#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p2g s ILE 13 N 0.00 2.97 0.11 1.69 -4.36 -1.26 -5.07 121.20 115.28 1p2g s ILE 13 Ca 0.00 -0.93 -0.30 0.00 -0.26 0.00 0.00 60.65 59.16 1p2g s ILE 13 Cb 0.00 -2.21 -0.11 0.00 1.25 0.00 0.00 42.46 41.39 1p2g s ILE 13 CO 0.00 0.46 1.49 -1.28 0.24 0.00 0.00 174.94 175.85 1p2g h SER 14 N 4.92 -1.57 0.00 4.36 0.87 -1.97 -1.47 113.55 118.70 1p2g h SER 14 Ca -0.47 0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.28 1p2g h SER 14 Cb 1.15 0.62 0.00 0.00 -0.44 0.00 0.00 62.40 63.73 1p2g h SER 14 CO 0.49 -0.41 0.03 1.33 -0.53 0.00 0.00 176.83 177.75 1p2g n VAL 15 N -5.08 0.60 -0.16 2.23 0.24 -1.26 -2.48 118.33 112.42 1p2g n VAL 15 Ca -0.05 0.18 0.07 0.00 -2.04 0.00 0.00 64.34 62.51 1p2g n VAL 15 Cb 0.32 -1.18 0.29 0.00 -1.47 0.00 0.00 33.84 31.80 1p2g n VAL 15 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 1p2g n ARG 16 N -1.09 3.21 0.00 7.34 3.00 -0.55 -5.05 116.66 123.52 1p2g n ARG 16 Ca 0.00 -2.26 0.00 0.00 -0.00 0.00 0.00 57.85 55.59 1p2g n ARG 16 Cb 0.03 -1.78 0.00 0.00 0.00 0.00 0.00 32.46 30.71 1p2g n ARG 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1p2g n GLY 17 N 0.93 -0.92 3.86 5.14 0.00 -1.03 -1.26 105.19 111.92 1p2g n GLY 17 Ca 0.20 -1.64 -0.34 0.00 0.00 0.00 0.00 46.02 44.25 1p2g n GLY 17 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1p2g s LEU 18 N -3.11 4.27 0.00 0.99 1.02 -1.26 -4.62 118.68 115.97 1p2g s LEU 18 Ca 0.00 0.93 0.00 0.00 0.02 0.00 0.00 54.13 55.08 1p2g s LEU 18 Cb 0.00 -3.37 0.00 0.00 0.02 0.00 0.00 46.19 42.84 1p2g s LEU 18 CO 0.00 0.05 0.00 0.00 0.02 0.00 0.00 176.35 176.42 1p2g n ALA 19 N 0.42 0.00 -0.01 4.21 0.00 -1.26 -4.16 120.51 119.70 1p2g n ALA 19 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1p2g n ALA 19 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1p2g n ALA 19 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p2g n GLY 20 N 2.44 1.25 0.35 0.00 0.00 -1.26 -4.45 105.19 103.52 1p2g n GLY 20 Ca 0.00 -1.25 -0.12 0.00 0.00 0.00 0.00 46.02 44.65 1p2g n GLY 20 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1p2g h VAL 21 N 0.00 0.00 0.08 1.61 2.07 -1.99 -0.41 116.25 117.61 1p2g h VAL 21 Ca 0.00 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.54 1p2g h VAL 21 Cb 0.00 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 29.74 1p2g h VAL 21 CO 0.00 0.00 -0.23 -0.33 0.02 0.00 0.00 177.57 177.03 1p2g h GLU 22 N -0.58 -0.40 -0.48 1.57 5.08 -1.99 -2.58 114.58 115.20 1p2g h GLU 22 Ca -0.01 0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.47 1p2g h GLU 22 Cb 0.57 0.09 -0.10 0.00 0.50 0.00 0.00 28.75 29.81 1p2g h GLU 22 CO -0.18 -0.26 -0.23 -0.97 -1.00 0.00 0.00 179.01 176.36 1p2g h ASN 23 N -0.41 -0.81 -0.57 1.42 -1.24 -1.79 -0.78 115.58 111.40 1p2g h ASN 23 Ca 0.04 0.18 -0.04 0.00 0.71 0.00 0.00 56.30 57.19 1p2g h ASN 23 Cb 0.45 0.43 -0.02 0.00 0.73 0.00 0.00 38.32 39.91 1p2g h ASN 23 CO -0.15 -0.26 0.19 0.58 -1.29 0.00 0.00 177.43 176.50 1p2g h VAL 24 N -0.13 1.24 0.00 2.57 2.07 -0.97 -1.98 116.25 119.05 1p2g h VAL 24 Ca 0.22 -0.78 0.00 0.00 0.82 0.00 0.00 66.70 66.96 1p2g h VAL 24 Cb 0.48 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 1p2g h VAL 24 CO -0.56 0.30 0.00 0.71 0.02 0.00 0.00 177.57 178.03 1p2g h THR 25 N 0.79 0.00 0.23 2.57 1.35 -1.08 -1.98 112.91 114.79 1p2g h THR 25 Ca 0.19 -0.46 -0.33 0.00 -0.55 0.00 0.00 66.41 65.26 1p2g h THR 25 Cb 0.26 1.35 0.03 0.00 -1.73 0.00 0.00 68.15 68.07 1p2g h THR 25 CO -0.01 0.00 -1.50 -0.08 -0.25 0.00 0.00 175.52 173.68 1p2g h GLU 26 N 0.00 0.48 -0.27 4.72 4.57 -0.78 -3.10 114.58 120.20 1p2g h GLU 26 Ca 0.00 -0.82 -0.06 0.00 -1.18 0.00 0.00 59.36 57.30 1p2g h GLU 26 Cb 0.57 0.31 -0.01 0.00 -0.16 0.00 0.00 28.75 29.46 1p2g h GLU 26 CO 0.00 1.39 -0.05 -0.07 -1.18 0.00 0.00 179.01 179.09 1p2g h LEU 27 N 0.13 0.52 -0.64 1.64 3.38 -1.07 -2.51 115.31 116.77 1p2g h LEU 27 Ca -0.26 -0.36 0.03 0.00 0.09 0.00 0.00 57.88 57.39 1p2g h LEU 27 Cb 2.14 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 42.70 1p2g h LEU 27 CO 0.25 0.75 0.39 0.11 0.09 0.00 0.00 178.44 180.04 1p2g h LYS 28 N 0.27 0.75 -0.53 1.13 1.57 -1.49 0.22 116.57 118.49 1p2g h LYS 28 Ca 0.07 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.68 1p2g h LYS 28 Cb 0.52 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.65 1p2g h LYS 28 CO 0.02 0.49 -0.14 1.57 -0.57 0.00 0.00 179.45 180.83 1p2g h LYS 29 N 0.77 1.03 -0.28 3.15 2.10 -1.52 -1.99 116.57 119.82 1p2g h LYS 29 Ca 0.26 -0.40 -0.11 0.00 -2.00 0.00 0.00 60.65 58.40 1p2g h LYS 29 Cb 0.03 -0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 31.29 1p2g h LYS 29 CO -0.11 1.09 -0.28 -0.91 -2.00 0.00 0.00 179.45 177.24 1p2g h ASN 30 N 0.90 0.59 -0.64 7.07 2.35 -1.05 -0.53 115.58 124.27 1p2g h ASN 30 Ca 0.13 -0.22 0.03 0.00 -0.55 0.00 0.00 56.30 55.69 1p2g h ASN 30 Cb 0.72 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.89 1p2g h ASN 30 CO 0.06 0.85 0.40 0.15 -1.65 0.00 0.00 177.43 177.23 1p2g h PHE 31 N 0.50 0.75 -0.18 1.19 3.57 -0.28 -1.73 116.94 120.76 1p2g h PHE 31 Ca 0.06 0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.46 1p2g h PHE 31 Cb 0.75 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.23 1p2g h PHE 31 CO 0.03 0.43 -0.43 -0.91 -2.23 0.00 0.00 178.31 175.20 1p2g h ASN 32 N 0.79 0.45 0.16 0.41 2.35 -0.92 -2.00 115.58 116.81 1p2g h ASN 32 Ca 0.26 -0.20 -0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1p2g h ASN 32 Cb 0.01 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 38.25 1p2g h ASN 32 CO -0.10 0.82 -0.10 0.03 -1.65 0.00 0.00 177.43 176.43 1p2g h ARG 33 N 0.34 -0.25 -0.81 0.81 3.08 -0.38 -1.90 114.38 115.27 1p2g h ARG 33 Ca 0.03 0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 1p2g h ARG 33 Cb 0.90 0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.97 1p2g h ARG 33 CO 0.08 -0.17 0.39 0.45 -1.07 0.00 0.00 179.97 179.65 1p2g h HIS 34 N -0.26 1.16 -0.63 3.04 3.86 -1.30 0.43 115.15 121.45 1p2g h HIS 34 Ca -0.01 -0.05 -0.04 0.00 -1.16 0.00 0.00 60.37 59.10 1p2g h HIS 34 Cb 0.22 -0.36 -0.03 0.00 1.06 0.00 0.00 27.41 28.30 1p2g h HIS 34 CO -0.09 0.84 0.21 1.25 0.86 0.00 0.00 177.93 181.00 1p2g h LEU 35 N 1.15 0.87 0.04 2.43 5.85 -1.21 0.17 115.31 124.62 1p2g h LEU 35 Ca 0.28 -0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.86 1p2g h LEU 35 Cb 0.11 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 40.92 1p2g h LEU 35 CO -0.04 0.80 -0.02 -0.74 -0.34 0.00 0.00 178.44 178.11 1p2g h HIS 36 N 0.92 -0.05 0.18 1.25 2.76 -0.93 -1.10 115.15 118.17 1p2g h HIS 36 Ca 0.21 -0.00 -0.34 0.00 -2.20 0.00 0.00 60.37 58.04 1p2g h HIS 36 Cb 0.24 0.02 0.01 0.00 1.55 0.00 0.00 27.41 29.22 1p2g h HIS 36 CO 0.02 0.28 -1.64 0.74 -1.30 0.00 0.00 177.93 176.02 1p2g h PHE 37 N -0.99 0.70 0.12 5.26 0.04 -0.22 -2.85 116.94 118.99 1p2g h PHE 37 Ca -0.01 -0.51 -0.25 0.00 2.80 0.00 0.00 57.97 60.00 1p2g h PHE 37 Cb 0.35 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.48 1p2g h PHE 37 CO 0.08 1.58 -1.25 1.15 -0.60 0.00 0.00 178.31 179.27 1p2g h THR 38 N 0.10 1.15 0.00 -1.55 2.02 -0.90 -3.37 112.91 110.37 1p2g h THR 38 Ca -0.30 -2.43 0.00 0.00 0.77 0.00 0.00 66.41 64.45 1p2g h THR 38 Cb 2.09 2.82 0.00 0.00 -1.74 0.00 0.00 68.15 71.32 1p2g h THR 38 CO 0.19 0.69 -0.92 0.18 0.37 0.00 0.00 175.52 176.04 1p2g n LEU 39 N -3.99 0.67 -3.37 2.58 4.77 0.19 -5.00 117.00 112.84 1p2g n LEU 39 Ca -0.22 -0.14 -0.17 0.00 -0.03 0.00 0.00 56.01 55.44 1p2g n LEU 39 Cb 0.87 -0.11 0.04 0.00 -2.33 0.00 0.00 43.42 41.90 1p2g n LEU 39 CO 0.42 0.12 0.06 0.52 -1.33 0.00 0.00 177.39 177.17 1p2g n VAL 40 N -1.73 -8.07 -3.95 4.08 0.31 -1.01 -4.98 118.33 102.97 1p2g n VAL 40 Ca 0.03 -0.90 -0.09 0.00 -0.01 0.00 0.00 64.34 63.38 1p2g n VAL 40 Cb 0.39 -5.75 -0.04 0.00 -0.91 0.00 0.00 33.84 27.53 1p2g n VAL 40 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1p2g s LYS 41 N -4.58 1.69 0.25 5.55 1.02 -0.45 -5.01 119.74 118.21 1p2g s LYS 41 Ca 0.33 -1.20 0.08 0.00 0.02 0.00 0.00 55.97 55.20 1p2g s LYS 41 Cb -0.08 0.53 -0.05 0.00 -0.52 0.00 0.00 37.83 37.71 1p2g s LYS 41 CO 0.79 -0.73 -0.12 0.16 -0.92 0.00 0.00 175.35 174.53 1p2g s ASP 42 N -3.00 2.84 0.64 2.83 1.47 -1.26 -3.92 116.67 116.27 1p2g s ASP 42 Ca 0.19 -1.09 0.28 0.00 1.18 0.00 0.00 52.55 53.10 1p2g s ASP 42 Cb -0.03 -0.18 1.47 0.00 -0.34 0.00 0.00 42.92 43.84 1p2g s ASP 42 CO 0.09 -0.21 1.85 0.03 0.68 0.00 0.00 175.17 177.61 1p2g h ARG 43 N 2.39 0.00 -0.00 2.11 2.47 -1.97 -0.99 114.38 118.39 1p2g h ARG 43 Ca -0.39 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.33 1p2g h ARG 43 Cb 1.23 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.55 1p2g h ARG 43 CO 0.64 0.00 -0.18 0.09 0.56 0.00 0.00 179.97 181.08 1p2g n ASN 44 N -3.16 0.57 0.00 7.04 4.13 -1.26 -3.98 115.26 118.59 1p2g n ASN 44 Ca 0.02 -0.53 0.00 0.00 1.68 0.00 0.00 54.58 55.75 1p2g n ASN 44 Cb 0.53 -0.02 0.00 0.00 -1.54 0.00 0.00 39.78 38.75 1p2g n ASN 44 CO 0.00 0.00 0.00 1.33 0.28 0.00 0.00 177.26 178.87 1p2g n VAL 45 N -0.98 0.00 -1.80 2.41 0.24 -0.48 -5.07 118.33 112.64 1p2g n VAL 45 Ca 0.12 -0.24 -0.42 0.00 -2.04 0.00 0.00 64.34 61.77 1p2g n VAL 45 Cb 0.30 1.04 -0.02 0.00 -1.47 0.00 0.00 33.84 33.70 1p2g n VAL 45 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1p2g s ALA 46 N -0.44 3.77 0.30 2.33 0.00 -0.56 -4.94 121.76 122.22 1p2g s ALA 46 Ca 0.00 1.54 0.03 0.00 0.00 0.00 0.00 51.96 53.53 1p2g s ALA 46 Cb 0.00 -3.65 -0.03 0.00 0.00 0.00 0.00 23.12 19.45 1p2g s ALA 46 CO 0.00 -0.94 0.46 0.95 0.00 0.00 0.00 175.76 176.23 1p2g s THR 47 N 0.26 4.97 0.45 0.00 -4.23 -1.26 -4.96 115.64 110.87 1p2g s THR 47 Ca 0.65 -0.79 0.18 0.00 -1.18 0.00 0.00 61.69 60.56 1p2g s THR 47 Cb -0.47 -3.78 0.37 0.00 1.34 0.00 0.00 72.50 69.96 1p2g s THR 47 CO 0.44 -0.38 1.94 -0.65 -0.54 0.00 0.00 174.62 175.42 1p2g h PRO 48 N 0.95 0.30 -0.43 3.99 0.11 -2.00 0.21 132.00 135.12 1p2g h PRO 48 Ca -0.50 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.50 1p2g h PRO 48 Cb 1.23 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 1p2g h PRO 48 CO 0.60 0.20 -0.08 -0.09 -0.21 0.00 0.00 178.00 178.41 1p2g h ARG 49 N 0.31 0.76 -0.74 1.05 2.43 -1.97 -1.45 114.38 114.76 1p2g h ARG 49 Ca 0.35 -0.24 -0.02 0.00 -0.81 0.00 0.00 59.98 59.26 1p2g h ARG 49 Cb 0.91 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.36 1p2g h ARG 49 CO -0.09 0.83 0.39 -0.44 -1.51 0.00 0.00 179.97 179.15 1p2g h ASP 50 N 0.70 0.94 -0.56 -3.80 3.45 -0.98 -1.57 116.42 114.60 1p2g h ASP 50 Ca 0.12 -0.11 -0.04 0.00 0.43 0.00 0.00 57.03 57.44 1p2g h ASP 50 Cb 0.55 -0.24 -0.02 0.00 -0.56 0.00 0.00 39.33 39.05 1p2g h ASP 50 CO 0.03 0.78 0.20 1.88 -1.57 0.00 0.00 179.24 180.56 1p2g h TYR 51 N 1.03 0.87 -0.69 4.55 0.05 -0.81 -1.23 116.97 120.76 1p2g h TYR 51 Ca 0.26 -0.08 0.03 0.00 0.05 0.00 0.00 58.73 59.00 1p2g h TYR 51 Cb 0.06 -0.26 -0.04 0.00 1.01 0.00 0.00 36.73 37.50 1p2g h TYR 51 CO 0.00 0.72 0.43 -0.92 -1.05 0.00 0.00 178.16 177.34 1p2g h TYR 52 N 0.77 0.79 -0.27 4.88 3.20 -0.89 -1.90 116.97 123.55 1p2g h TYR 52 Ca 0.18 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 61.97 1p2g h TYR 52 Cb 0.24 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 1p2g h TYR 52 CO 0.01 0.44 -0.29 0.74 -1.64 0.00 0.00 178.16 177.43 1p2g h PHE 53 N 0.83 0.62 -0.41 -3.82 -1.00 -0.93 0.13 116.94 112.37 1p2g h PHE 53 Ca 0.28 -0.15 -0.03 0.00 2.81 0.00 0.00 57.97 60.88 1p2g h PHE 53 Cb 0.04 -0.15 -0.02 0.00 3.61 0.00 0.00 35.95 39.44 1p2g h PHE 53 CO -0.05 0.78 0.14 0.00 -1.61 0.00 0.00 178.31 177.57 1p2g h ALA 54 N 1.22 0.53 -0.34 2.45 0.00 -0.85 -0.21 119.26 122.05 1p2g h ALA 54 Ca 0.06 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 1p2g h ALA 54 Cb 0.74 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1p2g h ALA 54 CO 0.06 0.16 -0.06 1.25 0.00 0.00 0.00 179.25 180.67 1p2g h LEU 55 N 0.51 0.64 -0.73 0.00 5.85 -1.17 -1.78 115.31 118.63 1p2g h LEU 55 Ca 0.13 -0.35 0.02 0.00 0.84 0.00 0.00 57.88 58.53 1p2g h LEU 55 Cb 0.24 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.05 1p2g h LEU 55 CO -0.01 0.84 0.46 0.00 -0.34 0.00 0.00 178.44 179.39 1p2g h ALA 56 N 0.83 0.95 -0.18 1.25 0.00 -0.50 -0.48 119.26 121.12 1p2g h ALA 56 Ca 0.09 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 1p2g h ALA 56 Cb 0.54 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1p2g h ALA 56 CO 0.03 0.27 -0.37 0.45 0.00 0.00 0.00 179.25 179.62 1p2g h HIS 57 N 0.92 0.44 -0.08 0.00 3.86 -0.96 -0.95 115.15 118.37 1p2g h HIS 57 Ca 0.29 -0.12 -0.01 0.00 -1.16 0.00 0.00 60.37 59.37 1p2g h HIS 57 Cb -0.01 -0.10 -0.00 0.00 1.06 0.00 0.00 27.41 28.35 1p2g h HIS 57 CO -0.03 0.70 0.02 1.15 0.86 0.00 0.00 177.93 180.63 1p2g h THR 58 N 0.32 1.20 -0.69 2.45 2.02 -0.51 -1.95 112.91 115.76 1p2g h THR 58 Ca 0.03 -0.63 -0.05 0.00 0.77 0.00 0.00 66.41 66.53 1p2g h THR 58 Cb 0.81 1.47 -0.03 0.00 -1.74 0.00 0.00 68.15 68.66 1p2g h THR 58 CO 0.06 0.18 0.21 0.58 0.37 0.00 0.00 175.52 176.93 1p2g h VAL 59 N -0.09 1.25 -0.84 3.16 2.07 -1.07 -2.61 116.25 118.12 1p2g h VAL 59 Ca 0.03 -0.88 0.09 0.00 0.82 0.00 0.00 66.70 66.76 1p2g h VAL 59 Cb 0.26 0.53 -0.06 0.00 -1.52 0.00 0.00 31.29 30.50 1p2g h VAL 59 CO 0.00 0.34 0.55 -0.09 0.02 0.00 0.00 177.57 178.39 1p2g h ARG 60 