.00 179.24 178.30 1lwn h SER 146 N 0.86 1.01 -0.15 2.28 0.02 -0.76 -1.64 113.55 115.16 1lwn h SER 146 Ca 0.20 -0.46 -0.05 0.00 -0.84 0.00 0.00 61.79 60.64 1lwn h SER 146 Cb 0.22 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.47 1lwn h SER 146 CO -0.01 1.25 -0.05 0.24 -1.14 0.00 0.00 176.83 177.12 1lwn h MET 147 N 0.78 0.45 -0.16 3.45 2.86 -0.61 0.34 114.93 122.03 1lwn h MET 147 Ca 0.07 -0.10 -0.13 0.00 -2.06 0.00 0.00 59.70 57.47 1lwn h MET 147 Cb 0.96 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.56 1lwn h MET 147 CO 0.09 0.52 -0.43 0.00 1.06 0.00 0.00 176.91 178.15 1lwn h ALA 148 N 1.53 0.27 0.00 6.32 0.00 -1.35 -0.99 119.26 125.03 1lwn h ALA 148 Ca 0.09 -0.47 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 1lwn h ALA 148 Cb 0.36 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1lwn h ALA 148 CO 0.02 0.39 -0.17 1.15 0.00 0.00 0.00 179.25 180.63 1lwn h THR 149 N 0.22 0.66 -0.57 0.00 2.02 -0.87 -1.96 112.91 112.41 1lwn h THR 149 Ca -0.01 -0.74 0.00 0.00 0.77 0.00 0.00 66.41 66.43 1lwn h THR 149 Cb 1.04 1.47 0.00 0.00 -1.74 0.00 0.00 68.15 68.92 1lwn h THR 149 CO 0.09 0.17 0.00 0.18 0.37 0.00 0.00 175.52 176.33 1lwn n LEU 150 N -3.66 4.04 -3.20 2.58 4.77 0.07 -4.71 117.00 116.90 1lwn n LEU 150 Ca -0.01 -2.03 -0.23 0.00 -0.03 0.00 0.00 56.01 53.70 1lwn n LEU 150 Cb 0.30 -0.52 0.04 0.00 -2.33 0.00 0.00 43.42 40.90 1lwn n LEU 150 CO 0.32 0.73 0.03 0.61 -1.33 0.00 0.00 177.39 177.75 1lwn n GLY 151 N 1.10 -0.52 3.85 -0.72 0.00 -0.74 -0.28 105.19 107.88 1lwn n GLY 151 Ca 0.22 0.15 -0.35 0.00 0.00 0.00 0.00 46.02 46.03 1lwn n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1lwn s LEU 152 N -6.78 4.36 -1.36 0.99 1.43 -0.39 -4.72 118.68 112.21 1lwn s LEU 152 Ca 0.38 0.93 -0.15 0.00 -1.03 0.00 0.00 54.13 54.25 1lwn s LEU 152 Cb -0.17 -3.04 0.07 0.00 0.03 0.00 0.00 46.19 43.08 1lwn s LEU 152 CO 0.47 0.17 1.94 0.00 0.23 0.00 0.00 176.35 179.15 1lwn n ALA 153 N 0.99 4.54 -2.65 4.21 0.00 -1.26 -4.69 120.51 121.65 1lwn n ALA 153 Ca -0.08 -3.92 -0.31 0.00 0.00 0.00 0.00 53.44 49.13 1lwn n ALA 153 Cb 0.52 -3.50 -0.09 0.00 0.00 0.00 0.00 19.45 16.38 1lwn n ALA 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1lwn s ALA 154 N 3.35 3.19 -0.05 0.00 0.00 -1.26 -1.26 121.76 125.73 1lwn s ALA 154 Ca 0.49 -1.06 0.02 0.00 0.00 0.00 0.00 51.96 51.41 1lwn s ALA 154 Cb 0.08 -1.19 0.02 0.00 0.00 0.00 0.00 23.12 22.03 1lwn s ALA 154 CO -0.00 0.66 -0.09 0.71 0.00 0.00 0.00 175.76 177.03 1lwn s TYR 155 N -1.16 1.16 -0.15 0.00 1.51 0.16 -3.85 117.35 115.03 1lwn s TYR 155 Ca 0.21 -0.40 -0.13 0.00 -1.01 0.00 0.00 57.07 55.75 1lwn s TYR 155 Cb -0.11 -0.90 -0.05 0.00 -0.11 0.00 0.00 41.96 40.79 1lwn s TYR 155 CO 0.13 -0.23 0.26 0.20 -1.11 0.00 0.00 175.55 174.80 1lwn s GLY 156 N 0.72 2.20 -0.10 0.71 0.00 -0.84 -1.19 107.32 108.83 1lwn s GLY 156 Ca -0.13 -0.49 0.03 0.00 0.00 0.00 0.00 44.72 44.13 1lwn s GLY 156 CO 0.02 0.28 -0.19 -0.19 0.00 0.00 0.00 173.10 173.02 1lwn s TYR 157 N 0.15 2.19 0.00 1.90 2.02 -0.68 -0.20 117.35 122.73 1lwn s TYR 157 Ca 0.16 -0.96 0.00 0.00 -0.37 0.00 0.00 57.07 55.90 1lwn s TYR 157 Cb -0.13 -1.52 0.00 0.00 -0.40 0.00 0.00 41.96 39.91 1lwn s TYR 157 CO 0.04 -0.44 0.00 0.41 -1.57 0.00 0.00 175.55 173.99 1lwn n GLY 158 N 3.86 3.47 3.47 0.71 0.00 -0.88 -2.33 105.19 113.49 1lwn n GLY 158 Ca -0.20 -0.82 -0.33 0.00 0.00 0.00 0.00 46.02 44.67 1lwn n GLY 158 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1lwn s ILE 159 N -2.25 3.19 -1.03 -0.61 1.01 -1.26 -1.25 121.20 118.99 1lwn s ILE 159 Ca 0.00 -0.66 -0.16 0.00 0.00 0.00 0.00 60.65 59.83 1lwn s ILE 159 Cb 0.00 -2.28 0.15 0.00 0.01 0.00 0.00 42.46 40.34 1lwn s ILE 159 CO 0.00 0.57 1.22 -0.60 0.00 0.00 0.00 174.94 176.13 1lwn s ARG 160 N -0.46 3.79 0.31 2.79 3.52 -0.21 -4.76 118.95 123.93 1lwn s ARG 160 Ca 0.06 -2.13 -0.29 0.00 -0.13 0.00 0.00 55.73 53.24 1lwn s ARG 160 Cb -0.12 -4.94 -0.10 0.00 -1.56 0.00 0.00 34.95 28.23 1lwn s ARG 160 CO 0.02 -1.73 1.32 0.71 -0.81 0.00 0.00 175.30 174.81 1lwn s TYR 161 N 2.06 3.06 0.23 5.12 2.02 -1.26 -4.77 117.35 123.81 1lwn s TYR 161 Ca 0.36 1.36 0.07 0.00 -0.37 0.00 0.00 57.07 58.48 1lwn s TYR 161 Cb -0.04 -3.69 0.23 0.00 -0.40 0.00 0.00 41.96 38.05 1lwn s TYR 161 CO -0.06 -1.95 1.54 1.49 -1.57 0.00 0.00 175.55 174.99 1lwn h GLU 162 N 3.69 0.10 -4.40 -0.62 4.81 -0.99 -3.42 114.58 113.76 1lwn h GLU 162 Ca -0.48 -0.08 -0.54 0.00 -0.13 0.00 0.00 59.36 58.12 1lwn h GLU 162 Cb 1.22 0.02 -0.36 0.00 0.63 0.00 0.00 28.75 30.26 1lwn h GLU 162 CO 0.68 0.74 -0.81 -0.06 -0.73 0.00 0.00 179.01 178.82 1lwn s PHE 163 N -3.53 1.65 0.00 0.92 0.40 -0.46 -4.45 117.98 112.52 1lwn s PHE 163 Ca -0.02 -0.82 0.00 0.00 -0.60 0.00 0.00 56.93 55.49 1lwn s PHE 163 Cb 0.12 -1.30 0.00 0.00 0.51 0.00 0.00 43.02 42.35 1lwn s PHE 163 CO 0.79 -0.51 0.00 0.41 0.70 0.00 0.00 175.22 176.61 1lwn n GLY 164 N 4.69 0.71 3.72 4.36 0.00 -1.23 -2.18 105.19 115.26 1lwn n GLY 164 Ca -0.15 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 43.77 1lwn n GLY 164 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1lwn n ILE 165 N 0.00 0.34 -0.92 -0.61 0.13 -0.17 -4.56 119.36 113.58 1lwn n ILE 165 Ca 0.00 -0.09 -0.33 0.00 -1.10 0.00 0.00 62.75 61.23 1lwn n ILE 165 Cb 0.00 -1.95 0.12 0.00 -0.84 0.00 0.00 39.64 36.97 1lwn n ILE 165 CO 0.00 0.00 0.00 2.22 2.80 0.00 0.00 176.55 181.57 1lwn n PHE 166 N 3.33 -0.46 -3.23 9.51 1.16 -1.26 -4.56 117.46 121.94 1lwn n PHE 166 Ca 0.14 0.31 -0.39 0.00 -1.87 0.00 0.00 57.45 55.64 1lwn n PHE 166 Cb 0.35 -1.90 -0.06 0.00 -1.61 0.00 0.00 39.48 36.26 1lwn n PHE 166 CO 0.00 0.00 0.00 -0.80 -1.87 0.00 0.00 176.76 174.09 1lwn s ASN 167 N -2.03 6.91 -0.25 5.98 0.01 0.49 -4.89 114.94 121.16 1lwn s ASN 167 Ca 0.63 1.09 -0.12 0.00 -0.71 0.00 0.00 52.86 53.75 1lwn s ASN 167 Cb -0.26 -2.35 -0.05 0.00 0.41 0.00 0.00 41.25 39.01 1lwn s ASN 167 CO 0.61 0.08 0.24 -1.58 -1.51 0.00 0.00 177.10 174.95 1lwn s GLN 168 N -0.03 4.05 -0.01 -0.60 0.74 -1.26 -1.25 119.66 121.29 1lwn s GLN 168 Ca 0.30 -0.15 0.05 0.00 0.05 0.00 0.00 55.36 55.61 1lwn s GLN 168 Cb -0.18 -3.59 -0.03 0.00 1.10 0.00 0.00 33.01 30.32 1lwn s GLN 168 CO 0.16 -0.08 -0.14 0.15 -0.55 0.00 0.00 175.29 174.84 1lwn s LYS 169 N 1.45 2.39 -0.29 1.67 1.02 -0.18 -3.75 119.74 122.05 1lwn s LYS 169 Ca 0.11 -0.78 -0.08 0.00 0.02 0.00 0.00 55.97 55.24 1lwn s LYS 169 Cb -0.15 -2.35 -0.00 0.00 -0.52 0.00 0.00 37.83 34.81 1lwn s LYS 169 CO 0.08 0.59 0.09 0.42 -0.92 0.00 0.00 175.35 175.62 1lwn s ILE 170 N -0.85 4.19 -0.21 2.17 -1.09 -1.26 0.58 121.20 124.73 1lwn s ILE 170 Ca 0.14 -0.52 0.02 0.00 -2.23 0.00 0.00 60.65 58.05 1lwn s ILE 170 Cb -0.11 -3.11 0.04 0.00 -1.58 0.00 0.00 42.46 37.70 1lwn s ILE 170 CO 0.03 0.13 -0.15 0.00 -1.23 0.00 0.00 174.94 173.73 1lwn n GLY 172 N 4.58 -0.47 2.46 0.00 0.00 -1.26 -1.31 105.19 109.20 1lwn n GLY 172 Ca -0.17 0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1lwn n GLY 172 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lwn n GLY 173 N -1.20 1.67 3.85 -0.02 0.00 -1.26 -5.02 105.19 103.21 1lwn n GLY 173 Ca -0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 1lwn n GLY 173 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1lwn s TRP 174 N -3.24 3.35 0.17 1.61 0.52 -0.42 -3.80 118.94 117.13 1lwn s TRP 174 Ca 0.00 0.14 -0.29 0.00 0.02 0.00 0.00 56.10 55.98 1lwn s TRP 174 Cb 0.00 -1.67 -0.08 0.00 -1.15 0.00 0.00 33.47 30.57 1lwn s TRP 174 CO 0.00 0.55 0.91 -1.14 0.02 0.00 0.00 176.95 177.29 1lwn s GLN 175 N -2.57 4.74 -0.04 4.98 0.74 -1.26 0.13 119.66 126.37 1lwn s GLN 175 Ca 0.32 1.40 0.04 0.00 0.05 0.00 0.00 55.36 57.17 1lwn s GLN 175 Cb -0.12 -3.31 -0.00 0.00 1.10 0.00 0.00 33.01 30.67 1lwn s GLN 175 CO 0.25 0.42 -0.18 -1.64 -0.55 0.00 0.00 175.29 173.59 1lwn s MET 176 N -0.73 1.78 -0.15 1.67 -1.94 0.19 -4.89 119.30 115.24 1lwn s MET 176 Ca 0.42 -0.62 -0.08 0.00 -1.71 0.00 0.00 55.69 53.70 1lwn s MET 176 Cb -0.24 -1.56 -0.04 0.00 2.01 0.00 0.00 34.83 34.99 1lwn s MET 176 CO 0.30 0.26 0.13 -1.21 -0.01 0.00 0.00 175.02 174.49 1lwn s GLU 177 N -0.02 3.70 -0.06 2.03 8.01 -1.26 -1.01 118.70 130.09 1lwn s GLU 177 Ca -0.03 -0.17 0.02 0.00 0.01 0.00 0.00 54.97 54.80 1lwn s GLU 177 Cb -0.11 -3.26 0.01 0.00 -4.31 0.00 0.00 34.13 26.46 1lwn s GLU 177 CO 0.02 0.60 -0.12 -1.21 0.01 0.00 0.00 175.26 174.56 1lwn s GLU 178 N -0.52 1.66 0.25 1.61 2.02 -0.38 -4.97 118.70 118.37 1lwn s GLU 178 Ca 0.12 -0.40 -0.30 0.00 0.02 0.00 0.00 54.97 54.41 1lwn s GLU 178 Cb -0.12 -1.38 -0.14 0.00 0.10 0.00 0.00 34.13 32.59 1lwn s GLU 178 CO 0.02 0.02 1.20 0.00 0.02 0.00 0.00 175.26 176.52 1lwn n ALA 179 N 3.82 0.16 -3.06 5.21 0.00 -1.26 -0.38 120.51 125.00 1lwn n ALA 179 Ca -0.23 0.41 -0.45 0.00 0.00 0.00 0.00 53.44 53.18 1lwn n ALA 179 Cb 0.52 -2.12 -0.02 0.00 0.00 0.00 0.00 19.45 17.82 1lwn n ALA 179 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1lwn s ASP 180 N -0.12 6.66 -1.54 0.00 2.15 -1.26 -4.66 116.67 117.89 1lwn s ASP 180 Ca 0.65 -2.23 -0.10 0.00 0.43 0.00 0.00 52.55 51.30 1lwn s ASP 180 Cb -0.72 -2.33 -0.03 0.00 -0.30 0.00 0.00 42.92 39.54 1lwn s ASP 180 CO 0.55 -0.91 2.73 -0.67 -0.17 0.00 0.00 175.17 176.70 1lwn n ASP 181 N 5.71 7.84 0.11 -0.34 4.64 -1.26 -3.51 116.55 129.73 1lwn n ASP 181 Ca 0.20 -2.72 0.09 0.00 -1.38 0.00 0.00 54.79 50.97 1lwn n ASP 181 Cb 0.48 -1.54 0.43 0.00 -1.04 0.00 0.00 41.12 39.45 1lwn n ASP 181 CO 0.00 0.00 0.00 -2.67 -0.82 0.00 0.00 177.20 173.71 1lwn n TRP 182 N 3.65 0.55 0.47 -0.67 4.27 -1.26 -2.12 117.44 122.32 1lwn n TRP 182 Ca 0.71 0.26 0.11 0.00 -3.89 0.00 0.00 57.50 54.70 1lwn n TRP 182 Cb 0.26 -0.92 0.17 0.00 -1.36 0.00 0.00 31.31 29.45 1lwn n TRP 182 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 1lwn n LEU 183 N -2.05 3.19 -0.27 5.67 4.77 -1.26 -4.64 117.00 122.41 1lwn n LEU 183 Ca 0.00 -1.35 0.06 0.00 -0.03 0.00 0.00 56.01 54.68 1lwn n LEU 183 Cb 0.08 -0.16 0.16 0.00 -2.33 0.00 0.00 43.42 41.17 1lwn n LEU 183 CO 0.10 0.65 0.81 -0.09 -1.33 0.00 0.00 177.39 177.54 1lwn h ARG 184 N 4.20 0.09 -0.39 3.23 9.65 -1.82 0.01 114.38 129.36 1lwn h ARG 184 Ca 0.00 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 1lwn h ARG 184 Cb 0.93 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 29.49 1lwn h ARG 184 CO 0.00 0.06 0.00 0.66 2.80 0.00 0.00 179.97 183.49 1lwn n TYR 185 N -5.37 0.51 0.00 2.20 4.01 -1.26 -5.06 117.16 112.19 1lwn n TYR 185 Ca 0.14 -0.25 0.00 0.00 -0.16 0.00 0.00 57.90 57.63 1lwn n TYR 185 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.52 1lwn n TYR 185 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1lwn n GLY 186 N 1.47 0.79 2.99 2.72 0.00 -0.01 -4.95 105.19 108.20 1lwn n GLY 186 Ca 0.19 -1.75 -0.31 0.00 0.00 0.00 0.00 46.02 44.15 1lwn n GLY 186 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1lwn s ASN 187 N -1.15 4.61 0.29 1.61 2.47 -1.26 -4.88 114.94 116.63 1lwn s ASN 187 Ca 0.00 -1.97 0.24 0.00 0.42 0.00 0.00 52.86 51.55 1lwn s ASN 187 Cb 0.00 -1.51 1.06 0.00 -1.45 0.00 0.00 41.25 39.35 1lwn s ASN 187 CO 0.00 -0.36 1.72 -0.81 -3.72 0.00 0.00 177.10 173.93 1lwn n PRO 188 N 4.36 0.19 0.11 0.43 -0.04 -1.26 -3.14 135.00 135.65 1lwn n PRO 188 Ca 0.01 0.49 0.05 0.00 -0.04 0.00 0.00 63.50 64.01 1lwn n PRO 188 Cb 0.42 -1.92 0.01 0.00 -0.04 0.00 0.00 33.50 31.97 1lwn n PRO 188 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1lwn h TRP 189 N 0.00 0.00 -3.21 0.54 4.06 -1.96 -3.47 115.95 111.91 1lwn h TRP 189 Ca 0.00 0.00 -0.51 0.00 2.06 0.00 0.00 58.89 60.44 1lwn h TRP 189 Cb 0.27 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.42 1lwn h TRP 189 CO 0.00 0.32 -0.13 -1.83 -3.56 0.00 0.00 178.44 173.25 1lwn s GLU 190 N -3.09 3.63 -0.16 0.49 -1.05 -1.19 -4.19 118.70 113.15 1lwn s GLU 190 Ca 0.01 0.01 -0.01 0.00 -0.15 0.00 0.00 54.97 54.83 1lwn s GLU 190 Cb 0.08 -2.63 0.04 0.00 -0.44 0.00 0.00 34.13 31.18 1lwn s GLU 190 CO 0.77 0.19 -0.02 0.21 0.95 0.00 0.00 175.26 177.35 1lwn s LYS 191 N -3.62 1.13 0.38 -4.83 2.47 0.99 -4.93 119.74 111.33 1lwn s LYS 191 Ca 0.44 -0.40 -0.27 0.00 -1.56 0.00 0.00 55.97 54.18 1lwn s LYS 191 Cb -0.11 -1.87 -0.09 0.00 -1.46 0.00 0.00 37.83 34.30 1lwn s LYS 191 CO 0.31 -0.46 1.31 0.00 0.16 0.00 0.00 175.35 176.67 1lwn s ALA 192 N 1.73 3.36 -0.52 3.13 0.00 -1.26 -0.97 121.76 127.24 1lwn s ALA 192 Ca 0.01 1.26 0.07 0.00 0.00 0.00 0.00 51.96 53.30 1lwn s ALA 192 Cb -0.15 -3.49 0.28 0.00 0.00 0.00 0.00 23.12 19.76 1lwn s ALA 192 CO -0.07 -0.77 0.72 0.54 0.00 0.00 0.00 175.76 176.17 1lwn n ARG 193 N 0.38 1.92 0.30 0.00 5.12 -0.09 -4.91 116.66 119.38 1lwn n ARG 193 Ca 0.02 -4.11 0.17 0.00 -1.93 0.00 0.00 57.85 52.00 1lwn n ARG 193 Cb 0.43 -1.87 0.97 0.00 -1.16 0.00 0.00 32.46 30.83 1lwn n ARG 193 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 1lwn h PRO 194 N 3.73 0.00 0.00 5.56 0.13 -1.94 -1.25 132.00 138.23 1lwn h PRO 194 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1lwn h PRO 194 Cb 0.74 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 1lwn h PRO 194 CO 0.68 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.60 1lwn n GLU 195 N -3.70 0.16 -0.64 0.86 0.00 -1.26 -2.79 120.64 113.28 1lwn n GLU 195 Ca -0.03 0.41 0.01 0.00 0.00 0.00 0.00 57.16 57.55 1lwn n GLU 195 Cb 0.09 -1.82 0.22 0.00 0.00 0.00 0.00 31.44 29.93 1lwn n GLU 195 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 1lwn n PHE 196 N -2.13 1.06 -2.04 -1.84 3.72 -0.47 -5.03 117.46 110.72 1lwn n PHE 196 Ca 0.02 -1.27 -0.40 0.00 -0.05 0.00 0.00 57.45 55.75 1lwn n PHE 196 Cb 0.21 -0.42 -0.01 0.00 -0.94 0.00 0.00 39.48 38.32 1lwn n PHE 196 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1lwn s THR 197 N -3.06 2.58 0.06 4.37 2.01 -1.12 -4.63 115.64 115.86 1lwn s THR 197 Ca 0.44 0.55 0.05 0.00 0.31 0.00 0.00 61.69 63.04 1lwn s THR 197 Cb 0.38 -3.34 -0.03 0.00 0.01 0.00 0.00 72.50 69.52 1lwn s THR 197 CO 0.04 0.11 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.18 1lwn s LEU 198 N -2.11 2.24 0.25 4.42 1.43 -0.49 -4.92 118.68 119.50 1lwn s LEU 198 Ca 0.53 -0.56 -0.22 0.00 -1.03 0.00 0.00 54.13 52.85 1lwn s LEU 198 Cb -0.40 -0.54 -0.09 0.00 0.03 0.00 0.00 46.19 45.19 1lwn s LEU 198 CO 0.53 -0.04 0.79 -2.16 0.23 0.00 0.00 176.35 175.70 1lwn s PRO 199 N -1.54 4.36 -0.04 1.29 0.04 -1.26 0.43 135.00 138.27 1lwn s PRO 199 Ca -0.01 1.02 0.04 0.00 0.04 0.00 0.00 61.00 62.09 1lwn s PRO 199 Cb -0.09 -2.86 -0.00 0.00 0.04 0.00 0.00 34.50 31.58 1lwn s PRO 199 CO 0.02 0.36 -0.16 0.08 0.04 0.00 0.00 177.00 177.35 1lwn s VAL 200 N -1.54 1.32 0.03 -0.36 1.01 0.72 -4.85 120.40 116.72 1lwn s VAL 200 Ca 0.45 -0.65 0.01 0.00 0.00 0.00 0.00 61.98 61.79 1lwn s VAL 200 Cb -0.17 -1.14 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 1lwn s VAL 200 CO 0.22 0.38 0.09 -1.00 0.00 0.00 0.00 175.10 174.80 1lwn s HIS 201 N 0.12 3.28 0.06 5.22 3.76 -1.26 -1.11 115.29 125.36 1lwn s HIS 201 Ca -0.05 0.17 0.01 0.00 -0.15 0.00 0.00 55.06 55.04 1lwn s HIS 201 Cb -0.11 -1.70 -0.03 0.00 1.11 0.00 0.00 32.58 31.84 1lwn s HIS 201 CO 0.02 0.55 -0.06 -0.06 -0.85 0.00 0.00 174.74 174.34 1lwn s PHE 202 N -1.29 0.63 0.00 1.40 0.08 -0.18 -4.96 117.98 113.67 1lwn s PHE 202 Ca 0.26 -0.76 0.00 0.00 0.12 0.00 0.00 56.93 56.55 1lwn s PHE 202 Cb -0.12 -0.40 0.00 0.00 -0.57 0.00 0.00 43.02 41.93 1lwn s PHE 202 CO 0.18 -0.19 0.00 0.66 -0.10 0.00 0.00 175.22 175.77 1lwn n TYR 203 N 0.71 0.00 -4.26 0.36 4.02 0.42 -0.41 117.16 118.00 1lwn n TYR 203 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.71 1lwn n TYR 203 Cb 0.58 0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.92 1lwn n TYR 203 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1lwn n GLY 204 N 0.00 -1.27 3.26 2.72 0.00 -1.20 -4.56 105.19 104.13 1lwn n GLY 204 Ca 0.00 -1.24 -0.10 0.00 0.00 0.00 0.00 46.02 44.68 1lwn n GLY 204 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1lwn s ARG 205 N 0.00 1.07 -0.16 1.61 1.70 0.11 -4.84 118.95 118.42 1lwn s ARG 205 Ca 0.00 -1.27 -0.05 0.00 -0.47 0.00 0.00 55.73 53.93 1lwn s ARG 205 Cb 0.00 0.32 -0.03 0.00 -0.57 0.00 0.00 34.95 34.67 1lwn s ARG 205 CO 0.00 -0.36 0.00 0.08 -1.08 0.00 0.00 175.30 173.94 1lwn s VAL 206 N -4.00 4.26 -0.03 4.99 1.01 -1.26 -1.01 120.40 124.37 1lwn s VAL 206 Ca 0.20 -0.23 0.05 0.00 0.00 0.00 0.00 61.98 62.01 1lwn s VAL 206 Cb 0.05 -2.89 -0.01 0.00 0.00 0.00 0.00 36.38 33.53 1lwn s VAL 206 CO 0.01 0.48 -0.18 -1.83 0.00 0.00 0.00 175.10 173.58 1lwn s GLU 207 N 0.33 1.64 -0.31 2.72 -1.05 -0.32 -4.95 118.70 116.75 1lwn s GLU 207 Ca -0.01 -0.66 -0.16 0.00 -0.15 0.00 0.00 54.97 54.00 1lwn s GLU 207 Cb -0.13 -1.52 -0.02 0.00 -0.44 0.00 0.00 34.13 32.01 1lwn s GLU 207 CO 0.02 0.35 0.39 -1.01 0.95 0.00 0.00 175.26 175.96 1lwn s HIS 208 N -0.27 3.22 0.57 4.83 3.76 -1.26 -0.92 115.29 125.21 1lwn s HIS 208 Ca 0.03 0.21 0.04 0.00 -0.15 0.00 0.00 55.06 55.19 1lwn s HIS 208 Cb -0.09 -2.67 0.06 0.00 1.11 0.00 0.00 32.58 30.99 1lwn s HIS 208 CO 0.00 -0.36 0.78 0.95 -0.85 0.00 0.00 174.74 175.27 1lwn s THR 209 N 2.11 2.51 0.44 1.30 -4.23 0.27 -4.98 115.64 113.06 1lwn s THR 209 Ca 0.14 -0.79 0.14 0.00 -1.18 0.00 0.00 61.69 60.00 1lwn s THR 209 Cb -0.16 -2.71 0.18 0.00 1.34 0.00 0.00 72.50 71.15 1lwn s THR 209 CO 0.11 0.00 1.99 0.77 -0.54 0.00 0.00 174.62 176.95 1lwn h SER 210 N 0.08 0.04 -0.57 3.99 4.64 -2.02 -2.83 113.55 116.88 1lwn h SER 210 Ca -0.38 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1lwn h SER 210 Cb 1.28 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1lwn h SER 210 CO 0.45 0.21 0.00 0.00 -0.87 0.00 0.00 176.83 176.62 1lwn n GLN 211 N -4.32 2.63 0.00 4.77 10.64 -1.26 -5.07 117.38 124.77 1lwn n GLN 211 Ca -0.02 -2.44 0.00 0.00 -1.83 0.00 0.00 57.00 52.71 1lwn n GLN 211 Cb 0.24 -1.51 0.00 0.00 -0.86 0.00 0.00 30.24 28.11 1lwn n GLN 211 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1lwn n GLY 212 N 1.44 1.33 3.81 2.61 0.00 -1.07 -5.11 105.19 108.20 1lwn n GLY 212 Ca 0.21 -1.67 -0.35 0.00 0.00 0.00 0.00 46.02 44.22 1lwn n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lwn s ALA 213 N -1.58 3.13 -0.04 4.61 0.00 -1.26 -0.57 121.76 126.06 1lwn s ALA 213 Ca 0.00 0.42 0.01 0.00 0.00 0.00 0.00 51.96 52.39 1lwn s ALA 213 Cb 0.00 -3.13 0.02 0.00 0.00 0.00 0.00 23.12 20.01 1lwn s ALA 213 CO 0.00 0.17 -0.04 0.21 0.00 0.00 0.00 175.76 176.10 1lwn s LYS 214 N -2.71 0.71 -0.41 0.00 2.20 -0.09 -4.91 119.74 114.52 1lwn s LYS 214 Ca 0.56 -0.08 -0.19 0.00 -0.36 0.00 0.00 55.97 55.91 1lwn s LYS 214 Cb -0.13 -0.74 0.02 0.00 -1.51 0.00 0.00 37.83 35.46 1lwn s LYS 214 CO 0.17 -0.08 0.55 -0.46 -0.36 0.00 0.00 175.35 175.18 1lwn s TRP 215 N 0.86 3.12 0.42 4.03 -0.00 -1.26 -1.18 118.94 124.93 1lwn s TRP 215 Ca -0.11 -0.09 0.04 0.00 -0.00 0.00 0.00 56.10 55.94 1lwn s TRP 215 Cb -0.14 -3.11 -0.04 0.00 -0.00 0.00 0.00 33.47 30.18 1lwn s TRP 215 CO -0.00 -0.74 0.05 0.14 -0.00 0.00 0.00 176.95 176.40 1lwn s VAL 216 N 2.52 1.19 -1.51 5.86 -7.23 -0.18 -4.81 120.40 116.24 1lwn s VAL 216 Ca 0.19 -2.00 -0.13 0.00 -1.81 0.00 0.00 61.98 58.23 1lwn s VAL 216 Cb -0.15 -2.53 0.09 0.00 0.56 0.00 0.00 36.38 34.34 1lwn s VAL 216 CO 0.16 0.00 0.86 0.47 -0.31 0.00 0.00 175.10 176.28 1lwn n ASP 217 N -1.08 -4.61 -4.91 4.85 8.00 -1.26 -0.72 116.55 116.82 1lwn n ASP 217 Ca -0.09 -0.70 -0.27 0.00 0.71 0.00 0.00 54.79 54.44 1lwn n ASP 217 Cb 0.66 -3.71 -0.02 0.00 -0.02 0.00 0.00 41.12 38.03 1lwn n ASP 217 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1lwn s THR 218 N -3.22 5.02 -0.02 -3.53 -4.23 -1.26 -3.26 115.64 105.14 1lwn s THR 218 Ca 0.61 -0.05 -0.15 0.00 -1.18 0.00 0.00 61.69 60.92 1lwn s THR 218 Cb -0.31 -3.79 -0.05 0.00 1.34 0.00 0.00 72.50 69.69 1lwn s THR 218 CO 0.75 -0.48 0.41 -1.10 -0.54 0.00 0.00 174.62 173.66 1lwn s GLN 219 N -3.97 3.99 -0.10 3.99 -0.21 0.45 -4.88 119.66 118.92 1lwn s GLN 219 Ca 0.44 0.40 -0.02 0.00 0.02 0.00 0.00 55.36 56.19 1lwn s GLN 219 Cb -0.10 -3.26 -0.03 0.00 1.00 0.00 0.00 33.01 30.62 1lwn s GLN 219 CO 0.34 0.60 -0.03 0.08 -2.12 0.00 0.00 175.29 174.17 1lwn s VAL 220 N -0.78 4.04 -0.04 1.09 1.01 -1.26 -1.01 120.40 123.46 1lwn s VAL 220 Ca 0.24 -0.33 0.03 0.00 0.00 0.00 0.00 61.98 61.92 1lwn s VAL 220 Cb -0.16 -2.71 0.00 0.00 0.00 0.00 0.00 36.38 33.51 1lwn s VAL 220 CO 0.12 0.57 -0.14 -0.69 0.00 0.00 0.00 175.10 174.96 1lwn s VAL 221 N -0.47 1.16 0.16 2.92 1.01 -0.26 -4.58 120.40 120.34 1lwn s VAL 221 Ca 0.08 -0.56 -0.15 0.00 0.00 0.00 0.00 61.98 61.34 1lwn s VAL 221 Cb -0.12 -1.01 -0.07 0.00 0.00 0.00 0.00 36.38 35.18 1lwn s VAL 221 CO 0.02 0.34 0.57 -0.76 0.00 0.00 0.00 175.10 175.28 1lwn s LEU 222 N 0.13 4.34 -0.30 3.92 1.43 0.11 -0.20 118.68 128.11 1lwn s LEU 222 Ca -0.04 1.13 -0.02 0.00 -1.03 0.00 0.00 54.13 54.17 1lwn s LEU 222 Cb -0.11 -3.31 0.05 0.00 0.03 0.00 0.00 46.19 42.85 1lwn s LEU 222 CO 0.02 0.09 -0.00 0.00 0.23 0.00 0.00 176.35 176.69 1lwn s ALA 223 N -1.47 2.81 -0.24 4.21 0.00 0.17 -0.34 121.76 126.90 1lwn s ALA 223 Ca 0.39 -1.78 -0.10 0.00 0.00 0.00 0.00 51.96 50.47 1lwn s ALA 223 Cb -0.15 -1.93 -0.05 0.00 0.00 0.00 0.00 23.12 20.99 1lwn s ALA 223 CO 0.19 -1.28 0.14 1.41 0.00 0.00 0.00 175.76 176.22 1lwn s MET 224 N 1.24 3.99 0.26 0.00 1.75 0.11 -1.40 119.30 125.25 1lwn s MET 224 Ca -0.05 -0.31 -0.18 0.00 -1.25 0.00 0.00 55.69 53.90 1lwn s MET 224 Cb -0.20 -3.47 -0.08 0.00 2.84 0.00 0.00 34.83 33.92 1lwn s MET 224 CO -0.01 0.04 0.72 -1.25 -0.65 0.00 0.00 175.02 173.87 1lwn s PRO 225 N 1.09 4.14 -0.11 4.11 0.04 -1.26 0.14 135.00 143.14 1lwn s PRO 225 Ca 0.07 0.77 0.01 0.00 0.04 0.00 0.00 61.00 61.89 1lwn s PRO 225 Cb -0.14 -2.70 0.02 0.00 0.04 0.00 0.00 34.50 31.72 1lwn s PRO 225 CO 0.04 0.30 -0.14 0.71 0.04 0.00 0.00 177.00 177.96 1lwn s TYR 226 N -1.71 1.90 -0.15 0.56 2.02 0.07 -0.91 117.35 119.12 1lwn s TYR 226 Ca 0.47 -0.92 -0.08 0.00 -0.37 0.00 0.00 57.07 56.17 1lwn s TYR 226 Cb -0.14 -1.40 -0.04 0.00 -0.40 0.00 0.00 41.96 39.98 1lwn s TYR 226 CO 0.19 -0.50 0.14 -0.51 -1.57 0.00 0.00 175.55 173.30 1lwn s ASP 227 N 1.14 6.32 -0.07 2.29 1.01 -0.14 -1.15 116.67 126.07 1lwn s ASP 227 Ca -0.04 0.38 0.03 0.00 0.71 0.00 0.00 52.55 53.63 1lwn s ASP 227 Cb -0.14 -2.08 0.01 0.00 1.01 0.00 0.00 42.92 41.72 1lwn s ASP 227 CO -0.04 0.32 -0.15 -0.89 0.21 0.00 0.00 175.17 174.62 1lwn s THR 228 N -0.49 1.35 0.39 -1.27 2.01 -0.01 -0.01 115.64 117.62 1lwn s THR 228 Ca 0.12 -0.61 -0.23 0.00 0.31 0.00 0.00 61.69 61.28 1lwn s THR 228 Cb -0.12 -1.21 -0.10 0.00 0.01 0.00 0.00 72.50 71.08 1lwn s THR 228 CO 0.02 0.40 0.97 -2.16 -0.69 0.00 0.00 174.62 173.16 1lwn s PRO 229 N 0.57 4.31 -0.21 4.92 0.04 -1.26 -0.71 135.00 142.65 1lwn s PRO 229 Ca -0.15 1.26 -0.02 0.00 0.04 0.00 0.00 61.00 62.13 1lwn s PRO 229 Cb -0.16 -2.43 0.06 0.00 0.04 0.00 0.00 34.50 32.01 1lwn s PRO 229 CO 0.05 0.03 0.02 0.14 0.04 0.00 0.00 177.00 177.28 1lwn s VAL 230 N -1.91 0.80 0.25 -0.36 -7.23 -0.00 -4.88 120.40 107.08 1lwn s VAL 230 Ca 0.58 -0.80 -0.30 0.00 -1.81 0.00 0.00 61.98 59.65 1lwn s VAL 230 Cb -0.15 -1.28 -0.09 0.00 0.56 0.00 0.00 36.38 35.42 1lwn s VAL 230 CO 0.19 -0.23 0.96 -2.16 -0.31 0.00 0.00 175.10 173.55 1lwn s PRO 231 N 1.72 4.81 0.58 4.82 0.04 -1.26 -0.41 135.00 145.30 1lwn s PRO 231 Ca -0.01 1.52 -0.03 0.00 0.04 0.00 0.00 61.00 62.51 1lwn s PRO 231 Cb -0.18 -3.23 0.02 0.00 0.04 0.00 0.00 34.50 31.15 1lwn s PRO 231 CO -0.09 0.46 0.86 0.20 0.04 0.00 0.00 177.00 178.47 1lwn s GLY 232 N -1.18 1.66 -0.51 0.56 0.00 -0.16 -4.76 107.32 102.94 1lwn s GLY 232 Ca 0.42 -0.94 -0.28 0.00 0.00 0.00 0.00 44.72 43.92 1lwn s GLY 232 CO 0.32 -0.65 1.51 -0.47 0.00 0.00 0.00 173.10 173.82 1lwn s TYR 233 N -2.92 2.17 -0.88 1.90 5.04 -1.26 -4.17 117.35 117.23 1lwn s TYR 233 Ca 0.55 0.57 -0.07 0.00 -2.44 0.00 0.00 57.07 55.68 1lwn s TYR 233 Cb -0.10 -4.31 0.06 0.00 0.35 0.00 0.00 41.96 37.96 1lwn s TYR 233 CO 0.42 -2.13 0.25 0.54 -1.34 0.00 0.00 175.55 173.29 1lwn n ARG 234 N 8.58 -2.62 -0.02 4.97 5.12 0.23 -4.80 116.66 128.12 1lwn n ARG 234 Ca 0.15 0.27 0.02 0.00 -1.93 0.00 0.00 57.85 56.37 1lwn n ARG 234 Cb 0.49 -4.87 0.03 0.00 -1.16 0.00 0.00 32.46 26.95 1lwn n ARG 234 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 1lwn n ASN 235 N -1.95 1.67 -0.83 0.55 6.94 -1.26 -4.94 115.26 115.44 1lwn n ASN 235 Ca -0.01 -1.44 -0.11 0.00 -0.02 0.00 0.00 54.58 53.01 1lwn n ASN 235 Cb 0.52 -0.03 -0.05 0.00 -2.36 0.00 0.00 39.78 37.87 1lwn n ASN 235 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1lwn n ASN 236 N 0.12 -4.82 -4.65 0.53 3.02 -1.26 -0.05 115.26 108.15 1lwn n ASN 236 Ca 0.03 0.27 -0.38 0.00 -0.03 0.00 0.00 54.58 54.47 1lwn n ASN 236 Cb 0.17 -3.27 -0.09 0.00 -0.61 0.00 0.00 39.78 35.98 1lwn n ASN 236 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1lwn s VAL 237 N -2.23 5.25 -0.22 2.41 1.01 -1.26 -4.76 120.40 120.60 1lwn s VAL 237 Ca 0.00 0.50 0.01 0.00 0.00 0.00 0.00 61.98 62.50 1lwn s VAL 237 Cb 0.00 -3.65 0.05 0.00 0.00 0.00 0.00 36.38 32.78 1lwn s VAL 237 CO 0.00 0.26 -0.09 -0.69 0.00 0.00 0.00 175.10 174.58 1lwn s VAL 238 N 1.40 1.75 0.68 2.92 1.01 -1.26 -0.99 120.40 125.92 1lwn s VAL 238 Ca 0.14 -1.23 -0.02 0.00 0.00 0.00 0.00 61.98 60.87 1lwn s VAL 238 Cb -0.15 -1.89 0.14 0.00 0.00 0.00 0.00 36.38 34.49 1lwn s VAL 238 CO 0.07 0.05 0.93 0.59 0.00 0.00 0.00 175.10 176.75 1lwn n ASN 239 N 4.61 1.07 -4.26 3.32 3.02 0.45 -4.72 115.26 118.76 1lwn n ASN 239 Ca -0.14 -1.95 -0.29 0.00 -0.03 0.00 0.00 54.58 52.17 1lwn n ASN 239 Cb 0.45 -0.62 -0.16 0.00 -0.61 0.00 0.00 39.78 38.84 1lwn n ASN 239 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1lwn s THR 240 N -2.85 1.83 -0.24 3.41 2.01 -1.25 -0.82 115.64 117.73 1lwn s THR 240 Ca 0.60 -0.99 -0.01 0.00 0.31 0.00 0.00 61.69 61.61 1lwn s THR 240 Cb -0.03 -1.53 0.03 0.00 0.01 0.00 0.00 72.50 70.98 1lwn s THR 240 CO 0.40 0.52 -0.08 -0.32 -0.69 0.00 0.00 174.62 174.45 1lwn s MET 241 N -0.51 2.84 -0.32 4.92 1.75 0.11 -1.99 119.30 126.11 1lwn s MET 241 Ca 0.08 -0.96 -0.08 0.00 -1.25 0.00 0.00 55.69 53.47 1lwn s MET 241 Cb -0.09 -2.92 0.01 0.00 2.84 0.00 0.00 34.83 34.67 1lwn s MET 241 CO -0.01 -0.38 0.12 0.50 -0.65 0.00 0.00 175.02 174.61 1lwn s ARG 242 N 1.31 3.00 -0.15 4.11 3.52 0.72 -0.83 118.95 130.63 1lwn s ARG 242 Ca 0.00 -0.93 -0.04 0.00 -0.13 0.00 0.00 55.73 54.64 1lwn s ARG 242 Cb -0.16 -3.48 -0.03 0.00 -1.56 0.00 0.00 34.95 29.72 1lwn s ARG 242 CO -0.06 -0.52 -0.04 -0.51 -0.81 0.00 0.00 175.30 173.37 1lwn s LEU 243 N 1.51 3.25 0.11 -0.88 1.43 -0.30 -2.08 118.68 121.73 1lwn s LEU 243 Ca 0.02 -0.13 -0.19 0.00 -1.03 0.00 0.00 54.13 52.81 1lwn s LEU 243 Cb -0.18 -1.78 -0.07 0.00 0.03 0.00 0.00 46.19 44.19 1lwn s LEU 243 CO 0.04 0.17 0.60 0.26 0.23 0.00 0.00 176.35 177.65 1lwn s TRP 244 N 0.34 3.75 -0.03 0.29 0.52 -0.38 -0.75 118.94 122.67 1lwn s TRP 244 Ca -0.04 1.26 0.06 0.00 0.02 0.00 0.00 56.10 57.41 1lwn s TRP 244 Cb -0.14 -2.50 -0.01 0.00 -1.15 0.00 0.00 33.47 29.66 1lwn s TRP 244 CO 0.03 0.52 -0.23 0.45 0.02 0.00 0.00 176.95 177.74 1lwn s SER 245 N -1.32 2.73 0.04 2.95 0.15 0.12 -1.05 113.70 117.33 1lwn s SER 245 Ca 0.33 -0.44 -0.28 0.00 0.70 0.00 0.00 55.95 56.27 1lwn s SER 245 Cb -0.18 -0.53 -0.05 0.00 -1.71 0.00 0.00 66.02 63.55 1lwn s SER 245 CO 0.20 0.25 0.88 0.00 1.20 0.00 0.00 173.24 175.77 1lwn s ALA 246 N -0.32 3.27 0.01 5.45 0.00 -1.26 0.06 121.76 128.97 1lwn s ALA 246 Ca 0.03 0.43 0.02 0.00 0.00 0.00 0.00 51.96 52.44 1lwn s ALA 246 Cb -0.11 -3.18 -0.01 0.00 0.00 0.00 0.00 23.12 19.82 1lwn s ALA 246 CO 0.01 -0.06 -0.07 0.15 0.00 0.00 0.00 175.76 175.79 1lwn s LYS 247 N 0.32 0.51 0.18 0.00 -0.14 0.54 -4.57 119.74 116.59 1lwn s LYS 247 Ca 0.45 -0.40 -0.18 0.00 -1.36 0.00 0.00 55.97 54.48 1lwn s LYS 247 Cb -0.21 -0.43 -0.08 0.00 -1.68 0.00 0.00 37.83 35.43 1lwn s LYS 247 CO 0.26 0.11 0.65 0.00 -0.76 0.00 0.00 175.35 175.61 1lwn s ALA 248 N -0.55 3.49 0.77 5.17 0.00 -1.26 0.06 121.76 129.44 1lwn s ALA 248 Ca -0.01 0.05 -0.11 0.00 0.00 0.00 0.00 51.96 51.88 1lwn s ALA 248 Cb -0.05 -2.70 0.05 0.00 0.00 0.00 0.00 23.12 20.43 1lwn s ALA 248 CO 0.00 0.38 1.08 -2.14 0.00 0.00 0.00 175.76 175.08 1lwn s PRO 249 N -1.89 2.33 0.00 0.00 0.02 -1.26 -4.87 135.00 129.33 1lwn s PRO 249 Ca 0.40 1.05 0.22 0.00 0.02 0.00 0.00 61.00 62.69 1lwn s PRO 249 Cb -0.16 -1.91 1.10 0.00 0.02 0.00 0.00 34.50 33.54 1lwn s PRO 249 CO 0.20 -1.56 1.73 0.09 -0.33 0.00 0.00 177.00 177.14 1lwn n ASN 250 N -3.45 0.66 -4.02 2.53 5.03 -1.26 -5.11 115.26 109.64 1lwn n ASN 250 Ca 0.08 -1.46 -0.31 0.00 0.87 0.00 0.00 54.58 53.76 1lwn n ASN 250 Cb 0.53 -0.03 -0.15 0.00 -1.02 0.00 0.00 39.78 39.11 1lwn n ASN 250 CO 0.00 0.00 0.00 1.51 -1.83 0.00 0.00 177.26 176.94 1lwn s ASP 251 N -1.67 4.52 0.09 6.41 -4.77 -1.26 -5.20 116.67 114.79 1lwn s ASP 251 Ca 0.33 -1.72 -0.02 0.00 -3.30 0.00 0.00 52.55 47.84 1lwn s ASP 251 Cb 0.16 -1.52 -0.01 0.00 -1.09 0.00 0.00 42.92 40.45 1lwn s ASP 251 CO 0.26 -0.29 -0.07 0.61 0.70 0.00 0.00 175.17 176.38 1lwn n GLY 261 N 4.39 -0.42 0.21 2.12 0.00 -1.26 -5.17 105.19 105.06 1lwn n GLY 261 Ca -0.05 -0.07 -0.07 0.00 0.00 0.00 0.00 46.02 45.82 1lwn n GLY 261 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1lwn h TYR 262 N -0.09 0.64 0.08 1.61 5.03 -2.06 -2.50 116.97 119.69 1lwn h TYR 262 Ca -0.04 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.27 1lwn h TYR 262 Cb 0.12 -0.21 -0.01 0.00 1.55 0.00 0.00 36.73 38.18 1lwn h TYR 262 CO 0.02 0.44 -0.07 0.82 -1.32 0.00 0.00 178.16 178.05 1lwn h ILE 263 N 0.65 0.85 -0.74 1.81 1.08 -2.06 -2.54 117.51 116.56 1lwn h ILE 263 Ca 0.17 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.71 1lwn h ILE 263 Cb -0.01 0.85 -0.06 0.00 -3.07 0.00 0.00 36.82 34.53 1lwn h ILE 263 CO -0.03 0.00 0.42 -0.61 -0.69 0.00 0.00 178.15 177.24 1lwn h GLN 264 N -0.16 0.73 -0.80 2.37 5.75 -1.98 -0.92 115.11 120.11 1lwn h GLN 264 Ca -0.00 -0.04 0.08 0.00 -0.15 0.00 0.00 58.65 58.53 1lwn h GLN 264 Cb 0.14 -0.16 -0.05 0.00 1.07 0.00 0.00 27.48 28.48 1lwn h GLN 264 CO -0.01 0.48 0.52 0.00 -2.65 0.00 0.00 178.83 177.18 1lwn h ALA 265 N 1.39 1.67 -0.06 3.38 0.00 -1.18 0.10 119.26 124.56 1lwn h ALA 265 Ca 0.34 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 55.10 1lwn h ALA 265 Cb 0.24 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.83 1lwn h ALA 265 CO -0.20 0.19 -0.49 0.28 0.00 0.00 0.00 179.25 179.03 1lwn h VAL 266 N 0.82 1.40 -0.44 0.00 2.07 -0.87 -3.24 116.25 115.98 1lwn h VAL 266 Ca 0.35 -1.88 -0.02 0.00 0.82 0.00 0.00 66.70 65.97 1lwn h VAL 266 Cb 0.31 2.35 -0.02 0.00 -1.52 0.00 0.00 31.29 32.41 1lwn h VAL 266 CO -0.13 0.55 0.18 -0.07 0.02 0.00 0.00 177.57 178.13 1lwn h LEU 267 N -0.02 0.56 0.00 2.57 3.38 -0.44 -2.42 115.31 118.95 1lwn h LEU 267 Ca -0.04 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1lwn h LEU 267 Cb 1.16 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.76 1lwn h LEU 267 CO 0.10 0.51 0.00 0.47 0.09 0.00 0.00 178.44 179.61 1lwn n ASP 268 N -4.37 0.00 0.22 -0.43 10.43 0.29 -2.91 116.55 119.78 1lwn n ASP 268 Ca 0.03 -0.26 0.06 0.00 2.57 0.00 0.00 54.79 57.20 1lwn n ASP 268 Cb 0.14 -0.10 0.52 0.00 1.84 0.00 0.00 41.12 43.52 1lwn n ASP 268 CO 0.00 0.00 0.00 0.03 -1.07 0.00 0.00 177.20 176.16 1lwn h ARG 269 N 0.00 0.00 -0.58 -1.24 3.08 -1.54 -2.51 114.38 111.59 1lwn h ARG 269 Ca 0.00 0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.12 1lwn h ARG 269 Cb 0.05 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.06 1lwn h ARG 269 CO 0.00 0.21 0.39 -0.91 -1.07 0.00 0.00 179.97 178.58 1lwn h ASN 270 N 0.00 0.44 -0.88 7.04 2.35 -1.77 -2.31 115.58 120.45 1lwn h ASN 270 Ca -0.00 0.00 0.16 0.00 -0.55 0.00 0.00 56.30 55.91 1lwn h ASN 270 Cb 0.39 -0.09 -0.10 0.00 0.05 0.00 0.00 38.32 38.57 1lwn h ASN 270 CO 0.03 0.28 0.46 -0.07 -1.65 0.00 0.00 177.43 176.48 1lwn h LEU 271 N 0.50 0.55 -0.50 1.61 3.38 -1.71 -0.72 115.31 118.43 1lwn h LEU 271 Ca 0.26 0.10 -0.17 0.00 0.09 0.00 0.00 57.88 58.16 1lwn h LEU 271 Cb 0.37 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1lwn h LEU 271 CO -0.07 0.21 -0.73 0.00 0.09 0.00 0.00 178.44 177.94 1lwn h ALA 272 N 1.58 0.72 0.00 1.53 0.00 -1.60 -3.13 119.26 118.35 1lwn h ALA 272 Ca 0.49 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1lwn h ALA 272 Cb 0.72 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1lwn h ALA 272 CO -0.38 0.83 0.00 0.39 0.00 0.00 0.00 179.25 180.09 1lwn n GLU 273 N -3.76 0.39 0.23 0.00 1.02 -0.37 -3.34 120.64 114.81 1lwn n GLU 273 Ca -0.03 0.01 0.16 0.00 -0.02 0.00 0.00 57.16 57.28 1lwn n GLU 273 Cb 0.70 -1.50 0.60 0.00 -0.02 0.00 0.00 31.44 31.23 1lwn n GLU 273 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 1lwn h ASN 274 N 0.00 0.00 -0.91 1.62 2.35 -1.25 -3.24 115.58 114.15 1lwn h ASN 274 Ca 0.00 0.00 0.13 0.00 -0.55 0.00 0.00 56.30 55.88 1lwn h ASN 274 Cb 0.28 0.00 -0.09 0.00 0.05 0.00 0.00 38.32 38.57 1lwn h ASN 274 CO 0.00 0.00 0.53 0.40 -1.65 0.00 0.00 177.43 176.71 1lwn h ILE 275 N 0.00 0.84 -0.51 2.81 2.04 -1.77 -2.00 117.51 118.92 1lwn h ILE 275 Ca 0.00 -0.28 -0.17 0.00 1.00 0.00 0.00 64.86 65.41 1lwn h ILE 275 Cb 0.51 -0.04 -0.10 0.00 -0.74 0.00 0.00 36.82 36.45 1lwn h ILE 275 CO 0.00 0.15 0.13 -1.54 0.00 0.00 0.00 178.15 176.88 1lwn n SER 276 N -4.74 3.80 -0.00 1.72 3.41 -1.22 -4.68 113.62 111.91 1lwn n SER 276 Ca 0.17 -3.36 -0.18 0.00 -0.26 0.00 0.00 58.87 55.25 1lwn n SER 276 Cb 0.37 -0.66 -0.09 0.00 -0.26 0.00 0.00 64.21 63.57 1lwn n SER 276 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1lwn h ARG 277 N 1.80 0.62 -3.26 4.33 2.43 -1.48 -2.28 114.38 116.54 1lwn h ARG 277 Ca 0.21 -0.58 -0.15 0.00 -0.81 0.00 0.00 59.98 58.65 1lwn h ARG 277 Cb 1.93 0.14 -0.23 0.00 -0.42 0.00 0.00 29.97 31.40 1lwn h ARG 277 CO 0.52 1.20 -0.42 0.54 -1.51 0.00 0.00 179.97 180.30 1lwn s VAL 278 N -3.49 0.04 0.05 0.20 0.11 -1.26 -1.35 120.40 114.70 1lwn s VAL 278 Ca -0.11 -0.36 -0.29 0.00 -2.93 0.00 0.00 61.98 58.28 1lwn s VAL 278 Cb 0.06 -0.43 -0.04 0.00 -1.53 0.00 0.00 36.38 34.43 1lwn s VAL 278 CO 0.87 -0.20 0.94 -0.22 -3.33 0.00 0.00 175.10 173.17 1lwn s LEU 279 N -0.75 4.43 0.03 2.54 2.96 -0.93 -4.99 118.68 121.97 1lwn s LEU 279 Ca -0.08 1.68 -0.30 0.00 -0.22 0.00 0.00 54.13 55.20 1lwn s LEU 279 Cb -0.05 -3.53 -0.07 0.00 0.50 0.00 0.00 46.19 43.05 1lwn s LEU 279 CO 0.02 -0.15 1.49 -0.31 -1.32 0.00 0.00 176.35 176.08 1lwn s TYR 280 N 0.50 2.73 -0.30 5.38 1.51 -1.26 -4.85 117.35 121.06 1lwn s TYR 280 Ca 0.48 0.65 0.00 0.00 -1.01 0.00 0.00 57.07 57.19 1lwn s TYR 280 Cb -0.22 -3.77 0.03 0.00 -0.11 0.00 0.00 41.96 37.88 1lwn s TYR 280 CO 0.28 -2.96 0.89 -0.35 -1.11 0.00 0.00 175.55 172.30 1lwn n PRO 281 N 5.33 1.07 -3.43 -1.71 -0.04 -1.26 -4.89 135.00 130.07 1lwn n PRO 281 Ca 0.14 -0.11 -0.37 0.00 -0.04 0.00 0.00 63.50 63.12 1lwn n PRO 281 Cb 0.42 -1.19 -0.06 0.00 -0.04 0.00 0.00 33.50 32.63 1lwn n PRO 281 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1lwn s ASN 282 N 0.64 6.60 -0.22 3.54 0.02 -1.26 -4.45 114.94 119.81 1lwn s ASN 282 Ca 0.02 0.71 -0.02 0.00 -1.02 0.00 0.00 52.86 52.55 1lwn s ASN 282 Cb 0.02 -2.24 0.01 0.00 0.02 0.00 0.00 41.25 39.06 1lwn s ASN 282 CO 0.00 0.09 -0.10 -0.62 0.02 0.00 0.00 177.10 176.50 1lwn s ASP 283 N 0.31 3.95 -1.27 -1.22 -1.08 -1.26 -4.68 116.67 111.41 1lwn s ASP 283 Ca 0.22 -0.62 -0.01 0.00 -0.52 0.00 0.00 52.55 51.62 1lwn s ASP 283 Cb -0.14 -1.64 0.00 0.00 -1.46 0.00 0.00 42.92 39.68 1lwn s ASP 283 CO 0.08 -0.05 0.85 0.59 0.52 0.00 0.00 175.17 177.16 1lwn n ASN 284 N 4.70 -1.82 -3.64 -0.34 3.02 -1.26 -5.00 115.26 110.92 1lwn n ASN 284 Ca -0.18 -0.73 -0.08 0.00 -0.03 0.00 0.00 54.58 53.56 1lwn n ASN 284 Cb 0.49 -4.52 -0.07 0.00 -0.61 0.00 0.00 39.78 35.07 1lwn n ASN 284 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1lwn s PHE 285 N -3.52 -1.01 -0.24 3.10 2.19 -1.26 -4.40 117.98 112.84 1lwn s PHE 285 Ca 0.05 2.07 -0.13 0.00 0.33 0.00 0.00 56.93 59.25 1lwn s PHE 285 Cb -0.02 0.58 -0.05 0.00 -1.31 0.00 0.00 43.02 42.23 1lwn s PHE 285 CO 0.78 -0.50 0.26 0.12 1.83 0.00 0.00 175.22 177.71 1lwn s PHE 286 N 1.48 3.31 -0.29 10.12 5.36 0.12 -4.88 117.98 133.20 1lwn s PHE 286 Ca -0.09 0.35 0.00 0.00 -0.96 0.00 0.00 56.93 56.24 1lwn s PHE 286 Cb -0.05 -2.39 0.06 0.00 -0.34 0.00 0.00 43.02 40.29 1lwn s PHE 286 CO -0.17 -0.02 -0.04 -2.00 -1.46 0.00 0.00 175.22 171.53 1lwn s GLU 287 N 1.33 2.33 -1.47 10.12 2.12 -1.26 -4.98 118.70 126.90 1lwn s GLU 287 Ca 0.12 -1.32 -0.13 0.00 0.36 0.00 0.00 54.97 54.00 1lwn s GLU 287 Cb -0.14 -3.07 -0.01 0.00 0.26 0.00 0.00 34.13 31.16 1lwn s GLU 287 CO 0.07 -0.61 2.44 0.41 -0.54 0.00 0.00 175.26 177.02 1lwn n GLY 288 N 4.54 4.26 3.89 -1.50 0.00 -1.26 -4.94 105.19 110.19 1lwn n GLY 288 Ca -0.13 -1.53 -0.35 0.00 0.00 0.00 0.00 46.02 44.01 1lwn n GLY 288 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lwn s LYS 289 N 2.97 3.47 0.19 1.61 -0.14 -1.26 -5.02 119.74 121.57 1lwn s LYS 289 Ca 0.54 -0.20 -0.12 0.00 -1.36 0.00 0.00 55.97 54.83 1lwn s LYS 289 Cb 0.15 -3.13 0.18 0.00 -1.68 0.00 0.00 37.83 33.35 1lwn s LYS 289 CO -0.07 0.71 1.75 1.49 -0.76 0.00 0.00 175.35 178.47 1lwn h GLU 290 N 4.24 0.37 -1.00 1.68 4.81 -2.00 -2.04 114.58 120.64 1lwn h GLU 290 Ca -0.51 -0.02 0.10 0.00 -0.13 0.00 0.00 59.36 58.79 1lwn h GLU 290 Cb 1.20 -0.08 -0.08 0.00 0.63 0.00 0.00 28.75 30.43 1lwn h GLU 290 CO 0.65 0.24 0.64 1.25 -0.73 0.00 0.00 179.01 181.06 1lwn h LEU 291 N 0.38 0.97 -0.57 1.64 5.85 -1.99 -0.36 115.31 121.23 1lwn h LEU 291 Ca 0.24 0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.95 1lwn h LEU 291 Cb 0.25 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 1lwn h LEU 291 CO -0.24 0.56 0.17 -0.09 -0.34 0.00 0.00 178.44 178.51 1lwn h ARG 292 N 1.06 0.89 -0.69 1.25 9.65 -1.75 -1.20 114.38 123.59 1lwn h ARG 292 Ca 0.46 -0.19 -0.05 0.00 -1.10 0.00 0.00 59.98 59.10 1lwn h ARG 292 Cb 0.35 -0.13 -0.03 0.00 -1.39 0.00 0.00 29.97 28.77 1lwn h ARG 292 CO -0.22 0.80 0.24 1.25 2.80 0.00 0.00 179.97 184.84 1lwn h LEU 293 N 0.80 0.97 -0.69 3.80 5.85 -0.85 -1.14 115.31 124.04 1lwn h LEU 293 Ca 0.18 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 1lwn h LEU 293 Cb 0.29 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 1lwn h LEU 293 CO -0.01 0.89 0.38 0.11 -0.34 0.00 0.00 178.44 179.47 1lwn h LYS 294 N 1.01 0.96 -0.55 1.25 1.57 -0.65 -1.29 116.57 118.88 1lwn h LYS 294 Ca 0.23 -0.11 0.01 0.00 -1.87 0.00 0.00 60.65 58.91 1lwn h LYS 294 Cb 0.25 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.34 1lwn h LYS 294 CO -0.01 0.72 0.35 1.96 -0.57 0.00 0.00 179.45 181.90 1lwn h GLN 295 N 0.95 0.69 -0.39 3.15 4.20 -0.62 0.96 115.11 124.05 1lwn h GLN 295 Ca 0.24 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.89 1lwn h GLN 295 Cb 0.04 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.65 1lwn h GLN 295 CO -0.04 0.46 0.15 0.93 -0.67 0.00 0.00 178.83 179.66 1lwn h GLU 296 N 0.71 0.59 -0.23 1.46 5.08 -0.68 -2.25 114.58 119.26 1lwn h GLU 296 Ca 0.21 -0.11 -0.16 0.00 -1.00 0.00 0.00 59.36 58.30 1lwn h GLU 296 Cb -0.04 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 1lwn h GLU 296 CO -0.07 0.57 -0.49 -0.92 -1.00 0.00 0.00 179.01 177.10 1lwn h TYR 297 N 0.49 0.78 0.12 4.33 5.03 -1.03 -2.90 116.97 123.79 1lwn h TYR 297 Ca 0.13 -0.26 0.02 0.00 2.58 0.00 0.00 58.73 61.20 1lwn h TYR 297 Cb 0.20 -0.15 -0.04 0.00 1.55 0.00 0.00 36.73 38.29 1lwn h TYR 297 CO 0.00 1.00 -0.39 0.35 -1.32 0.00 0.00 178.16 177.80 1lwn h PHE 298 N 0.50 -1.09 -0.97 -3.82 3.57 -0.62 0.37 116.94 114.88 1lwn h PHE 298 Ca 0.02 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.55 1lwn h PHE 298 Cb 1.04 0.46 -0.05 0.00 2.79 0.00 0.00 35.95 40.19 1lwn h PHE 298 CO 0.05 -0.49 0.61 -0.24 -2.23 0.00 0.00 178.31 176.00 1lwn h VAL 299 N -0.62 1.26 0.03 1.41 3.04 -1.45 -2.62 116.25 117.29 1lwn h VAL 299 Ca 0.03 -0.52 -0.00 0.00 -1.01 0.00 0.00 66.70 65.19 1lwn h VAL 299 Cb 0.65 -0.13 0.00 0.00 -2.01 0.00 0.00 31.29 29.80 1lwn h VAL 299 CO -0.23 0.26 -0.01 0.58 -1.01 0.00 0.00 177.57 177.16 1lwn h VAL 300 N 1.32 1.22 -0.38 1.51 2.07 -1.21 -1.83 116.25 118.95 1lwn h VAL 300 Ca 0.35 -0.79 -0.00 0.00 0.82 0.00 0.00 66.70 67.08 1lwn h VAL 300 Cb -0.10 1.75 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 1lwn h VAL 300 CO -0.07 0.20 0.23 0.00 0.02 0.00 0.00 177.57 177.95 1lwn h ALA 301 N 0.58 0.49 -0.29 1.67 0.00 -0.23 -1.42 119.26 120.05 1lwn h ALA 301 Ca -0.00 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1lwn h ALA 301 Cb 0.36 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1lwn h ALA 301 CO 0.01 -0.02 -0.08 0.00 0.00 0.00 0.00 179.25 179.16 1lwn h ALA 302 N 1.10 0.40 -0.06 0.00 0.00 -1.55 -2.89 119.26 116.27 1lwn h ALA 302 Ca 0.14 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.77 1lwn h ALA 302 Cb 0.00 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1lwn h ALA 302 CO -0.03 0.23 0.00 1.15 0.00 0.00 0.00 179.25 180.61 1lwn h THR 303 N 0.33 0.96 -0.42 0.00 2.02 -1.21 -2.26 112.91 112.33 1lwn h THR 303 Ca 0.07 -0.01 -0.01 0.00 0.77 0.00 0.00 66.41 67.23 1lwn h THR 303 Cb 0.57 0.94 -0.02 0.00 -1.74 0.00 0.00 68.15 67.89 1lwn h THR 303 CO 0.03 0.00 0.22 -0.07 0.37 0.00 0.00 175.52 176.07 1lwn h LEU 304 N 0.02 0.51 -0.63 2.58 3.38 -1.29 0.08 115.31 119.97 1lwn h LEU 304 Ca 0.03 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1lwn h LEU 304 Cb 0.03 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 1lwn h LEU 304 CO -0.05 0.42 0.13 1.56 0.09 0.00 0.00 178.44 180.60 1lwn h GLN 305 N 0.58 1.03 -0.57 1.13 4.20 -1.28 -0.70 115.11 119.50 1lwn h GLN 305 Ca 0.15 -0.26 -0.04 0.00 0.06 0.00 0.00 58.65 58.56 1lwn h GLN 305 Cb 0.04 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 1lwn h GLN 305 CO -0.02 0.94 0.22 0.22 -0.67 0.00 0.00 178.83 179.52 1lwn h ASP 306 N 0.94 0.80 -0.30 1.46 -0.00 -0.71 -1.68 116.42 116.93 1lwn h ASP 306 Ca 0.19 -0.18 -0.02 0.00 -0.00 0.00 0.00 57.03 57.03 1lwn h ASP 306 Cb 0.39 -0.21 -0.01 0.00 -0.00 0.00 0.00 39.33 39.50 1lwn h ASP 306 CO 0.01 0.76 0.11 0.40 -0.00 0.00 0.00 179.24 180.52 1lwn h ILE 307 N 0.79 1.19 -0.69 2.25 2.04 -0.65 -1.84 117.51 120.59 1lwn h ILE 307 Ca 0.19 -0.58 -0.03 0.00 1.00 0.00 0.00 64.86 65.44 1lwn h ILE 307 Cb 0.22 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.27 1lwn h ILE 307 CO -0.01 0.20 0.31 0.40 0.00 0.00 0.00 178.15 179.04 1lwn h ILE 308 N 0.34 1.24 0.02 -0.67 1.08 -1.03 -1.61 117.51 116.87 1lwn h ILE 308 Ca 0.10 -0.70 -0.00 0.00 -0.39 0.00 0.00 64.86 63.87 1lwn h ILE 308 Cb 0.20 0.41 0.00 0.00 -3.07 0.00 0.00 36.82 34.36 1lwn h ILE 308 CO -0.01 0.28 -0.01 -0.09 -0.69 0.00 0.00 178.15 177.64 1lwn h ARG 309 N 0.97 -0.02 -0.79 2.37 2.43 -1.19 -0.85 114.38 117.31 1lwn h ARG 309 Ca 0.24 0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.45 1lwn h ARG 309 Cb 0.16 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.66 1lwn h ARG 309 CO -0.03 0.03 0.52 -0.09 -1.51 0.00 0.00 179.97 178.89 1lwn h ARG 310 N -0.07 0.90 -0.49 0.20 2.43 -1.19 -1.86 114.38 114.31 1lwn h ARG 310 Ca -0.00 -0.05 -0.13 0.00 -0.81 0.00 0.00 59.98 58.99 1lwn h ARG 310 Cb 0.06 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.40 1lwn h ARG 310 CO 0.00 0.59 -0.19 0.35 -1.51 0.00 0.00 179.97 179.21 1lwn h PHE 311 N 0.92 1.14 0.00 2.20 3.57 -0.88 -2.92 116.94 120.97 1lwn h PHE 311 Ca 0.32 -0.27 0.00 0.00 3.53 0.00 0.00 57.97 61.56 1lwn h PHE 311 Cb 0.12 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 38.59 1lwn h PHE 311 CO -0.00 1.09 0.00 0.87 -2.23 0.00 0.00 178.31 178.04 1lwn h LYS 312 N 0.85 0.00 -1.15 1.11 1.57 -0.59 -3.16 116.57 115.21 1lwn h LYS 312 Ca 0.11 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.39 1lwn h LYS 312 Cb 0.77 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 32.84 1lwn h LYS 312 CO 0.06 0.00 0.65 0.43 -0.57 0.00 0.00 179.45 180.02 1lwn n SER 313 N -2.75 6.20 0.00 0.86 7.64 -0.75 -5.10 113.62 119.72 1lwn n SER 313 Ca 0.02 -3.44 0.00 0.00 1.01 0.00 0.00 58.87 56.46 1lwn n SER 313 Cb 0.35 -0.94 0.00 0.00 -1.01 0.00 0.00 64.21 62.61 1lwn n SER 313 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1lwn n SER 314 N -0.53 0.00 0.00 6.43 7.64 -1.20 -5.02 113.62 120.94 1lwn n SER 314 Ca 0.49 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.37 1lwn n SER 314 Cb 0.86 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.06 1lwn n SER 314 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1lwn n ASN 325 N 0.00 0.00 -0.22 6.43 5.15 -1.26 -4.72 115.26 120.64 1lwn n ASN 325 Ca 0.00 0.00 0.15 0.00 -0.60 0.00 0.00 54.58 54.13 1lwn n ASN 325 Cb 0.00 0.00 0.75 0.00 -0.53 0.00 0.00 39.78 40.00 1lwn n ASN 325 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1lwn n PHE 326 N 0.00 0.00 0.25 1.20 3.01 -1.26 -3.70 117.46 116.96 1lwn n PHE 326 Ca 0.00 -0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.57 1lwn n PHE 326 Cb 0.00 0.00 0.65 0.00 -0.01 0.00 0.00 39.48 40.12 1lwn n PHE 326 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 1lwn h ASP 327 N 1.05 0.00 -0.24 4.37 5.19 -2.03 -1.56 116.42 123.20 1lwn h ASP 327 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1lwn h ASP 327 Cb 0.22 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.73 1lwn h ASP 327 CO 0.00 0.16 0.00 0.00 -3.12 0.00 0.00 179.24 176.28 1lwn n ALA 328 N -2.30 2.46 0.01 3.45 0.00 -1.24 -4.48 120.51 118.41 1lwn n ALA 328 Ca -0.02 -0.79 -0.11 0.00 0.00 0.00 0.00 53.44 52.52 1lwn n ALA 328 Cb 0.27 -0.92 -0.04 0.00 0.00 0.00 0.00 19.45 18.76 1lwn n ALA 328 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1lwn h PHE 329 N 3.94 -0.86 0.00 0.00 3.57 -1.49 -0.77 116.94 121.33 1lwn h PHE 329 Ca 0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1lwn h PHE 329 Cb 0.86 0.40 0.00 0.00 2.79 0.00 0.00 35.95 39.99 1lwn h PHE 329 CO 0.15 -0.39 0.00 -1.35 -2.23 0.00 0.00 178.31 174.48 1lwn h PRO 330 N -0.40 0.00 0.00 6.41 0.11 -1.78 0.80 132.00 137.14 1lwn h PRO 330 Ca 0.09 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 1lwn h PRO 330 Cb 0.54 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.65 1lwn h PRO 330 CO -0.33 0.00 -0.48 -0.44 -0.21 0.00 0.00 178.00 176.54 1lwn h ASP 331 N 0.00 0.00 -0.00 -2.05 3.32 -1.44 -3.34 116.42 112.91 1lwn h ASP 331 Ca 0.00 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.94 1lwn h ASP 331 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1lwn h ASP 331 CO 0.00 0.05 -0.01 0.29 -1.72 0.00 0.00 179.24 177.86 1lwn n LYS 332 N -2.35 3.50 -4.00 3.56 4.76 -0.38 -4.63 118.16 118.62 1lwn n LYS 332 Ca 0.03 -0.22 -0.15 0.00 -2.87 0.00 0.00 58.31 55.10 1lwn n LYS 332 Cb 0.47 -0.73 -0.15 0.00 -1.84 0.00 0.00 35.03 32.78 1lwn n LYS 332 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1lwn s VAL 333 N -0.59 0.22 -0.04 -0.18 1.01 0.14 -1.24 120.40 119.72 1lwn s VAL 333 Ca 0.00 -0.05 0.01 0.00 0.00 0.00 0.00 61.98 61.94 1lwn s VAL 333 Cb 0.00 -0.24 0.02 0.00 0.00 0.00 0.00 36.38 36.17 1lwn s VAL 333 CO 0.01 0.10 -0.04 0.00 0.00 0.00 0.00 175.10 175.16 1lwn s ALA 334 N 0.34 0.67 -0.21 5.51 0.00 -0.86 -4.47 121.76 122.73 1lwn s ALA 334 Ca -0.03 -0.05 0.01 0.00 0.00 0.00 0.00 51.96 51.88 1lwn s ALA 