N 1.00 0.79 -0.09 1.57 2.43 -1.00 -1.20 114.38 117.88 1p2g h ARG 60 Ca 0.22 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.35 1p2g h ARG 60 Cb 0.30 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 29.67 1p2g h ARG 60 CO -0.01 0.53 0.06 -0.44 -1.51 0.00 0.00 179.97 178.60 1p2g h ASP 61 N 0.82 0.07 0.75 -3.80 3.45 -0.95 -1.23 116.42 115.53 1p2g h ASP 61 Ca 0.39 -0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.84 1p2g h ASP 61 Cb 0.41 -0.02 0.00 0.00 -0.56 0.00 0.00 39.33 39.16 1p2g h ASP 61 CO -0.16 0.05 0.00 1.41 -1.57 0.00 0.00 179.24 178.97 1p2g n HIS 62 N -4.52 0.00 -0.01 4.55 8.25 -0.46 -3.49 115.22 119.54 1p2g n HIS 62 Ca -0.01 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.23 1p2g n HIS 62 Cb 0.11 -0.46 -0.14 0.00 1.12 0.00 0.00 29.99 30.63 1p2g n HIS 62 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1p2g h LEU 63 N 0.00 0.35 -0.78 2.41 3.38 -1.27 -3.41 115.31 115.98 1p2g h LEU 63 Ca 0.00 -0.87 0.17 0.00 0.09 0.00 0.00 57.88 57.27 1p2g h LEU 63 Cb 0.38 -0.11 -0.14 0.00 0.09 0.00 0.00 40.66 40.87 1p2g h LEU 63 CO 0.00 1.78 -0.08 -0.37 0.09 0.00 0.00 178.44 179.86 1p2g h VAL 64 N -0.14 0.26 -0.30 1.22 -1.51 -1.58 0.65 116.25 114.85 1p2g h VAL 64 Ca -0.40 -0.02 0.04 0.00 -1.23 0.00 0.00 66.70 65.09 1p2g h VAL 64 Cb 1.89 0.21 -0.03 0.00 -2.13 0.00 0.00 31.29 31.23 1p2g h VAL 64 CO 0.04 0.01 0.09 1.23 -1.23 0.00 0.00 177.57 177.71 1p2g h GLY 65 N 0.05 0.37 1.34 5.19 0.00 -1.80 -1.29 103.07 106.93 1p2g h GLY 65 Ca 0.41 -0.05 -0.13 0.00 0.00 0.00 0.00 47.33 47.56 1p2g h GLY 65 CO -0.75 0.02 -0.33 3.21 0.00 0.00 0.00 176.54 178.69 1p2g h ARG 66 N 0.22 0.74 -0.31 4.80 3.08 -1.54 -2.35 114.38 119.01 1p2g h ARG 66 Ca 0.14 -0.35 -0.01 0.00 0.07 0.00 0.00 59.98 59.83 1p2g h ARG 66 Cb 0.12 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 1p2g h ARG 66 CO -0.15 0.97 0.18 2.35 -1.07 0.00 0.00 179.97 182.24 1p2g h TRP 67 N 0.62 0.43 -0.52 3.04 7.01 -0.61 0.13 115.95 126.05 1p2g h TRP 67 Ca 0.07 -0.01 -0.10 0.00 2.11 0.00 0.00 58.89 60.95 1p2g h TRP 67 Cb 0.86 -0.14 -0.02 0.00 -2.10 0.00 0.00 29.16 27.77 1p2g h TRP 67 CO 0.04 0.34 -0.08 0.82 -2.79 0.00 0.00 178.44 176.78 1p2g h ILE 68 N 0.39 1.27 -0.02 2.65 2.04 -1.22 -2.43 117.51 120.19 1p2g h ILE 68 Ca 0.11 -1.22 -0.16 0.00 1.00 0.00 0.00 64.86 64.60 1p2g h ILE 68 Cb 0.05 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 1p2g h ILE 68 CO -0.02 0.43 -0.70 0.08 0.00 0.00 0.00 178.15 177.94 1p2g h ARG 69 N 0.85 0.13 -0.12 2.37 0.11 -1.23 -1.06 114.38 115.43 1p2g h ARG 69 Ca 0.14 -0.10 -0.02 0.00 0.10 0.00 0.00 59.98 60.10 1p2g h ARG 69 Cb 0.63 0.02 -0.00 0.00 1.11 0.00 0.00 29.97 31.73 1p2g h ARG 69 CO 0.04 0.78 0.00 1.15 0.10 0.00 0.00 179.97 182.04 1p2g h THR 70 N 0.08 1.25 0.00 0.08 2.02 -0.67 0.29 112.91 115.96 1p2g h THR 70 Ca -0.02 -0.81 -0.05 0.00 0.77 0.00 0.00 66.41 66.31 1p2g h THR 70 Cb 1.25 1.56 -0.01 0.00 -1.74 0.00 0.00 68.15 69.21 1p2g h THR 70 CO 0.10 0.23 -0.22 1.56 0.37 0.00 0.00 175.52 177.56 1p2g h GLN 71 N -0.06 0.00 -0.12 6.66 1.08 -1.43 -2.12 115.11 119.13 1p2g h GLN 71 Ca 0.03 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.17 1p2g h GLN 71 Cb 0.36 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.79 1p2g h GLN 71 CO 0.01 0.22 -0.19 0.37 -0.95 0.00 0.00 178.83 178.29 1p2g h GLN 72 N 0.00 0.33 -0.28 1.46 5.75 -0.75 -2.95 115.11 118.67 1p2g h GLN 72 Ca -0.00 -0.20 0.06 0.00 -0.15 0.00 0.00 58.65 58.36 1p2g h GLN 72 Cb 0.52 0.02 -0.06 0.00 1.07 0.00 0.00 27.48 29.02 1p2g h GLN 72 CO 0.03 0.78 -0.13 1.25 -2.65 0.00 0.00 178.83 178.12 1p2g h HIS 73 N -0.08 -0.30 -0.46 3.99 2.76 0.15 -1.86 115.15 119.34 1p2g h HIS 73 Ca 0.01 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.20 1p2g h HIS 73 Cb 0.76 0.18 -0.02 0.00 1.55 0.00 0.00 27.41 29.87 1p2g h HIS 73 CO 0.10 -0.19 0.25 1.88 -1.30 0.00 0.00 177.93 178.67 1p2g h TYR 74 N -0.08 0.62 -0.49 5.26 0.05 -1.45 -0.22 116.97 120.65 1p2g h TYR 74 Ca 0.15 -0.00 -0.06 0.00 0.05 0.00 0.00 58.73 58.86 1p2g h TYR 74 Cb 0.30 -0.20 -0.02 0.00 1.01 0.00 0.00 36.73 37.82 1p2g h TYR 74 CO -0.32 0.44 0.06 -0.92 -1.05 0.00 0.00 178.16 176.37 1p2g h TYR 75 N 0.64 0.89 0.25 4.88 3.20 -1.18 0.34 116.97 125.99 1p2g h TYR 75 Ca 0.17 -0.13 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 1p2g h TYR 75 Cb 0.02 -0.24 0.00 0.00 1.54 0.00 0.00 36.73 38.06 1p2g h TYR 75 CO 0.00 0.82 -0.12 0.93 -1.64 0.00 0.00 178.16 178.16 1p2g h GLU 76 N 0.70 -0.32 0.00 1.82 5.08 -0.69 -3.30 114.58 117.87 1p2g h GLU 76 Ca 0.15 0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 58.44 1p2g h GLU 76 Cb 0.43 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 1p2g h GLU 76 CO 0.01 0.04 -0.44 0.87 -1.00 0.00 0.00 179.01 178.50 1p2g h LYS 77 N -0.85 0.00 -6.00 2.33 1.79 -1.12 -3.48 116.57 109.24 1p2g h LYS 77 Ca -0.03 0.00 -0.39 0.00 -2.18 0.00 0.00 60.65 58.05 1p2g h LYS 77 Cb 0.51 0.00 0.09 0.00 -1.58 0.00 0.00 32.23 31.25 1p2g h LYS 77 CO 0.06 0.44 -0.86 -3.47 -1.08 0.00 0.00 179.45 174.53 1p2g n ASP 78 N -3.64 -3.20 -4.48 0.86 2.03 0.12 -4.99 116.55 103.25 1p2g n ASP 78 Ca -0.01 -0.85 -0.29 0.00 0.52 0.00 0.00 54.79 54.17 1p2g n ASP 78 Cb 0.53 -4.12 0.16 0.00 -0.72 0.00 0.00 41.12 36.97 1p2g n ASP 78 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1p2g s PRO 79 N -5.68 0.65 0.21 -0.67 0.04 -1.26 -4.97 135.00 123.32 1p2g s PRO 79 Ca 0.20 0.07 -0.30 0.00 0.04 0.00 0.00 61.00 61.01 1p2g s PRO 79 Cb -0.05 -1.80 -0.09 0.00 0.04 0.00 0.00 34.50 32.59 1p2g s PRO 79 CO 0.81 -2.48 1.37 0.21 0.04 0.00 0.00 177.00 176.95 1p2g s LYS 80 N -5.45 4.33 -0.14 4.56 2.20 -1.26 -4.96 119.74 119.03 1p2g s LYS 80 Ca 0.67 2.15 -0.10 0.00 -0.36 0.00 0.00 55.97 58.33 1p2g s LYS 80 Cb -0.11 -3.17 -0.05 0.00 -1.51 0.00 0.00 37.83 32.99 1p2g s LYS 80 CO 0.53 -0.34 0.19 1.03 -0.36 0.00 0.00 175.35 176.41 1p2g s ARG 81 N -0.04 3.91 -0.25 4.03 3.00 -0.43 -4.55 118.95 124.61 1p2g s ARG 81 Ca 0.59 -0.06 -0.09 0.00 0.00 0.00 0.00 55.73 56.17 1p2g s ARG 81 Cb -0.39 -3.32 -0.04 0.00 0.00 0.00 0.00 34.95 31.21 1p2g s ARG 81 CO 0.39 0.50 0.11 0.42 0.00 0.00 0.00 175.30 176.72 1p2g s ILE 82 N -0.25 4.74 -0.31 1.52 -1.09 -0.45 -1.75 121.20 123.61 1p2g s ILE 82 Ca 0.14 -0.03 -0.06 0.00 -2.23 0.00 0.00 60.65 58.47 1p2g s ILE 82 Cb -0.12 -3.22 0.02 0.00 -1.58 0.00 0.00 42.46 37.56 1p2g s ILE 82 CO 0.03 0.32 0.07 -0.31 -1.23 0.00 0.00 174.94 173.82 1p2g s TYR 83 N 1.52 3.18 -0.52 3.97 2.02 -0.04 -0.48 117.35 127.00 1p2g s TYR 83 Ca 0.06 -1.22 -0.17 0.00 -0.37 0.00 0.00 57.07 55.38 1p2g s TYR 83 Cb -0.15 -2.24 0.10 0.00 -0.40 0.00 0.00 41.96 39.27 1p2g s TYR 83 CO 0.06 -0.65 0.50 -0.47 -1.57 0.00 0.00 175.55 173.42 1p2g s TYR 84 N 1.44 3.19 -0.15 2.71 5.04 -0.18 -0.94 117.35 128.46 1p2g s TYR 84 Ca 0.01 -1.03 -0.20 0.00 -2.44 0.00 0.00 57.07 53.40 1p2g s TYR 84 Cb -0.18 -3.58 -0.03 0.00 0.35 0.00 0.00 41.96 38.52 1p2g s TYR 84 CO 0.02 -0.98 0.59 -0.51 -1.34 0.00 0.00 175.55 173.33 1p2g s LEU 85 N 1.88 4.21 -0.10 6.97 1.02 -0.65 -1.28 118.68 130.73 1p2g s LEU 85 Ca 0.06 0.88 -0.21 0.00 0.02 0.00 0.00 54.13 54.88 1p2g s LEU 85 Cb -0.26 -2.86 0.05 0.00 0.02 0.00 0.00 46.19 43.14 1p2g s LEU 85 CO 0.06 -0.16 0.50 -0.55 0.02 0.00 0.00 176.35 176.21 1p2g s SER 86 N 0.97 -0.47 0.00 2.29 0.15 -0.81 -2.11 113.70 113.72 1p2g s SER 86 Ca 0.29 0.67 0.23 0.00 0.70 0.00 0.00 55.95 57.85 1p2g s SER 86 Cb -0.16 0.70 0.85 0.00 -1.71 0.00 0.00 66.02 65.70 1p2g s SER 86 CO 0.12 -0.37 1.61 0.18 1.20 0.00 0.00 173.24 175.98 1p2g n LEU 87 N 1.84 1.64 -3.83 3.45 4.32 -1.26 -4.10 117.00 119.07 1p2g n LEU 87 Ca -0.17 -0.64 -0.13 0.00 -0.02 0.00 0.00 56.01 55.05 1p2g n LEU 87 Cb 0.56 -0.07 -0.14 0.00 -1.62 0.00 0.00 43.42 42.15 1p2g n LEU 87 CO 0.17 0.32 -0.32 -1.61 -1.22 0.00 0.00 177.39 174.73 1p2g s GLU 88 N -1.86 0.03 -0.34 3.23 2.02 -1.26 -4.72 118.70 115.79 1p2g s GLU 88 Ca 0.34 0.11 0.00 0.00 0.02 0.00 0.00 54.97 55.45 1p2g s GLU 88 Cb 0.19 -0.06 0.14 0.00 0.10 0.00 0.00 34.13 34.49 1p2g s GLU 88 CO 0.29 -0.06 0.25 -0.06 0.02 0.00 0.00 175.26 175.70 1p2g s PHE 89 N 0.38 0.31 -1.32 1.61 0.40 -0.19 -4.63 117.98 114.55 1p2g s PHE 89 Ca -0.03 -1.22 -0.17 0.00 -0.60 0.00 0.00 56.93 54.91 1p2g s PHE 89 Cb -0.04 -0.74 0.07 0.00 0.51 0.00 0.00 43.02 42.82 1p2g s PHE 89 CO -0.01 -0.87 1.80 0.98 0.70 0.00 0.00 175.22 177.81 1p2g n TYR 90 N 4.33 4.51 -0.03 0.36 4.19 0.47 -3.79 117.16 127.20 1p2g n TYR 90 Ca 0.09 -2.88 -0.17 0.00 3.31 0.00 0.00 57.90 58.25 1p2g n TYR 90 Cb 0.40 -2.60 -0.06 0.00 0.49 0.00 0.00 39.34 37.57 1p2g n TYR 90 CO 0.00 0.00 0.00 0.52 0.91 0.00 0.00 176.86 178.29 1p2g h MET 91 N 7.31 0.79 0.00 2.98 2.86 -1.80 -3.42 114.93 123.65 1p2g h MET 91 Ca 0.46 -0.63 0.00 0.00 -2.06 0.00 0.00 59.70 57.47 1p2g h MET 91 Cb 0.83 0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.62 1p2g h MET 91 CO 1.51 1.24 0.00 0.41 1.06 0.00 0.00 176.91 181.13 1p2g n GLY 92 N 0.65 -0.80 3.84 8.32 0.00 -0.94 -4.81 105.19 111.45 1p2g n GLY 92 Ca -0.07 -1.17 -0.32 0.00 0.00 0.00 0.00 46.02 44.46 1p2g n GLY 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1p2g s ARG 93 N 0.00 3.98 0.00 1.61 0.52 -1.26 -2.20 118.95 121.60 1p2g s ARG 93 Ca 0.00 0.90 0.00 0.00 -0.52 0.00 0.00 55.73 56.11 1p2g s ARG 93 Cb 0.00 -2.20 -0.00 0.00 0.52 0.00 0.00 34.95 33.27 1p2g s ARG 93 CO 0.00 -0.16 0.07 0.25 0.02 0.00 0.00 175.30 175.47 1p2g n THR 94 N -1.29 0.00 0.21 0.02 -2.24 -1.26 -4.66 114.28 105.06 1p2g n THR 94 Ca 0.06 -0.49 -0.15 0.00 -2.27 0.00 0.00 64.05 61.20 1p2g n THR 94 Cb 0.54 1.00 -0.08 0.00 -2.10 0.00 0.00 70.33 69.69 1p2g n THR 94 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1p2g h LEU 95 N 0.01 -0.40 -0.64 3.22 5.85 -1.97 -1.53 115.31 119.85 1p2g h LEU 95 Ca 0.00 -0.01 -0.11 0.00 0.84 0.00 0.00 57.88 58.60 1p2g h LEU 95 Cb 0.01 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 1p2g h LEU 95 CO 0.00 -0.26 -0.14 -0.61 -0.34 0.00 0.00 178.44 177.10 1p2g h GLN 96 N -0.51 0.92 -0.86 1.25 4.15 -1.97 -2.34 115.11 115.76 1p2g h GLN 96 Ca -0.05 -0.34 -0.01 0.00 0.77 0.00 0.00 58.65 59.01 1p2g h GLN 96 Cb 0.38 -0.06 -0.04 0.00 0.21 0.00 0.00 27.48 27.97 1p2g h GLN 96 CO 0.08 1.00 0.48 -0.97 -1.93 0.00 0.00 178.83 177.49 1p2g h ASN 97 N 0.82 1.06 -0.40 -0.69 -0.73 -1.81 -0.66 115.58 113.17 1p2g h ASN 97 Ca 0.13 -0.09 -0.07 0.00 1.87 0.00 0.00 56.30 58.14 1p2g h ASN 97 Cb 0.68 -0.27 -0.01 0.00 0.27 0.00 0.00 38.32 38.98 1p2g h ASN 97 CO 0.05 0.84 -0.03 0.74 -0.37 0.00 0.00 177.43 178.66 1p2g h THR 98 N 1.20 1.27 -0.11 -3.57 2.02 -1.07 -1.87 112.91 110.77 1p2g h THR 98 Ca 0.30 -1.07 -0.00 0.00 0.77 0.00 0.00 66.41 66.42 1p2g h THR 98 Cb 0.01 1.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.57 1p2g h THR 98 CO -0.05 0.36 0.07 0.24 0.37 0.00 0.00 175.52 176.51 1p2g h MET 99 N 0.54 0.15 -0.04 6.66 2.86 -0.96 -1.83 114.93 122.33 1p2g h MET 99 Ca 0.11 -0.01 0.03 0.00 -2.06 0.00 0.00 59.70 57.77 1p2g h MET 99 Cb 0.52 -0.03 -0.05 0.00 0.06 0.00 0.00 31.60 32.10 1p2g h MET 99 CO 0.03 0.14 -0.24 0.28 1.06 0.00 0.00 176.91 178.18 1p2g h VAL 100 N 0.12 0.44 0.00 -2.22 2.07 -1.04 0.54 116.25 116.17 1p2g h VAL 100 Ca 0.04 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.56 1p2g h VAL 100 Cb 0.03 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 1p2g h VAL 100 CO -0.01 0.00 0.00 0.78 0.02 0.00 0.00 177.57 178.36 1p2g h ASN 101 N -0.35 0.00 -0.01 0.57 -0.26 -1.20 -1.63 115.58 112.70 1p2g h ASN 101 Ca 0.07 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.81 1p2g h ASN 101 Cb 0.45 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.71 1p2g h ASN 101 CO -0.24 0.00 -0.38 0.18 -1.06 0.00 0.00 177.43 175.93 1p2g n LEU 102 N -2.35 1.42 -1.83 1.61 4.32 -0.51 -1.13 117.00 118.54 1p2g n LEU 102 Ca 0.00 -0.72 -0.16 0.00 -0.02 0.00 0.00 56.01 55.11 1p2g n LEU 102 Cb 0.15 0.00 -0.01 0.00 -1.62 0.00 0.00 43.42 41.94 1p2g n LEU 102 CO 0.16 0.28 -0.21 0.00 -1.22 0.00 0.00 177.39 176.40 1p2g n ALA 103 N -0.35 -0.47 0.77 -1.18 0.00 0.18 -4.89 120.51 114.57 1p2g n ALA 103 Ca 0.06 0.13 0.11 0.00 0.00 0.00 0.00 53.44 53.73 1p2g n ALA 103 Cb 0.30 -1.81 0.11 0.00 0.00 0.00 0.00 19.45 18.06 1p2g n ALA 103 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1p2g n LEU 104 N -2.31 2.88 -0.14 0.00 4.77 -0.50 -4.40 117.00 117.30 1p2g n LEU 104 Ca -0.19 -1.10 -0.04 0.00 -0.03 0.00 0.00 56.01 54.65 1p2g n LEU 104 Cb 0.64 -0.04 0.05 0.00 -2.33 0.00 0.00 43.42 41.74 1p2g n LEU 104 CO 0.22 0.52 0.93 -0.08 -1.33 0.00 0.00 177.39 177.65 1p2g h GLU 105 N 4.17 0.27 -0.18 3.23 4.81 -1.69 -0.16 114.58 125.02 1p2g h GLU 105 Ca 0.00 -0.02 -0.14 0.00 -0.13 0.00 0.00 59.36 59.08 1p2g h GLU 105 Cb 0.90 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.22 1p2g h GLU 105 CO 0.00 0.18 -0.43 -0.91 -0.73 0.00 0.00 179.01 177.13 1p2g h ASN 106 N 0.28 0.69 -0.23 1.04 2.35 -1.44 -2.12 115.58 116.16 1p2g h ASN 106 Ca 0.22 -0.57 0.05 0.00 -0.55 0.00 0.00 56.30 55.45 1p2g h ASN 106 Cb 0.25 -0.20 -0.05 0.00 0.05 0.00 0.00 38.32 38.37 1p2g h ASN 106 CO -0.25 1.13 -0.07 0.00 -1.65 0.00 0.00 177.43 176.59 1p2g h ALA 107 N 0.58 0.13 -0.48 -0.83 0.00 -1.68 0.12 119.26 117.11 1p2g h ALA 107 Ca -0.00 0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 1p2g h ALA 107 Cb 1.03 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 1p2g h ALA 107 CO 0.09 -0.49 0.03 0.00 0.00 0.00 0.00 179.25 178.89 1p2g h ASP 109 N 0.73 1.04 0.02 0.00 3.58 -0.65 0.56 116.42 121.70 1p2g h ASP 109 Ca 0.15 -0.16 -0.00 0.00 0.42 0.00 0.00 57.03 57.44 1p2g h ASP 109 Cb 0.39 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 41.17 1p2g h ASP 109 CO 0.01 0.92 -0.01 -0.08 -2.88 0.00 0.00 179.24 177.20 1p2g h GLU 110 N 1.10 -0.03 -0.75 0.28 4.57 -0.34 -1.73 114.58 117.68 1p2g h GLU 110 Ca 0.26 0.00 0.06 0.00 -1.18 0.00 0.00 59.36 58.50 1p2g h GLU 110 Cb 0.18 0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 28.72 1p2g h GLU 110 CO -0.02 0.54 0.45 0.00 -1.18 0.00 0.00 179.01 178.79 1p2g h ALA 111 N 0.32 1.02 -0.08 2.92 0.00 -0.66 0.14 119.26 122.93 1p2g h ALA 111 Ca -0.00 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 1p2g h ALA 111 Cb 0.58 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1p2g h ALA 111 CO 0.01 0.16 -0.50 1.79 0.00 0.00 0.00 179.25 180.70 1p2g h THR 112 N 0.82 1.35 0.00 0.00 1.35 -0.94 -2.30 112.91 113.19 1p2g h THR 112 Ca 0.33 -1.73 -0.00 0.00 -0.55 0.00 0.00 66.41 64.46 1p2g h THR 112 Cb 0.17 1.85 0.00 0.00 -1.73 0.00 0.00 68.15 68.44 1p2g h THR 112 CO -0.17 0.51 -0.00 0.22 -0.25 0.00 0.00 175.52 175.83 1p2g h TYR 113 N 0.16 -0.00 0.00 4.73 3.20 -0.22 0.24 116.97 125.08 1p2g h TYR 113 Ca 0.01 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.87 1p2g h TYR 113 Cb 0.94 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 39.21 1p2g h TYR 113 CO 0.01 0.17 -0.04 1.96 -1.64 0.00 0.00 178.16 178.63 1p2g h GLN 114 N -0.18 0.00 -0.15 1.82 4.20 -0.66 0.17 115.11 120.31 1p2g h GLN 114 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1p2g h GLN 114 Cb 0.18 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.96 1p2g h GLN 114 CO 0.00 0.04 0.00 1.28 -0.67 0.00 0.00 178.83 179.48 1p2g n LEU 115 N -4.46 0.93 -2.17 1.46 4.77 -0.88 -4.89 117.00 111.77 1p2g n LEU 115 Ca -0.03 -0.44 -0.13 0.00 -0.03 0.00 0.00 56.01 55.37 1p2g n LEU 115 Cb 0.12 -0.10 0.04 0.00 -2.33 0.00 0.00 43.42 41.15 1p2g n LEU 115 CO 0.34 0.22 0.11 0.61 -1.33 0.00 0.00 177.39 177.34 1p2g n GLY 116 N 0.84 0.07 3.05 -0.72 0.00 0.58 -5.04 105.19 103.97 1p2g n GLY 116 Ca 0.09 -0.17 -0.19 0.00 0.00 0.00 0.00 46.02 45.74 1p2g n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1p2g s LEU 117 N -4.47 2.03 -0.38 0.99 1.43 0.79 -5.01 118.68 114.06 1p2g s LEU 117 Ca 0.30 -0.21 -0.21 0.00 -1.03 0.00 0.00 54.13 52.98 1p2g s LEU 117 Cb -0.13 -0.53 0.01 0.00 0.03 0.00 0.00 46.19 45.57 1p2g s LEU 117 CO 0.37 0.12 0.65 -0.62 0.23 0.00 0.00 176.35 177.09 1p2g s ASP 118 N -0.31 6.40 0.24 2.29 3.68 -1.26 -3.44 116.67 124.26 1p2g s ASP 118 Ca 0.04 -0.00 -0.07 0.00 2.13 0.00 0.00 52.55 54.65 1p2g s ASP 118 Cb -0.04 -2.33 0.25 0.00 -1.45 0.00 0.00 42.92 39.35 1p2g s ASP 118 CO -0.00 -0.67 1.91 -0.03 0.13 0.00 0.00 175.17 176.51 1p2g h MET 119 N 8.61 1.18 -0.94 4.34 1.85 -1.90 -2.54 114.93 125.53 1p2g h MET 119 Ca -0.26 -0.07 0.09 0.00 -0.61 0.00 0.00 59.70 58.85 1p2g h MET 119 Cb 1.10 -0.27 -0.07 0.00 0.43 0.00 0.00 31.60 32.80 1p2g h MET 119 CO 0.86 0.78 0.60 0.93 -0.40 0.00 0.00 176.91 179.69 1p2g h GLU 120 N 1.22 0.95 -0.62 0.39 5.08 -2.00 0.00 114.58 119.61 1p2g h GLU 120 Ca 0.35 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.58 1p2g h GLU 120 Cb -0.09 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 28.91 1p2g h GLU 120 CO -0.09 0.63 0.10 1.49 -1.00 0.00 0.00 179.01 180.14 1p2g h GLU 121 N 0.98 1.01 -0.31 2.33 4.81 -1.88 -2.73 114.58 118.79 1p2g h GLU 121 Ca 0.43 -0.26 -0.13 0.00 -0.13 0.00 0.00 59.36 59.28 1p2g h GLU 121 Cb 0.36 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 1p2g h GLU 121 CO -0.19 0.93 -0.33 -0.07 -0.73 0.00 0.00 179.01 178.62 1p2g h LEU 122 N 0.95 0.71 -1.08 1.64 4.07 -0.89 -3.08 115.31 117.63 1p2g h LEU 122 Ca 0.19 -0.29 -0.07 0.00 0.08 0.00 0.00 57.88 57.78 1p2g h LEU 122 Cb 0.42 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 41.94 1p2g h LEU 122 CO 0.01 0.99 -0.15 -0.33 -1.08 0.00 0.00 178.44 177.88 1p2g h GLU 123 N 0.57 0.48 0.00 1.13 5.08 -0.86 -2.41 114.58 118.57 1p2g h GLU 123 Ca 0.06 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1p2g h GLU 123 Cb 0.85 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.05 1p2g h GLU 123 CO 0.07 0.62 0.00 0.39 -1.00 0.00 0.00 179.01 179.09 1p2g n GLU 124 N -4.19 0.00 0.13 2.33 -0.58 -1.05 -2.21 120.64 115.08 1p2g n GLU 124 Ca 0.00 0.30 0.05 0.00 -0.42 0.00 0.00 57.16 57.10 1p2g n GLU 124 Cb 0.34 -1.50 0.03 0.00 -0.57 0.00 0.00 31.44 29.74 1p2g n GLU 124 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 1p2g h ILE 125 N 0.00 0.49 -3.23 -3.67 2.04 -1.50 -3.46 117.51 108.19 1p2g h ILE 125 Ca 0.00 -1.75 -0.53 0.00 1.00 0.00 0.00 64.86 63.58 1p2g h ILE 125 Cb 0.19 2.14 0.04 0.00 -0.74 0.00 0.00 36.82 38.45 1p2g h ILE 125 CO 0.00 0.28 0.73 -0.70 0.00 0.00 0.00 178.15 178.46 1p2g s GLU 126 N -3.06 4.31 0.34 2.37 2.12 -0.94 -5.00 118.70 118.85 1p2g s GLU 126 Ca 0.03 2.17 -0.26 0.00 0.36 0.00 0.00 54.97 57.27 1p2g s GLU 126 Cb 0.07 -3.17 -0.09 0.00 0.26 0.00 0.00 34.13 31.20 1p2g s GLU 126 CO 0.75 -0.39 1.02 -2.00 -0.54 0.00 0.00 175.26 174.10 1p2g s GLU 127 N 0.23 4.43 0.29 4.30 2.56 -1.26 -4.95 118.70 124.29 1p2g s GLU 127 Ca 0.61 1.50 -0.29 0.00 0.00 0.00 0.00 54.97 56.80 1p2g s GLU 127 Cb -0.39 -2.78 -0.09 0.00 2.00 0.00 0.00 34.13 32.86 1p2g s GLU 127 CO 0.37 0.10 1.06 -0.51 -0.56 0.00 0.00 175.26 175.72 1p2g s ASP 128 N -1.43 7.27 -0.88 -1.70 -0.00 -1.26 -4.58 116.67 114.07 1p2g s ASP 128 Ca 0.52 2.17 -0.19 0.00 -0.00 0.00 0.00 52.55 55.05 1p2g s ASP 128 Cb -0.23 -2.62 0.12 0.00 -0.00 0.00 0.00 42.92 40.19 1p2g s ASP 128 CO 0.29 -0.14 1.10 0.00 -0.00 0.00 0.00 175.17 176.42 1p2g s ALA 129 N -1.25 3.32 -0.75 5.23 0.00 -0.94 -4.88 121.76 122.49 1p2g s ALA 129 Ca 0.46 -2.61 -0.04 0.00 0.00 0.00 0.00 51.96 49.77 1p2g s ALA 129 Cb -0.29 -4.02 0.11 0.00 0.00 0.00 0.00 23.12 18.92 1p2g s ALA 129 CO 0.37 -2.95 2.58 0.41 0.00 0.00 0.00 175.76 176.17 1p2g n GLY 130 N 5.49 4.75 1.73 0.00 0.00 -1.26 -2.23 105.19 113.68 1p2g n GLY 130 Ca 0.19 -2.00 -0.09 0.00 0.00 0.00 0.00 46.02 44.12 1p2g n GLY 130 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1p2g n LEU 131 N 0.99 5.89 -3.84 0.99 4.77 -1.25 -0.89 117.00 123.67 1p2g n LEU 131 Ca 0.53 -2.90 -0.09 0.00 -0.03 0.00 0.00 56.01 53.53 1p2g n LEU 131 Cb 0.43 -1.11 -0.03 0.00 -2.33 0.00 0.00 43.42 40.38 1p2g n LEU 131 CO 0.45 1.16 0.34 -0.83 -1.33 0.00 0.00 177.39 177.17 1p2g s GLY 132 N 1.12 0.04 -0.27 -0.72 0.00 -1.26 -1.02 107.32 105.21 1p2g s GLY 132 Ca 0.19 -0.39 -0.05 0.00 0.00 0.00 0.00 44.72 44.47 1p2g s GLY 132 CO -0.01 -0.26 -0.29 0.70 0.00 0.00 0.00 173.10 173.24 1p2g n ASN 133 N -0.40 1.97 0.00 1.64 3.02 -1.26 -4.43 115.26 115.80 1p2g n ASN 133 Ca -0.06 0.07 0.00 0.00 -0.03 0.00 0.00 54.58 54.56 1p2g n ASN 133 Cb 0.61 -0.59 0.00 0.00 -0.61 0.00 0.00 39.78 39.19 1p2g n ASN 133 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1p2g n GLY 134 N 1.83 1.08 0.39 7.41 0.00 -1.26 -4.94 105.19 109.70 1p2g n GLY 134 Ca -0.50 0.38 -0.10 0.00 0.00 0.00 0.00 46.02 45.81 1p2g n GLY 134 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1p2g h GLY 135 N 0.00 -0.56 0.55 -0.02 0.00 -1.99 -1.27 103.07 99.79 1p2g h GLY 135 Ca 0.00 0.52 0.07 0.00 0.00 0.00 0.00 47.33 47.92 1p2g h GLY 135 CO 0.00 -0.20 0.24 -2.00 0.00 0.00 0.00 176.54 174.59 1p2g h LEU 136 N -0.36 0.30 -0.77 3.11 6.46 -1.99 -0.69 115.31 121.37 1p2g h LEU 136 Ca 0.13 0.05 -0.11 0.00 -0.12 0.00 0.00 57.88 57.83 1p2g h LEU 136 Cb 0.59 0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 40.51 1p2g h LEU 136 CO -0.52 0.19 -0.54 1.23 -0.62 0.00 0.00 178.44 178.18 1p2g h GLY 137 N 0.46 0.00 1.76 3.75 0.00 -1.75 -2.96 103.07 104.33 1p2g h GLY 137 Ca 0.27 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.39 1p2g h GLY 137 CO -0.23 0.00 -0.91 -0.09 0.00 0.00 0.00 176.54 175.31 1p2g h ARG 138 N 0.00 0.21 -0.86 4.80 1.12 -0.71 0.14 114.38 119.08 1p2g h ARG 138 Ca -0.01 -0.24 -0.02 0.00 -1.11 0.00 0.00 59.98 58.60 1p2g h ARG 138 Cb 1.06 0.07 -0.04 0.00 -0.01 0.00 0.00 29.97 31.05 1p2g h ARG 138 CO 0.07 0.98 0.45 1.25 -3.11 0.00 0.00 179.97 179.61 1p2g h LEU 139 N 0.11 1.10 -0.41 3.80 5.85 -1.06 -0.19 115.31 124.50 1p2g h LEU 139 Ca -0.05 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.56 1p2g h LEU 139 Cb 1.55 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 42.28 1p2g h LEU 139 CO 0.14 0.90 0.26 0.00 -0.34 0.00 0.00 178.44 179.39 1p2g h ALA 140 N 1.24 0.53 -0.36 1.25 0.00 -1.46 0.11 119.26 120.57 1p2g h ALA 140 Ca 0.30 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 1p2g h ALA 140 Cb 0.06 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1p2g h ALA 140 CO -0.04 0.01 0.18 0.00 0.00 0.00 0.00 179.25 179.40 1p2g h ALA 141 N 1.12 0.46 -0.71 0.00 0.00 -1.18 -1.71 119.26 117.23 1p2g h ALA 141 Ca 0.15 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 1p2g h ALA 141 Cb -0.02 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1p2g h ALA 141 CO -0.03 0.01 0.20 0.00 0.00 0.00 0.00 179.25 179.43 1p2g h PHE 143 N 1.07 1.03 -0.56 0.00 -1.00 -0.73 -1.47 116.94 115.27 1p2g h PHE 143 Ca 0.23 -0.05 0.02 0.00 2.81 0.00 0.00 57.97 60.98 1p2g h PHE 143 Cb 0.33 -0.32 -0.03 0.00 3.61 0.00 0.00 35.95 39.54 1p2g h PHE 143 CO 0.03 0.76 0.34 -0.07 -1.61 0.00 0.00 178.31 177.76 1p2g h LEU 144 N 1.00 0.56 0.03 1.54 4.07 -1.14 0.17 115.31 121.54 1p2g h LEU 144 Ca 0.24 -0.00 -0.00 0.00 0.08 0.00 0.00 57.88 58.20 1p2g h LEU 144 Cb 0.12 -0.12 0.00 0.00 1.08 0.00 0.00 40.66 41.74 1p2g h LEU 144 CO -0.03 0.40 -0.01 -0.78 -1.08 0.00 0.00 178.44 176.93 1p2g h ASP 145 N 0.68 -0.03 -0.56 -0.43 3.58 -1.29 -1.96 116.42 116.41 1p2g h ASP 145 Ca 0.22 -0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.62 1p2g h ASP 145 Cb 0.00 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.04 1p2g h ASP 145 CO -0.09 -0.02 0.17 0.28 -2.88 0.00 0.00 179.24 176.70 1p2g h SER 146 N -0.04 0.82 -0.94 2.28 0.02 -0.96 -0.38 113.55 114.35 1p2g h SER 146 Ca -0.00 -0.21 0.02 0.00 -0.84 0.00 0.00 61.79 60.75 1p2g h SER 146 Cb 0.03 -0.22 -0.05 0.00 0.14 0.00 0.00 62.40 62.31 1p2g h SER 146 CO 0.01 0.82 0.62 0.24 -1.14 0.00 0.00 176.83 177.37 1p2g h MET 147 N 0.79 1.22 -0.35 3.45 2.86 -0.54 0.83 114.93 123.18 1p2g h MET 147 Ca 0.18 -0.07 -0.16 0.00 -2.06 0.00 0.00 59.70 57.58 1p2g h MET 147 Cb 0.29 -0.27 -0.00 0.00 0.06 0.00 0.00 31.60 31.67 1p2g h MET 147 CO -0.00 0.80 -0.41 0.00 1.06 0.00 0.00 176.91 178.36 1p2g h ALA 148 N 1.42 0.53 0.00 6.32 0.00 -1.07 -1.85 119.26 124.61 1p2g h ALA 148 Ca 0.35 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1p2g h ALA 148 Cb -0.11 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1p2g h ALA 148 CO -0.08 0.65 0.00 1.15 0.00 0.00 0.00 179.25 180.97 1p2g h THR 149 N 0.71 0.00 -0.47 0.00 2.02 -0.25 -2.65 112.91 112.28 1p2g h THR 149 Ca 0.05 -0.43 0.00 0.00 0.77 0.00 0.00 66.41 66.80 1p2g h THR 149 Cb 1.01 1.42 0.00 0.00 -1.74 0.00 0.00 68.15 68.85 1p2g h THR 149 CO 0.10 0.00 0.00 0.18 0.37 0.00 0.00 175.52 176.17 1p2g n LEU 150 N -3.07 4.84 -2.65 2.58 4.77 0.21 -4.75 117.00 118.93 1p2g n LEU 150 Ca 0.00 -2.86 -0.19 0.00 -0.03 0.00 0.00 56.01 52.93 1p2g n LEU 150 Cb 0.27 -0.60 0.00 0.00 -2.33 0.00 0.00 43.42 40.76 1p2g n LEU 150 CO 0.26 0.68 -0.15 0.61 -1.33 0.00 0.00 177.39 177.45 1p2g n GLY 151 N 0.29 -0.50 3.82 -0.72 0.00 -1.00 -1.21 105.19 105.87 1p2g n GLY 151 Ca 0.25 0.04 -0.37 0.00 0.00 0.00 0.00 46.02 45.93 1p2g n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1p2g s LEU 152 N -6.15 4.46 -1.33 0.99 1.43 -0.71 -4.71 118.68 112.66 1p2g s LEU 152 Ca 0.11 1.25 -0.17 0.00 -1.03 0.00 0.00 54.13 54.29 1p2g s LEU 152 Cb -0.05 -3.09 0.07 0.00 0.03 0.00 0.00 46.19 43.15 1p2g s LEU 152 CO 0.14 0.20 1.82 0.00 0.23 0.00 0.00 176.35 178.74 1p2g n ALA 153 N 1.36 3.99 -2.56 4.21 0.00 -1.26 -4.69 120.51 121.57 1p2g n ALA 153 Ca -0.08 -3.89 -0.31 0.00 0.00 0.00 0.00 53.44 49.16 1p2g n ALA 153 Cb 0.51 -3.56 -0.11 0.00 0.00 0.00 0.00 19.45 16.30 1p2g n ALA 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1p2g s ALA 154 N 3.82 2.90 -0.08 0.00 0.00 -1.26 -1.34 121.76 125.80 1p2g s ALA 154 Ca 0.52 -1.11 0.02 0.00 0.00 0.00 0.00 51.96 51.39 1p2g s ALA 154 Cb 0.06 -0.98 0.01 0.00 0.00 0.00 0.00 23.12 22.21 1p2g s ALA 154 CO 0.04 0.61 -0.14 0.71 0.00 0.00 0.00 175.76 176.98 1p2g s TYR 155 N -1.03 1.67 -0.09 0.00 2.02 0.37 -4.01 117.35 116.27 1p2g s TYR 155 Ca 0.17 -0.66 -0.18 0.00 -0.37 0.00 0.00 57.07 56.04 1p2g s TYR 155 Cb -0.11 -1.21 -0.05 0.00 -0.40 0.00 0.00 41.96 40.20 1p2g s TYR 155 CO 0.08 -0.33 0.47 0.20 -1.57 0.00 0.00 175.55 174.40 1p2g s GLY 156 N 0.71 2.42 -0.08 0.71 0.00 -0.81 -1.01 107.32 109.25 1p2g s GLY 156 Ca -0.13 -0.19 0.02 0.00 0.00 0.00 0.00 44.72 44.42 1p2g s GLY 156 CO 0.03 0.67 -0.13 -0.19 0.00 0.00 0.00 173.10 173.48 1p2g s TYR 157 N 0.31 1.65 0.00 1.90 2.02 -0.40 -0.45 117.35 122.37 1p2g s TYR 157 Ca 0.26 -0.68 0.00 0.00 -0.37 0.00 0.00 57.07 56.27 1p2g s TYR 157 Cb -0.15 -1.21 0.00 0.00 -0.40 0.00 0.00 41.96 40.20 1p2g s TYR 157 CO 0.11 -0.36 0.00 0.41 -1.57 0.00 0.00 175.55 174.14 1p2g n GLY 158 