334 Cb -0.06 -0.43 0.03 0.00 0.00 0.00 0.00 23.12 22.66 1lwn s ALA 334 CO -0.01 -0.03 -0.14 0.42 0.00 0.00 0.00 175.76 176.00 1lwn s ILE 335 N 0.95 2.31 -0.24 0.00 1.01 -0.19 -1.01 121.20 124.02 1lwn s ILE 335 Ca -0.11 -1.11 -0.10 0.00 0.00 0.00 0.00 60.65 59.34 1lwn s ILE 335 Cb -0.14 -2.11 -0.05 0.00 0.01 0.00 0.00 42.46 40.17 1lwn s ILE 335 CO -0.00 0.33 0.15 -1.58 0.00 0.00 0.00 174.94 173.84 1lwn s GLN 336 N 1.26 4.02 -0.36 2.79 2.00 0.04 -1.94 119.66 127.47 1lwn s GLN 336 Ca 0.01 -0.29 -0.17 0.00 -2.00 0.00 0.00 55.36 52.91 1lwn s GLN 336 Cb -0.15 -3.51 -0.00 0.00 0.80 0.00 0.00 33.01 30.14 1lwn s GLN 336 CO -0.09 0.04 0.43 -0.51 -0.50 0.00 0.00 175.29 174.66 1lwn s LEU 337 N 1.11 4.50 -0.92 3.68 1.43 -0.02 -1.71 118.68 126.75 1lwn s LEU 337 Ca 0.07 -0.26 -0.24 0.00 -1.03 0.00 0.00 54.13 52.67 1lwn s LEU 337 Cb -0.14 -2.43 0.05 0.00 0.03 0.00 0.00 46.19 43.70 1lwn s LEU 337 CO 0.05 -0.44 1.38 0.21 0.23 0.00 0.00 176.35 177.78 1lwn s ASN 338 N 1.76 6.38 0.19 2.29 2.47 -0.76 -1.69 114.94 125.58 1lwn s ASN 338 Ca 0.14 -1.12 0.00 0.00 0.42 0.00 0.00 52.86 52.31 1lwn s ASN 338 Cb -0.16 -2.56 0.00 0.00 -1.45 0.00 0.00 41.25 37.08 1lwn s ASN 338 CO 0.13 -1.61 0.00 -0.67 -3.72 0.00 0.00 177.10 171.22 1lwn n ASP 339 N 8.99 -1.84 -0.16 -4.21 -0.08 -0.40 -4.20 116.55 114.65 1lwn n ASP 339 Ca 0.22 0.17 0.15 0.00 -1.51 0.00 0.00 54.79 53.82 1lwn n ASP 339 Cb 0.50 -0.48 0.69 0.00 2.34 0.00 0.00 41.12 44.18 1lwn n ASP 339 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 1lwn n THR 340 N -1.07 0.00 -0.27 5.18 -2.24 -1.26 -4.29 114.28 110.33 1lwn n THR 340 Ca 0.00 -0.08 0.05 0.00 -2.27 0.00 0.00 64.05 61.75 1lwn n THR 340 Cb 0.07 -0.10 0.19 0.00 -2.10 0.00 0.00 70.33 68.40 1lwn n THR 340 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1lwn h HIS 341 N 0.77 0.62 -0.50 4.78 3.86 -1.97 -0.98 115.15 121.74 1lwn h HIS 341 Ca 0.00 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1lwn h HIS 341 Cb 0.28 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 28.59 1lwn h HIS 341 CO 0.00 0.14 0.00 -0.35 0.86 0.00 0.00 177.93 178.58 1lwn n PRO 342 N -4.93 4.35 0.25 2.45 -0.04 -1.26 -4.62 135.00 131.20 1lwn n PRO 342 Ca 0.15 -2.71 0.18 0.00 -0.04 0.00 0.00 63.50 61.07 1lwn n PRO 342 Cb 0.39 -2.16 0.90 0.00 -0.04 0.00 0.00 33.50 32.59 1lwn n PRO 342 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1lwn h SER 343 N 3.45 0.00 0.30 3.54 4.64 -1.43 -1.49 113.55 122.56 1lwn h SER 343 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1lwn h SER 343 Cb 1.77 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.86 1lwn h SER 343 CO 0.42 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.56 1lwn n LEU 344 N -3.53 0.02 0.22 5.97 4.77 -1.26 -1.99 117.00 121.20 1lwn n LEU 344 Ca 0.00 0.51 0.08 0.00 -0.03 0.00 0.00 56.01 56.57 1lwn n LEU 344 Cb 0.29 -0.51 0.62 0.00 -2.33 0.00 0.00 43.42 41.50 1lwn n LEU 344 CO 0.24 -0.37 1.09 0.00 -1.33 0.00 0.00 177.39 177.02 1lwn h ALA 345 N 2.29 2.01 0.61 -1.18 0.00 -1.64 -0.72 119.26 120.63 1lwn h ALA 345 Ca 0.00 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1lwn h ALA 345 Cb 0.15 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.93 1lwn h ALA 345 CO 0.00 -0.02 -0.29 0.82 0.00 0.00 0.00 179.25 179.76 1lwn h ILE 346 N 0.05 0.09 0.00 0.00 2.04 -1.65 -0.23 117.51 117.82 1lwn h ILE 346 Ca 0.03 -0.39 -0.03 0.00 1.00 0.00 0.00 64.86 65.47 1lwn h ILE 346 Cb 0.06 0.14 -0.00 0.00 -0.74 0.00 0.00 36.82 36.27 1lwn h ILE 346 CO -0.00 0.02 -0.14 1.55 0.00 0.00 0.00 178.15 179.58 1lwn h PRO 347 N -1.17 0.00 -0.18 2.37 0.13 -1.72 -2.27 132.00 129.16 1lwn h PRO 347 Ca -0.08 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.83 1lwn h PRO 347 Cb 0.65 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.79 1lwn h PRO 347 CO 0.14 0.14 -0.74 1.49 -0.23 0.00 0.00 178.00 178.80 1lwn h GLU 348 N 0.00 0.80 -0.68 0.86 4.57 -1.10 0.10 114.58 119.14 1lwn h GLU 348 Ca -0.00 -0.62 -0.05 0.00 -1.18 0.00 0.00 59.36 57.50 1lwn h GLU 348 Cb 0.45 0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 29.13 1lwn h GLU 348 CO 0.02 1.23 0.21 1.25 -1.18 0.00 0.00 179.01 180.54 1lwn h LEU 349 N 0.56 0.99 -0.43 1.64 5.85 -0.79 -1.42 115.31 121.70 1lwn h LEU 349 Ca -0.04 -0.21 -0.02 0.00 0.84 0.00 0.00 57.88 58.45 1lwn h LEU 349 Cb 1.36 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 42.11 1lwn h LEU 349 CO 0.15 0.93 0.19 0.24 -0.34 0.00 0.00 178.44 179.62 1lwn h MET 350 N 0.99 0.64 -0.67 1.25 2.86 -1.30 -1.48 114.93 117.21 1lwn h MET 350 Ca 0.22 -0.10 0.05 0.00 -2.06 0.00 0.00 59.70 57.80 1lwn h MET 350 Cb 0.30 -0.11 -0.05 0.00 0.06 0.00 0.00 31.60 31.80 1lwn h MET 350 CO -0.01 0.56 0.39 -0.09 1.06 0.00 0.00 176.91 178.82 1lwn h ARG 351 N 0.56 0.71 -0.12 1.72 2.43 -0.52 -0.30 114.38 118.85 1lwn h ARG 351 Ca 0.15 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.25 1lwn h ARG 351 Cb 0.15 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1lwn h ARG 351 CO -0.02 0.47 -0.03 0.28 -1.51 0.00 0.00 179.97 179.16 1lwn h VAL 352 N 0.73 1.29 -0.71 0.20 2.07 -1.10 -0.38 116.25 118.36 1lwn h VAL 352 Ca 0.29 -0.97 -0.04 0.00 0.82 0.00 0.00 66.70 66.80 1lwn h VAL 352 Cb 0.13 1.70 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 1lwn h VAL 352 CO -0.16 0.28 0.28 -0.07 0.02 0.00 0.00 177.57 177.92 1lwn h LEU 353 N -0.09 0.99 0.00 2.57 3.38 -1.03 0.59 115.31 121.71 1lwn h LEU 353 Ca 0.03 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.77 1lwn h LEU 353 Cb 0.45 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1lwn h LEU 353 CO 0.01 0.90 -0.44 0.58 0.09 0.00 0.00 178.44 179.58 1lwn h VAL 354 N 1.02 0.64 -0.25 1.22 2.07 -1.10 0.63 116.25 120.48 1lwn h VAL 354 Ca 0.24 -1.60 -0.16 0.00 0.82 0.00 0.00 66.70 66.00 1lwn h VAL 354 Cb 0.22 1.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.31 1lwn h VAL 354 CO -0.02 0.22 -0.48 0.44 0.02 0.00 0.00 177.57 177.74 1lwn h ASP 355 N -1.00 0.85 0.03 0.57 3.45 -1.19 -2.43 116.42 116.71 1lwn h ASP 355 Ca -0.08 -0.54 -0.36 0.00 0.43 0.00 0.00 57.03 56.47 1lwn h ASP 355 Cb 0.68 -0.25 -0.05 0.00 -0.56 0.00 0.00 39.33 39.16 1lwn h ASP 355 CO -0.05 1.24 -2.06 0.18 -1.57 0.00 0.00 179.24 176.98 1lwn n LEU 356 N -4.12 2.36 -0.03 1.55 4.77 -0.67 -4.42 117.00 116.43 1lwn n LEU 356 Ca -0.05 0.21 0.12 0.00 -0.03 0.00 0.00 56.01 56.26 1lwn n LEU 356 Cb 0.59 -0.96 0.29 0.00 -2.33 0.00 0.00 43.42 41.00 1lwn n LEU 356 CO 0.48 0.66 0.51 -0.62 -1.33 0.00 0.00 177.39 177.09 1lwn n GLU 357 N -3.86 0.11 -3.64 3.23 -0.58 0.11 -4.98 120.64 111.03 1lwn n GLU 357 Ca -0.41 -0.06 -0.26 0.00 -0.42 0.00 0.00 57.16 56.02 1lwn n GLU 357 Cb 0.90 -1.50 0.06 0.00 -0.57 0.00 0.00 31.44 30.33 1lwn n GLU 357 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1lwn n ARG 358 N -1.39 -7.00 -2.57 3.49 1.74 -0.75 -4.93 116.66 105.24 1lwn n ARG 358 Ca 0.06 0.76 -0.31 0.00 -0.77 0.00 0.00 57.85 57.60 1lwn n ARG 358 Cb 0.34 -5.76 -0.03 0.00 -1.02 0.00 0.00 32.46 25.99 1lwn n ARG 358 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1lwn s LEU 359 N -7.25 3.68 0.57 0.55 1.43 0.14 -4.97 118.68 112.83 1lwn s LEU 359 Ca 0.59 1.32 -0.17 0.00 -1.03 0.00 0.00 54.13 54.84 1lwn s LEU 359 Cb -0.27 -4.25 -0.05 0.00 0.03 0.00 0.00 46.19 41.66 1lwn s LEU 359 CO 0.73 -0.52 1.07 1.51 0.23 0.00 0.00 176.35 179.36 1lwn s ASP 360 N -3.26 5.82 0.16 2.29 -4.77 -1.26 -4.43 116.67 111.21 1lwn s ASP 360 Ca 0.54 1.92 -0.24 0.00 -3.30 0.00 0.00 52.55 51.47 1lwn s ASP 360 Cb -0.10 -2.55 0.03 0.00 -1.09 0.00 0.00 42.92 39.21 1lwn s ASP 360 CO 0.34 -1.14 1.60 -0.25 0.70 0.00 0.00 175.17 176.41 1lwn h TRP 361 N 0.77 -0.96 -0.84 2.11 2.91 -1.97 -2.10 115.95 115.86 1lwn h TRP 361 Ca -0.48 0.05 0.06 0.00 1.13 0.00 0.00 58.89 59.65 1lwn h TRP 361 Cb 1.23 0.47 -0.05 0.00 -0.51 0.00 0.00 29.16 30.30 1lwn h TRP 361 CO 0.56 -0.40 0.55 -0.44 -1.03 0.00 0.00 178.44 177.69 1lwn h ASP 362 N -0.31 0.84 -0.28 2.65 3.45 -1.99 0.15 116.42 120.93 1lwn h ASP 362 Ca 0.15 0.00 -0.15 0.00 0.43 0.00 0.00 57.03 57.46 1lwn h ASP 362 Cb 0.55 -0.18 -0.00 0.00 -0.56 0.00 0.00 39.33 39.14 1lwn h ASP 362 CO -0.50 0.54 -0.40 0.50 -1.57 0.00 0.00 179.24 177.82 1lwn h LYS 363 N 0.95 0.76 -0.49 3.56 1.63 -1.88 -1.65 116.57 119.46 1lwn h LYS 363 Ca 0.36 -0.44 -0.01 0.00 -0.85 0.00 0.00 60.65 59.70 1lwn h LYS 363 Cb 0.19 0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 31.83 1lwn h LYS 363 CO -0.13 1.07 0.26 0.00 -3.45 0.00 0.00 179.45 177.20 1lwn h ALA 364 N 0.68 0.62 -0.68 5.00 0.00 -0.81 -1.86 119.26 122.21 1lwn h ALA 364 Ca 0.03 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1lwn h ALA 364 Cb 0.99 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 1lwn h ALA 364 CO 0.09 0.16 0.43 2.35 0.00 0.00 0.00 179.25 182.28 1lwn h TRP 365 N 0.64 0.87 -0.36 0.00 2.91 -0.92 0.21 115.95 119.31 1lwn h TRP 365 Ca 0.17 0.01 0.02 0.00 1.13 0.00 0.00 58.89 60.22 1lwn h TRP 365 Cb 0.07 -0.29 -0.03 0.00 -0.51 0.00 0.00 29.16 28.40 1lwn h TRP 365 CO -0.02 0.57 0.20 1.49 -1.03 0.00 0.00 178.44 179.66 1lwn h GLU 366 N 0.92 0.40 -0.70 2.65 4.81 -1.00 -1.03 114.58 120.63 1lwn h GLU 366 Ca 0.25 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.42 1lwn h GLU 366 Cb -0.07 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.19 1lwn h GLU 366 CO -0.05 0.26 0.33 0.28 -0.73 0.00 0.00 179.01 179.10 1lwn h VAL 367 N 0.41 1.23 0.19 0.32 2.07 -0.86 -2.31 116.25 117.30 1lwn h VAL 367 Ca 0.14 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 1lwn h VAL 367 Cb 0.02 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 30.17 1lwn h VAL 367 CO -0.08 0.28 -0.09 0.74 0.02 0.00 0.00 177.57 178.44 1lwn h THR 368 N 0.98 0.87 -0.97 2.57 2.02 -0.51 -1.93 112.91 115.93 1lwn h THR 368 Ca 0.24 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1lwn h THR 368 Cb 0.13 1.03 -0.05 0.00 -1.74 0.00 0.00 68.15 67.52 1lwn h THR 368 CO -0.03 0.06 0.62 0.58 0.37 0.00 0.00 175.52 177.13 1lwn h VAL 369 N -0.38 1.26 0.00 3.16 2.07 -1.18 -1.13 116.25 120.04 1lwn h VAL 369 Ca -0.03 -0.50 0.00 0.00 0.82 0.00 0.00 66.70 66.99 1lwn h VAL 369 Cb 0.30 -0.15 0.00 0.00 -1.52 0.00 0.00 31.29 29.91 1lwn h VAL 369 CO 0.04 0.26 0.00 0.11 0.02 0.00 0.00 177.57 178.00 1lwn h LYS 370 N 1.33 0.00 0.12 1.57 1.57 -1.31 -2.18 116.57 117.66 1lwn h LYS 370 Ca 0.35 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.77 1lwn h LYS 370 Cb -0.12 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 1lwn h LYS 370 CO -0.07 0.00 -1.99 2.41 -0.57 0.00 0.00 179.45 179.23 1lwn n THR 371 N -2.98 1.77 -3.37 -0.16 -1.04 -0.69 -4.90 114.28 102.91 1lwn n THR 371 Ca 0.01 -0.66 -0.34 0.00 -2.04 0.00 0.00 64.05 61.02 1lwn n THR 371 Cb 0.33 -1.69 -0.06 0.00 -1.82 0.00 0.00 70.33 67.09 1lwn n THR 371 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1lwn s ALA 373 N -1.60 -0.09 -0.05 0.00 0.00 -0.82 -1.47 121.76 117.74 1lwn s ALA 373 Ca 0.41 -0.13 0.04 0.00 0.00 0.00 0.00 51.96 52.29 1lwn s ALA 373 Cb -0.14 0.02 -0.00 0.00 0.00 0.00 0.00 23.12 23.00 1lwn s ALA 373 CO 0.20 -0.10 -0.19 -0.47 0.00 0.00 0.00 175.76 175.20 1lwn s TYR 374 N -0.69 1.88 -0.20 0.00 5.04 0.35 -0.84 117.35 122.89 1lwn s TYR 374 Ca -0.08 -0.59 -0.04 0.00 -2.44 0.00 0.00 57.07 53.92 1lwn s TYR 374 Cb -0.05 -1.27 -0.02 0.00 0.35 0.00 0.00 41.96 40.97 1lwn s TYR 374 CO -0.00 -0.21 -0.02 0.99 -1.34 0.00 0.00 175.55 174.97 1lwn s THR 375 N 0.10 3.82 -0.04 4.34 2.01 -0.68 -1.21 115.64 123.98 1lwn s THR 375 Ca -0.06 -0.36 -0.12 0.00 0.31 0.00 0.00 61.69 61.46 1lwn s THR 375 Cb -0.13 -2.72 -0.05 0.00 0.01 0.00 0.00 72.50 69.61 1lwn s THR 375 CO 0.03 0.44 0.31 0.21 -0.69 0.00 0.00 174.62 174.92 1lwn s ASN 376 N 0.98 6.66 0.00 3.53 3.84 -0.35 -1.28 114.94 128.31 1lwn s ASN 376 Ca 0.01 0.78 0.00 0.00 0.21 0.00 0.00 52.86 53.86 1lwn s ASN 376 Cb -0.14 -2.18 0.00 0.00 -0.55 0.00 0.00 41.25 38.37 1lwn s ASN 376 CO 0.01 0.35 0.48 1.41 -2.79 0.00 0.00 177.10 176.56 1lwn n HIS 377 N 1.81 0.00 -3.47 0.43 8.25 -1.26 -4.10 115.22 116.87 1lwn n HIS 377 Ca -0.16 -0.01 -0.12 0.00 -0.26 0.00 0.00 57.72 57.17 1lwn n HIS 377 Cb 0.53 -0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.61 1lwn n HIS 377 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1lwn s THR 378 N -0.03 0.00 -0.23 1.59 -1.32 -1.26 -4.54 115.64 109.86 1lwn s THR 378 Ca 0.00 0.00 0.06 0.00 -1.21 0.00 0.00 61.69 60.54 1lwn s THR 378 Cb 0.00 -1.00 -0.08 0.00 -1.51 0.00 0.00 72.50 69.91 1lwn s THR 378 CO 0.00 0.00 0.24 0.52 -2.21 0.00 0.00 174.62 173.17 1lwn n VAL 379 N -0.02 0.00 -1.76 5.08 0.31 -1.26 -5.00 118.33 115.68 1lwn n VAL 379 Ca -0.14 -0.30 -0.42 0.00 -0.01 0.00 0.00 64.34 63.47 1lwn n VAL 379 Cb 0.62 0.83 -0.03 0.00 -0.91 0.00 0.00 33.84 34.35 1lwn n VAL 379 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1lwn s LEU 380 N -2.60 4.40 0.47 7.52 1.43 -1.26 -4.89 118.68 123.75 1lwn s LEU 380 Ca 0.01 2.63 0.18 0.00 -1.03 0.00 0.00 54.13 55.92 1lwn s LEU 380 Cb 0.05 -3.55 1.16 0.00 0.03 0.00 0.00 46.19 43.88 1lwn s LEU 380 CO 0.26 -1.00 1.99 1.55 0.23 0.00 0.00 176.35 179.38 1lwn h PRO 381 N 9.44 0.25 0.00 1.29 0.13 -1.98 -1.50 132.00 139.63 1lwn h PRO 381 Ca -0.46 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1lwn h PRO 381 Cb 1.22 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1lwn h PRO 381 CO 0.94 0.16 0.00 -0.85 -0.23 0.00 0.00 178.00 178.03 1lwn n GLU 382 N -4.45 0.64 -0.00 0.86 0.00 -1.26 -2.64 120.64 113.78 1lwn n GLU 382 Ca 0.09 0.02 0.10 0.00 0.00 0.00 0.00 57.16 57.38 1lwn n GLU 382 Cb 0.45 -1.50 -0.12 0.00 0.00 0.00 0.00 31.44 30.27 1lwn n GLU 382 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1lwn n ALA 383 N -1.11 3.96 -2.39 -1.84 0.00 -0.56 -0.70 120.51 117.86 1lwn n ALA 383 Ca 0.17 -0.55 -0.42 0.00 0.00 0.00 0.00 53.44 52.63 1lwn n ALA 383 Cb 0.13 -0.78 -0.03 0.00 0.00 0.00 0.00 19.45 18.77 1lwn n ALA 383 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1lwn s LEU 384 N -3.61 4.39 -0.25 0.00 2.01 -1.08 -4.35 118.68 115.79 1lwn s LEU 384 Ca 0.02 1.99 -0.29 0.00 0.01 0.00 0.00 54.13 55.86 1lwn s LEU 384 Cb 0.15 -3.58 0.01 0.00 0.01 0.00 0.00 46.19 42.78 1lwn s LEU 384 CO 0.88 -0.40 1.03 -1.61 1.01 0.00 0.00 176.35 177.26 1lwn s GLU 385 N 0.78 4.21 -0.31 1.70 2.02 -1.26 -4.80 118.70 121.04 1lwn s GLU 385 Ca 0.56 1.27 -0.01 0.00 0.02 0.00 0.00 54.97 56.81 1lwn s GLU 385 Cb -0.28 -3.66 0.10 0.00 0.10 0.00 0.00 34.13 30.38 1lwn s GLU 385 CO 0.30 -0.68 0.10 1.03 0.02 0.00 0.00 175.26 176.03 1lwn s ARG 386 N 3.28 0.65 -0.06 1.61 0.52 -1.26 -2.27 118.95 121.42 1lwn s ARG 386 Ca 0.44 -1.00 -0.23 0.00 -0.52 0.00 0.00 55.73 54.42 1lwn s ARG 386 Cb -0.14 -1.89 -0.04 0.00 0.52 0.00 0.00 34.95 33.39 1lwn s ARG 386 CO 0.08 -0.98 0.67 -1.58 0.02 0.00 0.00 175.30 173.51 1lwn s TRP 387 N 1.68 3.59 0.28 -0.53 0.52 -0.85 -4.74 118.94 118.88 1lwn s TRP 387 Ca 0.09 1.22 -0.30 0.00 0.02 0.00 0.00 56.10 57.14 1lwn s TRP 387 Cb -0.17 -2.77 -0.11 0.00 -1.15 0.00 0.00 33.47 29.28 1lwn s TRP 387 CO -0.26 0.13 1.49 -2.14 0.02 0.00 0.00 176.95 176.18 1lwn s PRO 388 N 0.66 4.21 0.49 4.98 0.02 -1.26 -0.03 135.00 144.07 1lwn s PRO 388 Ca 0.36 2.41 0.20 0.00 0.02 0.00 0.00 61.00 63.98 1lwn s PRO 388 Cb -0.18 -3.07 1.23 0.00 0.02 0.00 0.00 34.50 32.50 1lwn s PRO 388 CO 0.18 -0.49 2.05 -0.39 -0.33 0.00 0.00 177.00 178.02 1lwn h VAL 389 N 3.43 0.91 0.00 3.83 -1.51 -1.44 -2.25 116.25 119.21 1lwn h VAL 389 Ca -0.47 -0.50 -0.04 0.00 -1.23 0.00 0.00 66.70 64.47 1lwn h VAL 389 Cb 1.22 1.28 -0.01 0.00 -2.13 0.00 0.00 31.29 31.66 1lwn h VAL 389 CO 0.77 0.13 -0.17 1.12 -1.23 0.00 0.00 177.57 178.19 1lwn h HIS 390 N 0.00 0.00 0.01 5.19 2.07 -1.90 0.25 115.15 120.77 1lwn h HIS 390 Ca -0.00 0.00 -0.23 0.00 -2.85 0.00 0.00 60.37 57.29 1lwn h HIS 390 Cb 0.27 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.25 1lwn h HIS 390 CO 0.00 0.17 -0.96 1.25 -3.07 0.00 0.00 177.93 175.32 1lwn h LEU 391 N 0.00 0.49 -0.14 6.12 5.85 -1.79 -3.14 115.31 122.70 1lwn h LEU 391 Ca -0.00 -0.41 -0.23 0.00 0.84 0.00 0.00 57.88 58.09 1lwn h LEU 391 Cb 0.32 -0.15 0.01 0.00 0.37 0.00 0.00 40.66 41.21 1lwn h LEU 391 CO 0.02 1.21 -0.80 -0.07 -0.34 0.00 0.00 178.44 178.47 1lwn h LEU 392 N 0.20 0.95 -1.28 2.25 3.38 -1.15 -2.06 115.31 117.60 1lwn h LEU 392 Ca -0.08 -0.64 -0.04 0.00 0.09 0.00 0.00 57.88 57.21 1lwn h LEU 392 Cb 1.60 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 42.06 1lwn h LEU 392 CO 0.16 1.43 -0.20 1.05 0.09 0.00 0.00 178.44 180.98 1lwn h GLU 393 N 0.53 0.00 0.14 1.13 4.11 -0.62 0.33 114.58 120.20 1lwn h GLU 393 Ca -0.06 0.00 -0.35 0.00 0.07 0.00 0.00 59.36 59.02 1lwn h GLU 393 Cb 1.43 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.67 1lwn h GLU 393 CO 0.16 0.20 -1.87 0.00 0.07 0.00 0.00 179.01 177.57 1lwn h THR 394 N 0.00 0.74 0.20 -1.06 1.03 -1.57 -3.28 112.91 108.97 1lwn h THR 394 Ca -0.00 -2.39 -0.28 0.00 -0.01 0.00 0.00 66.41 63.73 1lwn h THR 394 Cb 0.66 2.58 0.03 0.00 -1.07 0.00 0.00 68.15 70.36 1lwn h THR 394 CO 0.03 0.86 -1.23 0.25 -0.01 0.00 0.00 175.52 175.42 1lwn h LEU 395 N 0.02 0.73 -6.01 0.00 5.85 -1.30 -3.37 115.31 111.24 1lwn h LEU 395 Ca -0.39 -0.92 -0.56 0.00 0.84 0.00 0.00 57.88 56.85 1lwn h LEU 395 Cb 2.01 -0.24 -0.40 0.00 0.37 0.00 0.00 40.66 42.41 1lwn h LEU 395 CO 0.10 1.59 -1.03 0.18 -0.34 0.00 0.00 178.44 178.95 1lwn n LEU 396 N -3.87 0.93 -0.33 2.25 4.77 0.11 -0.43 117.00 120.43 1lwn n LEU 396 Ca -0.16 -4.88 0.13 0.00 -0.03 0.00 0.00 56.01 51.07 1lwn n LEU 396 Cb 1.00 0.42 0.31 0.00 -2.33 0.00 0.00 43.42 42.82 1lwn n LEU 396 CO 0.56 2.11 1.15 1.55 -1.33 0.00 0.00 177.39 181.43 1lwn h PRO 397 N 3.86 0.63 -0.02 3.23 0.13 -1.61 -2.06 132.00 136.17 1lwn h PRO 397 Ca 0.10 -0.04 -0.14 0.00 -0.87 0.00 0.00 66.00 65.05 1lwn h PRO 397 Cb 0.85 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 31.82 1lwn h PRO 397 CO 0.53 0.42 -0.63 -0.09 -0.23 0.00 0.00 178.00 178.00 1lwn h ARG 398 N 0.65 0.06 -0.10 0.86 9.65 -1.91 -2.88 114.38 120.72 1lwn h ARG 398 Ca 0.56 -0.05 -0.17 0.00 -1.10 0.00 0.00 59.98 59.23 1lwn h ARG 398 Cb 0.93 0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 29.51 1lwn h ARG 398 CO -0.42 0.67 -0.66 0.45 2.80 0.00 0.00 179.97 182.81 1lwn h HIS 399 N 0.04 0.55 -0.57 2.20 3.86 -1.75 -2.06 115.15 117.42 1lwn h HIS 399 Ca -0.01 -0.22 -0.07 0.00 -1.16 0.00 0.00 60.37 58.91 1lwn h HIS 399 Cb 1.12 -0.09 -0.02 0.00 1.06 0.00 0.00 27.41 29.47 1lwn h HIS 399 CO 0.01 0.96 0.07 1.25 0.86 0.00 0.00 177.93 181.07 1lwn h LEU 400 N 0.30 0.90 -0.21 2.43 5.85 -1.38 0.99 115.31 124.18 1lwn h LEU 400 Ca -0.02 -0.21 -0.02 0.00 0.84 0.00 0.00 57.88 58.48 1lwn h LEU 400 Cb 1.22 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 42.00 1lwn h LEU 400 CO 0.11 0.92 0.07 1.56 -0.34 0.00 0.00 178.44 180.76 1lwn h GLN 401 N 0.88 0.33 -0.87 1.25 4.20 -1.34 -1.80 115.11 117.76 1lwn h GLN 401 Ca 0.18 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.79 1lwn h GLN 401 Cb 0.43 -0.05 -0.04 0.00 0.30 0.00 0.00 27.48 28.12 1lwn h GLN 401 CO 0.01 0.42 0.43 0.82 -0.67 0.00 0.00 178.83 179.84 1lwn h ILE 402 N 0.17 1.26 -0.79 2.54 2.04 -1.02 -2.04 117.51 119.67 1lwn h ILE 402 Ca 0.07 -0.72 -0.04 0.00 1.00 0.00 0.00 64.86 65.17 1lwn h ILE 402 Cb 0.23 0.14 -0.04 0.00 -0.74 0.00 0.00 36.82 36.41 1lwn h ILE 402 CO -0.00 0.31 0.33 0.40 0.00 0.00 0.00 178.15 179.19 1lwn h ILE 403 N 1.23 1.26 -0.55 -0.67 2.04 -0.60 0.36 117.51 120.58 1lwn h ILE 403 Ca 0.30 -0.80 -0.06 0.00 1.00 0.00 0.00 64.86 65.30 1lwn h ILE 403 Cb 0.10 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.46 1lwn h ILE 403 CO -0.04 0.33 0.12 1.88 0.00 0.00 0.00 178.15 180.44 1lwn h TYR 404 N 1.15 0.94 -0.31 1.37 0.99 -0.99 0.79 116.97 120.91 1lwn h TYR 404 Ca 0.27 -0.12 -0.01 0.00 2.00 0.00 0.00 58.73 60.86 1lwn h TYR 404 Cb 0.20 -0.26 -0.01 0.00 1.00 0.00 0.00 36.73 37.65 1lwn h TYR 404 CO 0.02 0.82 0.14 1.49 -0.00 0.00 0.00 178.16 180.63 1lwn h GLU 405 N 0.79 0.46 -0.48 4.88 4.57 -1.04 0.35 114.58 124.11 1lwn h GLU 405 Ca 0.17 -0.07 0.04 0.00 -1.18 0.00 0.00 59.36 58.32 1lwn h GLU 405 Cb 0.36 -0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 28.83 1lwn h GLU 405 CO 0.00 0.44 0.25 0.82 -1.18 0.00 0.00 179.01 179.35 1lwn h ILE 406 N 0.37 0.98 0.06 2.32 2.04 -0.67 -2.04 117.51 120.57 1lwn h ILE 406 Ca 0.11 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.80 1lwn h ILE 406 Cb 0.14 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 36.65 1lwn h ILE 406 CO -0.01 0.09 -0.07 -1.13 0.00 0.00 0.00 178.15 177.03 1lwn h ASN 407 N 0.50 -0.17 -0.51 1.72 -1.24 -0.35 -1.00 115.58 114.53 1lwn h ASN 407 Ca 0.21 0.02 0.04 0.00 0.71 0.00 0.00 56.30 57.28 1lwn h ASN 407 Cb 0.10 0.06 -0.04 0.00 0.73 0.00 0.00 38.32 39.17 1lwn h ASN 407 CO -0.14 -0.10 0.26 -0.61 -1.29 0.00 0.00 177.43 175.55 1lwn h GLN 408 N -0.15 0.50 0.00 6.67 5.75 -0.66 0.19 115.11 127.41 1lwn h GLN 408 Ca 0.01 -0.03 -0.07 0.00 -0.15 0.00 0.00 58.65 58.41 1lwn h GLN 408 Cb 0.15 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 28.57 1lwn h GLN 408 CO -0.02 0.33 -0.33 0.00 -2.65 0.00 0.00 178.83 176.16 1lwn h ARG 409 N 0.51 0.00 0.02 1.69 3.08 -1.26 -1.25 114.38 117.17 1lwn h ARG 409 Ca 0.22 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 60.11 1lwn h ARG 409 Cb 0.12 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.18 1lwn h ARG 409 CO -0.15 0.33 -0.63 0.35 -1.07 0.00 0.00 179.97 178.81 1lwn h PHE 410 N 0.00 0.60 -0.20 3.04 3.57 -0.32 -3.10 116.94 120.53 1lwn h PHE 410 Ca -0.00 -0.34 -0.05 0.00 3.53 0.00 0.00 57.97 61.11 1lwn h PHE 410 Cb 0.73 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.39 1lwn h PHE 410 CO 0.00 1.17 -0.10 -0.07 -2.23 0.00 0.00 178.31 177.08 1lwn h LEU 411 N -0.14 0.30 -1.45 0.59 3.38 -0.52 -1.83 115.31 115.64 1lwn h LEU 411 Ca -0.08 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.77 1lwn h LEU 411 Cb 1.35 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.02 1lwn h LEU 411 CO 0.12 0.44 -0.24 0.78 0.09 0.00 0.00 178.44 179.63 1lwn h ASN 412 N 0.30 0.05 0.18 -0.43 -0.26 -1.25 -0.68 115.58 113.49 1lwn h ASN 412 Ca 0.06 -0.01 -0.20 0.00 -0.56 0.00 0.00 56.30 55.59 1lwn h ASN 412 Cb 0.37 -0.01 0.00 0.00 -1.06 0.00 0.00 38.32 37.62 1lwn h ASN 412 CO 0.02 0.29 -0.78 0.03 -1.06 0.00 0.00 177.43 175.93 1lwn h ARG 413 N 0.05 0.50 -0.23 0.81 3.08 -1.27 -2.69 114.38 114.63 1lwn h ARG 413 Ca 0.01 -0.43 -0.04 0.00 0.07 0.00 0.00 59.98 59.59 1lwn h ARG 413 Cb 0.45 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.59 1lwn h ARG 413 CO 0.03 1.06 -0.00 0.28 -1.07 0.00 0.00 179.97 180.27 1lwn h VAL 414 N 0.33 1.26 -0.55 2.04 2.07 -0.90 -2.47 116.25 118.02 1lwn h VAL 414 Ca -0.05 -0.90 0.03 0.00 0.82 0.00 0.00 66.70 66.61 1lwn h VAL 414 Cb 1.38 1.40 -0.03 0.00 -1.52 0.00 0.00 31.29 32.52 1lwn h VAL 414 CO 0.14 0.28 0.36 0.00 0.02 0.00 0.00 177.57 178.37 1lwn h ALA 415 N 0.80 1.74 -0.12 1.67 0.00 -1.15 0.55 119.26 122.76 1lwn h ALA 415 Ca 0.06 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.79 1lwn h ALA 415 Cb 0.41 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1lwn h ALA 415 CO 0.01 0.20 -0.60 0.00 0.00 0.00 0.00 179.25 178.86 1lwn h ALA 416 N 1.69 0.75 0.00 0.00 0.00 -1.27 -2.47 119.26 117.96 1lwn h ALA 416 Ca 0.22 -0.54 -0.08 0.00 0.00 0.00 0.00 54.91 54.51 1lwn h ALA 416 Cb 0.11 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1lwn h ALA 416 CO -0.06 0.71 -0.68 0.00 0.00 0.00 0.00 179.25 179.22 1lwn h ALA 417 N 1.07 0.71 -2.15 0.00 0.00 -0.88 -3.39 119.26 114.61 1lwn h ALA 417 Ca -0.00 -0.38 -0.57 0.00 0.00 0.00 0.00 54.91 53.95 1lwn h ALA 417 Cb 1.13 0.03 -0.39 0.00 0.00 0.00 0.00 17.79 18.56 1lwn h ALA 417 CO 0.10 0.47 -1.03 1.19 0.00 0.00 0.00 179.25 179.98 1lwn n PHE 418 N -3.04 -0.28 -1.70 0.00 3.01 0.11 -5.10 117.46 110.46 1lwn n PHE 418 Ca -0.01 -3.52 -0.44 0.00 1.01 0.00 0.00 57.45 54.49 1lwn n PHE 418 Cb 0.69 -0.17 -0.03 0.00 -0.01 0.00 0.00 39.48 39.96 1lwn n PHE 418 CO 0.00 0.00 0.00 -2.30 1.01 0.00 0.00 176.76 175.47 1lwn n PRO 419 N 1.86 2.40 -0.20 -1.08 -0.02 -0.93 -2.24 135.00 134.78 1lwn n PRO 419 Ca 0.24 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.58 1lwn n PRO 419 Cb 0.50 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 1lwn n PRO 419 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1lwn n GLY 420 N 2.95 2.32 2.88 -1.23 0.00 -1.26 -4.94 105.19 105.91 1lwn n GLY 420 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1lwn n GLY 420 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1lwn n ASP 421 N 0.00 4.31 0.25 1.61 4.64 -0.95 -4.72 116.55 121.70 1lwn n ASP 421 Ca 0.00 -2.92 0.10 0.00 -1.38 0.00 0.00 54.79 50.60 1lwn n ASP 421 Cb 0.00 -1.63 0.66 0.00 -1.04 0.00 0.00 41.12 39.12 1lwn n ASP 421 CO 0.00 0.00 0.00 -0.37 -0.82 0.00 0.00 177.20 176.01 1lwn h VAL 422 N 4.14 0.79 -0.28 5.18 -1.51 -1.92 -2.46 116.25 120.18 1lwn h VAL 422 Ca 0.51 -0.49 -0.08 0.00 -1.23 0.00 0.00 66.70 65.40 1lwn h VAL 422 Cb 0.67 1.29 -0.01 0.00 -2.13 0.00 0.00 31.29 31.12 1lwn h VAL 422 CO 1.76 0.13 -0.16 -0.78 -1.23 0.00 0.00 177.57 177.29 1lwn h ASP 423 N 0.00 0.62 -0.65 4.19 1.82 -2.00 -2.64 116.42 117.76 1lwn h ASP 423 Ca -0.00 -0.42 -0.01 0.00 -0.39 0.00 0.00 57.03 56.21 1lwn h ASP 423 Cb 0.28 -0.17 -0.03 0.00 0.68 0.00 0.00 39.33 40.09 1lwn h ASP 423 CO 0.02 0.90 0.37 -0.09 -1.61 0.00 0.00 179.24 178.83 1lwn h ARG 424 N 0.33 0.92 -0.70 0.28 2.43 -1.85 -1.49 114.38 114.31 1lwn h ARG 424 Ca 0.06 -0.09 -0.03 0.00 -0.81 0.00 0.00 59.98 59.11 1lwn h ARG 424 Cb 0.68 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 30.01 1lwn h ARG 424 CO 0.04 0.67 0.32 -0.07 -1.51 0.00 0.00 179.97 179.42 1lwn h LEU 425 N 0.93 0.91 -0.33 3.80 3.38 -1.32 -0.29 115.31 122.39 1lwn h LEU 425 Ca 0.24 -0.11 -0.12 0.00 0.09 0.00 0.00 57.88 57.99 1lwn h LEU 425 Cb 0.02 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1lwn h LEU 425 CO -0.04 0.78 -0.25 -0.09 0.09 0.00 0.00 178.44 178.94 1lwn h ARG 426 N 0.99 0.75 -0.38 1.13 2.43 -1.01 -2.58 114.38 115.71 1lwn h ARG 426 Ca 0.24 -0.37 -0.10 0.00 -0.81 0.00 0.00 59.98 58.95 1lwn h ARG 426 Cb 0.13 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.66 1lwn h ARG 426 CO -0.03 0.99 -0.16 0.00 -1.51 0.00 0.00 179.97 179.25 1lwn h ARG 427 N 0.52 0.70 0.00 0.20 3.08 -0.89 -3.21 114.38 114.78 1lwn h ARG 427 Ca 0.06 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 59.87 1lwn h ARG 427 Cb 0.81 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.81 1lwn h ARG 427 CO 0.07 0.82 -0.53 -1.33 -1.07 0.00 0.00 179.97 177.93 1lwn n MET 428 N -4.15 0.09 -1.62 0.04 2.81 -0.15 -4.96 117.12 109.17 1lwn n MET 428 Ca 0.01 0.02 -0.41 0.00 -1.81 0.00 0.00 57.70 55.51 1lwn n MET 428 Cb 0.38 -1.55 0.01 0.00 -0.71 0.00 0.00 33.22 31.36 1lwn n MET 428 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1lwn n SER 429 N -1.67 1.37 0.20 7.83 2.88 -0.97 -4.87 113.62 118.39 1lwn n SER 429 Ca 0.05 1.03 0.13 0.00 -1.33 0.00 0.00 58.87 58.75 1lwn n SER 429 Cb 0.37 -1.37 0.31 0.00 -0.75 0.00 0.00 64.21 62.77 1lwn n SER 429 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1lwn h LEU 430 N 1.55 0.00 -8.99 2.46 4.07 -1.91 -3.43 115.31 109.06 1lwn h LEU 430 Ca -0.45 0.00 -0.62 0.00 0.08 0.00 0.00 57.88 56.89 1lwn h LEU 430 Cb 1.33 0.00 -0.18 0.00 1.08 0.00 0.00 40.66 42.90 1lwn h LEU 430 CO 0.57 0.00 -0.58 -0.69 -1.08 0.00 0.00 178.44 176.66 1lwn s VAL 431 N -3.26 4.64 -0.23 1.22 1.01 -1.26 -0.84 120.40 121.68 1lwn s VAL 431 Ca 0.07 -0.08 -0.09 0.00 0.00 0.00 0.00 61.98 61.87 1lwn s VAL 431 Cb 0.07 -3.11 -0.04 0.00 0.00 0.00 0.00 36.38 33.30 1lwn s VAL 431 CO 0.62 0.43 0.13 -1.61 0.00 0.00 0.00 175.10 174.67 1lwn s GLU 432 N 0.64 3.97 1.04 2.72 2.02 0.12 -4.97 118.70 124.24 1lwn s GLU 432 Ca 0.03 -0.32 -0.17 0.00 0.02 0.00 0.00 54.97 54.52 1lwn s GLU 432 Cb -0.13 -3.44 0.24 0.00 0.10 0.00 0.00 34.13 30.89 1lwn s GLU 432 CO 0.02 0.05 1.28 -1.21 0.02 0.00 0.00 175.26 175.42 1lwn s GLU 433 N 1.05 -0.01 0.00 1.61 0.41 -1.26 -2.24 118.70 118.26 1lwn s GLU 433 Ca 0.06 -0.38 0.00 0.00 -0.41 0.00 0.00 54.97 54.24 1lwn s GLU 433 Cb -0.14 -1.77 0.00 0.00 -1.78 0.00 0.00 34.13 30.45 1lwn s GLU 433 CO 0.04 -2.85 0.00 0.41 -0.49 0.00 0.00 175.26 172.37 1lwn n GLY 434 N -3.07 0.98 0.14 -1.39 0.00 -1.26 -4.81 105.19 95.79 1lwn n GLY 434 Ca 0.16 -2.06 -0.11 0.00 0.00 0.00 0.00 46.02 44.01 1lwn n GLY 434 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lwn h ALA 435 N 0.00 0.33 -1.78 4.61 0.00 -2.07 -3.36 119.26 117.00 1lwn h ALA 435 Ca 0.00 -0.15 -0.66 0.00 0.00 0.00 0.00 54.91 54.10 1lwn h ALA 435 Cb 0.00 -0.10 -0.17 0.00 0.00 0.00 0.00 17.79 17.53 1lwn h ALA 435 CO 0.00 -0.03 0.42 0.08 0.00 0.00 0.00 179.25 179.72 1lwn s VAL 436 N -5.36 4.54 0.25 0.00 1.01 -1.26 -5.02 120.40 114.56 1lwn s VAL 436 Ca -0.14 -0.72 -0.30 0.00 0.00 0.00 0.00 61.98 60.83 1lwn s VAL 436 Cb 0.08 -4.63 -0.10 0.00 0.00 0.00 0.00 36.38 31.73 1lwn s VAL 436 CO 0.73 -1.35 1.45 -0.54 0.00 0.00 0.00 175.10 175.39 1lwn s LYS 437 N 3.43 4.26 0.07 2.72 1.02 -1.26 -4.87 119.74 125.11 1lwn s LYS 437 Ca 0.20 2.32 0.01 0.00 0.02 0.00 0.00 55.97 58.51 1lwn s LYS 437 Cb -0.18 -3.11 -0.03 0.00 -0.52 0.00 0.00 37.83 33.99 1lwn s LYS 437 CO 0.07 -0.44 -0.06 1.03 -0.92 0.00 0.00 175.35 175.03 1lwn s ARG 438 N -0.33 0.65 -0.23 1.68 0.52 -0.95 -1.09 118.95 119.21 1lwn s ARG 438 Ca 0.60 -1.09 -0.08 0.00 -0.52 0.00 0.00 55.73 54.64 1lwn s ARG 438 Cb -0.42 -0.09 -0.03 0.00 0.52 0.00 0.00 34.95 34.92 1lwn s ARG 438 CO 0.43 -0.03 0.08 0.42 0.02 0.00 0.00 175.30 176.22 1lwn s ILE 439 N -2.93 4.55 -0.63 1.52 -1.09 0.96 0.11 121.20 123.68 1lwn s ILE 439 Ca 0.03 -0.10 -0.26 0.00 -2.23 0.00 0.00 60.65 58.09 1lwn s ILE 439 Cb 0.01 -3.10 0.04 0.00 -1.58 0.00 0.00 42.46 37.83 1lwn s ILE 439 CO -0.04 0.37 1.11 0.21 -1.23 0.00 0.00 174.94 175.36 1lwn s ASN 440 N 1.19 6.29 0.46 3.58 3.84 -0.02 -2.00 114.94 128.28 1lwn s ASN 440 Ca 0.05 -0.37 0.16 0.00 0.21 0.00 0.00 52.86 52.91 1lwn s ASN 440 Cb -0.14 -2.50 1.08 0.00 -0.55 0.00 0.00 41.25 39.14 1lwn s ASN 440 CO 0.04 -1.51 2.02 0.24 -2.79 0.00 0.00 177.10 175.09 1lwn h MET 441 N 9.63 0.00 -0.42 0.43 2.86 -1.77 -2.42 114.93 123.24 1lwn h MET 441 Ca -0.27 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.25 1lwn h MET 441 Cb 1.06 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.71 1lwn h MET 441 CO 1.19 0.15 -0.21 0.00 1.06 0.00 0.00 176.91 179.10 1lwn h ALA 442 N 1.85 0.83 -0.47 6.32 0.00 -1.91 -1.78 119.26 124.09 1lwn h ALA 442 Ca -0.00 -0.37 -0.10 0.00 0.00 0.00 0.00 54.91 54.43 1lwn h ALA 442 Cb 0.28 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1lwn h ALA 442 CO 0.02 0.64 -0.12 0.45 0.00 0.00 0.00 179.25 180.25 1lwn h HIS 443 N 0.74 0.97 -0.73 0.00 3.86 -1.83 -1.93 115.15 116.23 1lwn h HIS 443 Ca 0.10 -0.19 -0.01 0.00 -1.16 0.00 0.00 60.37 59.12 1lwn h HIS 443 Cb 0.74 -0.24 -0.04 0.00 1.06 0.00 0.00 27.41 28.93 1lwn h HIS 443 CO 0.04 0.94 0.43 1.25 0.86 0.00 0.00 177.93 181.45 1lwn h LEU 444 N 0.78 0.88 -0.71 2.43 5.85 -1.18 -1.77 115.31 121.59 1lwn h LEU 444 Ca 0.13 -0.07 -0.09 0.00 0.84 0.00 0.00 57.88 58.69 1lwn h LEU 444 Cb 0.64 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 1lwn h LEU 444 CO 0.04 0.69 0.03 0.00 -0.34 0.00 0.00 178.44 178.87 1lwn h ILE 446 N 0.95 1.26 -0.55 0.00 2.04 -1.12 -2.18 117.51 117.91 1lwn h ILE 446 Ca 0.18 -0.93 -0.04 0.00 1.00 0.00 0.00 64.86 65.06 1lwn h ILE 446 Cb 0.50 1.30 -0.03 0.00 -0.74 0.00 0.00 36.82 37.86 1lwn h ILE 446 CO 0.02 0.30 0.17 0.00 0.00 0.00 0.00 178.15 178.64 1lwn h ALA 447 N 0.83 1.26 -0.68 1.87 0.00 -1.23 -3.15 119.26 118.17 1lwn h ALA 447 Ca 0.08 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1lwn h ALA 447 Cb 0.43 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1lwn h ALA 447 CO 0.02 0.52 0.00 0.41 0.00 0.00 0.00 179.25 180.20 1lwn n GLY 448 N -0.94 2.68 3.39 0.00 0.00 -0.73 -4.95 105.19 104.64 1lwn n GLY 448 Ca 0.04 -0.83 -0.30 0.00 0.00 0.00 0.00 46.02 44.94 1lwn n GLY 448 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1lwn s SER 449 N -0.95 3.37 0.00 1.61 0.01 -0.83 -3.83 113.70 113.08 1lwn s SER 449 Ca 0.50 -0.63 0.25 0.00 1.31 0.00 0.00 55.95 57.38 1lwn s SER 449 Cb 0.30 -0.32 0.55 0.00 0.21 0.00 0.00 66.02 66.76 1lwn s SER 449 CO 0.28 0.22 1.45 0.00 0.41 0.00 0.00 173.24 175.60 1lwn n HIS 450 N 1.30 0.02 -3.75 2.43 1.44 -0.54 -4.83 115.22 111.28 1lwn n HIS 450 Ca -0.17 0.00 -0.12 0.00 -2.01 0.00 0.00 57.72 55.42 1lwn n HIS 450 Cb 0.52 -0.28 -0.12 0.00 0.12 0.00 0.00 29.99 30.24 1lwn n HIS 450 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1lwn s ALA 451 N -3.01 -0.73 -0.08 1.59 0.00 -1.26 -4.61 121.76 113.67 1lwn s ALA 451 Ca 0.11 0.94 0.01 0.00 0.00 0.00 0.00 51.96 53.03 1lwn s ALA 451 Cb 0.17 -0.56 0.02 0.00 0.00 0.00 0.00 23.12 22.75 1lwn s ALA 451 CO 0.69 -0.17 -0.10 0.08 0.00 0.00 0.00 175.76 176.27 1lwn s VAL 452 N 0.53 1.01 0.06 0.00 1.01 -0.64 -0.50 120.40 121.87 1lwn s VAL 452 Ca -0.03 -0.36 0.05 0.00 0.00 0.00 0.00 61.98 61.63 1lwn s VAL 452 Cb -0.05 -0.97 -0.03 0.00 0.00 0.00 0.00 36.38 35.33 1lwn s VAL 452 CO -0.03 0.34 -0.13 0.54 0.00 0.00 0.00 175.10 175.82 1lwn s ASN 453 N 1.07 1.54 0.60 3.32 4.22 -0.35 -0.74 114.94 124.60 1lwn s ASN 453 Ca -0.07 -0.58 0.02 0.00 -2.14 0.00 0.00 52.86 50.09 1lwn s ASN 453 Cb -0.14 -0.05 0.07 0.00 1.28 0.00 0.00 41.25 42.41 1lwn s ASN 453 CO -0.01 -0.08 0.83 -0.83 -2.04 0.00 0.00 177.10 174.98 1lwn s GLY 454 N -1.61 1.80 -0.02 0.45 0.00 -1.02 -1.22 107.32 105.71 1lwn s GLY 454 Ca -0.03 -1.61 0.12 0.00 0.00 0.00 0.00 44.72 43.20 1lwn s GLY 454 CO 0.02 -1.22 1.28 3.33 0.00 0.00 0.00 173.10 176.51 1lwn n VAL 455 N -2.45 1.16 -3.58 1.40 0.24 -1.26 -2.29 118.33 111.54 1lwn n VAL 455 Ca 0.11 -1.10 -0.11 0.00 -2.04 0.00 0.00 64.34 61.20 1lwn n VAL 455 Cb 0.60 0.41 -0.06 0.00 -1.47 0.00 0.00 33.84 33.32 1lwn n VAL 455 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1lwn s ALA 456 N -1.22 -1.91 0.18 2.33 0.00 -1.26 -1.25 121.76 118.63 1lwn s ALA 456 Ca 0.26 1.63 -0.19 0.00 0.00 0.00 0.00 51.96 53.65 1lwn s ALA 456 Cb 0.15 -0.79 0.13 0.00 0.00 0.00 0.00 23.12 22.61 1lwn s ALA 456 CO 0.15 -0.30 1.60 -0.09 0.00 0.00 0.00 175.76 177.13 1lwn h ARG 457 N 3.06 -0.14 -0.61 0.00 2.43 -1.90 -0.03 114.38 117.18 1lwn h ARG 457 Ca -0.22 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 58.96 1lwn h ARG 457 Cb 1.16 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.71 1lwn h ARG 457 CO 0.27 -0.10 0.37 0.97 -1.51 0.00 0.00 179.97 179.97 1lwn h ILE 458 N -0.15 1.17 -0.20 1.20 2.10 -1.91 -1.73 117.51 117.99 1lwn h ILE 458 Ca 0.23 -0.37 -0.09 0.00 1.08 0.00 0.00 64.86 65.71 1lwn h ILE 458 Cb 0.52 0.31 -0.00 0.00 -1.09 0.00 0.00 36.82 36.56 1lwn h ILE 458 CO -0.61 0.18 -0.22 -0.74 -1.08 0.00 0.00 178.15 175.67 1lwn h HIS 459 N 0.83 0.60 -0.29 2.19 2.76 -1.43 -1.84 115.15 117.97 1lwn h HIS 459 Ca 0.22 -0.19 -0.03 0.00 -2.20 0.00 0.00 60.37 58.17 1lwn h HIS 459 Cb -0.04 -0.12 -0.02 0.00 1.55 0.00 0.00 27.41 28.78 1lwn h HIS 459 CO 0.00 0.86 0.05 0.77 -1.30 0.00 0.00 177.93 178.32 1lwn h SER 460 N 0.16 0.38 -0.29 3.26 0.02 -0.79 -1.26 113.55 115.03 1lwn h SER 460 Ca 0.03 -0.05 -0.15 0.00 -0.84 0.00 0.00 61.79 60.78 1lwn h SER 460 Cb 0.77 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 63.21 1lwn h SER 460 CO 0.05 0.41 -0.41 -0.33 -1.14 0.00 0.00 176.83 175.41 1lwn h GLU 461 N 0.41 0.79 -0.60 3.45 4.39 -1.22 -2.92 114.58 118.88 1lwn h GLU 461 Ca 0.10 -0.46 -0.03 0.00 0.34 0.00 0.00 59.36 59.31 1lwn h GLU 461 Cb 0.20 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.86 1lwn h GLU 461 CO -0.00 1.09 0.26 0.82 -1.16 0.00 0.00 179.01 180.02 1lwn h ILE 462 N 0.55 1.21 -0.86 3.13 2.04 -0.77 0.12 117.51 122.93 1lwn h ILE 462 Ca 0.03 -0.63 0.01 0.00 1.00 0.00 0.00 64.86 65.27 1lwn h ILE 462 Cb 1.01 0.47 -0.04 0.00 -0.74 0.00 0.00 36.82 37.51 1lwn h ILE 462 CO 0.10 0.25 0.56 -0.07 0.00 0.00 0.00 178.15 178.99 1lwn h LEU 463 N 0.86 1.00 -0.32 1.44 3.38 -1.14 0.22 115.31 120.74 1lwn h LEU 463 Ca 0.21 -0.04 -0.18 0.00 0.09 0.00 0.00 57.88 57.96 1lwn h LEU 463 Cb 0.14 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1lwn h LEU 463 CO -0.02 0.74 -0.85 0.11 0.09 0.00 0.00 178.44 178.51 1lwn h LYS 464 N 1.17 0.05 0.00 1.13 1.57 -1.21 -1.20 116.57 118.08 1lwn h LYS 464 Ca 0.31 -0.05 -0.14 0.00 -1.87 0.00 0.00 60.65 58.90 1lwn h LYS 464 Cb -0.11 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 1lwn h LYS 464 CO -0.07 0.86 -1.18 0.87 -0.57 0.00 0.00 179.45 179.37 1lwn h LYS 465 N 0.02 0.00 0.00 3.15 1.57 -0.67 -3.34 116.57 117.30 1lwn h LYS 465 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1lwn h LYS 465 Cb 1.48 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.79 1lwn h LYS 465 CO 0.11 0.31 0.00 0.25 -0.57 0.00 0.00 179.45 179.55 1lwn n THR 466 N -2.94 0.00 -0.31 -0.16 -2.24 0.73 -4.76 114.28 104.60 1lwn n THR 466 Ca -0.06 0.00 0.20 0.00 -2.27 0.00 0.00 64.05 61.92 1lwn n THR 466 Cb 0.79 0.00 0.48 0.00 -2.10 0.00 0.00 70.33 69.50 1lwn n THR 466 CO 0.00 0.00 0.00 0.16 -0.57 0.00 0.00 175.07 174.66 1lwn h ILE 467 N 0.00 0.59 -0.27 2.28 3.07 -1.71 -1.89 117.51 119.58 1lwn h ILE 467 Ca 0.00 -0.15 -0.05 0.00 1.55 0.00 0.00 64.86 66.20 1lwn h ILE 467 Cb 0.00 0.10 -0.03 0.00 -0.27 0.00 0.00 36.82 36.62 1lwn h ILE 467 CO 0.00 0.08 -0.02 0.49 -1.05 0.00 0.00 178.15 177.66 1lwn n PHE 468 N -4.61 0.91 -0.22 0.16 0.99 -0.45 -4.72 117.46 109.51 1lwn n PHE 468 Ca 0.23 -1.10 0.03 0.00 -0.00 0.00 0.00 57.45 56.61 1lwn n PHE 468 Cb 0.79 -0.35 0.14 0.00 -1.00 0.00 0.00 39.48 39.06 1lwn n PHE 468 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.76 176.54 1lwn h LYS 469 N 1.39 0.34 -0.63 -1.08 3.64 -1.34 -0.17 116.57 118.72 1lwn h LYS 469 Ca 0.07 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.44 1lwn h LYS 469 Cb 1.48 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 33.19 1lwn h LYS 469 CO 0.26 0.22 0.41 -0.44 -2.27 0.00 0.00 179.45 177.63 1lwn h ASP 470 N 0.35 0.70 -0.02 4.20 3.32 -1.84 -1.68 116.42 121.45 1lwn h ASP 470 Ca 0.36 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 57.27 1lwn h ASP 470 Cb 0.53 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.90 1lwn h ASP 470 CO -0.40 0.51 -0.38 -0.26 -1.72 0.00 0.00 179.24 176.99 1lwn h PHE 471 N 0.83 0.61 -0.42 4.55 -1.00 -1.69 -2.81 116.94 117.01 1lwn h PHE 471 Ca 0.24 -0.17 -0.10 0.00 2.81 0.00 0.00 57.97 60.75 1lwn h PHE 471 Cb -0.07 -0.13 -0.02 0.00 3.61 0.00 0.00 35.95 39.34 1lwn h PHE 471 CO -0.03 0.83 -0.14 -0.92 -1.61 0.00 0.00 178.31 176.43 1lwn h TYR 472 N 0.43 0.86 -0.12 -0.55 3.20 -0.72 -1.43 116.97 118.64 1lwn h TYR 472 Ca 0.04 -0.17 -0.09 0.00 3.14 0.00 0.00 58.73 61.66 1lwn h TYR 472 Cb 0.86 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.90 1lwn h TYR 472 CO 0.03 0.86 -0.33 0.93 -1.64 0.00 0.00 178.16 178.02 1lwn h GLU 473 N 0.69 0.23 0.06 1.82 5.08 -1.15 -1.46 114.58 119.85 1lwn h GLU 473 Ca 0.11 -0.09 -0.21 0.00 -1.00 0.00 0.00 59.36 58.18 1lwn h GLU 473 Cb 0.62 -0.01 0.02 0.00 0.50 0.00 0.00 28.75 29.88 1lwn h GLU 473 CO 0.04 0.54 -0.84 1.25 -1.00 0.00 0.00 179.01 179.00 1lwn h LEU 474 N 0.20 0.64 -6.30 1.33 5.85 -1.24 -3.41 115.31 112.38 1lwn h LEU 474 Ca 0.03 -0.81 -0.58 0.00 0.84 0.00 0.00 57.88 57.35 1lwn h LEU 474 Cb 0.68 -0.20 -0.39 0.00 0.37 0.00 0.00 40.66 41.12 1lwn h LEU 474 CO 0.05 1.38 -0.98 -0.62 -0.34 0.00 0.00 178.44 177.93 1lwn n GLU 475 N -4.06 0.50 -0.25 1.25 1.02 -0.56 -4.98 120.64 113.55 1lwn n GLU 475 Ca -0.12 -3.31 0.04 0.00 -0.02 0.00 0.00 57.16 53.76 1lwn n GLU 475 Cb 0.80 -1.60 0.28 0.00 -0.02 0.00 0.00 31.44 30.90 1lwn n GLU 475 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1lwn h PRO 476 N 5.12 0.91 -0.16 3.49 0.13 -1.49 -2.42 132.00 137.58 1lwn h PRO 476 Ca 0.21 -0.05 0.05 0.00 -0.87 0.00 0.00 66.00 65.33 1lwn h PRO 476 Cb 0.88 -0.20 -0.01 0.00 0.13 0.00 0.00 31.00 31.80 1lwn h PRO 476 CO 0.43 0.60 0.19 1.12 -0.23 0.00 0.00 178.00 180.11 1lwn h HIS 477 N 0.93 0.00 -0.33 1.56 2.07 -1.94 -2.81 115.15 114.64 1lwn h HIS 477 Ca 0.35 0.00 -0.14 0.00 -2.85 0.00 0.00 60.37 57.73 1lwn h HIS 477 Cb 0.18 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.15 1lwn h HIS 477 CO -0.00 0.00 -0.36 0.87 -3.07 0.00 0.00 177.93 175.37 1lwn h LYS 478 N 0.00 0.75 -6.31 5.12 1.57 -1.68 -3.45 116.57 112.57 1lwn h LYS 478 Ca 0.08 -0.37 -0.55 0.00 -1.87 0.00 0.00 60.65 57.93 1lwn h LYS 478 Cb 0.46 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.75 1lwn h LYS 478 CO -0.00 0.99 0.65 -0.06 -0.57 0.00 0.00 179.45 180.46 1lwn s PHE 479 N -4.37 3.29 0.39 -1.35 0.40 -1.06 -1.63 117.98 113.65 1lwn s PHE 479 Ca -0.09 1.33 0.05 0.00 -0.60 0.00 0.00 56.93 57.62 1lwn s PHE 479 Cb 0.12 -3.35 -0.02 0.00 0.51 0.00 0.00 43.02 40.27 1lwn s PHE 479 CO 0.85 -1.00 0.19 -0.65 0.70 0.00 0.00 175.22 175.31 1lwn s GLN 480 N 2.09 1.89 0.02 0.44 -0.21 0.08 -4.97 119.66 119.00 1lwn s GLN 480 Ca 0.54 -2.14 0.03 0.00 0.02 0.00 0.00 55.36 53.81 1lwn s GLN 480 Cb -0.23 -0.23 -0.01 0.00 1.00 0.00 0.00 33.01 33.53 1lwn s GLN 480 CO 0.21 -0.57 -0.10 1.21 -2.12 0.00 0.00 175.29 173.92 1lwn s ASN 481 N -3.53 1.21 -0.36 5.90 2.47 -1.26 -2.44 114.94 116.93 1lwn s ASN 481 Ca 0.29 -0.33 0.02 0.00 0.42 0.00 0.00 52.86 53.26 1lwn s ASN 481 Cb 0.02 -0.08 0.15 0.00 -1.45 0.00 0.00 41.25 39.89 1lwn s ASN 481 CO 0.20 0.03 0.32 -0.54 -3.72 0.00 0.00 177.10 173.38 1lwn s LYS 482 N -0.78 0.59 0.27 0.43 -0.14 -0.97 -4.91 119.74 114.23 1lwn s LYS 482 Ca 0.00 -0.99 -0.31 0.00 -1.36 0.00 0.00 55.97 53.32 1lwn s LYS 482 Cb -0.06 -0.91 -0.12 0.00 -1.68 0.00 0.00 37.83 35.06 1lwn s LYS 482 CO 0.00 -1.19 1.64 0.99 -0.76 0.00 0.00 175.35 176.03 1lwn s THR 483 N 1.35 2.03 1.12 2.17 2.01 -1.26 -4.29 115.64 118.77 1lwn s THR 483 Ca 0.17 0.03 -0.12 0.00 0.31 0.00 0.00 61.69 62.07 1lwn s THR 483 Cb -0.18 -3.02 0.26 0.00 0.01 0.00 0.00 72.50 69.57 1lwn s THR 483 CO -0.03 0.00 1.05 0.20 -0.69 0.00 0.00 174.62 175.15 1lwn s ASN 484 N 0.72 1.36 0.34 3.53 0.02 -0.38 -4.62 114.94 115.90 1lwn s ASN 484 Ca 0.67 1.63 -0.17 0.00 -1.02 0.00 0.00 52.86 53.97 1lwn s ASN 484 Cb -0.49 -2.34 0.04 0.00 0.02 0.00 0.00 41.25 38.48 1lwn s ASN 484 CO 0.43 -3.98 0.73 -0.83 0.02 0.00 0.00 177.10 173.47 1lwn s GLY 485 N -2.58 0.28 0.13 0.66 0.00 -1.26 -4.81 107.32 99.74 1lwn s GLY 485 Ca 0.68 -0.64 0.06 0.00 0.00 0.00 0.00 44.72 44.81 1lwn s GLY 485 CO 0.63 -0.29 -0.13 -0.26 0.00 0.00 0.00 173.10 173.05 1lwn s ILE 486 N -3.01 1.30 -0.11 0.90 -4.36 -0.15 -4.50 121.20 111.27 1lwn s ILE 486 Ca 0.15 -1.79 -0.28 0.00 -0.26 0.00 0.00 60.65 58.47 1lwn s ILE 486 Cb -0.05 -1.59 -0.02 0.00 1.25 0.00 0.00 42.46 42.05 1lwn s ILE 486 CO 0.10 -0.49 0.93 0.28 0.24 0.00 0.00 174.94 176.00 1lwn s THR 487 N -2.38 4.84 -0.28 8.37 -1.32 -1.26 -0.63 115.64 122.98 1lwn s THR 487 Ca 0.10 1.88 0.26 0.00 -1.21 0.00 0.00 61.69 62.72 1lwn s THR 487 Cb -0.03 -4.24 0.27 0.00 -1.51 0.00 0.00 72.50 66.98 1lwn s THR 487 CO 0.03 0.05 1.77 1.55 -2.21 0.00 0.00 174.62 175.81 1lwn h PRO 488 N 7.09 0.00 0.44 7.08 0.13 -1.93 -2.09 132.00 142.72 1lwn h PRO 488 Ca -0.33 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.78 1lwn h PRO 488 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1lwn h PRO 488 CO 0.83 0.00 -0.21 0.00 -0.23 0.00 0.00 178.00 178.38 1lwn h ARG 489 N 0.00 -0.58 -0.30 0.86 -0.00 -1.91 -2.51 114.38 109.94 1lwn h ARG 489 Ca 0.00 0.04 -0.15 0.00 -0.50 0.00 0.00 59.98 59.37 1lwn h ARG 489 Cb 0.29 0.13 -0.00 0.00 0.00 0.00 0.00 29.97 30.39 1lwn h ARG 489 CO 0.00 -0.38 -0.40 -0.09 0.00 0.00 0.00 179.97 179.09 1lwn h ARG 490 N -0.87 0.80 -0.32 0.04 2.43 -1.96 0.17 114.38 114.67 1lwn h ARG 490 Ca -0.06 -0.46 0.00 0.00 -0.81 0.00 0.00 59.98 58.65 1lwn h ARG 490 Cb 0.46 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.04 1lwn h ARG 490 CO 0.10 1.09 0.00 0.91 -1.51 0.00 0.00 179.97 180.56 1lwn n TRP 491 N -4.14 0.24 0.05 2.20 7.02 -0.79 -2.63 117.44 119.40 1lwn n TRP 491 Ca -0.04 -0.11 0.00 0.00 -1.02 0.00 0.00 57.50 56.33 1lwn n TRP 491 Cb 0.55 -0.04 0.00 0.00 -2.42 0.00 0.00 31.31 29.40 1lwn n TRP 491 CO 0.00 0.00 0.00 -0.11 -2.02 0.00 0.00 177.69 175.56 1lwn n LEU 492 N -0.03 -0.56 -0.16 -0.99 7.94 -0.98 -4.79 117.00 117.44 1lwn n LEU 492 Ca 0.05 0.17 -0.04 0.00 -1.11 0.00 0.00 56.01 55.08 1lwn n LEU 492 Cb 0.19 0.74 0.05 0.00 0.53 0.00 0.00 43.42 44.93 1lwn n LEU 492 CO 0.04 -0.43 1.00 0.58 -1.11 0.00 0.00 177.39 177.47 1lwn h VAL 493 N 0.00 0.93 0.10 1.96 2.07 -1.11 0.14 116.25 120.34 1lwn h VAL 493 Ca 0.00 -0.15 -0.00 0.00 0.82 0.00 0.00 66.70 67.36 1lwn h VAL 493 Cb 0.00 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 30.21 1lwn h VAL 493 CO 0.00 0.08 -0.05 -0.07 0.02 0.00 0.00 177.57 177.55 1lwn h LEU 494 N 0.45 -0.11 0.00 2.57 4.07 -0.77 -3.29 115.31 118.22 1lwn h LEU 494 Ca 0.22 -0.47 0.00 0.00 0.08 0.00 0.00 57.88 57.71 1lwn h LEU 494 Cb 0.15 0.03 0.00 0.00 1.08 0.00 0.00 40.66 41.92 1lwn h LEU 494 CO -0.17 0.49 -0.47 0.00 -1.08 0.00 0.00 178.44 177.21 1lwn n ASN 496 N -2.89 1.73 -0.04 0.00 4.05 0.50 -4.87 115.26 113.73 1lwn n ASN 496 Ca 0.02 -3.07 0.01 0.00 0.45 0.00 0.00 54.58 52.00 1lwn n ASN 496 Cb 0.54 -0.63 0.33 0.00 1.23 0.00 0.00 39.78 41.25 1lwn n ASN 496 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 1lwn h PRO 497 N 3.71 0.63 -0.82 1.20 0.13 -1.66 -1.59 132.00 133.60 1lwn h PRO 497 Ca 0.12 -0.08 0.02 0.00 -0.87 0.00 0.00 66.00 65.19 1lwn h PRO 497 Cb 0.80 -0.12 -0.04 0.00 0.13 0.00 0.00 31.00 31.76 1lwn h PRO 497 CO 0.61 0.50 0.53 0.78 -0.23 0.00 0.00 178.00 180.20 1lwn h GLY 498 N 0.76 1.17 0.86 1.56 0.00 -1.91 0.04 103.07 105.55 1lwn h GLY 498 Ca 0.16 -0.42 -0.11 0.00 0.00 0.00 0.00 47.33 46.96 1lwn h GLY 498 CO -0.02 0.39 -0.34 -2.00 0.00 0.00 0.00 176.54 174.56 1lwn h LEU 499 N 1.07 0.60 -1.03 3.11 6.46 -1.82 -2.95 115.31 120.75 1lwn h LEU 499 Ca 0.31 -0.55 0.07 0.00 -0.12 0.00 0.00 57.88 57.59 1lwn h LEU 499 Cb -0.07 -0.17 -0.07 0.00 -0.73 0.00 0.00 40.66 39.62 1lwn h LEU 499 CO -0.09 1.04 0.64 0.00 -0.62 0.00 0.00 178.44 179.41 1lwn h ALA 500 N 0.57 1.43 0.11 1.25 0.00 -0.89 -2.19 119.26 119.54 1lwn h ALA 500 Ca 0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1lwn h ALA 500 Cb 0.94 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1lwn h ALA 500 CO 0.08 0.40 -0.05 1.49 0.00 0.00 0.00 179.25 181.17 1lwn h GLU 501 N 1.14 -0.14 0.00 0.00 4.81 -0.98 -0.87 114.58 118.54 1lwn h GLU 501 Ca 0.44 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.65 1lwn h GLU 501 Cb 0.22 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.62 1lwn h GLU 501 CO -0.18 0.15 -0.13 -0.84 -0.73 0.00 0.00 179.01 177.27 1lwn h ILE 502 N -0.42 0.59 0.10 2.32 3.07 -1.36 -1.04 117.51 120.77 1lwn h ILE 502 Ca -0.01 -0.59 -0.27 0.00 1.55 0.00 0.00 64.86 65.54 1lwn h ILE 502 Cb 0.35 1.38 0.03 0.00 -0.27 0.00 0.00 36.82 38.30 1lwn h ILE 502 CO 0.02 0.13 -1.11 0.40 -1.05 0.00 0.00 178.15 176.54 1lwn h ILE 503 N 0.00 1.32 -0.11 0.16 2.04 -1.30 -3.27 117.51 116.36 1lwn h ILE 503 Ca -0.00 -2.41 -0.08 0.00 