N 4.03 3.01 3.55 0.71 0.00 -1.01 -1.92 105.19 113.57 1p2g n GLY 158 Ca -0.20 -0.69 -0.34 0.00 0.00 0.00 0.00 46.02 44.79 1p2g n GLY 158 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1p2g s ILE 159 N -2.53 3.61 -1.00 -0.61 1.01 -1.26 -1.26 121.20 119.16 1p2g s ILE 159 Ca 0.00 -0.51 -0.17 0.00 0.00 0.00 0.00 60.65 59.97 1p2g s ILE 159 Cb 0.00 -2.48 0.14 0.00 0.01 0.00 0.00 42.46 40.13 1p2g s ILE 159 CO 0.00 0.59 1.21 -0.60 0.00 0.00 0.00 174.94 176.13 1p2g s ARG 160 N -0.65 3.73 0.18 2.79 3.52 0.34 -4.75 118.95 124.11 1p2g s ARG 160 Ca 0.10 -1.99 -0.30 0.00 -0.13 0.00 0.00 55.73 53.41 1p2g s ARG 160 Cb -0.11 -4.95 -0.08 0.00 -1.56 0.00 0.00 34.95 28.24 1p2g s ARG 160 CO 0.02 -1.77 1.27 0.71 -0.81 0.00 0.00 175.30 174.72 1p2g s TYR 161 N 2.37 3.32 0.29 5.12 2.02 -1.26 -4.77 117.35 124.45 1p2g s TYR 161 Ca 0.35 1.29 0.06 0.00 -0.37 0.00 0.00 57.07 58.39 1p2g s TYR 161 Cb -0.04 -3.54 0.43 0.00 -0.40 0.00 0.00 41.96 38.42 1p2g s TYR 161 CO -0.07 -1.63 1.69 1.49 -1.57 0.00 0.00 175.55 175.46 1p2g h GLU 162 N 5.46 0.28 -4.37 -0.62 4.81 -1.00 -3.41 114.58 115.73 1p2g h GLU 162 Ca -0.44 -0.13 -0.56 0.00 -0.13 0.00 0.00 59.36 58.09 1p2g h GLU 162 Cb 1.21 -0.00 -0.37 0.00 0.63 0.00 0.00 28.75 30.22 1p2g h GLU 162 CO 0.77 0.64 -0.81 -0.06 -0.73 0.00 0.00 179.01 178.82 1p2g s PHE 163 N -4.18 1.79 0.00 0.92 0.40 -0.05 -4.31 117.98 112.54 1p2g s PHE 163 Ca -0.05 -1.00 0.00 0.00 -0.60 0.00 0.00 56.93 55.28 1p2g s PHE 163 Cb 0.13 -1.38 0.00 0.00 0.51 0.00 0.00 43.02 42.28 1p2g s PHE 163 CO 0.78 -0.59 0.00 0.41 0.70 0.00 0.00 175.22 176.51 1p2g n GLY 164 N 4.86 0.16 3.71 4.36 0.00 -1.22 -1.98 105.19 115.09 1p2g n GLY 164 Ca -0.14 -1.71 -0.43 0.00 0.00 0.00 0.00 46.02 43.74 1p2g n GLY 164 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1p2g n ILE 165 N 0.00 1.16 -1.51 -0.61 0.13 -0.07 -4.53 119.36 113.93 1p2g n ILE 165 Ca 0.00 -0.29 -0.36 0.00 -1.10 0.00 0.00 62.75 61.00 1p2g n ILE 165 Cb 0.00 -1.74 0.09 0.00 -0.84 0.00 0.00 39.64 37.14 1p2g n ILE 165 CO 0.00 0.00 0.00 2.22 2.80 0.00 0.00 176.55 181.57 1p2g n PHE 166 N 1.76 1.57 -2.87 9.51 1.16 -1.26 -4.55 117.46 122.78 1p2g n PHE 166 Ca 0.09 0.41 -0.41 0.00 -1.87 0.00 0.00 57.45 55.67 1p2g n PHE 166 Cb 0.35 -2.20 -0.04 0.00 -1.61 0.00 0.00 39.48 35.98 1p2g n PHE 166 CO 0.00 0.00 0.00 -0.80 -1.87 0.00 0.00 176.76 174.09 1p2g s ASN 167 N -1.60 7.14 -0.16 5.98 0.01 0.05 -4.86 114.94 121.49 1p2g s ASN 167 Ca 0.79 1.38 -0.16 0.00 -0.71 0.00 0.00 52.86 54.16 1p2g s ASN 167 Cb -0.35 -2.49 -0.04 0.00 0.41 0.00 0.00 41.25 38.78 1p2g s ASN 167 CO 0.44 -0.25 0.40 -1.58 -1.51 0.00 0.00 177.10 174.60 1p2g s GLN 168 N 1.26 4.25 -0.01 -0.60 0.74 -1.26 -1.57 119.66 122.47 1p2g s GLN 168 Ca 0.44 0.26 0.05 0.00 0.05 0.00 0.00 55.36 56.17 1p2g s GLN 168 Cb -0.19 -3.47 -0.01 0.00 1.10 0.00 0.00 33.01 30.43 1p2g s GLN 168 CO 0.20 0.10 -0.18 0.15 -0.55 0.00 0.00 175.29 175.01 1p2g s LYS 169 N 0.87 1.41 -0.22 1.67 1.02 -0.56 -3.55 119.74 120.38 1p2g s LYS 169 Ca 0.21 -0.64 -0.09 0.00 0.02 0.00 0.00 55.97 55.47 1p2g s LYS 169 Cb -0.14 -1.37 -0.04 0.00 -0.52 0.00 0.00 37.83 35.75 1p2g s LYS 169 CO 0.08 0.38 0.11 0.42 -0.92 0.00 0.00 175.35 175.41 1p2g s ILE 170 N -0.44 4.93 -0.12 2.17 -1.09 -1.26 0.62 121.20 126.02 1p2g s ILE 170 Ca 0.07 0.03 -0.01 0.00 -2.23 0.00 0.00 60.65 58.51 1p2g s ILE 170 Cb -0.07 -3.28 0.03 0.00 -1.58 0.00 0.00 42.46 37.57 1p2g s ILE 170 CO -0.01 0.38 -0.05 0.00 -1.23 0.00 0.00 174.94 174.03 1p2g n GLY 172 N 4.97 0.65 2.13 0.00 0.00 -1.26 -0.74 105.19 110.95 1p2g n GLY 172 Ca -0.11 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1p2g n GLY 172 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p2g n GLY 173 N -0.95 1.27 3.91 -0.02 0.00 -1.26 -5.03 105.19 103.11 1p2g n GLY 173 Ca -0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 1p2g n GLY 173 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1p2g s TRP 174 N -3.19 3.48 0.08 1.61 0.52 0.08 -3.70 118.94 117.82 1p2g s TRP 174 Ca 0.00 0.21 -0.30 0.00 0.02 0.00 0.00 56.10 56.03 1p2g s TRP 174 Cb 0.00 -1.73 -0.05 0.00 -1.15 0.00 0.00 33.47 30.54 1p2g s TRP 174 CO 0.00 0.57 0.97 -1.14 0.02 0.00 0.00 176.95 177.37 1p2g s GLN 175 N -2.63 4.65 -0.09 4.98 0.74 -1.26 -0.04 119.66 126.02 1p2g s GLN 175 Ca 0.34 1.45 0.04 0.00 0.05 0.00 0.00 55.36 57.24 1p2g s GLN 175 Cb -0.13 -3.40 0.00 0.00 1.10 0.00 0.00 33.01 30.59 1p2g s GLN 175 CO 0.28 0.13 -0.22 -1.64 -0.55 0.00 0.00 175.29 173.29 1p2g s MET 176 N 0.30 2.75 0.02 1.67 -1.94 0.20 -4.92 119.30 117.39 1p2g s MET 176 Ca 0.49 -0.80 -0.14 0.00 -1.71 0.00 0.00 55.69 53.52 1p2g s MET 176 Cb -0.23 -2.12 -0.06 0.00 2.01 0.00 0.00 34.83 34.43 1p2g s MET 176 CO 0.29 0.18 0.42 -1.21 -0.01 0.00 0.00 175.02 174.69 1p2g s GLU 177 N 0.33 3.91 -0.01 2.03 8.01 -1.26 -1.50 118.70 130.20 1p2g s GLU 177 Ca -0.16 0.40 0.02 0.00 0.01 0.00 0.00 54.97 55.24 1p2g s GLU 177 Cb -0.17 -3.17 0.00 0.00 -4.31 0.00 0.00 34.13 26.48 1p2g s GLU 177 CO 0.07 0.66 -0.07 -2.00 0.01 0.00 0.00 175.26 173.93 1p2g s GLU 178 N -1.24 0.69 0.23 1.61 2.12 -0.61 -4.97 118.70 116.52 1p2g s GLU 178 Ca 0.26 -0.24 -0.32 0.00 0.36 0.00 0.00 54.97 55.03 1p2g s GLU 178 Cb -0.16 -0.67 -0.12 0.00 0.26 0.00 0.00 34.13 33.44 1p2g s GLU 178 CO 0.15 0.11 1.69 0.00 -0.54 0.00 0.00 175.26 176.67 1p2g n ALA 179 N 3.15 2.72 -2.81 6.30 0.00 -1.26 -0.77 120.51 127.83 1p2g n ALA 179 Ca -0.16 0.40 -0.44 0.00 0.00 0.00 0.00 53.44 53.24 1p2g n ALA 179 Cb 0.56 -2.50 0.00 0.00 0.00 0.00 0.00 19.45 17.50 1p2g n ALA 179 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1p2g n ASP 180 N 3.52 5.16 -3.55 0.00 4.64 -1.26 -4.72 116.55 120.33 1p2g n ASP 180 Ca 0.14 -2.99 -0.41 0.00 -1.38 0.00 0.00 54.79 50.16 1p2g n ASP 180 Cb 0.35 -1.58 -0.01 0.00 -1.04 0.00 0.00 41.12 38.84 1p2g n ASP 180 CO 0.00 0.00 0.00 -0.67 -0.82 0.00 0.00 177.20 175.71 1p2g n ASP 181 N 5.75 6.23 0.11 1.67 2.03 -1.26 -3.41 116.55 127.67 1p2g n ASP 181 Ca 0.39 -2.77 0.11 0.00 0.52 0.00 0.00 54.79 53.04 1p2g n ASP 181 Cb 0.42 -1.59 0.46 0.00 -0.72 0.00 0.00 41.12 39.70 1p2g n ASP 181 CO 0.00 0.00 0.00 -2.67 -1.92 0.00 0.00 177.20 172.61 1p2g n TRP 182 N 4.64 0.65 1.09 -0.67 4.27 -1.26 -2.74 117.44 123.43 1p2g n TRP 182 Ca 0.63 0.27 0.12 0.00 -3.89 0.00 0.00 57.50 54.63 1p2g n TRP 182 Cb 0.31 -0.94 0.18 0.00 -1.36 0.00 0.00 31.31 29.50 1p2g n TRP 182 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 1p2g n LEU 183 N -2.11 2.69 -0.19 5.67 4.77 -1.26 -4.60 117.00 121.97 1p2g n LEU 183 Ca 0.02 -0.90 -0.03 0.00 -0.03 0.00 0.00 56.01 55.07 1p2g n LEU 183 Cb 0.18 -0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.31 1p2g n LEU 183 CO 0.16 0.45 0.71 -0.09 -1.33 0.00 0.00 177.39 177.30 1p2g h ARG 184 N 4.21 -0.06 -0.02 3.23 2.43 -1.90 -0.48 114.38 121.79 1p2g h ARG 184 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1p2g h ARG 184 Cb 0.90 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.46 1p2g h ARG 184 CO 0.00 -0.04 0.00 0.66 -1.51 0.00 0.00 179.97 179.08 1p2g n TYR 185 N -5.42 0.01 0.00 2.20 4.01 -1.26 -5.04 117.16 111.66 1p2g n TYR 185 Ca 0.06 -0.01 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 1p2g n TYR 185 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.36 1p2g n TYR 185 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1p2g n GLY 186 N 1.17 1.66 2.99 2.72 0.00 -0.19 -4.99 105.19 108.55 1p2g n GLY 186 Ca 0.19 -1.77 -0.31 0.00 0.00 0.00 0.00 46.02 44.13 1p2g n GLY 186 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1p2g s ASN 187 N -0.40 4.27 0.23 1.61 2.47 -1.26 -4.91 114.94 116.95 1p2g s ASN 187 Ca 0.00 -1.49 0.24 0.00 0.42 0.00 0.00 52.86 52.03 1p2g s ASN 187 Cb 0.00 -1.39 0.92 0.00 -1.45 0.00 0.00 41.25 39.33 1p2g s ASN 187 CO 0.00 -0.26 1.73 -0.81 -3.72 0.00 0.00 177.10 174.04 1p2g n PRO 188 N 4.51 0.20 0.04 0.43 -0.04 -1.26 -3.53 135.00 135.35 1p2g n PRO 188 Ca -0.09 0.34 -0.07 0.00 -0.04 0.00 0.00 63.50 63.64 1p2g n PRO 188 Cb 0.43 -1.83 -0.12 0.00 -0.04 0.00 0.00 33.50 31.94 1p2g n PRO 188 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1p2g h TRP 189 N 0.00 0.00 -3.88 0.54 4.06 -1.95 -3.47 115.95 111.25 1p2g h TRP 189 Ca 0.00 0.00 -0.48 0.00 2.06 0.00 0.00 58.89 60.47 1p2g h TRP 189 Cb 0.48 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.65 1p2g h TRP 189 CO 0.00 0.98 0.21 -1.83 -3.56 0.00 0.00 178.44 174.24 1p2g s GLU 190 N -2.69 3.88 -0.16 0.49 -1.05 -1.23 -4.32 118.70 113.60 1p2g s GLU 190 Ca -0.00 0.68 -0.01 0.00 -0.15 0.00 0.00 54.97 55.48 1p2g s GLU 190 Cb 0.09 -2.30 0.05 0.00 -0.44 0.00 0.00 34.13 31.53 1p2g s GLU 190 CO 0.82 -0.09 -0.01 0.21 0.95 0.00 0.00 175.26 177.13 1p2g s LYS 191 N -3.81 1.02 0.16 -4.83 2.47 0.75 -4.94 119.74 110.57 1p2g s LYS 191 Ca 0.55 -0.41 -0.30 0.00 -1.56 0.00 0.00 55.97 54.25 1p2g s LYS 191 Cb -0.10 -1.91 -0.08 0.00 -1.46 0.00 0.00 37.83 34.29 1p2g s LYS 191 CO 0.29 -0.50 1.26 0.00 0.16 0.00 0.00 175.35 176.57 1p2g s ALA 192 N 1.76 3.48 -0.59 3.13 0.00 -1.26 -0.69 121.76 127.58 1p2g s ALA 192 Ca 0.00 1.01 0.06 0.00 0.00 0.00 0.00 51.96 53.03 1p2g s ALA 192 Cb -0.16 -3.46 0.25 0.00 0.00 0.00 0.00 23.12 19.76 1p2g s ALA 192 CO -0.07 -0.47 0.71 0.54 0.00 0.00 0.00 175.76 176.47 1p2g n ARG 193 N 3.01 2.21 0.00 0.00 5.12 -0.67 -4.95 116.66 121.40 1p2g n ARG 193 Ca 0.07 -4.41 0.23 0.00 -1.93 0.00 0.00 57.85 51.80 1p2g n ARG 193 Cb 0.44 -2.07 0.70 0.00 -1.16 0.00 0.00 32.46 30.37 1p2g n ARG 193 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 1p2g h PRO 194 N 4.11 0.00 0.00 5.56 0.11 -1.94 -1.37 132.00 138.47 1p2g h PRO 194 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1p2g h PRO 194 Cb 0.70 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.81 1p2g h PRO 194 CO 0.77 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.71 1p2g n GLU 195 N -3.70 0.40 -0.51 1.05 0.00 -1.26 -2.70 120.64 113.91 1p2g n GLU 195 Ca 0.11 0.06 0.08 0.00 0.00 0.00 0.00 57.16 57.41 1p2g n GLU 195 Cb 0.82 -1.50 0.28 0.00 0.00 0.00 0.00 31.44 31.04 1p2g n GLU 195 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 1p2g n PHE 196 N -1.24 1.11 -2.03 -1.84 3.01 -0.52 -5.00 117.46 110.94 1p2g n PHE 196 Ca 0.12 -0.85 -0.41 0.00 1.01 0.00 0.00 57.45 57.31 1p2g n PHE 196 Cb 0.17 -0.34 -0.02 0.00 -0.01 0.00 0.00 39.48 39.28 1p2g n PHE 196 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 1p2g s THR 197 N -2.81 2.68 0.11 4.37 2.01 -1.10 -4.67 115.64 116.24 1p2g s THR 197 Ca 0.44 0.58 0.06 0.00 0.31 0.00 0.00 61.69 63.08 1p2g s THR 197 Cb 0.35 -3.37 -0.04 0.00 0.01 0.00 0.00 72.50 69.45 1p2g s THR 197 CO 0.10 0.10 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.22 1p2g s LEU 198 N -0.49 2.38 0.05 4.42 1.02 -0.67 -4.94 118.68 120.45 1p2g s LEU 198 Ca 0.58 -0.77 -0.13 0.00 0.02 0.00 0.00 54.13 53.83 1p2g s LEU 198 Cb -0.41 -0.54 -0.06 0.00 0.02 0.00 0.00 46.19 45.19 1p2g s LEU 198 CO 0.44 -0.13 0.43 -2.16 0.02 0.00 0.00 176.35 174.95 1p2g s PRO 199 N -2.49 3.88 -0.03 1.29 0.04 -1.26 0.68 135.00 137.11 1p2g s PRO 199 Ca 0.07 0.35 0.06 0.00 0.04 0.00 0.00 61.00 61.51 1p2g s PRO 199 Cb -0.06 -3.10 -0.01 0.00 0.04 0.00 0.00 34.50 31.37 1p2g s PRO 199 CO 0.03 0.61 -0.21 0.08 0.04 0.00 0.00 177.00 177.55 1p2g s VAL 200 N -1.25 1.67 0.02 -0.36 1.01 0.70 -4.87 120.40 117.32 1p2g s VAL 200 Ca 0.29 -0.89 0.02 0.00 0.00 0.00 0.00 61.98 61.41 1p2g s VAL 200 Cb -0.16 -1.40 -0.04 0.00 0.00 0.00 0.00 36.38 34.79 1p2g s VAL 200 CO 0.16 0.47 0.02 -1.00 0.00 0.00 0.00 175.10 174.75 1p2g s HIS 201 N -0.34 3.09 0.05 5.22 3.76 -1.26 -1.35 115.29 124.46 1p2g s HIS 201 Ca 0.04 0.08 0.01 0.00 -0.15 0.00 0.00 55.06 55.04 1p2g s HIS 201 Cb -0.10 -1.65 -0.03 0.00 1.11 0.00 0.00 32.58 31.91 1p2g s HIS 201 CO 0.00 0.48 -0.05 -0.06 -0.85 0.00 0.00 174.74 174.26 1p2g s PHE 202 N -1.16 0.58 0.00 1.40 0.40 -0.36 -4.97 117.98 113.87 1p2g s PHE 202 Ca 0.22 -0.71 0.00 0.00 -0.60 0.00 0.00 56.93 55.84 1p2g s PHE 202 Cb -0.12 -0.37 0.00 0.00 0.51 0.00 0.00 43.02 43.04 1p2g s PHE 202 CO 0.13 -0.18 0.00 0.66 0.70 0.00 0.00 175.22 176.53 1p2g n TYR 203 N 0.91 0.00 -4.14 0.36 4.01 0.21 -0.61 117.16 117.90 1p2g n TYR 203 Ca -0.19 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.55 1p2g n TYR 203 Cb 0.57 0.04 0.00 0.00 -0.31 0.00 0.00 39.34 39.64 1p2g n TYR 203 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1p2g n GLY 204 N 0.00 -1.10 3.50 2.72 0.00 -1.22 -4.62 105.19 104.46 1p2g n GLY 204 Ca 0.00 -1.23 -0.09 0.00 0.00 0.00 0.00 46.02 44.69 1p2g n GLY 204 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1p2g s ARG 205 N 0.00 1.36 -0.21 1.61 1.70 -0.21 -4.86 118.95 118.35 1p2g s ARG 205 Ca 0.00 -0.97 -0.10 0.00 -0.47 0.00 0.00 55.73 54.19 1p2g s ARG 205 Cb 0.00 0.49 -0.05 0.00 -0.57 0.00 0.00 34.95 34.82 1p2g s ARG 205 CO 0.00 -0.57 0.13 0.08 -1.08 0.00 0.00 175.30 173.86 1p2g s VAL 206 N -3.91 5.32 -0.12 4.99 1.01 -1.26 -1.07 120.40 125.36 1p2g s VAL 206 Ca 0.12 0.16 0.01 0.00 0.00 0.00 0.00 61.98 62.27 1p2g s VAL 206 Cb -0.00 -3.43 -0.01 0.00 0.00 0.00 0.00 36.38 32.93 1p2g s VAL 206 CO -0.01 0.42 -0.14 -0.70 0.00 0.00 0.00 175.10 174.67 1p2g s GLU 207 N 0.50 3.24 -0.24 2.72 2.12 0.99 -4.93 118.70 123.10 1p2g s GLU 207 Ca 0.07 -0.71 -0.09 0.00 0.36 0.00 0.00 54.97 54.61 1p2g s GLU 207 Cb -0.12 -2.57 -0.04 0.00 0.26 0.00 0.00 34.13 31.67 1p2g s GLU 207 CO -0.00 0.26 0.11 -1.01 -0.54 0.00 0.00 175.26 174.08 1p2g s HIS 208 N 0.21 3.18 0.00 5.30 3.76 -1.26 0.75 115.29 127.22 1p2g s HIS 208 Ca -0.09 -0.11 0.00 0.00 -0.15 0.00 0.00 55.06 54.71 1p2g s HIS 208 Cb -0.15 -2.25 0.00 0.00 1.11 0.00 0.00 32.58 31.28 1p2g s HIS 208 CO 0.05 -0.16 0.00 -2.37 -0.85 0.00 0.00 174.74 171.41 1p2g n THR 209 N 4.64 0.00 -0.00 1.30 5.66 -0.56 -4.99 114.28 120.32 1p2g n THR 209 Ca -0.15 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 60.76 1p2g n THR 209 Cb 0.52 0.00 0.08 0.00 -1.55 0.00 0.00 70.33 69.37 1p2g n THR 209 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 1p2g h SER 210 N 0.00 0.61 -0.01 1.09 0.02 -2.01 -2.78 113.55 110.47 1p2g h SER 210 Ca 0.00 -0.30 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 1p2g h SER 210 Cb 0.00 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.37 1p2g h SER 210 CO 0.00 0.99 0.00 0.00 -1.14 0.00 0.00 176.83 176.68 1p2g n GLN 211 N -3.99 1.08 0.00 3.45 1.13 -1.26 -5.02 117.38 112.77 1p2g n GLN 211 Ca -0.02 -0.11 0.00 0.00 -1.94 0.00 0.00 57.00 54.92 1p2g n GLN 211 Cb 0.56 -1.40 0.00 0.00 0.11 0.00 0.00 30.24 29.51 1p2g n GLN 211 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1p2g n GLY 212 N 0.92 -0.71 3.77 1.08 0.00 -1.05 -5.04 105.19 104.17 1p2g n GLY 212 Ca 0.19 -2.19 -0.37 0.00 0.00 0.00 0.00 46.02 43.66 1p2g n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p2g s ALA 213 N -2.00 2.87 -0.05 4.61 0.00 -1.26 -1.49 121.76 124.44 1p2g s ALA 213 Ca 0.00 0.96 -0.01 0.00 0.00 0.00 0.00 51.96 52.91 1p2g s ALA 213 Cb 0.00 -3.40 0.03 0.00 0.00 0.00 0.00 23.12 19.75 1p2g s ALA 213 CO 0.00 -0.79 0.02 0.15 0.00 0.00 0.00 175.76 175.13 1p2g s LYS 214 N -2.88 0.33 -0.29 0.00 -0.14 0.23 -4.91 119.74 112.07 1p2g s LYS 214 Ca 0.67 0.16 -0.19 0.00 -1.36 0.00 0.00 55.97 55.25 1p2g s LYS 214 Cb -0.29 -0.68 -0.02 0.00 -1.68 0.00 0.00 37.83 35.17 1p2g s LYS 214 CO 0.34 -0.24 0.58 -0.46 -0.76 0.00 0.00 175.35 174.81 1p2g s TRP 215 N 1.66 3.23 0.35 3.18 -0.00 -1.26 -0.00 118.94 126.09 1p2g s TRP 215 Ca -0.01 0.57 0.03 0.00 -0.00 0.00 0.00 56.10 56.70 1p2g s TRP 215 Cb -0.13 -2.88 -0.04 0.00 -0.00 0.00 0.00 33.47 30.42 1p2g s TRP 215 CO -0.03 -0.41 0.12 0.14 -0.00 0.00 0.00 176.95 176.77 1p2g s VAL 216 N 2.48 0.66 -1.60 5.86 -7.23 -0.23 -4.87 120.40 115.46 1p2g s VAL 216 Ca 0.23 -2.00 -0.16 0.00 -1.81 0.00 0.00 61.98 58.24 1p2g s VAL 216 Cb -0.15 -2.53 0.12 0.00 0.56 0.00 0.00 36.38 34.38 1p2g s VAL 216 CO 0.11 0.00 0.91 0.47 -0.31 0.00 0.00 175.10 176.28 1p2g n ASP 217 N -0.98 -4.22 -4.91 4.85 8.00 -1.26 -1.05 116.55 116.99 1p2g n ASP 217 Ca -0.03 -0.87 -0.28 0.00 0.71 0.00 0.00 54.79 54.33 1p2g n ASP 217 Cb 0.65 -3.44 -0.03 0.00 -0.02 0.00 0.00 41.12 38.29 1p2g n ASP 217 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1p2g s THR 218 N -3.30 5.02 0.07 -3.53 -4.23 -1.26 -3.41 115.64 105.00 1p2g s THR 218 Ca 0.69 0.01 -0.20 0.00 -1.18 0.00 0.00 61.69 61.01 1p2g s THR 218 Cb -0.36 -3.77 -0.07 0.00 1.34 0.00 0.00 72.50 69.65 1p2g s THR 218 CO 0.87 -0.42 0.60 -1.58 -0.54 0.00 0.00 174.62 173.55 1p2g s GLN 219 N -3.80 4.27 -0.10 3.99 0.74 0.22 -4.87 119.66 120.11 1p2g s GLN 219 Ca 0.44 0.80 -0.01 0.00 0.05 0.00 0.00 55.36 56.64 1p2g s GLN 219 Cb -0.10 -3.26 -0.03 0.00 1.10 0.00 0.00 33.01 30.72 1p2g s GLN 219 CO 0.32 0.59 -0.05 0.08 -0.55 0.00 0.00 175.29 175.68 1p2g s VAL 220 N -0.97 3.85 -0.03 1.34 1.01 -1.26 -1.23 120.40 123.11 1p2g s VAL 220 Ca 0.30 -0.41 0.03 0.00 0.00 0.00 0.00 61.98 61.91 1p2g s VAL 220 Cb -0.20 -2.62 -0.00 0.00 0.00 0.00 0.00 36.38 33.56 1p2g s VAL 220 CO 0.20 0.57 -0.13 -0.69 0.00 0.00 0.00 175.10 175.05 1p2g s VAL 221 N -0.44 1.07 0.16 2.92 1.01 -0.46 -4.47 120.40 120.20 1p2g s VAL 221 Ca 0.07 -0.52 -0.13 0.00 0.00 0.00 0.00 61.98 61.40 1p2g s VAL 221 Cb -0.12 -0.93 -0.07 0.00 0.00 0.00 0.00 36.38 35.26 1p2g s VAL 221 CO 0.02 0.32 0.53 -0.76 0.00 0.00 0.00 175.10 175.21 1p2g s LEU 222 N 0.10 4.30 -0.27 3.92 1.43 -0.14 -0.22 118.68 127.80 1p2g s LEU 222 Ca -0.03 1.01 -0.01 0.00 -1.03 0.00 0.00 54.13 54.07 1p2g s LEU 222 Cb -0.10 -3.33 0.04 0.00 0.03 0.00 0.00 46.19 42.83 1p2g s LEU 222 CO 0.01 0.07 -0.05 0.00 0.23 0.00 0.00 176.35 176.61 1p2g s ALA 223 N -1.54 2.72 -0.23 4.21 0.00 0.21 -1.55 121.76 125.58 1p2g s ALA 223 Ca 0.39 -1.59 -0.08 0.00 0.00 0.00 0.00 51.96 50.68 1p2g s ALA 223 Cb -0.14 -1.75 -0.04 0.00 0.00 0.00 0.00 23.12 21.19 1p2g s ALA 223 CO 0.19 -1.00 0.09 1.41 0.00 0.00 0.00 175.76 176.45 1p2g s MET 224 N 1.28 3.83 0.25 0.00 1.75 -0.06 -1.67 119.30 124.69 1p2g s MET 224 Ca -0.03 -0.40 -0.17 0.00 -1.25 0.00 0.00 55.69 53.85 1p2g s MET 224 Cb -0.18 -3.34 -0.08 0.00 2.84 0.00 0.00 34.83 34.07 1p2g s MET 224 CO -0.03 -0.00 0.70 -1.25 -0.65 0.00 0.00 175.02 173.79 1p2g s PRO 225 N 1.14 4.11 -0.16 4.11 0.04 -1.26 -0.64 135.00 142.34 1p2g s PRO 225 Ca 0.05 0.73 -0.00 0.00 0.04 0.00 0.00 61.00 61.82 1p2g s PRO 225 Cb -0.14 -2.71 0.04 0.00 0.04 0.00 0.00 34.50 31.72 1p2g s PRO 225 CO 0.04 0.31 -0.08 0.71 0.04 0.00 0.00 177.00 178.02 1p2g s TYR 226 N -1.70 1.87 -0.05 0.56 1.51 -0.21 -1.66 117.35 117.67 1p2g s TYR 226 Ca 0.47 -1.15 -0.15 0.00 -1.01 0.00 0.00 57.07 55.23 1p2g s TYR 226 Cb -0.14 -1.40 -0.05 0.00 -0.11 0.00 0.00 41.96 40.26 1p2g s TYR 226 CO 0.19 -0.63 0.39 -0.51 -1.11 0.00 0.00 175.55 173.88 1p2g s ASP 227 N 1.58 6.71 -0.07 2.29 1.01 0.13 -1.61 116.67 126.70 1p2g s ASP 227 Ca 0.02 0.84 0.04 0.00 0.71 0.00 0.00 52.55 54.16 1p2g s ASP 227 Cb -0.15 -2.24 -0.00 0.00 1.01 0.00 0.00 42.92 41.55 1p2g s ASP 227 CO -0.08 0.24 -0.21 -0.89 0.21 0.00 0.00 175.17 174.43 1p2g s THR 228 N -0.53 1.81 0.36 -1.27 2.01 0.13 -0.18 115.64 117.97 1p2g s THR 228 Ca 0.22 -0.90 -0.26 0.00 0.31 0.00 0.00 61.69 61.06 1p2g s THR 228 Cb -0.16 -1.56 -0.09 0.00 0.01 0.00 0.00 72.50 70.70 1p2g s THR 228 CO 0.11 0.51 1.11 -2.16 -0.69 0.00 0.00 174.62 173.50 1p2g s PRO 229 N 0.18 4.29 -0.36 4.92 0.04 -1.26 -1.19 135.00 141.62 1p2g s PRO 229 Ca -0.11 1.74 0.01 0.00 0.04 0.00 0.00 61.00 62.68 1p2g s PRO 229 Cb -0.15 -2.81 0.11 0.00 0.04 0.00 0.00 34.50 31.69 1p2g s PRO 229 CO 0.05 -0.09 0.12 0.08 0.04 0.00 0.00 177.00 177.21 1p2g s VAL 230 N -1.40 1.50 0.12 -0.36 1.01 0.16 -4.89 120.40 116.54 1p2g s VAL 230 Ca 0.53 -2.04 -0.30 0.00 0.00 0.00 0.00 61.98 60.17 1p2g s VAL 230 Cb -0.29 -2.10 -0.06 0.00 0.00 0.00 0.00 36.38 33.93 1p2g s VAL 230 CO 0.36 -0.71 1.10 -2.16 0.00 0.00 0.00 175.10 173.70 1p2g s PRO 231 N 1.02 4.55 0.82 2.72 0.04 -1.26 -0.39 135.00 142.50 1p2g s PRO 231 Ca 0.12 1.68 -0.12 0.00 0.04 0.00 0.00 61.00 62.72 1p2g s PRO 231 Cb -0.20 -3.32 0.08 0.00 0.04 0.00 0.00 34.50 31.10 1p2g s PRO 231 CO -0.13 -0.02 1.13 0.20 0.04 0.00 0.00 177.00 178.22 1p2g s GLY 232 N 0.35 1.60 -0.46 0.56 0.00 0.92 -4.76 107.32 105.54 1p2g s GLY 232 Ca 0.52 -0.43 -0.28 0.00 0.00 0.00 0.00 44.72 44.53 1p2g s GLY 232 CO 0.32 0.04 1.10 -0.47 0.00 0.00 0.00 173.10 174.09 1p2g s TYR 233 N -3.33 2.87 -0.58 1.90 6.14 -1.26 -4.19 117.35 118.90 1p2g s TYR 233 Ca 0.61 0.72 0.00 0.00 0.64 0.00 0.00 57.07 59.05 1p2g s TYR 233 Cb -0.13 -4.29 0.00 0.00 0.42 0.00 0.00 41.96 37.96 1p2g s TYR 233 CO 0.52 -1.19 0.00 0.54 0.64 0.00 0.00 175.55 176.06 1p2g n ARG 234 N 7.64 -2.56 -0.02 4.97 3.00 -0.28 -4.79 116.66 124.62 1p2g n ARG 234 Ca 0.11 0.33 0.01 0.00 -0.01 0.00 0.00 57.85 58.29 1p2g n ARG 234 Cb 0.49 -4.88 0.02 0.00 0.00 0.00 0.00 32.46 28.09 1p2g n ARG 234 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 1p2g n ASN 235 N -1.64 1.73 -0.93 0.55 2.04 -1.26 -4.97 115.26 110.78 1p2g n ASN 235 Ca -0.08 -1.59 -0.12 0.00 -0.44 0.00 0.00 54.58 52.35 1p2g n ASN 235 Cb 0.56 -0.02 -0.05 0.00 -2.53 0.00 0.00 39.78 37.73 1p2g n ASN 235 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 1p2g n ASN 236 N -0.11 -4.96 -4.78 0.53 3.02 -1.26 -0.92 115.26 106.77 1p2g n ASN 236 Ca 0.02 0.30 -0.36 0.00 -0.03 0.00 0.00 54.58 54.51 1p2g n ASN 236 Cb 0.18 -3.53 -0.07 0.00 -0.61 0.00 0.00 39.78 35.75 1p2g n ASN 236 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1p2g s VAL 237 N -2.28 5.41 -0.25 2.41 1.01 -1.26 -4.78 120.40 120.66 1p2g s VAL 237 Ca 0.00 0.27 -0.01 0.00 0.00 0.00 0.00 61.98 62.24 1p2g s VAL 237 Cb 0.00 -3.48 0.08 0.00 0.00 0.00 0.00 36.38 32.98 1p2g s VAL 237 CO 0.00 0.49 0.04 -0.69 0.00 0.00 0.00 175.10 174.95 1p2g s VAL 238 N -0.11 0.87 0.68 2.92 1.01 -1.26 -0.05 120.40 124.46 1p2g s VAL 238 Ca 0.12 -1.02 -0.06 0.00 0.00 0.00 0.00 61.98 61.02 1p2g s VAL 238 Cb -0.12 -1.44 0.15 0.00 0.00 0.00 0.00 36.38 34.97 1p2g s VAL 238 CO 0.01 -0.37 0.93 0.59 0.00 0.00 0.00 175.10 176.27 1p2g n ASN 239 N 4.89 0.65 -4.21 3.32 5.03 0.47 -4.64 115.26 120.78 1p2g n ASN 239 Ca -0.07 -1.69 -0.25 0.00 0.87 0.00 0.00 54.58 53.44 1p2g n ASN 239 Cb 0.45 -0.66 -0.15 0.00 -1.02 0.00 0.00 39.78 38.40 1p2g n ASN 239 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1p2g s THR 240 N -2.87 1.53 -0.24 3.41 2.01 -1.26 -0.66 115.64 117.56 1p2g s THR 240 Ca 0.57 -0.97 0.00 0.00 0.31 0.00 0.00 61.69 61.60 1p2g s THR 240 Cb -0.02 -1.30 0.03 0.00 0.01 0.00 0.00 72.50 71.22 1p2g s THR 240 CO 0.39 0.31 -0.10 -0.32 -0.69 0.00 0.00 174.62 174.21 1p2g s MET 241 N -0.77 2.72 -0.27 4.92 1.75 -0.33 -1.93 119.30 125.39 1p2g s MET 241 Ca 0.07 -1.04 -0.07 0.00 -1.25 0.00 0.00 55.69 53.40 1p2g s MET 241 Cb -0.08 -2.88 -0.02 0.00 2.84 0.00 0.00 34.83 34.70 1p2g s MET 241 CO 0.00 -0.40 0.08 0.50 -0.65 0.00 0.00 175.02 174.55 1p2g s ARG 242 N 1.26 3.46 -0.17 4.11 3.52 0.40 -0.69 118.95 130.84 1p2g s ARG 242 Ca -0.01 -0.61 -0.03 0.00 -0.13 0.00 0.00 55.73 54.95 1p2g s ARG 242 Cb -0.17 -3.35 -0.02 0.00 -1.56 0.00 0.00 34.95 29.86 1p2g s ARG 242 CO -0.06 -0.28 -0.05 -0.51 -0.81 0.00 0.00 175.30 173.58 1p2g s LEU 243 N 1.58 3.04 0.18 -0.88 1.02 -0.63 -2.39 118.68 120.59 1p2g s LEU 243 Ca 0.05 -0.25 -0.20 0.00 0.02 0.00 0.00 54.13 53.75 1p2g s LEU 243 Cb -0.16 -1.74 -0.08 0.00 0.02 0.00 0.00 46.19 44.24 1p2g s LEU 243 CO 0.03 0.10 0.69 0.26 0.02 0.00 0.00 176.35 177.45 1p2g s TRP 244 N 0.75 3.71 -0.04 0.29 0.52 -0.39 -1.05 118.94 122.74 1p2g s TRP 244 Ca -0.02 1.37 0.05 0.00 0.02 0.00 0.00 56.10 57.52 1p2g s TRP 244 Cb -0.15 -2.59 -0.01 0.00 -1.15 0.00 0.00 33.47 29.57 1p2g s TRP 244 CO 0.02 0.42 -0.20 0.45 0.02 0.00 0.00 176.95 177.66 1p2g s SER 245 N -1.48 2.47 -0.06 2.95 0.15 0.18 -0.51 113.70 117.40 1p2g s SER 245 Ca 0.39 -0.40 -0.25 0.00 0.70 0.00 0.00 55.95 56.39 1p2g s SER 245 Cb -0.18 -0.58 -0.03 0.00 -1.71 0.00 0.00 66.02 63.51 1p2g s SER 245 CO 0.21 0.20 0.78 0.00 1.20 0.00 0.00 173.24 175.64 1p2g s ALA 246 N -0.14 3.32 0.04 5.45 0.00 -1.26 -0.88 121.76 128.28 1p2g s ALA 246 Ca -0.01 0.21 0.04 0.00 0.00 0.00 0.00 51.96 52.21 1p2g s ALA 246 Cb -0.11 -3.08 -0.02 0.00 0.00 0.00 0.00 23.12 19.91 1p2g s ALA 246 CO 0.02 -0.20 -0.13 0.15 0.00 0.00 0.00 175.76 175.60 1p2g s LYS 247 N 1.02 0.86 0.27 0.00 -0.14 -0.60 -4.56 119.74 116.59 1p2g s LYS 247 Ca 0.41 -0.74 -0.16 0.00 -1.36 0.00 0.00 55.97 54.12 1p2g s LYS 247 Cb -0.18 -0.85 -0.08 0.00 -1.68 0.00 0.00 37.83 35.03 1p2g s LYS 247 CO 0.20 0.21 0.70 0.00 -0.76 0.00 0.00 175.35 175.69 1p2g s ALA 248 N -0.89 3.39 0.84 5.17 0.00 -1.26 -0.97 121.76 128.05 1p2g s ALA 248 Ca 0.00 0.04 -0.11 0.00 0.00 0.00 0.00 51.96 51.89 1p2g s ALA 248 Cb -0.08 -2.74 0.10 0.00 0.00 0.00 0.00 23.12 20.40 1p2g s ALA 248 CO 0.01 0.36 1.10 -2.14 0.00 0.00 0.00 175.76 175.08 1p2g s PRO 249 N -2.55 1.66 0.30 0.00 0.02 -1.26 -4.86 135.00 128.31 1p2g s PRO 249 Ca 0.48 1.08 0.22 0.00 0.02 0.00 0.00 61.00 62.80 1p2g s PRO 249 Cb -0.13 -1.84 0.13 0.00 0.02 0.00 0.00 34.50 32.69 1p2g s PRO 249 CO 0.19 -2.03 1.29 -0.91 -0.33 0.00 0.00 177.00 175.21 1p2g h ASN 250 N -1.41 0.00 -2.22 2.53 -0.26 -1.99 -3.48 115.58 108.75 1p2g h ASN 250 Ca -0.46 0.00 -0.60 0.00 -0.56 0.00 0.00 56.30 54.68 1p2g h ASN 250 Cb 1.26 0.00 -0.12 0.00 -1.06 0.00 0.00 38.32 38.40 1p2g h ASN 250 CO 0.51 0.07 0.95 1.51 -1.06 0.00 0.00 177.43 179.41 1p2g s ASP 251 N -5.81 6.29 0.05 5.81 -4.77 -1.26 -5.18 116.67 111.79 1p2g s ASP 251 Ca 0.03 -1.02 0.00 0.00 -3.30 0.00 0.00 52.55 48.26 1p2g s ASP 251 Cb 0.07 -2.50 0.00 0.00 -1.09 0.00 0.00 42.92 39.41 1p2g s ASP 251 CO 0.74 -1.55 0.00 0.18 0.70 0.00 0.00 175.17 175.24 1p2g n LEU 254 N 8.39 -5.62 0.00 2.11 7.99 -1.26 -5.17 117.00 123.44 1p2g n LEU 254 Ca 0.09 2.69 0.00 0.00 -0.01 0.00 0.00 56.01 58.78 1p2g n LEU 254 Cb 0.48 -3.01 0.00 0.00 -0.11 0.00 0.00 43.42 40.78 1p2g n LEU 254 CO 0.65 -2.56 0.02 0.61 -1.51 0.00 0.00 177.39 174.61 1p2g n GLY 261 N 1.89 -0.35 0.10 -0.72 0.00 -1.26 -5.20 105.19 99.65 1p2g n GLY 261 Ca 0.00 0.07 -0.11 0.00 0.00 0.00 0.00 46.02 45.98 1p2g n GLY 261 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1p2g h TYR 262 N 0.00 0.23 0.31 1.61 3.20 -2.06 -1.81 116.97 118.44 1p2g h TYR 262 Ca 0.00 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.84 1p2g h TYR 262 Cb 0.00 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.20 1p2g h TYR 262 CO 0.00 0.28 -0.15 0.82 -1.64 0.00 0.00 178.16 177.47 1p2g h ILE 263 N 0.11 0.71 -0.95 1.81 1.08 -2.05 -2.70 117.51 115.51 1p2g h ILE 263 Ca 0.05 -0.09 0.09 0.00 -0.39 0.00 0.00 64.86 64.52 1p2g h ILE 263 Cb 0.14 