1.00 0.00 0.00 64.86 63.38 1lwn h ILE 503 Cb 0.37 2.72 -0.01 0.00 -0.74 0.00 0.00 36.82 39.16 1lwn h ILE 503 CO 0.02 0.72 -0.28 0.00 0.00 0.00 0.00 178.15 178.61 1lwn h ALA 504 N 0.27 1.33 0.00 1.87 0.00 -0.71 -1.35 119.26 120.68 1lwn h ALA 504 Ca -0.17 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1lwn h ALA 504 Cb 1.80 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.51 1lwn h ALA 504 CO 0.21 0.46 0.00 1.05 0.00 0.00 0.00 179.25 180.98 1lwn h GLU 505 N 0.17 0.00 0.00 0.00 4.11 -1.26 0.12 114.58 117.73 1lwn h GLU 505 Ca 0.03 0.00 -0.34 0.00 0.07 0.00 0.00 59.36 59.11 1lwn h GLU 505 Cb 0.60 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.78 1lwn h GLU 505 CO 0.04 0.00 -2.30 0.54 0.07 0.00 0.00 179.01 177.36 1lwn n ARG 506 N -2.95 0.59 -0.01 1.06 5.12 -0.98 -4.76 116.66 114.72 1lwn n ARG 506 Ca 0.00 0.13 0.00 0.00 -1.93 0.00 0.00 57.85 56.05 1lwn n ARG 506 Cb 0.24 -1.46 0.01 0.00 -1.16 0.00 0.00 32.46 30.09 1lwn n ARG 506 CO 0.00 0.00 0.00 0.44 -1.93 0.00 0.00 177.63 176.14 1lwn n ILE 507 N -3.16 0.85 -1.10 0.55 -5.35 -0.55 -5.13 119.36 105.48 1lwn n ILE 507 Ca -0.40 -0.93 0.00 0.00 -0.27 0.00 0.00 62.75 61.15 1lwn n ILE 507 Cb 0.94 0.58 0.00 0.00 -1.74 0.00 0.00 39.64 39.41 1lwn n ILE 507 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1lwn n GLY 508 N -0.37 -2.57 0.79 3.28 0.00 0.42 -4.62 105.19 102.11 1lwn n GLY 508 Ca 0.01 -1.76 0.10 0.00 0.00 0.00 0.00 46.02 44.36 1lwn n GLY 508 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1lwn n GLU 509 N -0.27 1.73 0.29 1.61 1.02 -1.26 -4.15 120.64 119.61 1lwn n GLU 509 Ca 0.00 -1.70 0.18 0.00 -0.02 0.00 0.00 57.16 55.62 1lwn n GLU 509 Cb 0.00 -1.37 0.83 0.00 -0.02 0.00 0.00 31.44 30.88 1lwn n GLU 509 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1lwn h GLU 510 N 3.72 0.00 0.00 3.49 5.08 -1.96 -2.88 114.58 122.03 1lwn h GLU 510 Ca 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 1lwn h GLU 510 Cb 0.80 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.05 1lwn h GLU 510 CO 0.00 0.04 -0.16 0.10 -1.00 0.00 0.00 179.01 177.99 1lwn h TYR 511 N 0.00 0.00 -0.07 4.33 -0.00 -1.80 -2.91 116.97 116.51 1lwn h TYR 511 Ca -0.00 0.00 0.02 0.00 0.00 0.00 0.00 58.73 58.75 1lwn h TYR 511 Cb 0.35 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.08 1lwn h TYR 511 CO 0.00 0.16 0.14 0.82 -0.00 0.00 0.00 178.16 179.28 1lwn h ILE 512 N 0.00 0.27 0.00 -0.90 2.04 -1.86 -0.92 117.51 116.13 1lwn h ILE 512 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1lwn h ILE 512 Cb 0.39 0.88 0.00 0.00 -0.74 0.00 0.00 36.82 37.35 1lwn h ILE 512 CO 0.02 0.00 -0.17 -1.54 0.00 0.00 0.00 178.15 176.47 1lwn n SER 513 N -3.45 1.25 -2.76 1.72 3.41 -1.16 -4.67 113.62 107.97 1lwn n SER 513 Ca -0.01 -2.33 -0.08 0.00 -0.26 0.00 0.00 58.87 56.19 1lwn n SER 513 Cb 0.23 -0.24 0.04 0.00 -0.26 0.00 0.00 64.21 63.98 1lwn n SER 513 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1lwn n ASP 514 N -0.66 -2.96 0.21 4.04 4.64 -0.47 -5.03 116.55 116.32 1lwn n ASP 514 Ca 0.07 -3.23 0.17 0.00 -1.38 0.00 0.00 54.79 50.42 1lwn n ASP 514 Cb 0.59 1.78 0.83 0.00 -1.04 0.00 0.00 41.12 43.28 1lwn n ASP 514 CO 0.00 0.00 0.00 0.25 -0.82 0.00 0.00 177.20 176.63 1lwn h LEU 515 N 4.18 0.00 -2.03 -2.67 5.85 -1.52 -2.19 115.31 116.93 1lwn h LEU 515 Ca -0.11 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.61 1lwn h LEU 515 Cb 1.04 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.07 1lwn h LEU 515 CO 0.28 0.00 0.15 0.44 -0.34 0.00 0.00 178.44 178.97 1lwn h ASP 516 N 0.00 0.00 0.71 1.25 3.45 -1.85 0.11 116.42 120.09 1lwn h ASP 516 Ca 0.08 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.54 1lwn h ASP 516 Cb 0.46 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.23 1lwn h ASP 516 CO -0.00 0.00 0.00 0.00 -1.57 0.00 0.00 179.24 177.67 1lwn n GLN 517 N -2.69 0.14 0.32 3.56 6.02 -0.82 -2.14 117.38 121.77 1lwn n GLN 517 Ca -0.02 0.35 0.21 0.00 -0.01 0.00 0.00 57.00 57.53 1lwn n GLN 517 Cb 0.20 -1.75 1.09 0.00 1.02 0.00 0.00 30.24 30.80 1lwn n GLN 517 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1lwn h LEU 518 N 0.00 0.00 -0.96 1.08 3.38 -1.21 -1.79 115.31 115.82 1lwn h LEU 518 Ca 0.00 0.00 0.16 0.00 0.09 0.00 0.00 57.88 58.13 1lwn h LEU 518 Cb 0.36 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.01 1lwn h LEU 518 CO 0.00 0.00 0.56 -0.09 0.09 0.00 0.00 178.44 179.00 1lwn h ARG 519 N 0.00 0.74 -0.15 1.13 9.65 -1.13 -0.13 114.38 124.48 1lwn h ARG 519 Ca 0.00 -0.04 0.04 0.00 -1.10 0.00 0.00 59.98 58.88 1lwn h ARG 519 Cb 0.09 -0.17 -0.01 0.00 -1.39 0.00 0.00 29.97 28.50 1lwn h ARG 519 CO 0.00 0.49 0.40 0.87 2.80 0.00 0.00 179.97 184.53 1lwn h LYS 520 N 0.76 0.00 0.00 0.20 1.57 -1.57 -0.20 116.57 117.33 1lwn h LYS 520 Ca 0.53 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.31 1lwn h LYS 520 Cb 0.75 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.06 1lwn h LYS 520 CO -0.36 0.00 0.00 -0.07 -0.57 0.00 0.00 179.45 178.45 1lwn h LEU 521 N 0.00 0.00 -1.46 2.94 3.38 -1.22 -2.67 115.31 116.29 1lwn h LEU 521 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1lwn h LEU 521 Cb 0.88 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.63 1lwn h LEU 521 CO -0.00 0.00 0.00 -0.07 0.09 0.00 0.00 178.44 178.46 1lwn h LEU 522 N 0.00 0.00 -0.06 1.67 3.38 -1.21 0.92 115.31 120.02 1lwn h LEU 522 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1lwn h LEU 522 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1lwn h LEU 522 CO 0.00 0.00 -0.12 -1.20 0.09 0.00 0.00 178.44 177.21 1lwn n SER 523 N -2.31 0.21 -0.49 -0.43 7.64 -1.01 -3.51 113.62 113.72 1lwn n SER 523 Ca -0.01 -0.00 0.06 0.00 1.01 0.00 0.00 58.87 59.93 1lwn n SER 523 Cb 0.06 -0.22 0.15 0.00 -1.01 0.00 0.00 64.21 63.19 1lwn n SER 523 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1lwn n TYR 524 N -1.34 0.44 0.26 1.43 4.02 0.32 -4.64 117.16 117.64 1lwn n TYR 524 Ca 0.10 -0.71 0.08 0.00 -0.01 0.00 0.00 57.90 57.36 1lwn n TYR 524 Cb 0.31 -0.14 0.65 0.00 -0.02 0.00 0.00 39.34 40.13 1lwn n TYR 524 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 1lwn h VAL 525 N 1.18 0.97 -0.00 -0.72 2.07 -1.61 -2.40 116.25 115.73 1lwn h VAL 525 Ca 0.00 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.43 1lwn h VAL 525 Cb 0.96 1.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.78 1lwn h VAL 525 CO 0.07 0.03 -0.75 0.47 0.02 0.00 0.00 177.57 177.40 1lwn n ASP 526 N -4.43 1.22 -4.64 0.57 8.00 -1.26 -4.88 116.55 111.13 1lwn n ASP 526 Ca -0.03 -1.11 -0.43 0.00 0.71 0.00 0.00 54.79 53.94 1lwn n ASP 526 Cb 0.11 0.83 -0.03 0.00 -0.02 0.00 0.00 41.12 42.02 1lwn n ASP 526 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1lwn s ASP 527 N -2.64 6.55 0.47 -2.24 3.68 -0.90 -4.88 116.67 116.70 1lwn s ASP 527 Ca 0.10 1.84 0.13 0.00 2.13 0.00 0.00 52.55 56.75 1lwn s ASP 527 Cb 0.15 -2.53 1.09 0.00 -1.45 0.00 0.00 42.92 40.18 1lwn s ASP 527 CO 0.70 -1.08 2.09 -0.08 0.13 0.00 0.00 175.17 176.93 1lwn h GLU 528 N 10.01 0.18 0.16 4.34 4.57 -1.92 -1.56 114.58 130.36 1lwn h GLU 528 Ca -0.35 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 57.81 1lwn h GLU 528 Cb 1.16 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.71 1lwn h GLU 528 CO 0.98 0.15 -0.07 0.00 -1.18 0.00 0.00 179.01 178.89 1lwn h ALA 529 N 1.88 -0.21 -0.25 2.92 0.00 -1.95 -1.66 119.26 120.00 1lwn h ALA 529 Ca 0.05 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.81 1lwn h ALA 529 Cb 0.04 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1lwn h ALA 529 CO -0.01 -0.49 0.15 0.35 0.00 0.00 0.00 179.25 179.26 1lwn h PHE 530 N -0.47 0.28 -0.73 0.00 -0.00 -1.80 -0.47 116.94 113.75 1lwn h PHE 530 Ca -0.02 0.01 0.12 0.00 -0.00 0.00 0.00 57.97 58.07 1lwn h PHE 530 Cb 0.37 -0.09 -0.08 0.00 -0.00 0.00 0.00 35.95 36.15 1lwn h PHE 530 CO 0.01 0.17 0.33 0.82 -0.00 0.00 0.00 178.31 179.65 1lwn h ILE 531 N 0.31 0.76 -0.60 1.41 2.04 -1.26 0.15 117.51 120.32 1lwn h ILE 531 Ca 0.09 -0.18 -0.09 0.00 1.00 0.00 0.00 64.86 65.68 1lwn h ILE 531 Cb -0.02 0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 36.23 1lwn h ILE 531 CO -0.04 0.10 0.01 0.03 0.00 0.00 0.00 178.15 178.25 1lwn h ARG 532 N 0.53 1.05 -0.43 2.37 3.08 -0.68 -2.55 114.38 117.75 1lwn h ARG 532 Ca 0.38 -0.33 -0.09 0.00 0.07 0.00 0.00 59.98 60.01 1lwn h ARG 532 Cb 0.49 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.43 1lwn h ARG 532 CO -0.33 1.03 -0.07 -0.44 -1.07 0.00 0.00 179.97 179.09 1lwn h ASP 533 N 0.95 0.81 -0.33 7.04 3.45 0.35 -0.98 116.42 127.71 1lwn h ASP 533 Ca 0.17 -0.35 -0.01 0.00 0.43 0.00 0.00 57.03 57.28 1lwn h ASP 533 Cb 0.55 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 39.08 1lwn h ASP 533 CO 0.03 0.96 0.17 0.58 -1.57 0.00 0.00 179.24 179.42 1lwn h VAL 534 N 0.64 1.15 0.00 -1.35 2.07 -0.72 -0.59 116.25 117.44 1lwn h VAL 534 Ca 0.11 -0.40 -0.06 0.00 0.82 0.00 0.00 66.70 67.18 1lwn h VAL 534 Cb 0.59 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 1lwn h VAL 534 CO 0.04 0.15 -0.29 0.00 0.02 0.00 0.00 177.57 177.49 1lwn h ALA 535 N 1.04 1.52 -0.12 1.67 0.00 -1.38 -2.57 119.26 119.42 1lwn h ALA 535 Ca 0.12 -0.26 -0.16 0.00 0.00 0.00 0.00 54.91 54.61 1lwn h ALA 535 Cb 0.08 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 17.83 1lwn h ALA 535 CO -0.02 0.36 -0.53 -0.22 0.00 0.00 0.00 179.25 178.84 1lwn h LYS 536 N 0.00 0.57 -0.86 0.00 3.64 -0.60 -2.53 116.57 116.79 1lwn h LYS 536 Ca -0.00 -0.45 0.01 0.00 -1.27 0.00 0.00 60.65 58.93 1lwn h LYS 536 Cb 0.51 0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.38 1lwn h LYS 536 CO 0.04 1.08 0.57 0.28 -2.27 0.00 0.00 179.45 179.14 1lwn h VAL 537 N 0.19 1.22 -0.50 2.00 2.07 -0.96 -1.54 116.25 118.72 1lwn h VAL 537 Ca -0.03 -0.40 -0.09 0.00 0.82 0.00 0.00 66.70 67.00 1lwn h VAL 537 Cb 1.17 -0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 1lwn h VAL 537 CO 0.11 0.21 -0.06 0.50 0.02 0.00 0.00 177.57 178.35 1lwn h LYS 538 N 1.16 0.89 -0.40 1.57 1.63 -1.46 -1.80 116.57 118.15 1lwn h LYS 538 Ca 0.32 -0.29 -0.12 0.00 -0.85 0.00 0.00 60.65 59.71 1lwn h LYS 538 Cb -0.13 -0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 31.41 1lwn h LYS 538 CO -0.07 0.92 -0.24 0.37 -3.45 0.00 0.00 179.45 176.98 1lwn h GLN 539 N 0.81 0.82 -0.40 1.90 5.75 -1.01 -1.11 115.11 121.87 1lwn h GLN 539 Ca 0.14 -0.34 -0.11 0.00 -0.15 0.00 0.00 58.65 58.19 1lwn h GLN 539 Cb 0.57 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 29.07 1lwn h GLN 539 CO 0.03 0.97 -0.20 0.93 -2.65 0.00 0.00 178.83 177.91 1lwn h GLU 540 N 0.71 0.77 -0.51 1.69 5.08 -1.15 0.02 114.58 121.19 1lwn h GLU 540 Ca 0.09 -0.30 -0.09 0.00 -1.00 0.00 0.00 59.36 58.06 1lwn h GLU 540 Cb 0.77 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.96 1lwn h GLU 540 CO 0.06 0.91 -0.04 -0.91 -1.00 0.00 0.00 179.01 178.04 1lwn h ASN 541 N 0.68 0.87 -0.06 1.42 -0.26 -1.06 -1.05 115.58 116.11 1lwn h ASN 541 Ca 0.10 -0.24 -0.15 0.00 -0.56 0.00 0.00 56.30 55.45 1lwn h ASN 541 Cb 0.71 -0.23 -0.01 0.00 -1.06 0.00 0.00 38.32 37.73 1lwn h ASN 541 CO 0.05 0.95 -0.48 0.11 -1.06 0.00 0.00 177.43 177.01 1lwn h LYS 542 N 0.81 0.62 -0.36 0.81 1.57 -0.85 -0.78 116.57 118.40 1lwn h LYS 542 Ca 0.15 -0.36 -0.05 0.00 -1.87 0.00 0.00 60.65 58.52 1lwn h LYS 542 Cb 0.54 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 1lwn h LYS 542 CO 0.03 0.96 0.03 -0.07 -0.57 0.00 0.00 179.45 179.84 1lwn h LEU 543 N 0.49 0.59 -0.24 2.94 4.07 -0.75 -1.12 115.31 121.29 1lwn h LEU 543 Ca 0.03 -0.28 -0.00 0.00 0.08 0.00 0.00 57.88 57.70 1lwn h LEU 543 Cb 1.01 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 42.59 1lwn h LEU 543 CO 0.09 0.73 0.14 0.50 -1.08 0.00 0.00 178.44 178.82 1lwn h LYS 544 N 0.44 0.33 -0.63 1.13 3.64 -1.07 -1.77 116.57 118.63 1lwn h LYS 544 Ca 0.11 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 1lwn h LYS 544 Cb 0.40 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.13 1lwn h LYS 544 CO 0.01 0.28 0.32 0.35 -2.27 0.00 0.00 179.45 178.14 1lwn h PHE 545 N 0.28 0.90 -0.07 1.91 3.57 -1.02 -0.46 116.94 122.05 1lwn h PHE 545 Ca 0.08 -0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 1lwn h PHE 545 Cb 0.04 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.50 1lwn h PHE 545 CO -0.04 0.67 -0.07 0.00 -2.23 0.00 0.00 178.31 176.64 1lwn h ALA 546 N 1.14 1.77 -0.15 2.41 0.00 -0.99 -0.73 119.26 122.71 1lwn h ALA 546 Ca 0.22 -0.10 -0.21 0.00 0.00 0.00 0.00 54.91 54.82 1lwn h ALA 546 Cb 0.10 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.85 1lwn h ALA 546 CO -0.03 0.18 -0.72 0.00 0.00 0.00 0.00 179.25 178.68 1lwn h ALA 547 N 1.84 0.29 -0.55 0.00 0.00 -0.61 -2.65 119.26 117.57 1lwn h ALA 547 Ca 0.02 -0.58 -0.05 0.00 0.00 0.00 0.00 54.91 54.30 1lwn h ALA 547 Cb 0.18 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1lwn h ALA 547 CO 0.01 0.62 0.13 -0.92 0.00 0.00 0.00 179.25 179.09 1lwn h TYR 548 N 0.46 0.87 -0.34 0.00 5.03 -0.37 -1.83 116.97 120.80 1lwn h TYR 548 Ca -0.05 -0.08 -0.06 0.00 2.58 0.00 0.00 58.73 61.13 1lwn h TYR 548 Cb 1.35 -0.26 -0.01 0.00 1.55 0.00 0.00 36.73 39.36 1lwn h TYR 548 CO 0.09 0.73 -0.00 -0.07 -1.32 0.00 0.00 178.16 177.59 1lwn h LEU 549 N 0.82 0.59 -0.40 2.82 3.38 -1.11 -2.50 115.31 118.90 1lwn h LEU 549 Ca 0.18 -0.31 -0.08 0.00 0.09 0.00 0.00 57.88 57.76 1lwn h LEU 549 Cb 0.30 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1lwn h LEU 549 CO -0.00 0.76 -0.05 1.05 0.09 0.00 0.00 178.44 180.29 1lwn h GLU 550 N 0.40 0.74 0.97 1.13 4.11 -1.33 0.11 114.58 120.71 1lwn h GLU 550 Ca 0.10 -0.26 -0.05 0.00 0.07 0.00 0.00 59.36 59.22 1lwn h GLU 550 Cb 0.46 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.66 1lwn h GLU 550 CO 0.02 0.85 -0.47 0.00 0.07 0.00 0.00 179.01 179.48 1lwn h ARG 551 N 0.56 -1.25 0.00 1.06 3.08 -1.29 -2.36 114.38 114.18 1lwn h ARG 551 Ca 0.11 0.09 0.00 0.00 0.07 0.00 0.00 59.98 60.24 1lwn h ARG 551 Cb 0.55 0.29 0.00 0.00 0.08 0.00 0.00 29.97 30.88 1lwn h ARG 551 CO 0.03 -0.84 -0.73 0.39 -1.07 0.00 0.00 179.97 177.76 1lwn n GLU 552 N -5.65 0.12 -0.65 0.04 -0.58 -0.95 -4.55 120.64 108.42 1lwn n GLU 552 Ca -0.16 0.01 0.01 0.00 -0.42 0.00 0.00 57.16 56.60 1lwn n GLU 552 Cb 0.51 -1.55 0.01 0.00 -0.57 0.00 0.00 31.44 29.84 1lwn n GLU 552 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 1lwn n TYR 553 N -1.72 0.00 0.00 -0.32 4.01 0.33 -5.07 117.16 114.39 1lwn n TYR 553 Ca 0.04 -0.14 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 1lwn n TYR 553 Cb 0.38 -0.07 0.00 0.00 -0.31 0.00 0.00 39.34 39.33 1lwn n TYR 553 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1lwn n LYS 554 N 0.01 0.00 0.00 -0.72 4.81 -0.89 -4.84 118.16 116.53 1lwn n LYS 554 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.46 1lwn n LYS 554 Cb 0.77 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.82 1lwn n LYS 554 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 1lwn n VAL 555 N 0.80 0.00 -2.90 3.15 0.31 -1.26 -5.01 118.33 113.43 1lwn n VAL 555 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.32 1lwn n VAL 555 Cb 0.00 0.00 0.01 0.00 -0.91 0.00 0.00 33.84 32.94 1lwn n VAL 555 CO 0.00 0.00 0.00 -2.28 -1.32 0.00 0.00 176.83 173.23 1lwn s HIS 556 N -1.00 -1.19 0.35 3.52 2.46 -1.26 -4.69 115.29 113.48 1lwn s HIS 556 Ca 0.00 -0.09 -0.25 0.00 0.47 0.00 0.00 55.06 55.19 1lwn s HIS 556 Cb 0.00 0.23 -0.10 0.00 -0.13 0.00 0.00 32.58 32.58 1lwn s HIS 556 CO 0.00 -0.87 0.96 0.96 -2.47 0.00 0.00 174.74 173.32 1lwn s ILE 557 N 1.43 4.17 -0.32 0.89 -4.36 -1.26 -5.01 121.20 116.74 1lwn s ILE 557 Ca 0.21 1.69 -0.28 0.00 -0.26 0.00 0.00 60.65 62.01 1lwn s ILE 557 Cb 0.01 -3.89 0.01 0.00 1.25 0.00 0.00 42.46 39.85 1lwn s ILE 557 CO -0.09 0.04 1.01 0.21 0.24 0.00 0.00 174.94 176.35 1lwn s ASN 558 N -1.71 6.88 0.00 4.36 2.47 -1.26 -4.93 114.94 120.75 1lwn s ASN 558 Ca 0.53 0.97 0.12 0.00 0.42 0.00 0.00 52.86 54.90 1lwn s ASN 558 Cb -0.17 -2.51 0.72 0.00 -1.45 0.00 0.00 41.25 37.84 1lwn s ASN 558 CO 0.22 -0.82 1.16 -0.81 -3.72 0.00 0.00 177.10 173.13 1lwn n PRO 559 N 6.71 0.52 0.00 0.43 -0.04 -1.26 -2.37 135.00 138.98 1lwn n PRO 559 Ca 0.10 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.64 1lwn n PRO 559 Cb 0.47 -1.37 0.01 0.00 -0.04 0.00 0.00 33.50 32.58 1lwn n PRO 559 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1lwn n ASN 560 N -0.87 1.81 -4.90 3.54 5.03 -1.26 -4.86 115.26 113.76 1lwn n ASN 560 Ca 0.09 -1.41 -0.28 0.00 0.87 0.00 0.00 54.58 53.85 1lwn n ASN 560 Cb 0.04 0.36 0.07 0.00 -1.02 0.00 0.00 39.78 39.24 1lwn n ASN 560 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 1lwn s SER 561 N -1.80 4.84 -0.08 6.41 1.04 -1.00 -4.93 113.70 118.17 1lwn s SER 561 Ca 0.15 0.79 -0.29 0.00 0.48 0.00 0.00 55.95 57.07 1lwn s SER 561 Cb 0.13 -1.41 -0.02 0.00 0.10 0.00 0.00 66.02 64.82 1lwn s SER 561 CO 0.36 -1.67 0.99 -0.22 0.98 0.00 0.00 173.24 173.69 1lwn s LEU 562 N -5.43 4.27 -0.72 2.42 2.96 -0.26 -4.82 118.68 117.12 1lwn s LEU 562 Ca 0.60 1.54 -0.23 0.00 -0.22 0.00 0.00 54.13 55.82 1lwn s LEU 562 Cb -0.11 -3.54 0.07 0.00 0.50 0.00 0.00 46.19 43.11 1lwn s LEU 562 CO 0.48 -0.40 1.05 -0.36 -1.32 0.00 0.00 176.35 175.81 1lwn s PHE 563 N 1.79 2.65 -0.49 5.38 0.40 -1.26 -0.67 117.98 125.77 1lwn s PHE 563 Ca 0.49 -0.57 -0.20 0.00 -0.60 0.00 0.00 56.93 56.04 1lwn s PHE 563 Cb -0.19 -4.36 0.04 0.00 0.51 0.00 0.00 43.02 39.02 1lwn s PHE 563 CO 0.20 -1.71 0.68 0.34 0.70 0.00 0.00 175.22 175.42 1lwn s ASP 564 N 3.75 6.28 -0.08 1.36 3.68 -0.04 -1.71 116.67 129.91 1lwn s ASP 564 Ca 0.26 -0.61 0.04 0.00 2.13 0.00 0.00 52.55 54.38 1lwn s ASP 564 Cb -0.14 -2.32 -0.01 0.00 -1.45 0.00 0.00 42.92 39.00 1lwn s ASP 564 CO 0.08 -0.89 -0.21 -0.69 0.13 0.00 0.00 175.17 173.59 1lwn s VAL 565 N 2.89 2.44 -0.31 1.11 1.01 -0.37 0.13 120.40 127.30 1lwn s VAL 565 Ca 0.20 -0.92 -0.02 0.00 0.00 0.00 0.00 61.98 61.25 1lwn s VAL 565 Cb -0.16 -1.94 0.10 0.00 0.00 0.00 0.00 36.38 34.39 1lwn s VAL 565 CO 0.16 0.56 0.12 -1.58 0.00 0.00 0.00 175.10 174.36 1lwn s GLN 566 N -0.10 0.54 -0.11 2.72 0.74 -0.13 -1.33 119.66 121.98 1lwn s GLN 566 Ca -0.04 -0.92 0.02 0.00 0.05 0.00 0.00 55.36 54.46 1lwn s GLN 566 Cb -0.14 -1.68 0.02 0.00 1.10 0.00 0.00 33.01 32.31 1lwn s GLN 566 CO 0.04 -1.01 -0.14 0.14 -0.55 0.00 0.00 175.29 173.76 1lwn s VAL 567 N 1.72 1.45 0.00 1.34 -7.23 -1.26 -1.90 120.40 114.51 1lwn s VAL 567 Ca 0.10 -0.61 0.00 0.00 -1.81 0.00 0.00 61.98 59.66 1lwn s VAL 567 Cb -0.17 -1.33 0.00 0.00 0.56 0.00 0.00 36.38 35.44 1lwn s VAL 567 CO -0.28 0.43 0.00 2.29 -0.31 0.00 0.00 175.10 177.24 1lwn n LYS 568 N 4.24 0.00 -1.67 4.82 2.85 -1.06 -4.99 118.16 122.35 1lwn n LYS 568 Ca -0.19 0.00 -0.39 0.00 -1.05 0.00 0.00 58.31 56.68 1lwn n LYS 568 Cb 0.51 0.00 0.04 0.00 -0.65 0.00 0.00 35.03 34.93 1lwn n LYS 568 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1lwn n ARG 569 N -0.33 1.32 -2.56 -1.58 5.12 -1.26 -4.08 116.66 113.29 1lwn n ARG 569 Ca 0.00 0.49 -0.43 0.00 -1.93 0.00 0.00 57.85 55.99 1lwn n ARG 569 Cb 0.00 -2.32 -0.02 0.00 -1.16 0.00 0.00 32.46 28.96 1lwn n ARG 569 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1lwn s ILE 570 N -1.37 4.51 -0.05 0.55 -1.09 -0.60 -4.90 121.20 118.24 1lwn s ILE 570 Ca 0.72 1.81 -0.18 0.00 -2.23 0.00 0.00 60.65 60.76 1lwn s ILE 570 Cb -0.44 -4.16 0.04 0.00 -1.58 0.00 0.00 42.46 36.31 1lwn s ILE 570 CO 0.50 -0.05 0.41 -1.00 -1.23 0.00 0.00 174.94 173.56 1lwn s HIS 571 N 2.54 -0.33 0.26 3.97 3.76 -1.26 -4.75 115.29 119.48 1lwn s HIS 571 Ca 0.51 0.61 -0.02 0.00 -0.15 0.00 0.00 55.06 56.01 1lwn s HIS 571 Cb -0.20 0.17 0.32 0.00 1.11 0.00 0.00 32.58 33.98 1lwn s HIS 571 CO 0.17 -0.40 1.76 0.93 -0.85 0.00 0.00 174.74 176.35 1lwn h GLU 572 N 4.02 0.83 0.00 1.40 5.08 -1.97 -2.78 114.58 121.16 1lwn h GLU 572 Ca -0.29 -0.21 -0.03 0.00 -1.00 0.00 0.00 59.36 57.83 1lwn h GLU 572 Cb 1.17 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.31 1lwn h GLU 572 CO 0.36 0.81 -0.16 0.10 -1.00 0.00 0.00 179.01 179.12 1lwn h TYR 573 N 0.78 0.00 0.00 4.33 -0.00 -1.97 -2.07 116.97 118.03 1lwn h TYR 573 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.89 1lwn h TYR 573 Cb 0.42 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.15 1lwn h TYR 573 CO 0.02 0.16 0.00 1.63 -0.00 0.00 0.00 178.16 179.98 1lwn n LYS 574 N -3.36 0.13 -3.68 0.10 5.02 -1.05 -2.84 118.16 112.48 1lwn n LYS 574 Ca -0.00 0.16 -0.22 0.00 -2.02 0.00 0.00 58.31 56.22 1lwn n LYS 574 Cb 0.38 -1.66 0.03 0.00 -0.02 0.00 0.00 35.03 33.76 1lwn n LYS 574 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1lwn n ARG 575 N -1.89 -4.32 0.23 1.97 1.74 -0.78 -3.97 116.66 109.65 1lwn n ARG 575 Ca 0.06 0.61 0.09 0.00 -0.77 0.00 0.00 57.85 57.83 1lwn n ARG 575 Cb 0.35 -5.08 0.58 0.00 -1.02 0.00 0.00 32.46 27.29 1lwn n ARG 575 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1lwn h GLN 576 N -1.82 0.00 -0.51 5.56 7.50 -1.84 -1.67 115.11 122.32 1lwn h GLN 576 Ca -0.62 0.00 -0.03 0.00 0.50 0.00 0.00 58.65 58.50 1lwn h GLN 576 Cb 1.36 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.86 1lwn h GLN 576 CO 0.55 0.20 0.19 -0.07 -1.50 0.00 0.00 178.83 178.20 1lwn h LEU 577 N 0.00 0.68 -0.77 1.46 3.38 -1.91 0.37 115.31 118.52 1lwn h LEU 577 Ca -0.00 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 1lwn h LEU 577 Cb 0.44 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 1lwn h LEU 577 CO 0.03 0.63 0.31 0.25 0.09 0.00 0.00 178.44 179.74 1lwn h LEU 578 N 0.74 1.06 -0.27 1.67 5.85 -1.68 -0.37 115.31 122.31 1lwn h LEU 578 Ca 0.18 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1lwn h LEU 578 Cb 0.17 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 1lwn h LEU 578 CO -0.01 0.94 0.17 -1.13 -0.34 0.00 0.00 178.44 178.07 1lwn h ASN 579 N 1.12 0.32 -0.73 1.25 -0.00 -1.21 -2.33 115.58 114.00 1lwn h ASN 579 Ca 0.26 -0.04 0.08 0.00 -0.00 0.00 0.00 56.30 56.60 1lwn h ASN 579 Cb 0.21 -0.08 -0.06 0.00 -0.00 0.00 0.00 38.32 38.39 1lwn h ASN 579 CO -0.02 0.26 0.40 0.00 -0.00 0.00 0.00 177.43 178.06 1lwn h LEU 581 N 0.70 0.90 -0.28 0.00 3.38 -0.71 -2.02 115.31 117.28 1lwn h LEU 581 Ca 0.34 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 58.20 1lwn h LEU 581 Cb 0.29 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1lwn h LEU 581 CO -0.23 0.69 -0.07 -0.74 0.09 0.00 0.00 178.44 178.19 1lwn h HIS 582 N 1.04 0.62 -0.06 1.13 2.76 -0.68 -1.70 115.15 118.26 1lwn h HIS 582 Ca 0.27 -0.13 -0.07 0.00 -2.20 0.00 0.00 60.37 58.24 1lwn h HIS 582 Cb -0.04 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 28.75 1lwn h HIS 582 CO 0.00 0.75 -0.28 -0.39 -1.30 0.00 0.00 177.93 176.71 1lwn h VAL 583 N 0.31 1.23 -0.15 5.26 -1.51 -1.07 -0.49 116.25 119.81 1lwn h VAL 583 Ca 0.07 -1.08 -0.14 0.00 -1.23 0.00 0.00 66.70 64.33 1lwn h VAL 583 Cb 0.55 1.50 -0.01 0.00 -2.13 0.00 0.00 31.29 31.19 1lwn h VAL 583 CO 0.03 0.32 -0.51 0.40 -1.23 0.00 0.00 177.57 176.58 1lwn h ILE 584 N 0.10 1.33 -0.62 7.19 2.04 -1.27 -1.40 117.51 124.89 1lwn h ILE 584 Ca 0.01 -1.74 -0.04 0.00 1.00 0.00 0.00 64.86 64.09 1lwn h ILE 584 Cb 0.55 1.77 -0.03 0.00 -0.74 0.00 0.00 36.82 38.37 1lwn h ILE 584 CO 0.04 0.53 0.21 0.74 0.00 0.00 0.00 178.15 179.67 1lwn h THR 585 N 0.33 1.24 -0.55 -0.27 2.02 -0.37 -0.27 112.91 115.04 1lwn h THR 585 Ca 0.01 -0.80 -0.02 0.00 0.77 0.00 0.00 66.41 66.37 1lwn h THR 585 Cb 1.00 0.60 -0.03 0.00 -1.74 0.00 0.00 68.15 67.99 1lwn h THR 585 CO 0.09 0.31 0.25 -0.07 0.37 0.00 0.00 175.52 176.47 1lwn h LEU 586 N 0.88 0.73 -0.21 2.58 4.07 -0.86 -1.28 115.31 121.22 1lwn h LEU 586 Ca 0.20 -0.14 -0.03 0.00 0.08 0.00 0.00 57.88 57.99 1lwn h LEU 586 Cb 0.26 -0.19 -0.01 0.00 1.08 0.00 0.00 40.66 41.81 1lwn h LEU 586 CO -0.01 0.67 0.03 0.22 -1.08 0.00 0.00 178.44 178.27 1lwn h TYR 587 N 0.75 0.38 -0.51 1.13 3.20 -0.99 -2.19 116.97 118.75 1lwn h TYR 587 Ca 0.19 -0.06 -0.03 0.00 3.14 0.00 0.00 58.73 61.97 1lwn h TYR 587 Cb 0.14 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.28 1lwn h TYR 587 CO -0.00 0.51 0.18 -0.91 -1.64 0.00 0.00 178.16 176.30 1lwn h ASN 588 N 0.15 0.67 -0.37 -2.11 -0.26 -0.94 -1.61 115.58 111.11 1lwn h ASN 588 Ca 0.06 -0.09 -0.03 0.00 -0.56 0.00 0.00 56.30 55.69 1lwn h ASN 588 Cb 0.34 -0.17 -0.02 0.00 -1.06 0.00 0.00 38.32 37.41 1lwn h ASN 588 CO 0.01 0.62 0.13 0.03 -1.06 0.00 0.00 177.43 177.15 1lwn h ARG 589 N 0.73 0.56 -0.40 0.81 -0.00 -1.07 -1.16 114.38 113.85 1lwn h ARG 589 Ca 0.17 -0.11 -0.04 0.00 -0.50 0.00 0.00 59.98 59.50 1lwn h ARG 589 Cb 0.17 -0.08 -0.02 0.00 0.00 0.00 0.00 29.97 30.04 1lwn h ARG 589 CO -0.01 0.56 0.09 0.82 0.00 0.00 0.00 179.97 181.43 1lwn h ILE 590 N 0.44 1.23 -0.56 2.04 2.04 -1.11 -2.00 117.51 119.60 1lwn h ILE 590 Ca 0.12 -0.81 -0.01 0.00 1.00 0.00 0.00 64.86 65.16 1lwn h ILE 590 Cb 0.23 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.28 1lwn h ILE 590 CO -0.01 0.28 0.29 0.11 0.00 0.00 0.00 178.15 178.82 1lwn h LYS 591 N 0.50 0.77 -0.19 2.37 1.79 -1.18 0.33 116.57 120.95 1lwn h LYS 591 Ca 0.12 -0.08 -0.03 0.00 -2.18 0.00 0.00 60.65 58.48 1lwn h LYS 591 Cb 0.33 -0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 30.82 1lwn h LYS 591 CO 0.00 0.58 0.01 -0.22 -1.08 0.00 0.00 179.45 178.74 1lwn h LYS 592 N 0.77 0.33 -2.63 3.15 3.64 -0.92 -3.35 116.57 117.55 1lwn h LYS 592 Ca 0.20 -0.10 -0.60 0.00 -1.27 0.00 0.00 60.65 58.87 1lwn h LYS 592 Cb 0.05 -0.03 -0.40 0.00 -0.41 0.00 0.00 32.23 31.43 1lwn h LYS 592 CO -0.03 0.52 -0.76 0.39 -2.27 0.00 0.00 179.45 177.30 1lwn n GLU 593 N -4.72 1.24 0.25 1.90 1.02 -0.78 -4.98 120.64 114.58 1lwn n GLU 593 Ca -0.05 -3.94 0.08 0.00 -0.02 0.00 0.00 57.16 53.23 1lwn n GLU 593 Cb 0.22 -1.97 0.62 0.00 -0.02 0.00 0.00 31.44 30.28 1lwn n GLU 593 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1lwn h PRO 594 N 5.21 0.00 -0.62 3.49 0.13 -0.51 -2.82 132.00 136.87 1lwn h PRO 594 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 1lwn h PRO 594 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 1lwn h PRO 594 CO 0.59 0.03 0.00 0.09 -0.23 0.00 0.00 178.00 178.48 1lwn n ASN 595 N -4.50 3.80 -4.86 1.44 3.02 -1.26 -4.88 115.26 108.02 1lwn n ASN 595 Ca -0.03 -2.35 -0.35 0.00 -0.03 0.00 0.00 54.58 51.82 1lwn n ASN 595 Cb 0.12 -0.51 -0.06 0.00 -0.61 0.00 0.00 39.78 38.72 1lwn n ASN 595 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1lwn s LYS 596 N -1.78 3.77 0.29 3.52 2.20 -1.07 -5.06 119.74 121.61 1lwn s LYS 596 Ca 0.40 0.20 -0.28 0.00 -0.36 0.00 0.00 55.97 55.93 1lwn s LYS 596 Cb 0.26 -3.05 -0.09 0.00 -1.51 0.00 0.00 37.83 33.43 1lwn s LYS 596 CO 0.19 0.60 1.00 0.12 -0.36 0.00 0.00 175.35 176.90 1lwn s PHE 597 N -1.31 3.73 -0.02 4.03 5.36 -1.26 -5.06 117.98 123.45 1lwn s PHE 597 Ca 0.30 1.80 -0.05 0.00 -0.96 0.00 0.00 56.93 58.02 1lwn s PHE 597 Cb -0.14 -3.08 0.00 0.00 -0.34 0.00 0.00 43.02 39.46 1lwn s PHE 597 CO 0.16 -0.02 0.11 0.14 -1.46 0.00 0.00 175.22 174.15 1lwn s VAL 598 N -1.31 0.05 -0.08 3.12 -7.23 -1.26 -5.11 120.40 108.59 1lwn s VAL 598 Ca 0.46 -0.43 -0.29 0.00 -1.81 0.00 0.00 61.98 59.91 1lwn s VAL 598 Cb -0.26 -0.30 -0.06 0.00 0.56 0.00 0.00 36.38 36.32 1lwn s VAL 598 CO 0.33 -0.23 1.81 -0.69 -0.31 0.00 0.00 175.10 176.00 1lwn s VAL 599 N -0.78 3.37 0.49 1.32 1.01 -1.26 -4.92 120.40 119.62 1lwn s VAL 599 Ca -0.09 0.43 -0.23 0.00 0.00 0.00 0.00 61.98 62.09 1lwn s VAL 599 Cb -0.05 -3.32 -0.07 0.00 0.00 0.00 0.00 36.38 32.94 1lwn s VAL 599 CO 0.01 -0.08 1.24 -2.65 0.00 0.00 0.00 175.10 173.61 1lwn n PRO 600 N 7.55 1.67 -3.89 2.72 -0.02 -1.26 -4.89 135.00 136.88 1lwn n PRO 600 Ca 0.20 0.61 -0.11 0.00 -2.02 0.00 0.00 63.50 62.17 1lwn n PRO 600 Cb 0.43 -2.40 -0.13 0.00 -0.02 0.00 0.00 33.50 31.38 1lwn n PRO 600 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1lwn s ARG 601 N -2.50 0.08 -0.29 -0.52 0.52 -0.58 -1.10 118.95 114.57 1lwn s ARG 601 Ca 0.67 -0.12 0.01 0.00 -0.52 0.00 0.00 55.73 55.76 1lwn s ARG 601 Cb -0.47 0.03 0.06 0.00 0.52 0.00 0.00 34.95 35.09 1lwn s ARG 601 CO 0.53 -0.01 -0.05 0.99 0.02 0.00 0.00 175.30 176.79 1lwn s THR 602 N -0.32 2.58 -0.28 0.02 2.01 0.15 -1.92 115.64 117.88 1lwn s THR 602 Ca -0.04 -1.56 -0.15 0.00 0.31 0.00 0.00 61.69 60.26 1lwn s THR 602 Cb -0.02 -2.52 -0.03 0.00 0.01 0.00 0.00 72.50 69.93 1lwn s THR 602 CO -0.00 -0.10 0.37 -0.69 -0.69 0.00 0.00 174.62 173.51 1lwn s VAL 603 N 1.16 5.17 -0.15 3.82 1.01 0.12 -0.86 120.40 130.67 1lwn s VAL 603 Ca -0.06 0.50 0.00 0.00 0.00 0.00 0.00 61.98 62.42 1lwn s VAL 603 Cb -0.20 -3.72 -0.00 0.00 0.00 0.00 0.00 36.38 32.46 1lwn s VAL 603 CO -0.03 0.12 -0.15 -0.04 0.00 0.00 0.00 175.10 174.99 1lwn s MET 604 N 2.07 3.22 -0.07 2.72 -1.94 0.12 -0.27 119.30 125.16 1lwn s MET 604 Ca 0.15 -0.75 0.02 0.00 -1.71 0.00 0.00 55.69 53.40 1lwn s MET 604 Cb -0.16 -2.63 0.02 0.00 2.01 0.00 0.00 34.83 34.07 1lwn s MET 604 CO 0.10 0.03 -0.11 0.42 -0.01 0.00 0.00 175.02 175.45 1lwn s ILE 605 N 0.79 1.03 0.08 2.53 1.01 -0.27 -0.96 121.20 125.41 1lwn s ILE 605 Ca -0.06 -0.41 -0.04 0.00 0.00 0.00 0.00 60.65 60.14 1lwn s ILE 605 Cb -0.15 -0.96 -0.02 0.00 0.01 0.00 0.00 42.46 41.33 1lwn s ILE 605 CO 0.00 0.34 0.08 -0.83 0.00 0.00 0.00 174.94 174.52 1lwn s GLY 606 N 0.79 0.36 0.00 6.18 0.00 -0.80 -1.08 107.32 112.78 1lwn s GLY 606 Ca -0.12 -0.99 0.00 0.00 0.00 0.00 0.00 44.72 43.61 1lwn s GLY 606 CO 0.02 -1.10 0.00 0.61 0.00 0.00 0.00 173.10 172.63 1lwn n GLY 607 N 0.01 4.01 3.92 0.20 0.00 -1.26 -2.56 105.19 109.52 1lwn n GLY 607 Ca -0.13 -1.01 -0.29 0.00 0.00 0.00 0.00 46.02 44.59 1lwn n GLY 607 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lwn s LYS 608 N -2.82 3.51 0.00 1.61 1.02 -1.26 -4.66 119.74 117.15 1lwn s LYS 608 Ca 0.00 -0.35 0.04 0.00 0.02 0.00 0.00 55.97 55.68 1lwn s LYS 608 Cb 0.00 -2.91 -0.03 0.00 -0.52 0.00 0.00 37.83 34.37 1lwn s LYS 608 CO 0.00 0.48 -0.10 0.00 -0.92 0.00 0.00 175.35 174.81 1lwn s ALA 609 N -1.72 2.89 0.44 5.17 0.00 -1.26 -1.56 121.76 125.72 1lwn s ALA 609 Ca 0.38 -1.04 -0.25 0.00 0.00 0.00 0.00 51.96 51.04 1lwn s ALA 609 Cb -0.12 -1.04 -0.08 0.00 0.00 0.00 0.00 23.12 21.89 1lwn s ALA 609 CO 0.28 0.60 1.33 0.00 0.00 0.00 0.00 175.76 177.97 1lwn s ALA 610 N -0.94 3.16 0.26 0.00 0.00 -1.26 -4.91 121.76 118.06 1lwn s ALA 610 Ca 0.16 1.29 -0.02 0.00 0.00 0.00 0.00 51.96 53.39 1lwn s ALA 610 Cb -0.11 -3.52 0.54 0.00 0.00 0.00 0.00 23.12 20.03 1lwn s ALA 610 CO 0.06 -1.00 1.73 -1.35 0.00 0.00 0.00 175.76 175.20 1lwn h PRO 611 N 2.33 0.45 -0.63 0.00 0.11 -1.99 -2.54 132.00 129.73 1lwn h PRO 611 Ca -0.50 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1lwn h PRO 611 Cb 1.26 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1lwn h PRO 611 CO 0.61 0.30 0.00 0.41 -0.21 0.00 0.00 178.00 179.11 1lwn n GLY 612 N -1.33 2.14 3.39 -0.55 0.00 -1.26 -4.71 105.19 102.87 1lwn n GLY 612 Ca 0.17 -0.64 -0.45 0.00 0.00 0.00 0.00 46.02 45.09 1lwn n GLY 612 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1lwn s TYR 613 N -1.84 3.76 0.16 1.61 6.14 -0.96 -4.92 117.35 121.30 1lwn s TYR 613 Ca 0.39 -2.15 -0.23 0.00 0.64 0.00 0.00 57.07 55.72 1lwn s TYR 613 Cb 0.26 -4.02 0.05 0.00 0.42 0.00 0.00 41.96 38.67 1lwn s TYR 613 CO 0.18 -1.16 1.60 1.25 0.64 0.00 0.00 175.55 178.06 1lwn h HIS 614 N 7.45 -0.86 -0.89 4.97 -0.00 -1.86 -2.20 115.15 121.76 1lwn h HIS 614 Ca 0.19 0.05 0.06 0.00 -0.00 0.00 0.00 60.37 60.67 1lwn h HIS 614 Cb 0.94 0.43 -0.06 0.00 -0.00 0.00 0.00 27.41 28.73 1lwn h HIS 614 CO 0.98 -0.37 0.56 1.98 -0.00 0.00 0.00 177.93 181.08 1lwn h MET 615 N -0.26 1.01 -0.29 5.26 1.85 -1.98 -0.90 114.93 119.62 1lwn h MET 615 Ca 0.17 -0.06 -0.05 0.00 -0.61 0.00 0.00 59.70 59.14 1lwn h MET 615 Cb 0.53 -0.23 -0.02 0.00 0.43 0.00 0.00 31.60 32.32 1lwn h MET 615 CO -0.51 0.67 -0.04 0.00 -0.40 0.00 0.00 176.91 176.62 1lwn h ALA 616 N 1.41 1.39 0.00 0.39 0.00 -1.79 -0.75 119.26 119.91 1lwn h ALA 616 Ca 0.38 -0.21 -0.14 0.00 0.00 0.00 0.00 54.91 54.95 1lwn h ALA 616 Cb 0.14 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1lwn h ALA 616 CO -0.16 0.42 -0.66 0.87 0.00 0.00 0.00 179.25 179.72 1lwn h LYS 617 N 0.44 0.00 -0.13 0.00 1.57 -0.76 -2.88 116.57 114.81 1lwn h LYS 617 Ca 0.09 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.71 1lwn h LYS 617 Cb 0.35 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 1lwn h LYS 617 CO 0.01 0.66 -0.60 0.52 -0.57 0.00 0.00 179.45 179.48 1lwn h MET 618 N 0.00 0.42 -0.42 3.15 2.86 -0.46 -2.87 114.93 117.62 1lwn h MET 618 Ca -0.01 -0.29 -0.08 0.00 -2.06 0.00 0.00 59.70 57.27 1lwn h MET 618 Cb 1.31 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.99 1lwn h MET 618 CO 0.09 0.90 -0.07 0.82 1.06 0.00 0.00 176.91 179.70 1lwn h ILE 619 N 0.32 1.25 -0.56 -1.22 2.04 -1.03 -0.89 117.51 117.41 1lwn h ILE 619 Ca -0.00 -1.07 -0.07 0.00 1.00 0.00 0.00 64.86 64.71 1lwn h ILE 619 Cb 1.13 1.01 -0.02 0.00 -0.74 0.00 0.00 36.82 38.20 1lwn h ILE 619 CO 0.10 0.37 0.07 0.40 0.00 0.00 0.00 178.15 179.09 1lwn h ILE 620 N 0.66 1.26 -0.43 -0.67 2.04 -1.41 -1.32 117.51 117.63 1lwn h ILE 620 Ca 0.12 -1.00 -0.08 0.00 1.00 0.00 0.00 64.86 64.90 1lwn h ILE 620 Cb 0.52 0.82 -0.02 0.00 -0.74 0.00 0.00 36.82 37.40 1lwn h ILE 620 CO 0.03 0.36 -0.04 0.50 0.00 0.00 0.00 178.15 179.00 1lwn h LYS 621 N 0.82 0.72 -0.53 2.37 1.63 -1.25 -1.99 116.57 118.34 1lwn h LYS 621 Ca 0.17 -0.20 -0.07 0.00 -0.85 0.00 0.00 60.65 59.69 1lwn h LYS 621 Cb 0.44 -0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 31.97 1lwn h LYS 621 CO 0.01 0.76 0.04 1.25 -3.45 0.00 0.00 179.45 178.07 1lwn h LEU 622 N 0.67 0.87 -0.46 5.20 5.85 -0.82 -0.06 115.31 126.55 1lwn h LEU 622 Ca 0.13 -0.28 -0.00 0.00 0.84 0.00 0.00 57.88 58.56 1lwn h LEU 622 Cb 0.48 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1lwn h LEU 622 CO 0.02 0.94 0.28 0.40 -0.34 0.00 0.00 178.44 179.74 1lwn h ILE 623 N 0.78 1.15 -0.22 4.05 2.04 -0.80 -0.81 117.51 123.70 1lwn h ILE 623 Ca 0.15 -0.34 -0.12 0.00 1.00 0.00 0.00 64.86 65.55 1lwn h ILE 623 Cb 0.47 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 1lwn h ILE 623 CO 0.02 0.15 -0.39 0.71 0.00 0.00 0.00 178.15 178.64 1lwn h THR 624 N 0.61 1.30 -0.31 -0.27 1.35 -1.25 -2.52 112.91 111.82 1lwn h THR 624 Ca 0.17 -1.54 -0.08 0.00 -0.55 0.00 0.00 66.41 64.41 1lwn h THR 624 Cb 0.00 1.56 -0.02 0.00 -1.73 0.00 0.00 68.15 67.96 1lwn h THR 624 CO -0.03 0.48 -0.13 0.00 -0.25 0.00 0.00 175.52 175.59 1lwn h ALA 625 N 1.16 1.19 -0.55 6.62 0.00 -0.61 -1.36 119.26 125.71 1lwn h ALA 625 Ca 0.04 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.56 1lwn h ALA 625 Cb 0.87 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1lwn h ALA 625 CO 0.07 0.52 -0.08 0.82 0.00 0.00 0.00 179.25 180.58 1lwn h ILE 626 N 0.50 1.27 -0.16 0.00 2.04 -0.94 -2.81 117.51 117.41 1lwn h ILE 626 Ca 0.09 -1.23 -0.08 0.00 1.00 0.00 0.00 64.86 64.64 1lwn h ILE 626 Cb 0.52 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.53 1lwn h ILE 626 CO 0.03 0.44 -0.25 1.23 0.00 0.00 0.00 178.15 179.60 1lwn h GLY 627 N 0.91 0.31 1.01 5.37 0.00 -1.02 -1.13 103.07 108.51 1lwn h GLY 627 Ca 0.15 -0.24 0.01 0.00 0.00 0.00 0.00 47.33 47.25 1lwn h GLY 627 CO 0.04 0.22 0.56 -0.55 0.00 0.00 0.00 176.54 176.82 1lwn h ASP 628 N 0.26 0.99 0.12 0.19 3.45 -1.00 -0.11 116.42 120.32 1lwn h ASP 628 Ca 0.04 -0.03 -0.01 0.00 0.43 0.00 0.00 57.03 57.47 1lwn h ASP 628 Cb 0.59 -0.25 0.00 0.00 -0.56 0.00 0.00 39.33 39.11 1lwn h ASP 628 CO 0.04 0.72 -0.06 0.58 -1.57 0.00 0.00 179.24 178.95 1lwn h VAL 629 N 1.16 0.32 -0.63 -1.35 2.07 -1.38 -3.31 116.25 113.12 1lwn h VAL 629 Ca 0.31 -1.07 0.02 0.00 0.82 0.00 0.00 66.70 66.79 1lwn h VAL 629 Cb -0.13 0.57 -0.04 0.00 -1.52 0.00 0.00 31.29 30.18 1lwn h VAL 629 CO -0.07 0.10 0.40 0.58 0.02 0.00 0.00 177.57 178.60 1lwn h VAL 630 N -1.02 1.10 0.00 2.57 2.07 -1.25 -2.63 116.25 117.09 1lwn h VAL 630 Ca -0.02 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1lwn h VAL 630 Cb 0.29 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.29 1lwn h VAL 630 CO 0.03 0.15 0.00 0.78 0.02 0.00 0.00 177.57 178.54 1lwn h ASN 631 N 0.80 0.00 -0.12 0.57 2.35 -1.19 -3.03 115.58 114.95 1lwn h ASN 631 Ca 0.25 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.00 1lwn h ASN 631 Cb -0.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.36 1lwn h ASN 631 CO -0.09 0.00 0.00 1.41 -1.65 0.00 0.00 177.43 177.10 1lwn n HIS 632 N -2.38 0.16 -2.77 1.19 8.25 -1.07 -4.94 115.22 113.66 1lwn n HIS 632 Ca 0.02 -0.45 -0.43 0.00 -0.26 0.00 0.00 57.72 56.60 1lwn n HIS 632 Cb 0.23 -0.04 -0.04 0.00 1.12 0.00 0.00 29.99 31.27 1lwn n HIS 632 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1lwn s ASP 633 N -0.93 6.62 0.50 0.41 3.68 -1.02 -4.93 116.67 121.00 1lwn s ASP 633 Ca 0.08 0.43 0.15 0.00 2.13 0.00 0.00 52.55 55.34 1lwn s ASP 633 Cb 0.04 -2.47 1.20 0.00 -1.45 0.00 0.00 42.92 40.24 1lwn s ASP 633 CO 0.06 -0.98 2.11 1.55 0.13 0.00 0.00 175.17 178.04 1lwn h PRO 634 N 8.77 0.12 0.00 4.34 0.13 -1.92 -2.24 132.00 141.21 1lwn h PRO 634 Ca -0.23 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 1lwn h PRO 634 Cb 1.07 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1lwn h PRO 634 CO 1.02 0.08 0.00 -0.39 -0.23 0.00 0.00 178.00 178.48 1lwn h VAL 635 N 0.12 0.00 0.05 1.56 -1.51 -1.97 -3.04 116.25 111.46 1lwn h VAL 635 Ca 0.07 -0.65 -0.13 0.00 -1.23 0.00 0.00 66.70 64.76 1lwn h VAL 635 Cb 0.12 1.62 0.01 0.00 -2.13 0.00 0.00 31.29 30.91 1lwn h VAL 635 CO -0.01 0.00 -0.53 0.58 -1.23 0.00 0.00 177.57 176.38 1lwn h VAL 636 N 0.00 1.52 0.00 7.19 2.07 -1.75 -3.48 116.25 121.80 1lwn h VAL 636 Ca 0.00 -2.22 0.00 0.00 0.82 0.00 0.00 66.70 65.30 1lwn h VAL 636 Cb 0.75 2.91 0.00 0.00 -1.52 0.00 0.00 31.29 33.43 1lwn h VAL 636 CO 0.00 0.62 0.00 0.61 0.02 0.00 0.00 177.57 178.82 1lwn n GLY 637 N 1.31 2.86 0.48 2.17 0.00 -1.10 -2.62 105.19 108.29 1lwn n GLY 637 Ca -0.11 -0.32 0.10 0.00 0.00 0.00 0.00 46.02 45.69 1lwn n GLY 637 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1lwn n ASP 638 N 3.49 1.45 0.22 1.61 5.75 -1.26 -4.22 116.55 123.58 1lwn n ASP 638 Ca 0.00 -1.68 0.11 0.00 -0.01 0.00 0.00 54.79 53.21 1lwn n ASP 638 Cb 0.00 -0.09 0.22 0.00 -1.03 0.00 0.00 41.12 40.22 1lwn n ASP 638 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 1lwn h ARG 639 N 1.91 0.00 -2.64 0.11 3.08 -1.85 -3.43 114.38 111.56 1lwn h ARG 639 Ca 0.00 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.93 1lwn h ARG 639 Cb 0.42 0.00 -0.27 0.00 0.08 0.00 0.00 29.97 30.20 1lwn h ARG 639 CO 0.00 0.08 -0.34 -1.17 -1.07 0.00 0.00 179.97 177.47 1lwn s LEU 640 N -6.26 -0.23 -0.04 3.04 2.96 -1.26 -1.52 118.68 115.37 1lwn s LEU 640 Ca 0.06 0.89 0.01 0.00 -0.22 0.00 0.00 54.13 54.86 1lwn s LEU 640 Cb 0.06 1.29 0.02 0.00 0.50 0.00 0.00 46.19 48.06 1lwn s LEU 640 CO 0.66 -0.20 -0.02 -0.60 -1.32 0.00 0.00 176.35 174.87 1lwn s ARG 641 N 1.76 0.57 -0.23 1.98 6.06 -0.81 -4.69 118.95 123.59 1lwn s ARG 641 Ca -0.07 -0.01 -0.03 0.00 -2.50 0.00 0.00 55.73 53.12 1lwn s ARG 641 Cb -0.10 -0.67 0.01 0.00 0.06 0.00 0.00 34.95 34.25 1lwn s ARG 641 CO -0.12 -0.11 -0.05 0.08 -2.50 0.00 0.00 175.30 172.59 1lwn s VAL 642 N 1.00 3.14 -0.05 7.11 1.01 -1.26 0.15 120.40 131.49 1lwn s VAL 642 Ca -0.10 -0.73 0.05 0.00 0.00 0.00 0.00 61.98 61.20 1lwn s VAL 642 Cb -0.14 -2.50 -0.01 0.00 0.00 0.00 0.00 36.38 33.74 1lwn s VAL 642 CO -0.01 0.33 -0.20 -0.63 0.00 0.00 0.00 175.10 174.58 1lwn s ILE 643 N 1.41 1.70 -0.34 2.22 -1.09 0.63 -4.62 121.20 121.12 1lwn s ILE 643 Ca 0.04 -0.86 -0.13 0.00 -2.23 0.00 0.00 60.65 57.47 1lwn s ILE 643 Cb -0.15 -1.46 -0.01 0.00 -1.58 0.00 0.00 42.46 39.26 1lwn s ILE 643 CO -0.04 0.48 0.23 0.12 -1.23 0.00 0.00 174.94 174.50 1lwn s PHE 644 N 0.00 3.22 -0.48 3.97 5.36 -1.26 -1.12 117.98 127.68 1lwn s PHE 644 Ca -0.05 -0.30 -0.29 0.00 -0.96 0.00 0.00 56.93 55.33 1lwn s PHE 644 Cb -0.13 -2.47 0.03 0.00 -0.34 0.00 0.00 43.02 40.11 1lwn s PHE 644 CO 0.03 -0.39 1.12 -0.51 -1.46 0.00 0.00 175.22 174.01 1lwn s LEU 645 N 1.70 3.66 0.43 6.12 1.43 -0.24 -4.96 118.68 126.82 1lwn s LEU 645 Ca 0.06 0.40 -0.21 0.00 -1.03 0.00 0.00 54.13 53.34 1lwn s LEU 645 Cb -0.17 -3.49 -0.11 0.00 0.03 0.00 0.00 46.19 42.45 1lwn s LEU 645 CO 0.10 -1.25 0.96 -1.83 0.23 0.00 0.00 176.35 174.56 1lwn s GLU 646 N 4.43 4.21 -1.27 1.70 -1.05 -1.26 -3.98 118.70 121.47 1lwn s GLU 646 Ca 0.46 1.18 -0.02 0.00 -0.15 0.00 0.00 54.97 56.44 1lwn s GLU 646 Cb -0.07 -2.24 0.01 0.00 -0.44 0.00 0.00 34.13 31.39 1lwn s GLU 646 CO 0.31 -0.05 0.96 -1.71 0.95 0.00 0.00 175.26 175.72 1lwn n ASN 647 N -0.55 -2.75 -4.71 0.83 5.15 -1.25 -4.92 115.26 107.06 1lwn n ASN 647 Ca 0.07 -0.67 -0.42 0.00 -0.60 0.00 0.00 54.58 52.96 1lwn n ASN 647 Cb 0.53 -4.77 -0.03 0.00 -0.53 0.00 0.00 39.78 34.98 1lwn n ASN 647 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 1lwn s TYR 648 N -3.42 2.73 0.35 1.20 6.14 -1.26 -4.88 117.35 118.21 1lwn s TYR 648 Ca 0.14 0.27 -0.13 0.00 0.64 0.00 0.00 57.07 58.00 1lwn s TYR 648 Cb -0.07 -4.13 0.03 0.00 0.42 0.00 0.00 41.96 38.21 1lwn s TYR 648 CO 0.76 -4.38 0.67 -0.98 0.64 0.00 0.00 175.55 172.26 1lwn s ARG 649 N 1.57 2.04 0.21 4.97 1.70 -1.26 -4.75 118.95 123.44 1lwn s ARG 649 Ca 0.76 -1.45 -0.10 0.00 -0.47 0.00 0.00 55.73 54.47 1lwn s ARG 649 Cb -0.48 0.56 0.30 0.00 -0.57 0.00 0.00 34.95 34.76 1lwn s ARG 649 CO 0.33 -0.92 1.69 0.28 -1.08 0.00 0.00 175.30 175.60 1lwn h VAL 650 N 2.05 0.59 0.00 4.99 2.07 -1.97 -0.19 116.25 123.79 1lwn h VAL 650 Ca -0.29 -0.07 -0.07 0.00 0.82 0.00 0.00 66.70 67.09 1lwn h VAL 650 Cb 1.25 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 1lwn h VAL 650 CO 0.38 0.04 -0.32 0.77 0.02 0.00 0.00 177.57 178.46 1lwn h SER 651 N 0.21 0.00 0.48 0.57 4.64 -1.97 -1.67 113.55 115.81 1lwn h SER 651 Ca 0.32 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.39 1lwn h SER 651 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1lwn h SER 651 CO -0.45 0.32 -1.08 0.25 -0.87 0.00 0.00 176.83 175.00 1lwn h LEU 652 N 0.00 0.48 -1.11 5.97 5.85 -1.65 -3.12 115.31 121.72 1lwn h LEU 652 Ca -0.00 -0.44 -0.00 0.00 0.84 0.00 0.00 57.88 58.27 1lwn h LEU 652 Cb 0.61 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.44 1lwn h LEU 652 CO 0.04 1.28 0.51 0.00 -0.34 0.00 0.00 178.44 179.94 1lwn h ALA 653 N 0.67 1.34 0.00 1.25 0.00 -0.59 0.05 119.26 121.98 1lwn h ALA 653 Ca -0.11 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1lwn h ALA 653 Cb 1.76 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 19.21 1lwn h ALA 653 CO 0.18 0.58 -0.05 0.93 0.00 0.00 0.00 179.25 180.89 1lwn h GLU 654 N 1.14 0.00 0.03 0.00 5.08 -1.26 -1.78 114.58 117.78 1lwn h GLU 654 Ca 0.30 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.35 1lwn h GLU 654 Cb -0.07 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.14 1lwn h GLU 654 CO -0.06 0.05 -1.71 1.63 -1.00 0.00 0.00 179.01 177.93 1lwn n LYS 655 N -3.39 0.62 0.03 2.33 5.02 -0.24 -4.49 118.16 118.04 1lwn n LYS 655 Ca -0.02 0.43 -0.19 0.00 -2.02 0.00 0.00 58.31 56.51 1lwn n LYS 655 Cb 0.19 -1.69 -0.09 0.00 -0.02 0.00 0.00 35.03 33.42 1lwn n LYS 655 CO 0.00 0.00 0.00 -0.24 -0.52 0.00 0.00 177.40 176.64 1lwn h VAL 656 N -0.69 1.29 -0.38 -0.18 3.04 -1.02 -3.35 116.25 114.95 1lwn h VAL 656 Ca -0.44 -2.20 0.05 0.00 -1.01 0.00 0.00 66.70 63.10 1lwn h VAL 656 Cb 1.56 2.29 -0.04 0.00 -2.01 0.00 0.00 31.29 33.09 1lwn h VAL 656 CO -0.17 0.68 0.13 0.40 -1.01 0.00 0.00 177.57 177.60 1lwn h ILE 657 N 0.42 0.88 0.00 3.17 2.04 -1.55 -1.19 117.51 121.28 1lwn h ILE 657 Ca -0.11 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.65 1lwn h ILE 657 Cb 1.62 0.57 0.00 0.00 -0.74 0.00 0.00 36.82 38.28 1lwn h ILE 657 CO 0.19 0.05 0.00 -0.65 0.00 0.00 0.00 178.15 177.74 1lwn h PRO 658 N 0.28 0.00 -0.13 2.37 0.11 -1.79 -1.97 132.00 130.88 1lwn h PRO 658 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1lwn h PRO 658 Cb 0.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.27 1lwn h PRO 658 CO -0.18 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.61 1lwn n ALA 659 N -1.85 2.48 -1.97 -0.75 0.00 -0.47 -4.76 120.51 113.18 1lwn n ALA 659 Ca -0.00 -0.70 -0.36 0.00 0.00 0.00 0.00 53.44 52.38 1lwn n ALA 659 Cb 0.13 -0.92 -0.06 0.00 0.00 0.00 0.00 19.45 18.60 1lwn n ALA 659 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1lwn s ALA 660 N -1.86 3.29 -0.20 0.00 0.00 -0.74 -4.65 121.76 117.60 1lwn s ALA 660 Ca 0.33 0.29 -0.02 0.00 0.00 0.00 0.00 51.96 52.56 1lwn s ALA 660 Cb 0.21 -2.97 -0.12 0.00 0.00 0.00 0.00 23.12 20.24 1lwn s ALA 660 CO 0.31 0.26 -0.20 -0.25 0.00 0.00 0.00 175.76 175.88 1lwn n ASP 661 N 0.37 2.22 -4.05 0.00 10.43 -0.86 -4.11 116.55 120.54 1lwn n ASP 661 Ca 0.01 -0.01 -0.28 0.00 2.57 0.00 0.00 54.79 57.08 1lwn n ASP 661 Cb 0.51 -0.39 -0.17 0.00 1.84 0.00 0.00 41.12 42.92 1lwn n ASP 661 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 1lwn s LEU 662 N -6.40 1.71 -0.26 0.64 2.96 -0.69 -0.20 118.68 116.44 1lwn s LEU 662 Ca -0.27 -0.41 -0.11 0.00 -0.22 0.00 0.00 54.13 53.12 1lwn s LEU 662 Cb 0.08 -1.06 -0.05 0.00 0.50 0.00 0.00 46.19 45.66 1lwn s LEU 662 CO 0.42 0.02 0.17 -0.55 -1.32 0.00 0.00 176.35 175.09 1lwn s SER 663 N 0.95 6.00 -0.46 3.68 0.15 0.30 -1.24 113.70 123.07 1lwn s SER 663 Ca -0.08 0.02 -0.20 0.00 0.70 0.00 0.00 55.95 56.40 1lwn s SER 663 Cb -0.15 -2.10 0.04 0.00 -1.71 0.00 0.00 66.02 62.09 1lwn s SER 663 CO -0.01 -0.01 0.62 -1.61 1.20 0.00 0.00 173.24 173.44 1lwn s GLU 664 N 1.50 3.20 -0.58 5.44 0.41 -0.44 -1.69 118.70 126.53 1lwn s GLU 664 Ca 0.07 -0.59 0.06 0.00 -0.41 0.00 0.00 54.97 54.10 1lwn s GLU 664 Cb -0.15 -4.01 0.23 0.00 -1.78 0.00 0.00 34.13 28.42 1lwn s GLU 664 CO 0.08 -1.08 0.62 1.04 -0.49 0.00 0.00 175.26 175.44 1lwn n GLN 665 N 6.19 1.84 -1.21 1.61 1.13 -0.87 -4.79 117.38 121.29 1lwn n GLN 665 Ca -0.04 -4.22 -0.19 0.00 -1.94 0.00 0.00 57.00 50.61 1lwn n GLN 665 Cb 0.47 -2.00 0.14 0.00 0.11 0.00 0.00 30.24 28.97 1lwn n GLN 665 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 1lwn n ILE 666 N 1.32 2.97 -1.66 5.09 -5.35 -1.26 -2.66 119.36 117.81 1lwn n ILE 666 Ca 0.26 -2.77 -0.34 0.00 -0.27 0.00 0.00 62.75 59.63 1lwn n ILE 666 Cb 0.43 -0.66 0.07 0.00 -1.74 0.00 0.00 39.64 37.74 1lwn n ILE 666 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1lwn s SER 667 N -2.19 4.72 0.26 7.28 1.04 -1.25 -4.61 113.70 118.94 1lwn s SER 667 Ca 0.53 2.21 -0.30 0.00 0.48 0.00 0.00 55.95 58.88 1lwn s SER 667 Cb 0.45 -2.58 -0.11 0.00 0.10 0.00 0.00 66.02 63.89 1lwn s SER 667 CO 0.03 -1.90 1.52 -0.89 0.98 0.00 0.00 173.24 172.98 1lwn s THR 668 N -2.07 2.38 0.05 2.02 2.01 -1.13 -4.67 115.64 114.23 1lwn s THR 668 Ca 0.72 0.32 -0.37 0.00 0.31 0.00 0.00 61.69 62.67 1lwn s THR 668 Cb -0.26 -3.20 -0.16 0.00 0.01 0.00 0.00 72.50 68.89 1lwn s THR 668 CO 0.42 0.05 1.44 0.00 -0.69 0.00 0.00 174.62 175.84 1lwn n ALA 669 N 2.44 -0.47 -0.30 7.40 0.00 -1.26 -1.89 120.51 126.43 1lwn n ALA 669 Ca 0.08 0.48 0.00 0.00 0.00 0.00 0.00 53.44 54.00 1lwn n ALA 669 Cb 0.39 -2.15 0.00 0.00 0.00 0.00 0.00 19.45 17.69 1lwn n ALA 669 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lwn n GLY 670 N 2.93 0.66 0.07 0.00 0.00 -1.26 -4.70 105.19 102.89 1lwn n GLY 670 Ca 0.19 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.14 1lwn n GLY 670 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1lwn n THR 671 N -2.02 0.92 -3.01 2.61 -2.24 -0.79 -4.88 114.28 104.87 1lwn n THR 671 Ca 0.00 -0.51 -0.43 0.00 -2.27 0.00 0.00 64.05 60.83 1lwn n THR 671 Cb 0.00 -0.75 -0.06 0.00 -2.10 0.00 0.00 70.33 67.42 1lwn n THR 671 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1lwn s GLU 672 N -2.32 3.29 0.21 -0.78 2.56 -1.26 -4.71 118.70 115.69 1lwn s GLU 672 Ca -0.10 -0.40 -0.12 0.00 0.00 0.00 0.00 54.97 54.35 1lwn s GLU 672 Cb 0.04 -4.01 0.27 0.00 2.00 0.00 0.00 34.13 32.43 1lwn s GLU 672 CO 0.50 -1.22 1.66 0.00 -0.56 0.00 0.00 175.26 175.64 1lwn h ALA 673 N 9.05 0.54 0.00 6.30 0.00 -1.90 -2.91 119.26 130.35 1lwn h ALA 673 Ca -0.26 0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1lwn h ALA 673 Cb 1.09 0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.23 1lwn h ALA 673 CO 0.98 -0.41 0.00 0.45 0.00 0.00 0.00 179.25 180.28 1lwn n SER 674 N -5.31 -1.04 0.00 0.00 2.88 -1.26 -4.24 113.62 104.65 1lwn n SER 674 Ca 0.08 0.48 0.00 0.00 -1.33 0.00 0.00 58.87 58.10 1lwn n SER 674 Cb 0.34 1.13 0.00 0.00 -0.75 0.00 0.00 64.21 64.93 1lwn n SER 674 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1lwn n GLY 675 N 0.67 0.01 0.00 0.46 0.00 -1.26 -1.32 105.19 103.75 1lwn n GLY 675 Ca 0.00 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.45 1lwn n GLY 675 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1lwn n THR 676 N 0.42 0.00 -0.10 2.61 -2.24 -1.26 -4.77 114.28 108.94 1lwn n THR 676 Ca 0.00 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.79 1lwn n THR 676 Cb 0.00 -0.02 0.29 0.00 -2.10 0.00 0.00 70.33 68.50 1lwn n THR 676 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1lwn h GLY 677 N 0.00 0.79 0.51 3.38 0.00 -1.95 -1.62 103.07 104.19 1lwn h GLY 677 Ca 0.00 -0.36 0.11 0.00 0.00 0.00 0.00 47.33 47.07 1lwn h GLY 677 CO 0.00 0.35 0.57 3.45 0.00 0.00 0.00 176.54 180.91 1lwn h ASN 678 N 0.74 0.84 -0.08 0.19 7.08 -1.94 -1.22 115.58 121.20 1lwn h ASN 678 Ca 0.19 0.05 -0.15 0.00 -3.08 0.00 0.00 56.30 53.30 1lwn h ASN 678 Cb 0.08 -0.12 -0.01 0.00 -2.08 0.00 0.00 38.32 36.19 1lwn h ASN 678 CO -0.03 0.47 -0.46 0.24 -2.08 0.00 0.00 177.43 175.58 1lwn h MET 679 N 0.94 0.63 -0.75 4.14 2.86 -1.63 -2.47 114.93 118.64 1lwn h MET 679 Ca 0.46 -0.35 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 1lwn h MET 679 Cb 0.42 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.06 1lwn h MET 679 CO -0.25 0.95 0.47 0.87 1.06 0.00 0.00 176.91 180.01 1lwn h LYS 680 N 0.50 1.00 -0.44 1.72 1.57 -0.72 -1.84 116.57 118.37 1lwn h LYS 680 Ca 0.03 -0.08 -0.13 0.00 -1.87 0.00 0.00 60.65 58.61 1lwn h LYS 680 Cb 0.99 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 33.07 1lwn h LYS 680 CO 0.09 0.69 -0.22 0.74 -0.57 0.00 0.00 179.45 180.17 1lwn h PHE 681 N 1.02 1.02 -0.67 -1.35 0.04 -1.26 -2.83 116.94 112.90 1lwn h PHE 681 Ca 0.27 -0.24 -0.04 0.00 2.80 0.00 0.00 57.97 60.76 1lwn h PHE 681 Cb -0.08 -0.24 -0.03 0.00 2.20 0.00 0.00 35.95 37.81 1lwn h PHE 681 CO -0.01 1.02 0.25 1.98 -0.60 0.00 0.00 178.31 180.95 1lwn h MET 682 N 0.77 1.02 0.00 1.51 4.05 -1.07 -2.45 114.93 118.77 1lwn h MET 682 Ca 0.10 -0.20 -0.03 0.00 -0.28 0.00 0.00 59.70 59.29 1lwn h MET 682 Cb 0.77 -0.16 -0.00 0.00 -0.80 0.00 0.00 31.60 31.41 1lwn h MET 682 CO 0.06 0.86 -0.15 1.25 0.23 0.00 0.00 176.91 179.17 1lwn h LEU 683 N 0.96 0.00 -3.40 3.39 5.85 -1.28 -3.22 115.31 117.62 1lwn h LEU 683 Ca 0.22 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.94 1lwn h LEU 683 Cb 0.24 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.27 1lwn h LEU 683 CO -0.01 0.15 0.00 0.59 -0.34 0.00 0.00 178.44 178.82 1lwn n ASN 684 N -3.42 4.87 -0.04 1.25 4.13 -1.01 -4.92 115.26 116.12 1lwn n ASN 684 Ca -0.01 -2.91 0.00 0.00 1.68 0.00 0.00 54.58 53.34 1lwn n ASN 684 Cb 0.33 -0.61 0.00 0.00 -1.54 0.00 0.00 39.78 37.96 1lwn n ASN 684 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1lwn n GLY 685 N 0.20 0.62 3.53 7.41 0.00 -1.18 -4.79 105.19 110.98 1lwn n GLY 685 Ca 0.25 -0.75 -0.30 0.00 0.00 0.00 0.00 46.02 45.21 1lwn n GLY 685 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lwn s ALA 686 N -2.08 2.80 0.27 4.61 0.00 -0.95 -4.75 121.76 121.66 1lwn s ALA 686 Ca 0.00 -1.25 -0.05 0.00 0.00 0.00 0.00 51.96 50.66 1lwn s ALA 686 Cb 0.00 -0.81 -0.05 0.00 0.00 0.00 0.00 23.12 22.26 1lwn s ALA 686 CO 0.00 0.61 0.54 -0.51 0.00 0.00 0.00 175.76 176.40 1lwn s LEU 687 N -1.95 4.08 -0.14 0.00 1.43 0.72 -4.44 118.68 118.39 1lwn s LEU 687 Ca 0.18 0.73 -0.04 0.00 -1.03 0.00 0.00 54.13 53.98 1lwn s LEU 687 Cb -0.11 -3.54 -0.03 0.00 0.03 0.00 0.00 46.19 42.54 1lwn s LEU 687 CO 0.10 -0.17 -0.02 -0.89 0.23 0.00 0.00 176.35 175.60 1lwn s THR 688 N -2.03 4.06 -0.22 5.49 2.01 -1.26 -0.54 115.64 123.16 1lwn s THR 688 Ca 0.44 -0.31 -0.02 0.00 0.31 0.00 0.00 61.69 62.12 1lwn s THR 688 Cb -0.11 -2.77 0.01 0.00 0.01 0.00 0.00 72.50 69.64 1lwn s THR 688 CO 0.29 0.51 -0.09 -0.51 -0.69 0.00 0.00 174.62 174.12 1lwn s ILE 689 N 0.12 2.88 0.29 1.82 2.07 -0.68 -1.21 121.20 126.49 1lwn s ILE 689 Ca 0.00 -0.75 -0.19 0.00 -1.41 0.00 0.00 60.65 58.31 1lwn s ILE 689 Cb -0.13 -2.33 0.07 0.00 0.13 0.00 0.00 42.46 40.20 1lwn s ILE 689 CO 0.02 0.40 0.91 -0.83 -1.91 0.00 0.00 174.94 173.53 1lwn s GLY 690 N 1.39 0.25 0.49 1.50 0.00 -0.23 -2.05 107.32 108.68 1lwn s GLY 690 Ca 0.04 -0.56 0.02 0.00 0.00 0.00 0.00 44.72 44.22 1lwn s GLY 690 CO -0.06 1.00 0.71 -0.51 0.00 0.00 0.00 173.10 174.23 1lwn s THR 691 N -2.23 3.24 -1.36 0.90 -4.23 -1.09 -2.00 115.64 108.87 1lwn s THR 691 Ca 0.19 -0.65 -0.14 0.00 -1.18 0.00 0.00 61.69 59.91 1lwn s THR 691 Cb -0.04 -3.19 0.09 0.00 1.34 0.00 0.00 72.50 70.69 1lwn s THR 691 CO 0.09 -0.13 1.97 0.23 -0.54 0.00 0.00 174.62 176.24 1lwn n MET 692 N -2.17 3.14 -4.19 3.99 2.81 -1.26 -4.67 117.12 114.77 1lwn n MET 692 Ca 0.05 -3.07 -0.19 0.00 -1.81 0.00 0.00 57.70 52.69 1lwn n MET 692 Cb 0.59 -3.23 -0.12 0.00 -0.71 0.00 0.00 33.22 29.74 1lwn n MET 692 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1lwn s ASP 693 N 2.89 1.69 0.47 7.83 3.68 -1.26 -4.60 116.67 127.37 1lwn s ASP 693 Ca 0.47 -0.60 0.00 0.00 2.13 0.00 0.00 52.55 54.54 1lwn s ASP 693 Cb 0.09 -0.06 0.00 0.00 -1.45 0.00 0.00 42.92 41.51 1lwn s ASP 693 CO -0.02 -0.06 0.00 0.61 0.13 0.00 0.00 175.17 175.82 1lwn n GLY 694 N 1.33 2.33 0.00 2.66 0.00 -1.10 -1.02 105.19 109.39 1lwn n GLY 694 Ca -0.21 -0.17 0.09 0.00 0.00 0.00 0.00 46.02 45.74 1lwn n GLY 694 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lwn n ALA 695 N 7.40 1.91 -0.29 4.61 0.00 -0.43 -3.07 120.51 130.64 1lwn n ALA 695 Ca 0.00 -0.07 0.04 0.00 0.00 0.00 0.00 53.44 53.41 1lwn n ALA 695 Cb 0.00 -1.32 0.24 0.00 0.00 0.00 0.00 19.45 18.38 1lwn n ALA 695 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1lwn h ASN 696 N 0.00 0.90 -0.48 0.00 4.21 -1.29 -0.28 115.58 118.64 1lwn h ASN 696 Ca 0.00 0.00 0.03 0.00 1.21 0.00 0.00 56.30 57.55 1lwn h ASN 696 Cb 0.32 -0.19 -0.04 0.00 -1.12 0.00 0.00 38.32 37.29 1lwn h ASN 696 CO 0.00 0.58 0.25 0.58 -1.29 0.00 0.00 177.43 177.56 1lwn h VAL 697 N 1.02 0.99 -0.00 2.81 2.07 -1.60 -1.76 116.25 119.77 1lwn h VAL 697 Ca 0.38 -0.17 -0.14 0.00 0.82 0.00 0.00 66.70 67.58 1lwn h VAL 697 Cb 0.17 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 1lwn h VAL 697 CO -0.13 0.09 -0.67 -0.33 0.02 0.00 0.00 177.57 176.55 1lwn h GLU 698 N 0.50 0.02 -0.31 1.57 5.08 -1.48 -2.10 114.58 117.86 1lwn h GLU 698 Ca 0.20 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.47 1lwn h GLU 698 Cb 0.09 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1lwn h GLU 698 CO -0.13 0.68 -0.10 0.52 -1.00 0.00 0.00 179.01 178.99 1lwn h MET 699 N 0.01 0.60 -0.40 2.33 2.86 -0.74 -0.77 114.93 118.83 1lwn h MET 699 Ca -0.01 -0.24 -0.08 0.00 -2.06 0.00 0.00 59.70 57.31 1lwn h MET 699 Cb 1.18 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.80 1lwn h MET 699 CO 0.09 0.80 -0.07 0.00 1.06 0.00 0.00 176.91 178.79 1lwn h ALA 700 N 0.78 1.12 -0.39 6.32 0.00 -1.33 -0.28 119.26 125.49 1lwn h ALA 700 Ca 0.07 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.71 1lwn h ALA 700 Cb 0.59 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1lwn h ALA 700 CO 0.03 0.55 0.25 1.49 0.00 0.00 0.00 179.25 181.58 1lwn h GLU 701 N 0.64 0.50 -0.18 0.00 4.81 -1.14 0.55 114.58 119.76 1lwn h GLU 701 Ca 0.12 -0.03 -0.20 0.00 -0.13 0.00 0.00 59.36 59.12 1lwn h GLU 701 Cb 0.50 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.77 1lwn h GLU 701 CO 0.03 0.33 -0.68 0.93 -0.73 0.00 0.00 179.01 178.89 1lwn h GLU 702 N 0.52 0.72 0.00 1.92 4.39 -0.66 -3.29 114.58 118.19 1lwn h GLU 702 Ca 0.15 -0.54 0.00 0.00 0.34 0.00 0.00 59.36 59.31 1lwn h GLU 702 Cb -0.05 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.70 1lwn h GLU 702 CO -0.04 1.16 -0.80 0.00 -1.16 0.00 0.00 179.01 178.17 1lwn h ALA 703 N 0.70 0.53 -0.04 3.43 0.00 -0.96 -3.46 119.26 119.46 1lwn h ALA 703 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1lwn h ALA 703 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1lwn h ALA 703 CO 0.14 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.80 1lwn n GLY 704 N 1.27 1.07 0.28 0.00 0.00 0.19 -4.54 105.19 103.46 1lwn n GLY 704 Ca 0.02 -1.27 0.16 0.00 0.00 0.00 0.00 46.02 44.93 1lwn n GLY 704 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1lwn h GLU 705 N 0.00 0.00 -0.00 1.61 5.08 -1.82 0.65 114.58 120.09 1lwn h GLU 705 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1lwn h GLU 705 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1lwn h GLU 705 CO 0.00 0.00 -0.07 -0.85 -1.00 0.00 0.00 179.01 177.09 1lwn n GLU 706 N -2.72 0.11 -0.42 2.33 0.00 -1.26 -2.92 120.64 115.76 1lwn n GLU 706 Ca -0.02 -0.02 0.08 0.00 0.00 0.00 0.00 57.16 57.20 1lwn n GLU 706 Cb 0.17 -1.50 0.25 0.00 0.00 0.00 0.00 31.44 30.36 1lwn n GLU 706 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1lwn n ASN 707 N -1.43 3.81 -4.16 -1.84 3.02 0.22 -4.95 115.26 109.93 1lwn n ASN 707 Ca 0.08 -2.71 -0.19 0.00 -0.03 0.00 0.00 54.58 51.74 1lwn n ASN 707 Cb 0.32 -0.47 -0.12 0.00 -0.61 0.00 0.00 39.78 38.89 1lwn n ASN 707 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1lwn s PHE 708 N -2.29 1.19 -0.91 3.10 2.19 -1.15 -4.81 117.98 115.30 1lwn s PHE 708 Ca 0.39 -0.43 -0.10 0.00 0.33 0.00 0.00 56.93 57.11 1lwn s PHE 708 Cb 0.29 -0.68 0.23 0.00 -1.31 0.00 0.00 43.02 41.55 1lwn s PHE 708 CO 0.12 0.05 0.86 -0.06 1.83 0.00 0.00 175.22 178.01 1lwn s PHE 709 N -1.16 3.92 0.06 10.12 0.40 -0.35 -4.96 117.98 126.01 1lwn s PHE 709 Ca -0.01 -2.40 -0.09 0.00 -0.60 0.00 0.00 56.93 53.82 1lwn s PHE 709 Cb -0.09 -3.71 -0.05 0.00 0.51 0.00 0.00 43.02 39.67 1lwn s PHE 709 CO 0.02 -0.94 0.36 0.42 0.70 0.00 0.00 175.22 175.78 1lwn s ILE 710 N -0.50 5.15 0.32 0.64 1.01 -1.26 -1.06 121.20 125.50 1lwn s ILE 710 Ca 0.23 0.39 -0.14 0.00 0.00 0.00 0.00 60.65 61.13 1lwn s ILE 710 Cb -0.11 -3.63 0.02 0.00 0.01 0.00 0.00 42.46 38.76 1lwn s ILE 710 CO -0.08 0.32 0.64 0.72 0.00 0.00 0.00 174.94 176.54 1lwn s PHE 711 N -1.36 0.25 0.09 3.97 -0.71 -0.85 -4.95 117.98 114.42 1lwn s PHE 711 Ca 0.31 -0.72 0.00 0.00 -1.04 0.00 0.00 56.93 55.48 1lwn s PHE 711 Cb -0.14 0.50 0.00 0.00 -1.21 0.00 0.00 43.02 42.17 1lwn s PHE 711 CO 0.17 -1.27 0.00 0.41 -1.34 0.00 0.00 175.22 173.19 1lwn n GLY 712 N -0.48 -2.16 3.76 1.99 0.00 -1.26 -4.31 105.19 102.72 1lwn n GLY 712 Ca -0.04 -1.44 -0.38 0.00 0.00 0.00 0.00 46.02 44.16 1lwn n GLY 712 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1lwn s MET 713 N -1.28 3.39 0.54 1.61 -1.94 -1.26 -4.90 119.30 115.47 1lwn s MET 713 Ca 0.00 2.11 0.03 0.00 -1.71 0.00 0.00 55.69 56.12 1lwn s MET 713 Cb 0.00 -2.35 0.04 0.00 2.01 0.00 0.00 34.83 34.53 1lwn s MET 713 CO 0.00 -0.95 0.75 1.03 -0.01 0.00 0.00 175.02 175.85 1lwn s ARG 714 N -2.78 2.48 0.27 2.03 3.00 -1.26 -4.48 118.95 118.21 1lwn s ARG 714 Ca 0.68 -1.01 -0.01 0.00 0.00 0.00 0.00 55.73 55.39 1lwn s ARG 714 Cb -0.37 -2.55 0.49 0.00 0.00 0.00 0.00 34.95 32.52 1lwn s ARG 714 CO 0.45 -0.71 1.83 0.28 0.00 0.00 0.00 175.30 177.14 1lwn h VAL 715 N 0.14 0.92 -0.15 3.52 2.07 -1.84 -1.30 116.25 119.61 1lwn h VAL 715 Ca -0.40 -0.32 -0.05 0.00 0.82 0.00 0.00 66.70 66.76 1lwn h VAL 715 Cb 1.29 -0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 1lwn h VAL 715 CO 0.48 0.17 -0.12 -0.33 0.02 0.00 0.00 177.57 177.79 1lwn h GLU 716 N 0.92 0.24 -0.08 1.57 3.07 -1.95 -2.24 114.58 116.10 1lwn h GLU 716 Ca 0.46 -0.05 -0.16 0.00 -0.50 0.00 0.00 59.36 59.11 1lwn h GLU 716 Cb 0.44 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.31 1lwn h GLU 716 CO -0.26 0.36 -0.64 -0.44 -1.40 0.00 0.00 179.01 176.64 1lwn h ASP 717 N 0.23 0.36 -0.28 1.42 3.45 -1.62 -2.29 116.42 117.68 1lwn h ASP 717 Ca 0.05 -0.21 -0.10 0.00 0.43 0.00 0.00 57.03 57.19 1lwn h ASP 717 Cb 0.35 -0.10 -0.02 0.00 -0.56 0.00 0.00 39.33 39.00 1lwn h ASP 717 CO 0.02 0.90 -0.17 0.58 -1.57 0.00 0.00 179.24 179.00 1lwn h VAL 718 N 0.22 1.26 -0.67 -1.35 2.07 -1.07 -1.98 116.25 114.73 1lwn h VAL 718 Ca -0.01 -1.24 -0.08 0.00 0.82 0.00 0.00 66.70 66.19 1lwn h VAL 718 Cb 1.17 1.15 -0.03 0.00 -1.52 0.00 0.00 31.29 32.06 1lwn h VAL 718 CO 0.10 0.42 0.11 0.44 0.02 0.00 0.00 177.57 178.66 1lwn h ASP 719 N 0.65 1.07 0.18 0.57 3.32 -1.20 -1.35 116.42 119.66 1lwn h ASP 719 Ca 0.10 -0.26 -0.01 0.00 0.02 0.00 0.00 57.03 56.89 1lwn h ASP 719 Cb 0.65 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.92 1lwn h ASP 719 CO 0.05 1.06 -0.08 0.03 -1.72 0.00 0.00 179.24 178.57 1lwn h ARG 720 N 1.04 -0.23 -0.75 3.56 3.08 -1.16 -1.16 114.38 118.77 1lwn h ARG 720 Ca 0.20 0.02 0.10 0.00 0.07 0.00 0.00 59.98 60.37 1lwn h ARG 720 Cb 0.44 0.05 -0.07 0.00 0.08 0.00 0.00 29.97 30.47 1lwn h ARG 720 CO 0.01 -0.06 0.38 1.25 -1.07 0.00 0.00 179.97 180.49 1lwn h LEU 721 N -0.35 0.50 -0.46 3.04 6.46 -1.24 -1.91 115.31 121.35 1lwn h LEU 721 Ca -0.02 0.06 -0.02 0.00 -0.12 0.00 0.00 57.88 57.78 1lwn h LEU 721 Cb 0.27 -0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 40.16 1lwn h LEU 721 CO 0.04 0.27 0.20 0.44 -0.62 0.00 0.00 178.44 178.77 1lwn h ASP 722 N 0.63 0.63 0.08 1.25 3.45 -0.99 0.72 116.42 122.19 1lwn h ASP 722 Ca 0.37 -0.16 0.01 0.00 0.43 0.00 0.00 57.03 57.69 1lwn h ASP 722 Cb 0.41 -0.16 -0.02 0.00 -0.56 0.00 0.00 39.33 38.99 1lwn h ASP 722 CO -0.28 0.61 -0.14 1.56 -1.57 0.00 0.00 179.24 179.42 1lwn h GLN 723 N 0.61 -0.27 0.00 3.56 4.20 -0.47 -2.79 115.11 119.95 1lwn h GLN 723 Ca 0.16 0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.81 1lwn h GLN 723 Cb 0.17 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 1lwn h GLN 723 CO -0.01 -0.18 -0.34 0.07 -0.67 0.00 0.00 178.83 177.69 1lwn h ARG 724 N -0.28 0.00 0.00 1.46 0.11 -1.30 -3.49 114.38 110.87 1lwn h ARG 724 Ca 0.02 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.10 1lwn h ARG 724 Cb 0.30 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.38 1lwn h ARG 724 CO -0.08 0.34 0.00 0.41 0.10 0.00 0.00 179.97 180.74 1lwn n GLY 725 N 0.90 2.50 3.66 0.08 0.00 0.25 -5.03 105.19 107.55 1lwn n GLY 725 Ca 0.02 -1.27 -0.42 0.00 0.00 0.00 0.00 46.02 44.35 1lwn n GLY 725 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1lwn s TYR 726 N 0.00 3.38 -0.39 1.61 6.04 -1.21 -4.85 117.35 121.93 1lwn s TYR 726 Ca 0.00 1.28 0.03 0.00 0.04 0.00 0.00 57.07 58.42 1lwn s TYR 726 Cb 0.00 -3.08 0.11 0.00 -1.04 0.00 0.00 41.96 37.95 1lwn s TYR 726 CO 0.00 -0.32 0.14 1.21 -1.54 0.00 0.00 175.55 175.04 1lwn s ASN 727 N 1.21 4.34 0.54 4.32 2.47 -1.26 -4.98 114.94 121.58 1lwn s ASN 727 Ca 0.39 -2.31 0.21 0.00 0.42 0.00 0.00 52.86 51.57 1lwn s ASN 727 Cb -0.16 -1.38 1.46 0.00 -1.45 0.00 0.00 41.25 39.72 1lwn s ASN 727 CO 0.10 -0.34 2.18 0.00 -3.72 0.00 0.00 177.10 175.33 1lwn h ALA 728 N 7.33 1.82 -0.80 1.71 0.00 -1.86 -2.49 119.26 124.96 1lwn h ALA 728 Ca -0.06 -0.00 0.09 0.00 0.00 0.00 0.00 54.91 54.93 1lwn h ALA 728 Cb 0.98 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.71 1lwn h ALA 728 CO 0.54 0.01 0.52 0.37 0.00 0.00 0.00 179.25 180.69 1lwn h GLN 729 N 0.00 0.75 -0.57 0.00 5.75 -1.91 -2.24 115.11 116.88 1lwn h GLN 729 Ca -0.00 -0.05 0.07 0.00 -0.15 0.00 0.00 58.65 58.53 1lwn h GLN 729 Cb 0.01 -0.17 -0.06 0.00 1.07 0.00 0.00 27.48 28.33 1lwn h GLN 729 CO 0.00 0.50 0.25 1.49 -2.65 0.00 0.00 178.83 178.42 1lwn h GLU 730 N 0.77 0.45 -0.25 1.69 4.81 -1.86 0.14 114.58 120.33 1lwn h GLU 730 Ca 0.37 -0.03 -0.16 0.00 -0.13 0.00 0.00 59.36 59.41 1lwn h GLU 730 Cb 0.40 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 1lwn h GLU 730 CO -0.14 0.30 -0.48 1.88 -0.73 0.00 0.00 179.01 179.84 1lwn h TYR 731 N 0.46 0.83 -0.55 0.92 -1.99 -1.58 -1.77 116.97 113.30 1lwn h TYR 731 Ca 0.27 -0.27 -0.01 0.00 2.00 0.00 0.00 58.73 60.72 1lwn h TYR 731 Cb 0.27 -0.17 -0.03 0.00 2.00 0.00 0.00 36.73 38.81 1lwn h TYR 731 CO -0.14 1.02 0.30 -0.92 -0.00 0.00 0.00 178.16 178.43 1lwn h TYR 732 N 0.54 0.75 -0.26 4.88 3.20 -1.01 -0.77 116.97 124.30 1lwn h TYR 732 Ca 0.03 -0.02 -0.10 0.00 3.14 0.00 0.00 58.73 61.78 1lwn h TYR 732 Cb 1.03 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 39.05 1lwn h TYR 732 CO 0.05 0.54 -0.26 -0.44 -1.64 0.00 0.00 178.16 176.41 1lwn h ASP 733 N 0.73 0.51 0.37 -2.11 3.45 -0.60 -3.29 116.42 115.49 1lwn h ASP 733 Ca 0.19 -0.18 0.00 0.00 0.43 0.00 0.00 57.03 57.47 1lwn h ASP 733 Cb 0.04 -0.14 0.00 0.00 -0.56 0.00 0.00 39.33 38.67 1lwn h ASP 733 CO -0.03 0.77 -0.86 0.54 -1.57 0.00 0.00 179.24 178.09 1lwn n ARG 734 N -4.11 0.15 -4.00 3.56 3.00 -0.68 -4.80 116.66 109.78 1lwn n ARG 734 Ca -0.00 -0.00 -0.31 0.00 -0.01 0.00 0.00 57.85 57.53 1lwn n ARG 734 Cb 0.42 -1.55 -0.15 0.00 0.00 0.00 0.00 32.46 31.18 1lwn n ARG 734 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 1lwn s ILE 735 N -3.10 2.20 0.22 0.55 1.01 -0.32 -5.01 121.20 116.75 1lwn s ILE 735 Ca 0.07 -2.32 -0.10 0.00 0.00 0.00 0.00 60.65 58.30 1lwn s ILE 735 Cb 0.16 -2.63 0.19 0.00 0.01 0.00 0.00 42.46 40.19 1lwn s ILE 735 CO 0.78 -0.61 1.68 -0.65 0.00 0.00 0.00 174.94 176.14 1lwn h PRO 736 N 7.61 0.17 -0.48 2.79 0.11 -1.87 -1.18 132.00 139.15 1lwn h PRO 736 Ca -0.05 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.03 1lwn h PRO 736 Cb 1.02 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.06 1lwn h PRO 736 CO 0.52 0.11 0.21 0.93 -0.21 0.00 0.00 178.00 179.56 1lwn h GLU 737 N 0.18 0.68 -0.24 1.05 5.08 -1.95 -0.48 114.58 118.89 1lwn h GLU 737 Ca 0.33 -0.09 -0.11 0.00 -1.00 0.00 0.00 59.36 58.49 1lwn h GLU 737 Cb 0.53 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 1lwn h GLU 737 CO -0.48 0.55 -0.28 1.25 -1.00 0.00 0.00 179.01 179.04 1lwn h LEU 738 N 0.68 0.66 -0.81 1.33 5.85 -1.70 -2.68 115.31 118.64 1lwn h LEU 738 Ca 0.17 -0.49 0.03 0.00 0.84 0.00 0.00 57.88 58.42 1lwn h LEU 738 Cb 0.11 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 40.90 1lwn h LEU 738 CO -0.02 1.02 0.52 -0.09 -0.34 0.00 0.00 178.44 179.54 1lwn h ARG 739 N 0.32 0.99 -0.81 1.25 2.43 -0.71 -1.89 114.38 115.97 1lwn h ARG 739 Ca 0.03 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.12 1lwn h ARG 739 Cb 0.85 -0.22 -0.04 0.00 -0.42 0.00 0.00 29.97 30.14 1lwn h ARG 739 CO 0.07 0.66 0.42 0.37 -1.51 0.00 0.00 179.97 179.97 1lwn h GLN 740 N 1.02 1.13 -0.20 0.20 4.15 -1.03 -0.94 115.11 119.45 1lwn h GLN 740 Ca 0.32 -0.14 -0.02 0.00 0.77 0.00 0.00 58.65 59.58 1lwn h GLN 740 Cb -0.01 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 27.46 1lwn h GLN 740 CO -0.11 0.85 0.04 0.82 -1.93 0.00 0.00 178.83 178.50 1lwn h ILE 741 N 1.13 1.22 -0.70 2.39 2.04 -1.02 -1.32 117.51 121.26 1lwn h ILE 741 Ca 0.28 -0.72 -0.03 0.00 1.00 0.00 0.00 64.86 65.39 1lwn h ILE 741 Cb 0.06 1.31 -0.03 0.00 -0.74 0.00 0.00 36.82 37.42 1lwn h ILE 741 CO -0.04 0.22 0.31 0.40 0.00 0.00 0.00 178.15 179.04 1lwn h ILE 742 N 0.13 1.23 -0.70 -0.67 1.08 -1.15 -1.10 117.51 116.33 1lwn h ILE 742 Ca 0.06 -0.69 -0.04 0.00 -0.39 0.00 0.00 64.86 63.81 1lwn h ILE 742 Cb 0.30 0.37 -0.03 0.00 -3.07 0.00 0.00 36.82 34.39 1lwn h ILE 742 CO 0.00 0.28 0.30 -0.33 -0.69 0.00 0.00 178.15 177.72 1lwn h GLU 743 N 1.00 1.04 -0.77 2.37 5.08 -0.96 -1.23 114.58 121.11 1lwn h GLU 743 Ca 0.24 -0.18 -0.05 0.00 -1.00 0.00 0.00 59.36 58.37 1lwn h GLU 743 Cb 0.15 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.19 1lwn h GLU 743 CO -0.03 0.85 0.29 1.96 -1.00 0.00 0.00 179.01 181.08 1lwn h GLN 744 N 0.99 1.15 -0.46 2.33 4.20 -0.42 -1.82 115.11 121.09 1lwn h GLN 744 Ca 0.24 -0.22 -0.10 0.00 0.06 0.00 0.00 58.65 58.63 1lwn h GLN 744 Cb 0.18 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 1lwn h GLN 744 CO -0.02 0.95 -0.09 -0.07 -0.67 0.00 0.00 178.83 178.92 1lwn h LEU 745 N 1.12 0.88 -0.70 1.46 3.38 -0.86 -1.33 115.31 119.25 1lwn h LEU 745 Ca 0.25 -0.35 -0.13 0.00 0.09 0.00 0.00 57.88 57.74 1lwn h LEU 745 Cb 0.23 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1lwn h LEU 745 CO -0.02 1.02 -0.63 0.28 0.09 0.00 0.00 178.44 179.19 1lwn h SER 746 N 0.71 0.00 0.66 -0.43 0.02 -1.12 -3.21 113.55 110.19 1lwn h SER 746 Ca 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1lwn h SER 746 Cb 0.63 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.17 1lwn h SER 746 CO 0.04 0.63 -0.08 -1.20 -1.14 0.00 0.00 176.83 175.08 1lwn n SER 747 N -3.73 0.16 0.00 3.07 7.64 -0.69 -4.62 113.62 115.44 1lwn n SER 747 Ca -0.01 -0.04 0.00 0.00 1.01 0.00 0.00 58.87 59.83 1lwn n SER 747 Cb 0.63 -0.25 0.00 0.00 -1.01 0.00 0.00 64.21 63.58 1lwn n SER 747 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1lwn n GLY 748 N 1.38 0.58 0.27 0.23 0.00 -1.03 -4.82 105.19 101.80 1lwn n GLY 748 Ca 0.11 -0.76 0.08 0.00 0.00 0.00 0.00 46.02 45.45 1lwn n GLY 748 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1lwn h PHE 749 N 0.00 0.09 -0.08 1.61 3.57 -1.49 -1.64 116.94 118.99 1lwn h PHE 749 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1lwn h PHE 749 Cb 0.02 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 38.73 1lwn h PHE 749 CO 0.00 0.05 0.00 1.19 -2.23 0.00 0.00 178.31 177.32 1lwn n PHE 750 N -4.52 0.08 -3.06 0.41 3.72 -1.26 -4.61 117.46 108.22 1lwn n PHE 750 Ca -0.01 -0.04 -0.18 0.00 -0.05 0.00 0.00 57.45 57.17 1lwn n PHE 750 Cb 0.11 -0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.63 1lwn n PHE 750 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1lwn n SER 751 N 1.20 -0.43 -0.25 4.37 3.41 -0.66 -4.80 113.62 116.45 1lwn n SER 751 Ca 0.13 -3.01 -0.05 0.00 -0.26 0.00 0.00 58.87 55.68 1lwn n SER 751 Cb 0.53 0.08 0.01 0.00 -0.26 0.00 0.00 64.21 64.57 1lwn n SER 751 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1lwn h PRO 752 N 3.57 -0.12 0.00 4.33 0.11 -1.71 -0.94 132.00 137.24 1lwn h PRO 752 Ca 0.02 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.14 1lwn h PRO 752 Cb 0.96 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1lwn h PRO 752 CO 0.41 -0.08 0.00 1.17 -0.21 0.00 0.00 178.00 179.29 1lwn n LYS 753 N -5.44 0.07 -3.22 1.05 4.81 -1.26 -3.94 118.16 110.24 1lwn n LYS 753 Ca 0.05 0.28 -0.22 0.00 -0.87 0.00 0.00 58.31 57.55 1lwn n LYS 753 Cb 0.36 -1.63 -0.07 0.00 0.02 0.00 0.00 35.03 33.71 1lwn n LYS 753 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1lwn n GLN 754 N -1.77 0.36 -0.35 1.64 6.02 -0.41 -5.03 117.38 117.85 1lwn n GLN 754 Ca 0.03 -2.92 0.27 0.00 -0.01 0.00 0.00 57.00 54.38 1lwn n GLN 754 Cb 0.22 -1.55 0.52 0.00 1.02 0.00 0.00 30.24 30.45 1lwn n GLN 754 