0.76 -0.07 0.00 -3.07 0.00 0.00 36.82 34.58 1p2g h ILE 263 CO -0.01 0.02 0.60 1.56 -0.69 0.00 0.00 178.15 179.63 1p2g h GLN 264 N -0.46 0.99 -0.77 2.37 1.08 -1.98 -0.78 115.11 115.56 1p2g h GLN 264 Ca -0.04 -0.06 0.01 0.00 -1.45 0.00 0.00 58.65 57.10 1p2g h GLN 264 Cb 0.35 -0.22 -0.04 0.00 -0.05 0.00 0.00 27.48 27.52 1p2g h GLN 264 CO 0.07 0.66 0.50 0.00 -0.95 0.00 0.00 178.83 179.11 1p2g h ALA 265 N 1.47 0.98 -0.42 3.87 0.00 -1.23 0.23 119.26 124.16 1p2g h ALA 265 Ca 0.44 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.22 1p2g h ALA 265 Cb 0.30 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1p2g h ALA 265 CO -0.21 0.41 -0.00 0.28 0.00 0.00 0.00 179.25 179.72 1p2g h VAL 266 N 1.05 1.26 0.00 0.00 2.07 -1.00 -2.99 116.25 116.64 1p2g h VAL 266 Ca 0.28 -1.03 -0.08 0.00 0.82 0.00 0.00 66.70 66.69 1p2g h VAL 266 Cb -0.10 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 1p2g h VAL 266 CO -0.06 0.35 -0.39 -0.07 0.02 0.00 0.00 177.57 177.42 1p2g h LEU 267 N 0.57 0.00 0.00 2.57 3.38 -0.64 -2.78 115.31 118.41 1p2g h LEU 267 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1p2g h LEU 267 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1p2g h LEU 267 CO 0.02 0.39 0.00 0.47 0.09 0.00 0.00 178.44 179.41 1p2g n ASP 268 N -4.00 0.00 0.27 -0.43 8.00 0.76 -2.58 116.55 118.58 1p2g n ASP 268 Ca -0.02 -0.29 0.15 0.00 0.71 0.00 0.00 54.79 55.34 1p2g n ASP 268 Cb 0.43 -0.14 0.76 0.00 -0.02 0.00 0.00 41.12 42.14 1p2g n ASP 268 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1p2g h ARG 269 N 0.00 0.00 0.00 -1.24 3.08 -1.54 -2.06 114.38 112.62 1p2g h ARG 269 Ca 0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 1p2g h ARG 269 Cb 0.09 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.14 1p2g h ARG 269 CO 0.00 0.08 -0.10 -0.91 -1.07 0.00 0.00 179.97 177.97 1p2g h ASN 270 N 0.00 0.00 -0.36 7.04 2.35 -1.74 -2.69 115.58 120.19 1p2g h ASN 270 Ca -0.00 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 1p2g h ASN 270 Cb 0.39 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.74 1p2g h ASN 270 CO 0.01 0.10 0.14 -0.07 -1.65 0.00 0.00 177.43 175.97 1p2g h LEU 271 N 0.00 0.49 -0.65 1.61 4.07 -1.61 -1.30 115.31 117.92 1p2g h LEU 271 Ca -0.00 -0.17 -0.14 0.00 0.08 0.00 0.00 57.88 57.65 1p2g h LEU 271 Cb 0.37 -0.13 -0.01 0.00 1.08 0.00 0.00 40.66 41.97 1p2g h LEU 271 CO 0.01 0.52 -0.45 0.00 -1.08 0.00 0.00 178.44 177.45 1p2g h ALA 272 N 0.99 0.83 0.00 1.53 0.00 -1.64 -2.98 119.26 117.99 1p2g h ALA 272 Ca 0.12 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1p2g h ALA 272 Cb 0.18 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1p2g h ALA 272 CO -0.01 0.65 0.00 0.39 0.00 0.00 0.00 179.25 180.29 1p2g n GLU 273 N -4.01 0.47 0.00 0.00 1.02 -1.07 -3.19 120.64 113.87 1p2g n GLU 273 Ca -0.02 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.23 1p2g n GLU 273 Cb 0.54 -1.50 0.55 0.00 -0.02 0.00 0.00 31.44 31.00 1p2g n GLU 273 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1p2g n ASN 274 N -1.26 0.00 -0.20 1.62 3.02 -0.51 -3.40 115.26 114.53 1p2g n ASN 274 Ca 0.15 0.15 -0.05 0.00 -0.03 0.00 0.00 54.58 54.80 1p2g n ASN 274 Cb 0.23 -0.36 0.11 0.00 -0.61 0.00 0.00 39.78 39.15 1p2g n ASN 274 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1p2g h ILE 275 N 0.00 1.25 -0.44 2.41 2.04 -1.74 -2.91 117.51 118.12 1p2g h ILE 275 Ca 0.00 -0.91 0.00 0.00 1.00 0.00 0.00 64.86 64.95 1p2g h ILE 275 Cb 0.28 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 36.94 1p2g h ILE 275 CO 0.00 0.34 0.00 -1.54 0.00 0.00 0.00 178.15 176.95 1p2g n SER 276 N -4.25 4.84 -0.03 1.72 3.41 -1.22 -4.64 113.62 113.46 1p2g n SER 276 Ca 0.05 -2.93 -0.15 0.00 -0.26 0.00 0.00 58.87 55.58 1p2g n SER 276 Cb 0.24 -0.61 -0.09 0.00 -0.26 0.00 0.00 64.21 63.49 1p2g n SER 276 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1p2g h ARG 277 N 3.02 0.38 -3.20 4.33 9.65 -1.62 -1.81 114.38 125.13 1p2g h ARG 277 Ca 0.00 -0.30 -0.16 0.00 -1.10 0.00 0.00 59.98 58.42 1p2g h ARG 277 Cb 1.70 0.06 -0.24 0.00 -1.39 0.00 0.00 29.97 30.10 1p2g h ARG 277 CO 0.35 0.94 -0.42 0.54 2.80 0.00 0.00 179.97 184.18 1p2g s VAL 278 N -3.68 0.02 0.01 0.20 0.11 -1.26 -0.87 120.40 114.92 1p2g s VAL 278 Ca -0.14 -0.19 -0.30 0.00 -2.93 0.00 0.00 61.98 58.42 1p2g s VAL 278 Cb 0.04 -0.39 -0.04 0.00 -1.53 0.00 0.00 36.38 34.46 1p2g s VAL 278 CO 0.79 -0.10 1.05 -0.22 -3.33 0.00 0.00 175.10 173.29 1p2g s LEU 279 N -0.34 4.36 0.02 2.54 2.96 -0.84 -4.99 118.68 122.39 1p2g s LEU 279 Ca -0.04 1.76 -0.30 0.00 -0.22 0.00 0.00 54.13 55.32 1p2g s LEU 279 Cb -0.03 -3.57 -0.07 0.00 0.50 0.00 0.00 46.19 43.02 1p2g s LEU 279 CO 0.01 -0.35 1.58 -0.31 -1.32 0.00 0.00 176.35 175.96 1p2g s TYR 280 N 1.16 2.46 -0.77 5.38 1.51 -1.26 -4.82 117.35 121.01 1p2g s TYR 280 Ca 0.54 0.44 0.00 0.00 -1.01 0.00 0.00 57.07 57.04 1p2g s TYR 280 Cb -0.23 -3.86 0.00 0.00 -0.11 0.00 0.00 41.96 37.75 1p2g s TYR 280 CO 0.27 -3.44 0.52 -0.35 -1.11 0.00 0.00 175.55 171.45 1p2g n PRO 281 N 5.84 0.85 -3.13 -1.71 -0.04 -1.26 -4.90 135.00 130.66 1p2g n PRO 281 Ca 0.15 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.22 1p2g n PRO 281 Cb 0.42 -1.35 -0.05 0.00 -0.04 0.00 0.00 33.50 32.48 1p2g n PRO 281 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1p2g s ASN 282 N 0.11 6.89 -0.35 3.54 0.01 -1.26 -4.54 114.94 119.34 1p2g s ASN 282 Ca 0.00 1.07 -0.04 0.00 -0.71 0.00 0.00 52.86 53.18 1p2g s ASN 282 Cb 0.00 -2.37 0.06 0.00 0.41 0.00 0.00 41.25 39.35 1p2g s ASN 282 CO 0.00 -0.09 0.10 -0.62 -1.51 0.00 0.00 177.10 174.99 1p2g s ASP 283 N 0.76 5.18 -1.13 -1.22 2.15 -1.26 -4.65 116.67 116.50 1p2g s ASP 283 Ca 0.34 -1.43 -0.00 0.00 0.43 0.00 0.00 52.55 51.88 1p2g s ASP 283 Cb -0.17 -1.81 0.00 0.00 -0.30 0.00 0.00 42.92 40.64 1p2g s ASP 283 CO 0.16 -0.37 0.94 0.59 -0.17 0.00 0.00 175.17 176.31 1p2g n ASN 284 N 4.70 -2.17 -3.66 -0.34 3.02 -1.26 -5.02 115.26 110.53 1p2g n ASN 284 Ca -0.10 -0.58 -0.09 0.00 -0.03 0.00 0.00 54.58 53.78 1p2g n ASN 284 Cb 0.43 -4.82 -0.08 0.00 -0.61 0.00 0.00 39.78 34.70 1p2g n ASN 284 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1p2g s PHE 285 N -3.33 -0.90 -0.03 3.10 5.36 -1.26 -4.23 117.98 116.69 1p2g s PHE 285 Ca 0.02 1.87 -0.17 0.00 -0.96 0.00 0.00 56.93 57.70 1p2g s PHE 285 Cb -0.01 0.48 -0.05 0.00 -0.34 0.00 0.00 43.02 43.10 1p2g s PHE 285 CO 0.68 -0.45 0.45 0.12 -1.46 0.00 0.00 175.22 174.56 1p2g s PHE 286 N 1.34 3.67 -0.26 10.12 5.99 0.07 -4.86 117.98 134.04 1p2g s PHE 286 Ca -0.08 1.00 0.00 0.00 0.00 0.00 0.00 56.93 57.85 1p2g s PHE 286 Cb -0.06 -2.41 0.08 0.00 0.00 0.00 0.00 43.02 40.64 1p2g s PHE 286 CO -0.14 0.48 0.02 -1.21 -0.00 0.00 0.00 175.22 174.37 1p2g s GLU 287 N -0.54 1.18 -0.47 10.12 0.41 -1.26 -5.01 118.70 123.13 1p2g s GLU 287 Ca 0.25 -1.04 -0.06 0.00 -0.41 0.00 0.00 54.97 53.72 1p2g s GLU 287 Cb -0.17 -2.42 -0.15 0.00 -1.78 0.00 0.00 34.13 29.62 1p2g s GLU 287 CO 0.13 -0.77 2.66 0.41 -0.49 0.00 0.00 175.26 177.21 1p2g n GLY 288 N 4.73 2.90 3.85 -1.39 0.00 -1.26 -4.90 105.19 109.12 1p2g n GLY 288 Ca -0.06 -0.97 -0.34 0.00 0.00 0.00 0.00 46.02 44.64 1p2g n GLY 288 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1p2g s LYS 289 N 2.07 3.96 0.14 1.61 -0.14 -1.26 -4.99 119.74 121.13 1p2g s LYS 289 Ca 0.50 0.50 -0.16 0.00 -1.36 0.00 0.00 55.97 55.45 1p2g s LYS 289 Cb 0.20 -2.78 -0.00 0.00 -1.68 0.00 0.00 37.83 33.56 1p2g s LYS 289 CO -0.02 0.38 1.73 1.49 -0.76 0.00 0.00 175.35 178.18 1p2g h GLU 290 N 3.09 0.55 -0.91 1.68 4.81 -2.01 -2.86 114.58 118.94 1p2g h GLU 290 Ca -0.48 -0.07 0.15 0.00 -0.13 0.00 0.00 59.36 58.82 1p2g h GLU 290 Cb 1.18 -0.10 -0.09 0.00 0.63 0.00 0.00 28.75 30.37 1p2g h GLU 290 CO 0.67 0.47 0.51 1.25 -0.73 0.00 0.00 179.01 181.18 1p2g h LEU 291 N 0.50 0.67 -0.81 1.64 5.85 -1.98 -0.96 115.31 120.23 1p2g h LEU 291 Ca 0.14 0.08 -0.05 0.00 0.84 0.00 0.00 57.88 58.89 1p2g h LEU 291 Cb 0.08 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 1p2g h LEU 291 CO -0.02 0.30 0.28 -0.09 -0.34 0.00 0.00 178.44 178.57 1p2g h ARG 292 N 0.74 1.16 -0.33 1.25 9.65 -1.86 -1.53 114.38 123.46 1p2g h ARG 292 Ca 0.49 -0.22 -0.06 0.00 -1.10 0.00 0.00 59.98 59.08 1p2g h ARG 292 Cb 0.64 -0.18 -0.01 0.00 -1.39 0.00 0.00 29.97 29.03 1p2g h ARG 292 CO -0.34 0.96 -0.03 1.25 2.80 0.00 0.00 179.97 184.61 1p2g h LEU 293 N 1.13 0.60 -1.24 3.80 5.85 -1.09 -1.80 115.31 122.55 1p2g h LEU 293 Ca 0.25 -0.33 0.08 0.00 0.84 0.00 0.00 57.88 58.72 1p2g h LEU 293 Cb 0.25 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.07 1p2g h LEU 293 CO -0.02 0.78 0.55 0.11 -0.34 0.00 0.00 178.44 179.53 1p2g h LYS 294 N 0.40 0.86 -0.31 1.25 1.57 -0.96 -0.55 116.57 118.82 1p2g h LYS 294 Ca 0.09 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.77 1p2g h LYS 294 Cb 0.50 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 1p2g h LYS 294 CO 0.02 0.57 0.01 1.96 -0.57 0.00 0.00 179.45 181.44 1p2g h GLN 295 N 0.88 0.54 -0.88 3.15 4.20 -0.92 0.09 115.11 122.17 1p2g h GLN 295 Ca 0.37 -0.16 0.01 0.00 0.06 0.00 0.00 58.65 58.93 1p2g h GLN 295 Cb 0.30 -0.05 -0.04 0.00 0.30 0.00 0.00 27.48 27.99 1p2g h GLN 295 CO -0.14 0.67 0.57 0.93 -0.67 0.00 0.00 178.83 180.19 1p2g h GLU 296 N 0.34 1.16 -0.06 1.46 5.08 -0.44 -1.96 114.58 120.16 1p2g h GLU 296 Ca 0.09 -0.08 -0.23 0.00 -1.00 0.00 0.00 59.36 58.15 1p2g h GLU 296 Cb 0.42 -0.26 0.01 0.00 0.50 0.00 0.00 28.75 29.41 1p2g h GLU 296 CO 0.01 0.78 -0.87 -0.92 -1.00 0.00 0.00 179.01 177.01 1p2g h TYR 297 N 1.19 0.85 -0.15 4.33 3.20 -1.01 -3.00 116.97 122.38 1p2g h TYR 297 Ca 0.32 -0.42 0.04 0.00 3.14 0.00 0.00 58.73 61.81 1p2g h TYR 297 Cb -0.13 -0.11 -0.04 0.00 1.54 0.00 0.00 36.73 37.99 1p2g h TYR 297 CO -0.01 1.23 -0.10 0.35 -1.64 0.00 0.00 178.16 177.99 1p2g h PHE 298 N 0.38 -0.26 -0.25 -3.82 3.57 -0.66 0.14 116.94 116.05 1p2g h PHE 298 Ca -0.07 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.35 1p2g h PHE 298 Cb 1.50 0.14 -0.01 0.00 2.79 0.00 0.00 35.95 40.36 1p2g h PHE 298 CO 0.08 -0.16 -0.24 -0.24 -2.23 0.00 0.00 178.31 175.51 1p2g h VAL 299 N -0.11 1.26 -0.08 1.41 3.04 -1.43 -2.76 116.25 117.58 1p2g h VAL 299 Ca 0.09 -1.24 -0.03 0.00 -1.01 0.00 0.00 66.70 64.51 1p2g h VAL 299 Cb 0.24 1.34 -0.00 0.00 -2.01 0.00 0.00 31.29 30.86 1p2g h VAL 299 CO -0.22 0.40 -0.07 0.58 -1.01 0.00 0.00 177.57 177.25 1p2g h VAL 300 N 0.42 1.36 -0.38 1.51 2.07 -1.29 -2.32 116.25 117.63 1p2g h VAL 300 Ca 0.06 -1.20 -0.07 0.00 0.82 0.00 0.00 66.70 66.32 1p2g h VAL 300 Cb 0.65 1.99 -0.01 0.00 -1.52 0.00 0.00 31.29 32.40 1p2g h VAL 300 CO 0.05 0.33 -0.02 0.00 0.02 0.00 0.00 177.57 177.95 1p2g h ALA 301 N 0.57 0.51 -0.34 1.67 0.00 -0.74 -1.64 119.26 119.30 1p2g h ALA 301 Ca 0.01 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.58 1p2g h ALA 301 Cb 0.57 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1p2g h ALA 301 CO 0.02 0.30 -0.10 0.00 0.00 0.00 0.00 179.25 179.47 1p2g h ALA 302 N 0.87 0.47 -0.29 0.00 0.00 -1.60 -2.86 119.26 115.85 1p2g h ALA 302 Ca 0.10 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1p2g h ALA 302 Cb 0.50 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1p2g h ALA 302 CO 0.02 0.32 0.16 1.15 0.00 0.00 0.00 179.25 180.90 1p2g h THR 303 N 0.45 1.13 -0.90 0.00 2.02 -1.38 -2.64 112.91 111.58 1p2g h THR 303 Ca 0.08 -0.34 0.01 0.00 0.77 0.00 0.00 66.41 66.93 1p2g h THR 303 Cb 0.60 0.83 -0.05 0.00 -1.74 0.00 0.00 68.15 67.80 1p2g h THR 303 CO 0.04 0.13 0.60 -0.07 0.37 0.00 0.00 175.52 176.58 1p2g h LEU 304 N 0.35 1.03 -0.86 2.58 3.38 -1.31 0.45 115.31 120.92 1p2g h LEU 304 Ca 0.10 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1p2g h LEU 304 Cb 0.07 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 1p2g h LEU 304 CO -0.02 0.74 0.47 1.56 0.09 0.00 0.00 178.44 181.28 1p2g h GLN 305 N 1.21 1.21 -0.68 1.13 4.20 -1.40 0.19 115.11 120.97 1p2g h GLN 305 Ca 0.34 -0.14 -0.07 0.00 0.06 0.00 0.00 58.65 58.83 1p2g h GLN 305 Cb -0.12 -0.23 -0.03 0.00 0.30 0.00 0.00 27.48 27.40 1p2g h GLN 305 CO -0.08 0.89 0.14 0.22 -0.67 0.00 0.00 178.83 179.32 1p2g h ASP 306 N 1.21 1.05 0.06 1.46 -0.00 -1.00 0.19 116.42 119.39 1p2g h ASP 306 Ca 0.30 -0.24 -0.00 0.00 -0.00 0.00 0.00 57.03 57.09 1p2g h ASP 306 Cb 0.03 -0.28 0.00 0.00 -0.00 0.00 0.00 39.33 39.09 1p2g h ASP 306 CO -0.05 1.03 -0.03 0.40 -0.00 0.00 0.00 179.24 180.59 1p2g h ILE 307 N 1.04 1.07 -0.46 2.25 2.04 -0.27 -1.86 117.51 121.32 1p2g h ILE 307 Ca 0.21 -0.46 -0.03 0.00 1.00 0.00 0.00 64.86 65.58 1p2g h ILE 307 Cb 0.40 1.38 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 1p2g h ILE 307 CO 0.01 0.12 0.17 0.40 0.00 0.00 0.00 178.15 178.84 1p2g h ILE 308 N -0.29 1.21 -0.10 -0.67 2.04 -0.89 -0.91 117.51 117.91 1p2g h ILE 308 Ca -0.01 -0.67 0.04 0.00 1.00 0.00 0.00 64.86 65.22 1p2g h ILE 308 Cb 0.26 0.80 -0.05 0.00 -0.74 0.00 0.00 36.82 37.09 1p2g h ILE 308 CO 0.01 0.25 -0.19 -0.09 0.00 0.00 0.00 178.15 178.13 1p2g h ARG 309 N 0.60 -0.25 -0.02 2.37 2.43 -0.95 0.54 114.38 119.09 1p2g h ARG 309 Ca 0.15 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.33 1p2g h ARG 309 Cb 0.22 0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.83 1p2g h ARG 309 CO -0.01 -0.17 -0.04 -0.09 -1.51 0.00 0.00 179.97 178.15 1p2g h ARG 310 N -0.26 0.03 0.15 0.20 2.43 -1.13 -2.87 