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 1lwn h PRO 755 N 5.16 0.23 -0.72 -1.09 0.13 -1.55 -1.87 132.00 132.29 1lwn h PRO 755 Ca 0.18 -0.01 -0.24 0.00 -0.87 0.00 0.00 66.00 65.06 1lwn h PRO 755 Cb 0.94 -0.05 -0.14 0.00 0.13 0.00 0.00 31.00 31.88 1lwn h PRO 755 CO 0.32 0.15 0.28 -0.40 -0.23 0.00 0.00 178.00 178.12 1lwn n ASP 756 N -5.03 4.47 -0.37 1.44 5.75 -1.26 -2.47 116.55 119.08 1lwn n ASP 756 Ca 0.33 -3.31 0.02 0.00 -0.01 0.00 0.00 54.79 51.83 1lwn n ASP 756 Cb 1.10 -0.74 0.17 0.00 -1.03 0.00 0.00 41.12 40.62 1lwn n ASP 756 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 1lwn h LEU 757 N 2.28 1.06 -3.46 -2.12 5.85 -1.67 -2.62 115.31 114.64 1lwn h LEU 757 Ca 0.29 0.00 -0.22 0.00 0.84 0.00 0.00 57.88 58.80 1lwn h LEU 757 Cb 2.31 -0.22 -0.13 0.00 0.37 0.00 0.00 40.66 42.98 1lwn h LEU 757 CO 0.73 0.69 0.28 0.49 -0.34 0.00 0.00 178.44 180.29 1lwn n PHE 758 N -4.48 2.22 -0.18 1.25 3.72 -1.26 -4.52 117.46 114.20 1lwn n PHE 758 Ca 0.15 -1.13 0.02 0.00 -0.05 0.00 0.00 57.45 56.44 1lwn n PHE 758 Cb 0.16 -0.65 0.29 0.00 -0.94 0.00 0.00 39.48 38.33 1lwn n PHE 758 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 1lwn h LYS 759 N 2.20 0.89 -0.65 -1.08 1.79 -1.78 -1.99 116.57 115.95 1lwn h LYS 759 Ca 0.27 -0.05 -0.08 0.00 -2.18 0.00 0.00 60.65 58.60 1lwn h LYS 759 Cb 2.19 -0.20 -0.02 0.00 -1.58 0.00 0.00 32.23 32.62 1lwn h LYS 759 CO 0.68 0.59 0.09 -0.44 -1.08 0.00 0.00 179.45 179.29 1lwn h ASP 760 N 0.91 1.04 -0.26 0.86 3.45 -1.84 -1.05 116.42 119.53 1lwn h ASP 760 Ca 0.27 -0.27 -0.07 0.00 0.43 0.00 0.00 57.03 57.39 1lwn h ASP 760 Cb -0.05 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 38.44 1lwn h ASP 760 CO -0.07 1.05 -0.09 0.40 -1.57 0.00 0.00 179.24 178.96 1lwn h ILE 761 N 0.99 1.29 -0.37 0.35 2.04 -1.78 -1.88 117.51 118.15 1lwn h ILE 761 Ca 0.19 -1.14 -0.02 0.00 1.00 0.00 0.00 64.86 64.89 1lwn h ILE 761 Cb 0.46 1.50 -0.02 0.00 -0.74 0.00 0.00 36.82 38.02 1lwn h ILE 761 CO 0.02 0.36 0.14 0.58 0.00 0.00 0.00 178.15 179.24 1lwn h VAL 762 N 0.26 1.20 -0.65 1.67 2.07 -1.31 -1.60 116.25 117.89 1lwn h VAL 762 Ca 0.06 -0.62 -0.02 0.00 0.82 0.00 0.00 66.70 66.94 1lwn h VAL 762 Cb 0.58 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 31.23 1lwn h VAL 762 CO 0.03 0.22 0.32 -1.13 0.02 0.00 0.00 177.57 177.03 1lwn h ASN 763 N 0.45 0.84 -0.20 0.57 -1.24 -1.18 -1.78 115.58 113.04 1lwn h ASN 763 Ca 0.12 -0.13 0.01 0.00 0.71 0.00 0.00 56.30 57.01 1lwn h ASN 763 Cb 0.21 -0.22 -0.01 0.00 0.73 0.00 0.00 38.32 39.03 1lwn h ASN 763 CO -0.01 0.74 0.12 -0.03 -1.29 0.00 0.00 177.43 176.96 1lwn h MET 764 N 0.89 0.24 -0.61 6.67 4.05 -1.17 0.19 114.93 125.19 1lwn h MET 764 Ca 0.22 -0.01 -0.03 0.00 -0.28 0.00 0.00 59.70 59.60 1lwn h MET 764 Cb 0.11 -0.05 -0.03 0.00 -0.80 0.00 0.00 31.60 30.83 1lwn h MET 764 CO -0.03 0.16 0.26 -0.07 0.23 0.00 0.00 176.91 177.46 1lwn h LEU 765 N 0.25 0.80 0.23 3.39 3.38 -1.09 0.65 115.31 122.91 1lwn h LEU 765 Ca 0.08 -0.10 -0.33 0.00 0.09 0.00 0.00 57.88 57.62 1lwn h LEU 765 Cb -0.01 -0.20 0.03 0.00 0.09 0.00 0.00 40.66 40.56 1lwn h LEU 765 CO -0.03 0.70 -1.47 0.24 0.09 0.00 0.00 178.44 177.97 1lwn h MET 766 N 0.87 0.48 0.00 1.13 2.86 -1.04 -3.42 114.93 115.80 1lwn h MET 766 Ca 0.21 -0.82 0.00 0.00 -2.06 0.00 0.00 59.70 57.03 1lwn h MET 766 Cb 0.14 0.30 0.00 0.00 0.06 0.00 0.00 31.60 32.11 1lwn h MET 766 CO -0.02 1.39 -0.39 0.72 1.06 0.00 0.00 176.91 179.66 1lwn n HIS 767 N -3.67 0.00 -2.79 -0.22 8.25 0.64 -4.27 115.22 113.16 1lwn n HIS 767 Ca -0.16 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.27 1lwn n HIS 767 Cb 1.09 0.00 0.05 0.00 1.12 0.00 0.00 29.99 32.24 1lwn n HIS 767 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1lwn n HIS 768 N -1.03 1.21 -2.97 4.41 8.25 0.08 -5.02 115.22 120.14 1lwn n HIS 768 Ca 0.00 -2.30 -0.43 0.00 -0.26 0.00 0.00 57.72 54.72 1lwn n HIS 768 Cb 0.00 -0.26 -0.05 0.00 1.12 0.00 0.00 29.99 30.81 1lwn n HIS 768 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1lwn s ASP 769 N -3.62 6.22 0.29 0.41 2.15 -0.37 -4.85 116.67 116.90 1lwn s ASP 769 Ca 0.27 -0.96 0.26 0.00 0.43 0.00 0.00 52.55 52.55 1lwn s ASP 769 Cb 0.36 -2.37 0.96 0.00 -0.30 0.00 0.00 42.92 41.56 1lwn s ASP 769 CO -0.02 -1.22 1.76 0.03 -0.17 0.00 0.00 175.17 175.55 1lwn h ARG 770 N 9.32 0.00 -0.38 4.34 3.08 -1.97 -3.24 114.38 125.53 1lwn h ARG 770 Ca -0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.77 1lwn h ARG 770 Cb 1.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.13 1lwn h ARG 770 CO 1.10 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 181.19 1lwn n PHE 771 N -2.40 0.83 -4.14 3.04 3.72 -1.26 -5.02 117.46 112.22 1lwn n PHE 771 Ca 0.03 -0.65 -0.37 0.00 -0.05 0.00 0.00 57.45 56.40 1lwn n PHE 771 Cb 0.31 -0.17 -0.03 0.00 -0.94 0.00 0.00 39.48 38.65 1lwn n PHE 771 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1lwn n LYS 772 N 0.28 -0.88 -0.02 -1.08 5.02 -1.23 -4.77 118.16 115.48 1lwn n LYS 772 Ca 0.18 0.13 -0.09 0.00 -2.02 0.00 0.00 58.31 56.51 1lwn n LYS 772 Cb 0.68 -3.24 -0.03 0.00 -0.02 0.00 0.00 35.03 32.41 1lwn n LYS 772 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1lwn h VAL 773 N -2.18 0.81 -0.65 -0.18 2.07 -1.93 -2.61 116.25 111.58 1lwn h VAL 773 Ca -0.68 0.00 0.05 0.00 0.82 0.00 0.00 66.70 66.89 1lwn h VAL 773 Cb 1.40 0.81 -0.04 0.00 -1.52 0.00 0.00 31.29 31.94 1lwn h VAL 773 CO 0.61 0.00 0.43 -0.26 0.02 0.00 0.00 177.57 178.37 1lwn h PHE 774 N -0.02 0.69 0.00 1.57 -1.00 -1.90 -2.64 116.94 113.64 1lwn h PHE 774 Ca 0.08 0.02 -0.01 0.00 2.81 0.00 0.00 57.97 60.87 1lwn h PHE 774 Cb 0.14 -0.23 -0.00 0.00 3.61 0.00 0.00 35.95 39.47 1lwn h PHE 774 CO -0.20 0.38 -0.04 0.00 -1.61 0.00 0.00 178.31 176.83 1lwn h ALA 775 N 1.64 1.20 -0.02 2.45 0.00 -1.84 -2.59 119.26 120.10 1lwn h ALA 775 Ca 0.28 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1lwn h ALA 775 Cb 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1lwn h ALA 775 CO -0.08 0.05 -0.03 -0.25 0.00 0.00 0.00 179.25 178.94 1lwn n ASP 776 N -3.43 2.01 0.13 0.00 10.43 -1.01 -4.73 116.55 119.96 1lwn n ASP 776 Ca -0.02 -1.51 -0.13 0.00 2.57 0.00 0.00 54.79 55.70 1lwn n ASP 776 Cb 0.16 0.06 -0.06 0.00 1.84 0.00 0.00 41.12 43.13 1lwn n ASP 776 CO 0.00 0.00 0.00 0.22 -1.07 0.00 0.00 177.20 176.35 1lwn h TYR 777 N 2.45 -0.67 -0.15 1.24 3.20 -1.30 -1.68 116.97 120.06 1lwn h TYR 777 Ca 0.00 0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.92 1lwn h TYR 777 Cb 0.54 0.27 -0.04 0.00 1.54 0.00 0.00 36.73 39.04 1lwn h TYR 777 CO 0.00 -0.36 -0.09 1.49 -1.64 0.00 0.00 178.16 177.57 1lwn h GLU 778 N -0.49 -0.07 -0.37 1.82 4.81 -1.85 -1.60 114.58 116.83 1lwn h GLU 778 Ca 0.02 0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.18 1lwn h GLU 778 Cb 0.49 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.87 1lwn h GLU 778 CO -0.11 -0.05 -0.06 0.93 -0.73 0.00 0.00 179.01 178.99 1lwn h GLU 779 N -0.08 0.61 0.05 1.92 4.39 -1.88 -2.39 114.58 117.19 1lwn h GLU 779 Ca 0.09 -0.16 -0.00 0.00 0.34 0.00 0.00 59.36 59.62 1lwn h GLU 779 Cb 0.21 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 1lwn h GLU 779 CO -0.20 0.67 -0.02 -0.92 -1.16 0.00 0.00 179.01 177.38 1lwn h TYR 780 N 0.57 -0.06 -0.66 4.33 3.20 -0.95 -0.34 116.97 123.07 1lwn h TYR 780 Ca 0.11 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.97 1lwn h TYR 780 Cb 0.45 0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.70 1lwn h TYR 780 CO 0.02 0.14 0.39 0.28 -1.64 0.00 0.00 178.16 177.35 1lwn h VAL 781 N -0.24 1.19 -0.59 1.81 2.07 -1.23 0.33 116.25 119.60 1lwn h VAL 781 Ca -0.01 -0.44 -0.04 0.00 0.82 0.00 0.00 66.70 67.04 1lwn h VAL 781 Cb 0.22 0.29 -0.03 0.00 -1.52 0.00 0.00 31.29 30.25 1lwn h VAL 781 CO 0.01 0.20 0.23 0.11 0.02 0.00 0.00 177.57 178.14 1lwn h LYS 782 N 0.90 0.88 -0.72 1.57 1.57 -1.37 -1.76 116.57 117.64 1lwn h LYS 782 Ca 0.24 -0.16 -0.06 0.00 -1.87 0.00 0.00 60.65 58.79 1lwn h LYS 782 Cb -0.02 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.12 1lwn h LYS 782 CO -0.04 0.76 0.21 0.00 -0.57 0.00 0.00 179.45 179.81 1lwn h GLN 784 N 1.08 0.05 -0.62 0.00 1.08 -0.62 -1.88 115.11 114.20 1lwn h GLN 784 Ca 0.23 -0.01 -0.10 0.00 -1.45 0.00 0.00 58.65 57.32 1lwn h GLN 784 Cb 0.32 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.72 1lwn h GLN 784 CO -0.01 0.23 0.01 0.93 -0.95 0.00 0.00 178.83 179.04 1lwn h GLU 785 N 0.05 1.08 -0.35 1.46 5.08 -0.61 -2.25 114.58 119.05 1lwn h GLU 785 Ca 0.01 -0.34 -0.07 0.00 -1.00 0.00 0.00 59.36 57.95 1lwn h GLU 785 Cb 0.34 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 1lwn h GLU 785 CO 0.02 1.05 -0.10 0.00 -1.00 0.00 0.00 179.01 178.99 1lwn h ARG 786 N 0.99 0.59 -0.30 2.33 3.08 -1.04 -1.77 114.38 118.27 1lwn h ARG 786 Ca 0.18 -0.17 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 1lwn h ARG 786 Cb 0.56 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 1lwn h ARG 786 CO 0.03 0.69 0.15 0.28 -1.07 0.00 0.00 179.97 180.05 1lwn h VAL 787 N 0.55 1.14 -0.94 2.04 2.07 -1.12 -1.75 116.25 118.23 1lwn h VAL 787 Ca 0.10 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.23 1lwn h VAL 787 Cb 0.50 0.85 -0.05 0.00 -1.52 0.00 0.00 31.29 31.07 1lwn h VAL 787 CO 0.03 0.14 0.56 0.28 0.02 0.00 0.00 177.57 178.60 1lwn h SER 788 N 0.35 1.14 -0.24 0.57 0.02 -1.15 -1.57 113.55 112.67 1lwn h SER 788 Ca 0.10 -0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1lwn h SER 788 Cb 0.09 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.33 1lwn h SER 788 CO -0.02 0.88 0.15 0.00 -1.14 0.00 0.00 176.83 176.71 1lwn h ALA 789 N 1.31 0.31 -0.23 3.77 0.00 -0.94 -2.77 119.26 120.71 1lwn h ALA 789 Ca 0.34 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 55.11 1lwn h ALA 789 Cb -0.04 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1lwn h ALA 789 CO -0.06 -0.20 -0.28 1.25 0.00 0.00 0.00 179.25 179.95 1lwn h LEU 790 N 0.31 0.46 -1.72 0.00 5.85 -1.05 -2.76 115.31 116.40 1lwn h LEU 790 Ca 0.09 -0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.61 1lwn h LEU 790 Cb -0.00 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 1lwn h LEU 790 CO -0.02 0.73 -0.18 0.22 -0.34 0.00 0.00 178.44 178.85 1lwn h TYR 791 N 0.39 0.00 0.00 1.25 3.20 -1.07 -1.45 116.97 119.30 1lwn h TYR 791 Ca 0.05 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.92 1lwn h TYR 791 Cb 0.70 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.97 1lwn h TYR 791 CO 0.02 0.18 0.00 0.87 -1.64 0.00 0.00 178.16 177.59 1lwn h LYS 792 N 0.00 0.00 -3.17 1.82 1.57 -1.21 -3.28 116.57 112.29 1lwn h LYS 792 Ca -0.00 0.00 -0.63 0.00 -1.87 0.00 0.00 60.65 58.15 1lwn h LYS 792 Cb 0.38 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.28 1lwn h LYS 792 CO 0.02 0.00 -0.53 1.21 -0.57 0.00 0.00 179.45 179.58 1lwn s ASN 793 N -4.20 4.86 0.27 0.86 3.04 -0.55 -4.99 114.94 114.23 1lwn s ASN 793 Ca 0.00 -3.68 -0.04 0.00 0.04 0.00 0.00 52.86 49.19 1lwn s ASN 793 Cb 0.08 -1.67 0.56 0.00 -1.54 0.00 0.00 41.25 38.68 1lwn s ASN 793 CO 0.30 -0.12 1.60 -0.65 -3.04 0.00 0.00 177.10 175.19 1lwn h PRO 794 N 5.68 0.06 -0.57 0.43 0.11 -1.76 -0.79 132.00 135.15 1lwn h PRO 794 Ca 0.10 -0.00 0.03 0.00 0.11 0.00 0.00 66.00 66.24 1lwn h PRO 794 Cb 0.79 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 31.85 1lwn h PRO 794 CO 0.73 0.04 0.35 -0.09 -0.21 0.00 0.00 178.00 178.81 1lwn h ARG 795 N 0.06 0.66 -0.04 1.05 2.43 -1.94 -0.51 114.38 116.10 1lwn h ARG 795 Ca 0.49 -0.04 -0.21 0.00 -0.81 0.00 0.00 59.98 59.41 1lwn h ARG 795 Cb 0.91 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 30.31 1lwn h ARG 795 CO -0.80 0.44 -0.84 0.93 -1.51 0.00 0.00 179.97 178.20 1lwn h GLU 796 N 0.68 0.42 0.39 0.20 4.39 -1.62 -2.37 114.58 116.68 1lwn h GLU 796 Ca 0.23 -0.40 -0.02 0.00 0.34 0.00 0.00 59.36 59.51 1lwn h GLU 796 Cb 0.02 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 1lwn h GLU 796 CO -0.10 1.05 -0.19 2.35 -1.16 0.00 0.00 179.01 180.96 1lwn h TRP 797 N 0.27 -0.51 -0.24 4.33 2.91 -0.90 -1.95 115.95 119.85 1lwn h TRP 797 Ca -0.05 -0.01 0.00 0.00 1.13 0.00 0.00 58.89 59.95 1lwn h TRP 797 Cb 1.44 0.17 -0.01 0.00 -0.51 0.00 0.00 29.16 30.25 1lwn h TRP 797 CO 0.05 -0.31 0.15 1.15 -1.03 0.00 0.00 178.44 178.45 1lwn h THR 798 N -0.54 1.07 -0.06 2.65 2.02 -1.12 -1.40 112.91 115.53 1lwn h THR 798 Ca -0.05 -0.14 -0.13 0.00 0.77 0.00 0.00 66.41 66.86 1lwn h THR 798 Cb 0.42 0.72 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 1lwn h THR 798 CO 0.08 0.07 -0.53 0.03 0.37 0.00 0.00 175.52 175.54 1lwn h ARG 799 N 0.33 0.16 -0.17 6.66 3.08 -1.12 -1.67 114.38 121.65 1lwn h ARG 799 Ca 0.09 -0.10 -0.19 0.00 0.07 0.00 0.00 59.98 59.85 1lwn h ARG 799 Cb -0.02 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.04 1lwn h ARG 799 CO -0.02 0.66 -0.66 1.98 -1.07 0.00 0.00 179.97 180.86 1lwn h MET 800 N 0.13 0.65 -0.37 0.04 4.05 -0.51 -2.81 114.93 116.10 1lwn h MET 800 Ca 0.00 -0.47 0.02 0.00 -0.28 0.00 0.00 59.70 58.97 1lwn h MET 800 Cb 0.98 0.08 -0.03 0.00 -0.80 0.00 0.00 31.60 31.84 1lwn h MET 800 CO 0.08 1.09 0.21 0.28 0.23 0.00 0.00 176.91 178.80 1lwn h VAL 801 N 0.47 1.02 -0.79 -5.77 2.07 -1.07 -1.78 116.25 110.41 1lwn h VAL 801 Ca -0.02 -0.15 0.02 0.00 0.82 0.00 0.00 66.70 67.38 1lwn h VAL 801 Cb 1.25 0.56 -0.04 0.00 -1.52 0.00 0.00 31.29 31.54 1lwn h VAL 801 CO 0.13 0.08 0.52 0.40 0.02 0.00 0.00 177.57 178.72 1lwn h ILE 802 N 0.43 1.16 0.00 4.57 2.04 -1.26 0.12 117.51 124.57 1lwn h ILE 802 Ca 0.15 -0.35 -0.03 0.00 1.00 0.00 0.00 64.86 65.63 1lwn h ILE 802 Cb 0.02 0.06 -0.00 0.00 -0.74 0.00 0.00 36.82 36.15 1lwn h ILE 802 CO -0.08 0.19 -0.15 0.03 0.00 0.00 0.00 178.15 178.14 1lwn h ARG 803 N 1.02 0.00 0.00 2.37 3.08 -1.08 -0.80 114.38 118.97 1lwn h ARG 803 Ca 0.30 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.34 1lwn h ARG 803 Cb -0.04 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.01 1lwn h ARG 803 CO -0.08 0.15 -0.08 -0.91 -1.07 0.00 0.00 179.97 177.98 1lwn h ASN 804 N 0.00 0.00 -0.98 7.04 2.35 -0.09 -3.26 115.58 120.64 1lwn h ASN 804 Ca -0.00 -0.29 0.15 0.00 -0.55 0.00 0.00 56.30 55.61 1lwn h ASN 804 Cb 0.42 0.00 -0.09 0.00 0.05 0.00 0.00 38.32 38.70 1lwn h ASN 804 CO 0.02 0.69 0.62 0.40 -1.65 0.00 0.00 177.43 177.50 1lwn h ILE 805 N -1.00 0.83 0.00 2.81 2.04 -0.89 -1.23 117.51 120.07 1lwn h ILE 805 Ca -0.01 -0.29 -0.00 0.00 1.00 0.00 0.00 64.86 65.55 1lwn h ILE 805 Cb 0.35 -0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 36.34 1lwn h ILE 805 CO -0.01 0.16 -0.02 0.00 0.00 0.00 0.00 178.15 178.28 1lwn h ALA 806 N 1.58 1.01 -0.27 1.87 0.00 -1.28 -3.07 119.26 119.10 1lwn h ALA 806 Ca 0.51 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.41 1lwn h ALA 806 Cb 0.68 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1lwn h ALA 806 CO -0.29 0.02 0.00 0.25 0.00 0.00 0.00 179.25 179.23 1lwn n THR 807 N -3.12 1.67 1.52 0.00 -2.24 -0.49 -2.53 114.28 109.08 1lwn n THR 807 Ca 0.00 -1.48 0.14 0.00 -2.27 0.00 0.00 64.05 60.44 1lwn n THR 807 Cb 0.28 0.10 0.64 0.00 -2.10 0.00 0.00 70.33 69.26 1lwn n THR 807 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1lwn n SER 808 N -0.11 0.60 -0.27 3.42 3.41 -1.06 -4.32 113.62 115.29 1lwn n SER 808 Ca 0.16 -0.83 0.16 0.00 -0.26 0.00 0.00 58.87 58.11 1lwn n SER 808 Cb 0.65 -0.04 0.45 0.00 -0.26 0.00 0.00 64.21 65.02 1lwn n SER 808 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1lwn h GLY 809 N 4.95 1.10 2.00 5.00 0.00 -1.81 -1.29 103.07 113.02 1lwn h GLY 809 Ca 0.00 -0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.09 1lwn h GLY 809 CO 0.00 0.01 -0.01 1.70 0.00 0.00 0.00 176.54 178.24 1lwn h LYS 810 N 0.53 0.00 -0.80 4.80 3.64 -1.90 -2.80 116.57 120.04 1lwn h LYS 810 Ca 0.48 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.75 1lwn h LYS 810 Cb 1.02 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.78 1lwn h LYS 810 CO -0.22 0.01 0.14 1.19 -2.27 0.00 0.00 179.45 178.30 1lwn n PHE 811 N -3.42 1.65 -3.05 1.91 3.01 -0.49 -4.79 117.46 112.28 1lwn n PHE 811 Ca -0.03 -0.79 -0.39 0.00 1.01 0.00 0.00 57.45 57.25 1lwn n PHE 811 Cb 0.10 -0.50 -0.06 0.00 -0.01 0.00 0.00 39.48 39.02 1lwn n PHE 811 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1lwn s SER 812 N -0.55 7.26 0.30 4.37 0.15 -1.06 -0.97 113.70 123.20 1lwn s SER 812 Ca 0.38 1.49 0.24 0.00 0.70 0.00 0.00 55.95 58.76 1lwn s SER 812 Cb 0.30 -2.46 1.09 0.00 -1.71 0.00 0.00 66.02 63.24 1lwn s SER 812 CO 0.10 0.17 1.73 0.77 1.20 0.00 0.00 173.24 177.20 1lwn h SER 813 N 4.78 0.00 -0.26 5.45 4.64 -1.10 -1.61 113.55 125.45 1lwn h SER 813 Ca -0.47 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.78 1lwn h SER 813 Cb 1.21 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.28 1lwn h SER 813 CO 0.67 0.00 -0.08 0.44 -0.87 0.00 0.00 176.83 176.99 1lwn h ASP 814 N 0.00 0.63 -0.13 4.97 3.32 -1.92 0.11 116.42 123.39 1lwn h ASP 814 Ca 0.00 -0.16 -0.04 0.00 0.02 0.00 0.00 57.03 56.84 1lwn h ASP 814 Cb 0.26 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.64 1lwn h ASP 814 CO 0.00 0.75 -0.09 -0.09 -1.72 0.00 0.00 179.24 178.09 1lwn h ARG 815 N 0.60 0.29 -0.03 3.56 1.12 -1.62 -1.37 114.38 116.93 1lwn h ARG 815 Ca 0.11 -0.14 0.02 0.00 -1.11 0.00 0.00 59.98 58.86 1lwn h ARG 815 Cb 0.49 -0.00 -0.02 0.00 -0.01 0.00 0.00 29.97 30.43 1lwn h ARG 815 CO 0.03 0.65 -0.07 1.15 -3.11 0.00 0.00 179.97 178.62 1lwn h THR 816 N -0.08 0.81 -0.87 0.20 2.02 -1.43 -1.83 112.91 111.74 1lwn h THR 816 Ca 0.03 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.19 1lwn h THR 816 Cb 0.58 0.81 -0.04 0.00 -1.74 0.00 0.00 68.15 67.76 1lwn h THR 816 CO 0.02 0.00 0.48 0.40 0.37 0.00 0.00 175.52 176.79 1lwn h ILE 817 N -0.11 1.25 -0.80 3.11 1.08 -0.81 -1.17 117.51 120.06 1lwn h ILE 817 Ca 0.04 -0.62 0.02 0.00 -0.39 0.00 0.00 64.86 63.91 1lwn h ILE 817 Cb 0.16 0.08 -0.04 0.00 -3.07 0.00 0.00 36.82 33.95 1lwn h ILE 817 CO -0.10 0.28 0.53 0.00 -0.69 0.00 0.00 178.15 178.17 1lwn h ALA 818 N 1.31 1.46 -0.28 1.87 0.00 -0.90 -0.03 119.26 122.70 1lwn h ALA 818 Ca 0.31 -0.05 -0.19 0.00 0.00 0.00 0.00 54.91 54.98 1lwn h ALA 818 Cb 0.02 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.51 1lwn h ALA 818 CO -0.05 0.48 -0.56 1.96 0.00 0.00 0.00 179.25 181.09 1lwn h GLN 819 N 1.05 0.85 -0.13 0.00 4.20 -0.46 -2.46 115.11 118.15 1lwn h GLN 819 Ca 0.30 -0.54 -0.01 0.00 0.06 0.00 0.00 58.65 58.46 1lwn h GLN 819 Cb -0.07 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 1lwn h GLN 819 CO -0.07 1.18 0.06 1.88 -0.67 0.00 0.00 178.83 181.21 1lwn h TYR 820 N 0.65 0.19 -0.31 2.96 0.05 -0.63 -0.25 116.97 119.62 1lwn h TYR 820 Ca 0.01 -0.01 0.05 0.00 0.05 0.00 0.00 58.73 58.83 1lwn h TYR 820 Cb 1.16 -0.06 -0.05 0.00 1.01 0.00 0.00 36.73 38.80 1lwn h TYR 820 CO 0.07 0.24 0.02 0.00 -1.05 0.00 0.00 178.16 177.45 1lwn h ALA 821 N 0.93 0.30 -0.01 3.88 0.00 -1.01 0.65 119.26 123.99 1lwn h ALA 821 Ca 0.05 0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 1lwn h ALA 821 Cb 0.12 0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.04 1lwn h ALA 821 CO -0.01 -0.38 -0.31 0.00 0.00 0.00 0.00 179.25 178.55 1lwn h ARG 822 N 0.12 0.23 0.00 0.00 -0.00 -1.39 0.26 114.38 113.60 1lwn h ARG 822 Ca 0.15 -0.23 -0.01 0.00 -0.50 0.00 0.00 59.98 59.39 1lwn h ARG 822 Cb 0.19 0.06 -0.00 0.00 0.00 0.00 0.00 29.97 30.22 1lwn h ARG 822 CO -0.23 0.94 -0.82 0.93 0.00 0.00 0.00 179.97 180.79 1lwn h GLU 823 N -0.39 0.00 0.00 0.04 5.08 -1.06 -3.37 114.58 114.88 1lwn h GLU 823 Ca -0.03 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 1lwn h GLU 823 Cb 1.03 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 1lwn h GLU 823 CO 0.06 0.02 -1.13 -0.89 -1.00 0.00 0.00 179.01 176.07 1lwn n ILE 824 N -2.78 0.20 0.14 3.13 5.41 0.08 -4.84 119.36 120.70 1lwn n ILE 824 Ca 0.00 -0.03 0.02 0.00 1.00 0.00 0.00 62.75 63.75 1lwn n ILE 824 Cb 0.56 -1.55 0.03 0.00 -0.71 0.00 0.00 39.64 37.97 1lwn n ILE 824 CO 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 176.55 176.05 1lwn h TRP 825 N -0.11 0.00 -1.64 1.39 6.55 -1.16 -3.48 115.95 117.50 1lwn h TRP 825 Ca -0.07 0.00 -0.10 0.00 0.95 0.00 0.00 58.89 59.66 1lwn h TRP 825 Cb 1.03 0.00 0.02 0.00 -0.86 0.00 0.00 29.16 29.35 1lwn h TRP 825 CO -0.01 0.52 -0.16 0.41 -1.05 0.00 0.00 178.44 178.15 1lwn n GLY 826 N 1.21 0.42 3.17 1.49 0.00 0.75 -4.95 105.19 107.27 1lwn n GLY 826 Ca 0.02 -0.53 -0.18 0.00 0.00 0.00 0.00 46.02 45.33 1lwn n GLY 826 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lwn s VAL 827 N -2.76 1.11 -0.23 1.61 0.11 -0.18 -5.01 120.40 115.04 1lwn s VAL 827 Ca 0.09 -1.34 -0.11 0.00 -2.93 0.00 0.00 61.98 57.70 1lwn s VAL 827 Cb -0.04 -1.10 -0.05 0.00 -1.53 0.00 0.00 36.38 33.66 1lwn s VAL 827 CO 0.11 -0.25 0.16 -1.61 -3.33 0.00 0.00 175.10 170.18 1lwn s GLU 828 N -1.83 4.09 1.08 1.54 0.41 -1.26 -3.44 118.70 119.29 1lwn s GLU 828 Ca -0.01 -0.25 -0.12 0.00 -0.41 0.00 0.00 54.97 54.18 1lwn s GLU 828 Cb -0.09 -3.53 0.24 0.00 -1.78 0.00 0.00 34.13 28.97 1lwn s GLU 828 CO 0.02 0.08 1.06 -2.14 -0.49 0.00 0.00 175.26 173.80 1lwn s PRO 829 N 0.99 -0.26 -0.28 0.39 0.02 -1.26 -4.94 135.00 129.65 1lwn s PRO 829 Ca 0.08 1.02 -0.21 0.00 0.02 0.00 0.00 61.00 61.91 1lwn s PRO 829 Cb -0.13 -1.62 0.09 0.00 0.02 0.00 0.00 34.50 32.86 1lwn s PRO 829 CO 0.04 -3.33 0.79 0.45 -0.33 0.00 0.00 177.00 174.62 1lwn s SER 830 N -2.63 -0.73 0.00 2.53 0.15 0.61 -5.02 113.70 108.60 1lwn s SER 830 Ca 0.68 1.30 0.18 0.00 0.70 0.00 0.00 55.95 58.81 1lwn s SER 830 Cb -0.24 1.31 0.37 0.00 -1.71 0.00 0.00 66.02 65.75 1lwn s SER 830 CO 0.62 -0.22 1.29 0.54 1.20 0.00 0.00 173.24 176.68 1lwn n ARG 831 N 3.20 2.30 -1.68 5.44 5.12 -1.26 -2.79 116.66 126.99 1lwn n ARG 831 Ca -0.16 -2.10 -0.45 0.00 -1.93 0.00 0.00 57.85 53.21 1lwn n ARG 831 Cb 0.57 -1.42 -0.04 0.00 -1.16 0.00 0.00 32.46 30.41 1lwn n ARG 831 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1lwn n GLN 832 N 1.15 2.28 -3.35 5.56 6.02 -1.26 -4.95 117.38 122.83 1lwn n GLN 832 Ca 0.16 0.82 -0.37 0.00 -0.01 0.00 0.00 57.00 57.61 1lwn n GLN 832 Cb 0.52 -2.60 -0.06 0.00 1.02 0.00 0.00 30.24 29.12 1lwn n GLN 832 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 1lwn s ARG 833 N 0.84 4.04 0.54 -1.09 1.04 -1.26 -4.93 118.95 118.13 1lwn s ARG 833 Ca 0.77 0.55 -0.07 0.00 -1.04 0.00 0.00 55.73 55.94 1lwn s ARG 833 Cb -0.64 -3.07 -0.04 0.00 -2.04 0.00 0.00 34.95 29.17 1lwn s ARG 833 CO 0.38 0.56 0.88 -0.51 -0.04 0.00 0.00 175.30 176.57 1lwn s LEU 834 N -1.57 3.46 0.52 -1.89 1.43 0.93 -5.01 118.68 116.55 1lwn s LEU 834 Ca 0.33 1.10 -0.19 0.00 -1.03 0.00 0.00 54.13 54.34 1lwn s LEU 834 Cb -0.17 -4.09 -0.07 0.00 0.03 0.00 0.00 46.19 41.90 1lwn s LEU 834 CO 0.18 -0.71 1.08 -2.84 0.23 0.00 0.00 176.35 174.29 1lwn s PRO 835 N -4.92 3.56 0.80 1.29 0.02 -1.26 -4.59 135.00 129.90 1lwn s PRO 835 Ca 0.50 1.44 -0.12 0.00 0.02 0.00 0.00 61.00 62.85 1lwn s PRO 835 Cb -0.11 -2.05 0.08 0.00 0.02 0.00 0.00 34.50 32.44 1lwn s PRO 835 CO 0.48 -0.65 1.13 0.00 -0.33 0.00 0.00 177.00 177.64 1lwn s ALA 836 N -1.95 1.98 0.20 -1.55 0.00 -1.26 -4.91 121.76 114.26 1lwn s ALA 836 Ca 0.69 0.53 -0.21 0.00 0.00 0.00 0.00 51.96 52.97 1lwn s ALA 836 Cb -0.19 -3.38 0.14 0.00 0.00 0.00 0.00 23.12 19.69 1lwn s ALA 836 CO 0.25 -2.09 1.56 -1.35 0.00 0.00 0.00 175.76 174.13 1lwn h PRO 837 N -1.11 -0.09 0.00 0.00 0.11 -1.95 -3.52 132.00 125.44 1lwn h PRO 837 Ca -0.44 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1lwn h PRO 837 Cb 1.26 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1lwn h PRO 837 CO 0.48 -0.06 0.00 -0.25 -0.21 0.00 0.00 178.00 177.96