114.38 112.93 1p2g h ARG 310 Ca 0.09 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.25 1p2g h ARG 310 Cb 0.39 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.93 1p2g h ARG 310 CO -0.25 0.07 -0.07 0.35 -1.51 0.00 0.00 179.97 178.56 1p2g h PHE 311 N 0.03 -0.19 0.00 2.20 3.57 0.36 -3.08 116.94 119.83 1p2g h PHE 311 Ca 0.01 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1p2g h PHE 311 Cb 0.09 0.06 0.00 0.00 2.79 0.00 0.00 35.95 38.89 1p2g h PHE 311 CO 0.00 0.23 0.04 1.63 -2.23 0.00 0.00 178.31 177.99 1p2g n LYS 312 N -4.96 0.00 -2.01 1.11 5.02 0.01 -2.22 118.16 115.11 1p2g n LYS 312 Ca -0.09 0.40 -0.36 0.00 -2.02 0.00 0.00 58.31 56.25 1p2g n LYS 312 Cb 0.26 -1.54 0.03 0.00 -0.02 0.00 0.00 35.03 33.76 1p2g n LYS 312 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1p2g n SER 313 N -1.40 6.76 -0.03 4.39 7.64 -1.16 -5.11 113.62 124.71 1p2g n SER 313 Ca 0.00 -3.80 -0.07 0.00 1.01 0.00 0.00 58.87 56.01 1p2g n SER 313 Cb 0.04 -0.88 -0.02 0.00 -1.01 0.00 0.00 64.21 62.34 1p2g n SER 313 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1p2g n SER 314 N -0.57 1.32 -3.11 6.43 7.64 -0.94 -5.03 113.62 119.35 1p2g n SER 314 Ca 0.51 0.21 -0.25 0.00 1.01 0.00 0.00 58.87 60.35 1p2g n SER 314 Cb 0.41 -0.48 -0.05 0.00 -1.01 0.00 0.00 64.21 63.08 1p2g n SER 314 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1p2g n THR 324 N -3.83 1.85 -3.32 0.44 -1.04 -1.26 -5.17 114.28 101.95 1p2g n THR 324 Ca -0.12 -5.15 -0.38 0.00 -2.04 0.00 0.00 64.05 56.36 1p2g n THR 324 Cb 0.37 -1.32 -0.06 0.00 -1.82 0.00 0.00 70.33 67.50 1p2g n THR 324 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1p2g s ASN 325 N -2.84 6.60 0.00 8.00 3.84 -1.26 -4.94 114.94 124.34 1p2g s ASN 325 Ca 0.44 0.72 0.00 0.00 0.21 0.00 0.00 52.86 54.23 1p2g s ASN 325 Cb 0.26 -2.27 0.00 0.00 -0.55 0.00 0.00 41.25 38.69 1p2g s ASN 325 CO -0.10 -0.05 0.56 0.49 -2.79 0.00 0.00 177.10 175.21 1p2g n PHE 326 N 4.09 0.00 0.23 0.43 3.72 -1.26 -3.81 117.46 120.86 1p2g n PHE 326 Ca -0.07 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.42 1p2g n PHE 326 Cb 0.51 -0.07 0.52 0.00 -0.94 0.00 0.00 39.48 39.51 1p2g n PHE 326 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1p2g h ASP 327 N 0.07 0.00 0.18 4.37 5.19 -1.98 -2.19 116.42 122.06 1p2g h ASP 327 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1p2g h ASP 327 Cb 0.34 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.85 1p2g h ASP 327 CO 0.00 0.24 -0.33 0.00 -3.12 0.00 0.00 179.24 176.03 1p2g n ALA 328 N -2.30 3.24 -0.20 3.45 0.00 -1.25 -4.44 120.51 119.02 1p2g n ALA 328 Ca -0.01 -0.46 0.01 0.00 0.00 0.00 0.00 53.44 52.98 1p2g n ALA 328 Cb 0.37 -1.04 0.11 0.00 0.00 0.00 0.00 19.45 18.89 1p2g n ALA 328 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1p2g h PHE 329 N 1.44 0.07 0.00 0.00 3.04 -1.65 -0.96 116.94 118.89 1p2g h PHE 329 Ca 0.00 0.04 -0.00 0.00 3.98 0.00 0.00 57.97 61.99 1p2g h PHE 329 Cb 0.57 0.06 -0.00 0.00 2.56 0.00 0.00 35.95 39.14 1p2g h PHE 329 CO 0.00 -0.11 -0.01 -1.35 -2.02 0.00 0.00 178.31 174.81 1p2g h PRO 330 N 0.18 0.00 0.00 6.41 0.11 -1.78 0.18 132.00 137.09 1p2g h PRO 330 Ca 0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.44 1p2g h PRO 330 Cb 0.52 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.63 1p2g h PRO 330 CO -0.48 0.01 -0.55 -0.44 -0.21 0.00 0.00 178.00 176.34 1p2g h ASP 331 N 0.00 0.00 0.00 -2.05 3.32 -1.48 -3.33 116.42 112.88 1p2g h ASP 331 Ca -0.00 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.99 1p2g h ASP 331 Cb 0.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.82 1p2g h ASP 331 CO 0.00 0.03 -0.58 0.29 -1.72 0.00 0.00 179.24 177.26 1p2g n LYS 332 N -2.57 3.31 -4.00 3.56 4.76 -0.87 -4.54 118.16 117.82 1p2g n LYS 332 Ca 0.02 -0.01 -0.16 0.00 -2.87 0.00 0.00 58.31 55.29 1p2g n LYS 332 Cb 0.50 -1.01 -0.15 0.00 -1.84 0.00 0.00 35.03 32.53 1p2g n LYS 332 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1p2g s VAL 333 N -2.04 0.24 -0.07 -0.18 1.01 0.56 -1.31 120.40 118.62 1p2g s VAL 333 Ca 0.03 -0.02 0.02 0.00 0.00 0.00 0.00 61.98 62.01 1p2g s VAL 333 Cb 0.08 -0.28 0.02 0.00 0.00 0.00 0.00 36.38 36.19 1p2g s VAL 333 CO 0.42 0.13 -0.11 0.00 0.00 0.00 0.00 175.10 175.54 1p2g s ALA 334 N 0.61 1.20 -0.25 5.51 0.00 -0.72 -4.49 121.76 123.62 1p2g s ALA 334 Ca -0.06 -0.38 0.02 0.00 0.00 0.00 0.00 51.96 51.54 1p2g s ALA 334 Cb -0.09 -0.58 0.05 0.00 0.00 0.00 0.00 23.12 22.50 1p2g s ALA 334 CO -0.01 0.06 -0.12 0.42 0.00 0.00 0.00 175.76 176.11 1p2g s ILE 335 N 0.77 2.20 -0.25 0.00 1.01 0.91 -0.86 121.20 124.98 1p2g s ILE 335 Ca -0.13 -1.48 -0.14 0.00 0.00 0.00 0.00 60.65 58.91 1p2g s ILE 335 Cb -0.15 -2.22 -0.04 0.00 0.01 0.00 0.00 42.46 40.05 1p2g s ILE 335 CO 0.02 0.08 0.31 -1.58 0.00 0.00 0.00 174.94 173.77 1p2g s GLN 336 N 1.15 4.04 -0.39 2.79 2.00 -0.11 -1.68 119.66 127.46 1p2g s GLN 336 Ca -0.06 -0.05 -0.19 0.00 -2.00 0.00 0.00 55.36 53.06 1p2g s GLN 336 Cb -0.19 -3.61 0.01 0.00 0.80 0.00 0.00 33.01 30.02 1p2g s GLN 336 CO -0.06 -0.16 0.56 -0.51 -0.50 0.00 0.00 175.29 174.62 1p2g s LEU 337 N 1.69 4.46 -0.92 3.68 1.02 -0.17 -1.64 118.68 126.80 1p2g s LEU 337 Ca 0.13 -0.20 -0.22 0.00 0.02 0.00 0.00 54.13 53.86 1p2g s LEU 337 Cb -0.15 -2.63 0.07 0.00 0.02 0.00 0.00 46.19 43.50 1p2g s LEU 337 CO 0.09 -0.61 1.29 0.21 0.02 0.00 0.00 176.35 177.35 1p2g s ASN 338 N 1.85 6.45 0.15 2.29 2.47 -0.90 -1.74 114.94 125.52 1p2g s ASN 338 Ca 0.20 -1.42 0.00 0.00 0.42 0.00 0.00 52.86 52.06 1p2g s ASN 338 Cb -0.15 -2.51 0.00 0.00 -1.45 0.00 0.00 41.25 37.14 1p2g s ASN 338 CO 0.15 -1.43 0.00 -0.67 -3.72 0.00 0.00 177.10 171.43 1p2g n ASP 339 N 8.22 -0.90 -0.22 -4.21 4.64 -0.62 -4.26 116.55 119.20 1p2g n ASP 339 Ca 0.23 0.00 0.14 0.00 -1.38 0.00 0.00 54.79 53.77 1p2g n ASP 339 Cb 0.50 0.00 0.53 0.00 -1.04 0.00 0.00 41.12 41.11 1p2g n ASP 339 CO 0.00 0.00 0.00 0.35 -0.82 0.00 0.00 177.20 176.73 1p2g n THR 340 N -0.29 0.00 -0.35 5.18 -2.24 -1.26 -4.33 114.28 110.99 1p2g n THR 340 Ca 0.00 -0.12 0.13 0.00 -2.27 0.00 0.00 64.05 61.79 1p2g n THR 340 Cb 0.00 0.16 0.32 0.00 -2.10 0.00 0.00 70.33 68.72 1p2g n THR 340 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1p2g h HIS 341 N 1.08 1.05 -0.54 4.78 3.86 -1.97 -0.19 115.15 123.22 1p2g h HIS 341 Ca 0.00 0.03 -0.09 0.00 -1.16 0.00 0.00 60.37 59.15 1p2g h HIS 341 Cb 0.42 -0.32 -0.05 0.00 1.06 0.00 0.00 27.41 28.51 1p2g h HIS 341 CO 0.00 0.26 0.10 -0.35 0.86 0.00 0.00 177.93 178.79 1p2g n PRO 342 N -4.73 3.78 0.26 2.45 -0.04 -1.26 -4.65 135.00 130.81 1p2g n PRO 342 Ca 0.23 -3.07 0.18 0.00 -0.04 0.00 0.00 63.50 60.80 1p2g n PRO 342 Cb 0.55 -2.12 0.87 0.00 -0.04 0.00 0.00 33.50 32.76 1p2g n PRO 342 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1p2g h SER 343 N 2.76 0.00 0.26 3.54 4.64 -1.28 -1.27 113.55 122.20 1p2g h SER 343 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1p2g h SER 343 Cb 1.96 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.05 1p2g h SER 343 CO 0.51 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.65 1p2g n LEU 344 N -3.31 0.00 -0.05 5.97 4.77 -1.26 -2.31 117.00 120.81 1p2g n LEU 344 Ca 0.01 0.35 0.02 0.00 -0.03 0.00 0.00 56.01 56.35 1p2g n LEU 344 Cb 0.37 -0.35 0.33 0.00 -2.33 0.00 0.00 43.42 41.44 1p2g n LEU 344 CO 0.21 -0.22 1.09 0.00 -1.33 0.00 0.00 177.39 177.13 1p2g h ALA 345 N 2.47 1.52 0.55 -1.18 0.00 -1.59 -0.64 119.26 120.38 1p2g h ALA 345 Ca 0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1p2g h ALA 345 Cb 0.13 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 17.74 1p2g h ALA 345 CO 0.00 0.38 -0.26 0.82 0.00 0.00 0.00 179.25 180.19 1p2g h ILE 346 N 0.64 0.41 0.00 0.00 2.04 -1.71 0.24 117.51 119.12 1p2g h ILE 346 Ca 0.16 -0.24 -0.04 0.00 1.00 0.00 0.00 64.86 65.74 1p2g h ILE 346 Cb 0.08 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 36.66 1p2g h ILE 346 CO -0.02 0.03 -0.19 1.55 0.00 0.00 0.00 178.15 179.52 1p2g h PRO 347 N -0.89 0.00 -0.20 2.37 0.13 -1.73 -2.47 132.00 129.21 1p2g h PRO 347 Ca -0.08 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.91 1p2g h PRO 347 Cb 0.62 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.75 1p2g h PRO 347 CO 0.12 0.19 -0.42 1.49 -0.23 0.00 0.00 178.00 179.15 1p2g h GLU 348 N 0.00 0.64 -0.79 0.86 4.57 -0.96 -0.67 114.58 118.22 1p2g h GLU 348 Ca -0.00 -0.42 -0.04 0.00 -1.18 0.00 0.00 59.36 57.72 1p2g h GLU 348 Cb 0.73 0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 29.34 1p2g h GLU 348 CO 0.02 1.04 0.34 1.25 -1.18 0.00 0.00 179.01 180.49 1p2g h LEU 349 N 0.32 1.07 -0.13 1.64 5.85 -0.41 -1.88 115.31 121.77 1p2g h LEU 349 Ca 0.00 -0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.57 1p2g h LEU 349 Cb 1.03 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.78 1p2g h LEU 349 CO 0.09 0.93 0.07 0.24 -0.34 0.00 0.00 178.44 179.43 1p2g h MET 350 N 1.15 0.18 -0.27 1.25 2.86 -1.33 -1.96 114.93 116.81 1p2g h MET 350 Ca 0.27 -0.02 0.06 0.00 -2.06 0.00 0.00 59.70 57.95 1p2g h MET 350 Cb 0.17 -0.03 -0.07 0.00 0.06 0.00 0.00 31.60 31.73 1p2g h MET 350 CO -0.03 0.23 -0.17 -0.09 1.06 0.00 0.00 176.91 177.91 1p2g h ARG 351 N 0.09 -0.14 -0.03 1.72 2.43 -0.71 0.22 114.38 117.96 1p2g h ARG 351 Ca 0.04 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1p2g h ARG 351 Cb 0.10 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.68 1p2g h ARG 351 CO -0.01 -0.10 0.02 0.28 -1.51 0.00 0.00 179.97 178.65 1p2g h VAL 352 N -0.15 1.01 -0.71 0.20 2.07 -1.30 0.57 116.25 117.95 1p2g h VAL 352 Ca 0.15 -0.03 -0.05 0.00 0.82 0.00 0.00 66.70 67.58 1p2g h VAL 352 Cb 0.37 0.99 -0.03 0.00 -1.52 0.00 0.00 31.29 31.10 1p2g h VAL 352 CO -0.36 0.01 0.23 -0.07 0.02 0.00 0.00 177.57 177.40 1p2g h LEU 353 N 0.03 1.00 0.00 2.57 3.38 -0.92 0.12 115.31 121.49 1p2g h LEU 353 Ca 0.01 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.76 1p2g h LEU 353 Cb 0.01 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1p2g h LEU 353 CO -0.00 0.93 -0.41 0.58 0.09 0.00 0.00 178.44 179.62 1p2g h VAL 354 N 1.04 0.49 -0.16 1.22 2.07 -0.47 0.69 116.25 121.13 1p2g h VAL 354 Ca 0.23 -1.47 -0.16 0.00 0.82 0.00 0.00 66.70 66.13 1p2g h VAL 354 Cb 0.27 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 1p2g h VAL 354 CO -0.01 0.17 -0.57 0.44 0.02 0.00 0.00 177.57 177.62 1p2g h ASP 355 N -1.00 0.54 0.00 0.57 3.45 0.03 -2.89 116.42 117.12 1p2g h ASP 355 Ca -0.07 -0.29 -0.43 0.00 0.43 0.00 0.00 57.03 56.67 1p2g h ASP 355 Cb 0.59 -0.16 -0.07 0.00 -0.56 0.00 0.00 39.33 39.14 1p2g h ASP 355 CO -0.04 0.99 -2.47 0.18 -1.57 0.00 0.00 179.24 176.34 1p2g n LEU 356 N -3.94 2.16 -0.11 1.55 4.77 -0.08 -4.54 117.00 116.81 1p2g n LEU 356 Ca -0.03 0.20 0.13 0.00 -0.03 0.00 0.00 56.01 56.28 1p2g n LEU 356 Cb 0.61 -0.80 0.45 0.00 -2.33 0.00 0.00 43.42 41.35 1p2g n LEU 356 CO 0.47 0.65 0.71 -0.62 -1.33 0.00 0.00 177.39 177.27 1p2g n GLU 357 N -3.93 0.49 -2.03 3.23 -0.58 0.21 -4.96 120.64 113.07 1p2g n GLU 357 Ca -0.50 -0.23 -0.20 0.00 -0.42 0.00 0.00 57.16 55.81 1p2g n GLU 357 Cb 0.90 -1.50 -0.04 0.00 -0.57 0.00 0.00 31.44 30.23 1p2g n GLU 357 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1p2g n ARG 358 N -1.06 -1.50 -1.49 3.49 5.12 -0.76 -4.95 116.66 115.53 1p2g n ARG 358 Ca 0.11 1.07 -0.31 0.00 -1.93 0.00 0.00 57.85 56.78 1p2g n ARG 358 Cb 0.32 -5.56 0.06 0.00 -1.16 0.00 0.00 32.46 26.12 1p2g n ARG 358 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1p2g s LEU 359 N -5.20 3.13 0.39 0.55 1.02 0.16 -4.97 118.68 113.77 1p2g s LEU 359 Ca 0.00 1.74 -0.23 0.00 0.02 0.00 0.00 54.13 55.66 1p2g s LEU 359 Cb 0.00 -4.51 -0.11 0.00 0.02 0.00 0.00 46.19 41.59 1p2g s LEU 359 CO 0.00 -1.68 0.95 1.51 0.02 0.00 0.00 176.35 177.15 1p2g s ASP 360 N -3.49 7.08 0.20 2.29 -4.77 -1.26 -4.45 116.67 112.26 1p2g s ASP 360 Ca 0.60 1.74 -0.24 0.00 -3.30 0.00 0.00 52.55 51.35 1p2g s ASP 360 Cb -0.16 -2.55 0.09 0.00 -1.09 0.00 0.00 42.92 39.21 1p2g s ASP 360 CO 0.53 -0.26 1.55 -0.25 0.70 0.00 0.00 175.17 177.44 1p2g h TRP 361 N 2.35 -1.48 -0.98 2.11 2.91 -1.96 -0.75 115.95 118.15 1p2g h TRP 361 Ca -0.48 0.12 0.07 0.00 1.13 0.00 0.00 58.89 59.72 1p2g h TRP 361 Cb 1.18 0.78 -0.07 0.00 -0.51 0.00 0.00 29.16 30.55 1p2g h TRP 361 CO 0.62 -0.39 0.63 -0.44 -1.03 0.00 0.00 178.44 177.82 1p2g h ASP 362 N -0.01 1.00 -0.24 2.65 5.19 -1.99 0.27 116.42 123.29 1p2g h ASP 362 Ca 0.25 0.01 -0.04 0.00 -0.62 0.00 0.00 57.03 56.63 1p2g h ASP 362 Cb 0.51 -0.20 -0.01 0.00 0.18 0.00 0.00 39.33 39.81 1p2g h ASP 362 CO -0.96 0.64 -0.03 0.50 -3.12 0.00 0.00 179.24 176.27 1p2g h LYS 363 N 1.13 0.44 -0.52 3.56 3.11 -1.64 -1.77 116.57 120.88 1p2g h LYS 363 Ca 0.42 -0.15 0.06 0.00 -2.81 0.00 0.00 60.65 58.17 1p2g h LYS 363 Cb 0.17 -0.03 -0.05 0.00 -1.00 0.00 0.00 32.23 31.32 1p2g h LYS 363 CO -0.18 0.64 0.23 0.00 -2.81 0.00 0.00 179.45 177.34 1p2g h ALA 364 N 0.78 0.66 -0.46 5.00 0.00 -0.35 -1.57 119.26 123.32 1p2g h ALA 364 Ca 0.06 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 1p2g h ALA 364 Cb 0.46 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1p2g h ALA 364 CO 0.02 -0.14 -0.02 2.35 0.00 0.00 0.00 179.25 181.46 1p2g h TRP 365 N 0.45 0.82 -0.37 0.00 2.91 -0.39 -0.36 115.95 119.00 1p2g h TRP 365 Ca 0.24 -0.12 -0.03 0.00 1.13 0.00 0.00 58.89 60.12 1p2g h TRP 365 Cb 0.20 -0.22 -0.02 0.00 -0.51 0.00 0.00 29.16 28.61 1p2g h TRP 365 CO -0.13 0.77 0.13 1.49 -1.03 0.00 0.00 178.44 179.67 1p2g h GLU 366 N 0.71 0.57 -0.01 2.65 4.81 -0.77 -1.16 114.58 121.38 1p2g h GLU 366 Ca 0.14 -0.11 -0.00 0.00 -0.13 0.00 0.00 59.36 59.25 1p2g h GLU 366 Cb 0.46 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.75 1p2g h GLU 366 CO 0.02 0.57 0.01 0.28 -0.73 0.00 0.00 179.01 179.15 1p2g h VAL 367 N 0.45 1.05 0.20 0.32 2.07 -1.01 -2.28 116.25 117.05 1p2g h VAL 367 Ca 0.12 -0.16 0.01 0.00 0.82 0.00 0.00 66.70 67.50 1p2g h VAL 367 Cb 0.23 1.14 -0.03 0.00 -1.52 0.00 0.00 31.29 31.11 1p2g h VAL 367 CO -0.01 0.04 -0.33 0.74 0.02 0.00 0.00 177.57 178.03 1p2g h THR 368 N -0.05 0.30 -0.93 2.57 2.02 -0.87 -1.97 112.91 113.98 1p2g h THR 368 Ca 0.00 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.28 1p2g h THR 368 Cb 0.06 0.30 -0.07 0.00 -1.74 0.00 0.00 68.15 66.70 1p2g h THR 368 CO -0.00 0.00 0.57 0.58 0.37 0.00 0.00 175.52 177.04 1p2g h VAL 369 N -0.61 0.97 0.00 3.16 2.07 -1.20 -1.67 116.25 118.97 1p2g h VAL 369 Ca 0.01 -0.33 -0.02 0.00 0.82 0.00 0.00 66.70 67.18 1p2g h VAL 369 Cb 0.60 -0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.29 1p2g h VAL 369 CO -0.15 0.18 -0.08 0.11 0.02 0.00 0.00 177.57 177.64 1p2g h LYS 370 N 0.97 0.00 0.00 1.57 1.57 -1.07 -2.01 116.57 117.60 1p2g h LYS 370 Ca 0.44 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 59.11 1p2g h LYS 370 Cb 0.34 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.63 1p2g h LYS 370 CO -0.23 0.08 -1.93 0.25 -0.57 0.00 0.00 179.45 177.05 1p2g n THR 371 N -3.21 0.54 -3.62 -0.16 -2.24 -0.74 -4.90 114.28 99.94 1p2g n THR 371 Ca 0.01 -0.62 -0.37 0.00 -2.27 0.00 0.00 64.05 60.80 1p2g n THR 371 Cb 0.36 -0.23 -0.06 0.00 -2.10 0.00 0.00 70.33 68.30 1p2g n THR 371 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1p2g s ALA 373 N -1.16 0.42 -0.05 0.00 0.00 -0.68 -1.74 121.76 118.54 1p2g s ALA 373 Ca 0.24 -0.70 0.03 0.00 0.00 0.00 0.00 51.96 51.53 1p2g s ALA 373 Cb -0.15 0.08 0.01 0.00 0.00 0.00 0.00 23.12 23.06 1p2g s ALA 373 CO 0.13 -0.07 -0.13 -0.47 0.00 0.00 0.00 175.76 175.22 1p2g s TYR 374 N -1.39 1.44 -0.25 0.00 6.04 0.16 -1.00 117.35 122.34 1p2g s TYR 374 Ca -0.12 -0.48 -0.06 0.00 0.04 0.00 0.00 57.07 56.45 1p2g s TYR 374 Cb -0.10 -1.03 -0.01 0.00 -1.04 0.00 0.00 41.96 39.78 1p2g s TYR 374 CO -0.00 -0.22 0.04 0.99 -1.54 0.00 0.00 175.55 174.82 1p2g s THR 375 N 0.44 3.97 0.05 4.34 2.01 -0.71 -1.55 115.64 124.19 1p2g s THR 375 Ca -0.10 -0.37 -0.20 0.00 0.31 0.00 0.00 61.69 61.33 1p2g s THR 375 Cb -0.14 -2.89 -0.06 0.00 0.01 0.00 0.00 72.50 69.42 1p2g s THR 375 CO 0.03 0.31 0.57 0.21 -0.69 0.00 0.00 174.62 175.05 1p2g s ASN 376 N 1.55 7.04 0.00 3.53 3.84 -0.56 -1.58 114.94 128.76 1p2g s ASN 376 Ca 0.05 1.23 0.06 0.00 0.21 0.00 0.00 52.86 54.41 1p2g s ASN 376 Cb -0.15 -2.36 -0.02 0.00 -0.55 0.00 0.00 41.25 38.17 1p2g s ASN 376 CO 0.01 0.24 0.38 1.41 -2.79 0.00 0.00 177.10 176.35 1p2g n HIS 377 N 1.96 0.00 -3.49 0.43 8.25 -1.26 -4.11 115.22 117.00 1p2g n HIS 377 Ca -0.10 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.27 1p2g n HIS 377 Cb 0.51 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.60 1p2g n HIS 377 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1p2g s THR 378 N -1.19 0.00 -0.29 1.59 -1.32 -1.26 -4.55 115.64 108.63 1p2g s THR 378 Ca 0.04 -0.03 0.05 0.00 -1.21 0.00 0.00 61.69 60.53 1p2g s THR 378 Cb 0.04 -1.04 -0.03 0.00 -1.51 0.00 0.00 72.50 69.96 1p2g s THR 378 CO 0.18 0.00 0.28 1.33 -2.21 0.00 0.00 174.62 174.20 1p2g n VAL 379 N -0.30 0.00 -2.12 5.08 0.24 -1.26 -5.00 118.33 114.97 1p2g n VAL 379 Ca -0.11 -0.42 -0.42 0.00 -2.04 0.00 0.00 64.34 61.35 1p2g n VAL 379 Cb 0.63 1.02 -0.03 0.00 -1.47 0.00 0.00 33.84 33.99 1p2g n VAL 379 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 1p2g s ILE 380 N -1.22 3.14 0.28 1.34 -4.36 -1.26 -4.92 121.20 114.20 1p2g s ILE 380 Ca 0.02 0.83 0.02 0.00 -0.26 0.00 0.00 60.65 61.27 1p2g s ILE 380 Cb 0.04 -3.53 0.28 0.00 1.25 0.00 0.00 42.46 40.50 1p2g s ILE 380 CO 0.16 0.07 1.82 1.55 0.24 0.00 0.00 174.94 178.78 1p2g h PRO 381 N 6.65 0.90 0.00 0.37 0.13 -1.98 -2.40 132.00 135.67 1p2g h PRO 381 Ca -0.42 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1p2g h PRO 381 Cb 1.21 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 32.14 1p2g h PRO 381 CO 0.87 0.60 0.00 -0.85 -0.23 0.00 0.00 178.00 178.38 1p2g n GLU 382 N -4.66 0.04 0.05 0.86 0.00 -1.26 -2.34 120.64 113.32 1p2g n GLU 382 Ca 0.20 0.29 0.10 0.00 0.00 0.00 0.00 57.16 57.74 1p2g n GLU 382 Cb 0.40 -1.50 -0.08 0.00 0.00 0.00 0.00 31.44 30.26 1p2g n GLU 382 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1p2g n ALA 383 N -1.45 2.55 -1.89 -1.84 0.00 -0.90 -0.75 120.51 116.23 1p2g n ALA 383 Ca 0.03 -0.40 -0.42 0.00 0.00 0.00 0.00 53.44 52.65 1p2g n ALA 383 Cb 0.12 -0.93 -0.03 0.00 0.00 0.00 0.00 19.45 18.61 1p2g n ALA 383 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1p2g s LEU 384 N -5.08 4.37 -0.28 0.00 2.01 -0.99 -4.32 118.68 114.39 1p2g s LEU 384 Ca -0.04 2.68 -0.27 0.00 0.01 0.00 0.00 54.13 56.51 1p2g s LEU 384 Cb 0.11 -3.60 0.01 0.00 0.01 0.00 0.00 46.19 42.71 1p2g s LEU 384 CO 0.84 -0.82 0.96 -1.61 1.01 0.00 0.00 176.35 176.73 1p2g s GLU 385 N 0.66 4.10 -0.35 1.70 2.02 -1.26 -4.75 118.70 120.82 1p2g s GLU 385 Ca 0.67 1.00 0.00 0.00 0.02 0.00 0.00 54.97 56.67 1p2g s GLU 385 Cb -0.44 -3.70 0.11 0.00 0.10 0.00 0.00 34.13 30.20 1p2g s GLU 385 CO 0.35 -0.73 0.14 1.03 0.02 0.00 0.00 175.26 176.07 1p2g s ARG 386 N 3.26 0.94 -0.03 1.61 0.52 -1.26 -2.41 118.95 121.59 1p2g s ARG 386 Ca 0.40 -1.43 -0.26 0.00 -0.52 0.00 0.00 55.73 53.93 1p2g s ARG 386 Cb -0.14 -2.17 -0.04 0.00 0.52 0.00 0.00 34.95 33.13 1p2g s ARG 386 CO 0.11 -1.04 0.79 -1.58 0.02 0.00 0.00 175.30 173.60 1p2g s TRP 387 N 1.16 3.63 0.32 -0.53 0.52 -0.88 -4.72 118.94 118.44 1p2g s TRP 387 Ca 0.13 1.42 -0.29 0.00 0.02 0.00 0.00 56.10 57.38 1p2g s TRP 387 Cb -0.20 -2.90 -0.12 0.00 -1.15 0.00 0.00 33.47 29.10 1p2g s TRP 387 CO -0.15 0.09 1.42 -2.30 0.02 0.00 0.00 176.95 176.03 1p2g n PRO 388 N 3.63 2.37 -0.15 4.98 -0.02 -1.26 -0.86 135.00 143.69 1p2g n PRO 388 Ca 0.01 0.84 -0.01 0.00 -2.02 0.00 0.00 63.50 62.31 1p2g n PRO 388 Cb 0.51 -2.51 0.24 0.00 -0.02 0.00 0.00 33.50 31.72 1p2g n PRO 388 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1p2g h VAL 389 N 2.90 1.20 -0.08 -1.45 2.07 -1.21 -2.51 116.25 117.17 1p2g h VAL 389 Ca -0.47 -0.56 -0.05 0.00 0.82 0.00 0.00 66.70 66.44 1p2g h VAL 389 Cb 1.26 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 1p2g h VAL 389 CO 0.69 0.24 -0.17 1.12 0.02 0.00 0.00 177.57 179.46 1p2g h HIS 390 N 0.86 0.13 -0.06 1.57 2.07 -1.90 0.26 115.15 118.08 1p2g h HIS 390 Ca 0.21 -0.01 -0.02 0.00 -2.85 0.00 0.00 60.37 57.70 1p2g h HIS 390 Cb 0.09 -0.04 -0.00 0.00 2.57 0.00 0.00 27.41 30.03 1p2g h HIS 390 CO 0.01 0.29 -0.05 1.25 -3.07 0.00 0.00 177.93 176.36 1p2g h LEU 391 N 0.12 0.15 -1.66 6.12 6.46 -1.83 -2.32 115.31 122.36 1p2g h LEU 391 Ca 0.02 -0.46 -0.04 0.00 -0.12 0.00 0.00 57.88 57.28 1p2g h LEU 391 Cb 0.37 -0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 40.26 1p2g h LEU 391 CO 0.02 0.58 -0.20 -0.07 -0.62 0.00 0.00 178.44 178.15 1p2g h LEU 392 N -0.28 0.00 -0.92 2.25 3.38 -1.35 -1.25 115.31 117.14 1p2g h LEU 392 Ca 0.01 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 1p2g h LEU 392 Cb 0.53 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 1p2g h LEU 392 CO 0.01 0.20 -0.19 -0.08 0.09 0.00 0.00 178.44 178.47 1p2g h GLU 393 N 0.00 0.57 0.01 1.13 4.81 -0.71 -0.40 114.58 120.00 1p2g h GLU 393 Ca -0.00 -0.20 -0.20 0.00 -0.13 0.00 0.00 59.36 58.83 1p2g h GLU 393 Cb 0.40 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.71 1p2g h GLU 393 CO 0.03 0.74 -1.06 1.15 -0.73 0.00 0.00 179.01 179.13 1p2g h THR 394 N 0.51 1.08 -0.13 0.32 2.02 -1.00 -3.33 112.91 112.38 1p2g h THR 394 Ca 0.08 -2.23 -0.16 0.00 0.77 0.00 0.00 66.41 64.87 1p2g h THR 394 Cb 0.62 2.49 0.01 0.00 -1.74 0.00 0.00 68.15 69.53 1p2g h THR 394 CO 0.04 0.41 -0.55 0.25 0.37 0.00 0.00 175.52 176.05 1p2g h LEU 395 N -0.91 0.71 -5.99 2.58 5.85 -1.32 -3.36 115.31 112.87 1p2g h LEU 395 Ca -0.28 -0.63 -0.55 0.00 0.84 0.00 0.00 57.88 57.27 1p2g h LEU 395 Cb 1.31 -0.21 -0.40 0.00 0.37 0.00 0.00 40.66 41.73 1p2g h LEU 395 CO -0.14 1.22 -1.06 0.18 -0.34 0.00 0.00 178.44 178.30 1p2g n LEU 396 N -4.17 0.90 -0.18 2.25 4.77 -0.17 -0.62 117.00 119.78 1p2g n LEU 396 Ca -0.08 -4.89 -0.01 0.00 -0.03 0.00 0.00 56.01 51.00 1p2g n LEU 396 Cb 0.62 0.47 0.08 0.00 -2.33 0.00 0.00 43.42 42.27 1p2g n LEU 396 CO 0.48 2.14 0.84 1.55 -1.33 0.00 0.00 177.39 181.07 1p2g h PRO 397 N 3.72 0.12 -0.68 3.23 0.13 -1.64 -2.07 132.00 134.81 1p2g h PRO 397 Ca 0.09 -0.01 -0.07 0.00 -0.87 0.00 0.00 66.00 65.14 1p2g h PRO 397 Cb 0.86 -0.03 -0.03 0.00 0.13 0.00 0.00 31.00 31.94 1p2g h PRO 397 CO 0.52 0.08 0.13 -0.09 -0.23 0.00 0.00 178.00 178.42 1p2g h ARG 398 N 0.12 1.10 -0.17 0.86 9.65 -1.92 -2.59 114.38 121.44 1p2g h ARG 398 Ca 0.29 -0.28 -0.02 0.00 -1.10 0.00 0.00 59.98 58.86 1p2g h ARG 398 Cb 0.44 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 28.88 1p2g h ARG 398 CO -0.47 0.99 -0.01 0.45 2.80 0.00 0.00 179.97 183.73 1p2g h HIS 399 N 1.03 0.24 -0.50 2.20 3.86 -1.75 -1.67 115.15 118.57 1p2g h HIS 399 Ca 0.21 -0.01 -0.08 0.00 -1.16 0.00 0.00 60.37 59.33 1p2g h HIS 399 Cb 0.41 -0.08 -0.02 0.00 1.06 0.00 0.00 27.41 28.78 1p2g h HIS 399 CO 0.03 0.26 0.01 1.25 0.86 0.00 0.00 177.93 180.34 1p2g h LEU 400 N 0.24 0.85 -0.76 2.43 6.46 -1.02 -0.93 115.31 122.58 1p2g h LEU 400 Ca 0.06 -0.30 -0.05 0.00 -0.12 0.00 0.00 57.88 57.46 1p2g h LEU 400 Cb 0.18 -0.23 -0.03 0.00 -0.73 0.00 0.00 40.66 39.85 1p2g h LEU 400 CO 0.00 0.94 0.26 1.56 -0.62 0.00 0.00 178.44 180.59 1p2g h GLN 401 N 0.73 1.16 -0.57 1.25 4.20 -1.15 -0.87 115.11 119.86 1p2g h GLN 401 Ca 0.14 -0.23 -0.09 0.00 0.06 0.00 0.00 58.65 58.53 1p2g h GLN 401 Cb 0.50 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.08 1p2g h GLN 401 CO 0.02 0.97 -0.01 0.82 -0.67 0.00 0.00 178.83 179.96 1p2g h ILE 402 N 1.11 1.26 -0.62 2.54 2.04 -1.11 -1.59 117.51 121.15 1p2g h ILE 402 Ca 0.25 -1.13 -0.08 0.00 1.00 0.00 0.00 64.86 64.90 1p2g h ILE 402 Cb 0.27 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 1p2g h ILE 402 CO -0.01 0.41 0.07 0.40 0.00 0.00 0.00 178.15 179.02 1p2g h ILE 403 N 0.91 1.26 -0.59 -0.67 2.04 -0.73 -0.02 117.51 119.71 1p2g h ILE 403 Ca 0.16 -1.05 -0.03 0.00 1.00 0.00 0.00 64.86 64.95 1p2g h ILE 403 Cb 0.54 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.33 1p2g h ILE 403 CO 0.03 0.39 0.27 1.88 0.00 0.00 0.00 178.15 180.72 1p2g h TYR 404 N 0.95 0.87 -0.53 1.37 0.05 -0.94 0.00 116.97 118.74 1p2g h TYR 404 Ca 0.18 -0.05 -0.05 0.00 0.05 0.00 0.00 58.73 58.87 1p2g h TYR 404 Cb 0.47 -0.27 -0.02 0.00 1.01 0.00 0.00 36.73 37.92 1p2g h TYR 404 CO 0.03 0.68 0.16 1.49 -1.05 0.00 0.00 178.16 179.47 1p2g h GLU 405 N 0.81 0.83 -0.66 4.88 4.57 -1.04 -0.14 114.58 123.84 1p2g h GLU 405 Ca 0.20 -0.19 -0.00 0.00 -1.18 0.00 0.00 59.36 58.19 1p2g h GLU 405 Cb 0.15 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.59 1p2g h GLU 405 CO -0.02 0.77 0.40 0.82 -1.18 0.00 0.00 179.01 179.80 1p2g h ILE 406 N 0.74 1.19 -0.42 2.32 2.04 -0.69 -2.33 117.51 120.36 1p2g h ILE 406 Ca 0.17 -0.40 -0.02 0.00 1.00 0.00 0.00 64.86 65.61 1p2g h ILE 406 Cb 0.30 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.63 1p2g h ILE 406 CO -0.00 0.19 0.19 -1.13 0.00 0.00 0.00 178.15 177.40 1p2g h ASN 407 N 0.89 0.55 0.41 1.72 -1.24 -0.60 -1.34 115.58 115.96 1p2g h ASN 407 Ca 0.24 -0.14 -0.01 0.00 0.71 0.00 0.00 56.30 57.10 1p2g h ASN 407 Cb -0.04 -0.14 -0.03 0.00 0.73 0.00 0.00 38.32 38.84 1p2g h ASN 407 CO -0.05 0.53 -0.45 -0.61 -1.29 0.00 0.00 177.43 175.57 1p2g h GLN 408 N 0.53 -0.85 -0.04 6.67 5.75 -0.73 0.55 115.11 127.00 1p2g h GLN 408 Ca 0.14 0.06 -0.02 0.00 -0.15 0.00 0.00 58.65 58.68 1p2g h GLN 408 Cb 0.14 0.19 -0.00 0.00 1.07 0.00 0.00 27.48 28.87 1p2g h GLN 408 CO -0.02 -0.57 -0.09 0.00 -2.65 0.00 0.00 178.83 175.51 1p2g h ARG 409 N -0.88 0.06 -0.19 1.69 3.08 -1.41 -1.55 114.38 115.17 1p2g h ARG 409 Ca -0.04 -0.01 -0.13 0.00 0.07 0.00 0.00 59.98 59.87 1p2g h ARG 409 Cb 0.79 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.83 1p2g h ARG 409 CO -0.09 0.15 -0.39 0.35 -1.07 0.00 0.00 179.97 178.92 1p2g h PHE 410 N 0.06 0.76 0.00 3.04 3.57 -0.74 -2.93 116.94 120.70 1p2g h PHE 410 Ca 0.01 -0.28 -0.04 0.00 3.53 0.00 0.00 57.97 61.19 1p2g h PHE 410 Cb 0.19 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 1p2g h PHE 410 CO 0.00 1.03 -0.21 -0.07 -2.23 0.00 0.00 178.31 176.83 1p2g h LEU 411 N 0.28 0.00 -1.04 0.59 3.38 -0.52 -2.03 115.31 115.97 1p2g h LEU 411 Ca 0.01 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 1p2g h LEU 411 Cb 0.99 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.73 1p2g h LEU 411 CO 0.09 0.21 -0.40 0.78 0.09 0.00 0.00 178.44 179.21 1p2g h ASN 412 N 0.00 0.16 0.15 -0.43 -0.26 -1.21 0.04 115.58 114.03 1p2g h ASN 412 Ca -0.00 -0.06 -0.21 0.00 -0.56 0.00 0.00 56.30 55.47 1p2g h ASN 412 Cb 0.70 -0.04 0.00 0.00 -1.06 0.00 0.00 38.32 37.91 1p2g h ASN 412 CO 0.03 0.55 -0.79 -0.09 -1.06 0.00 0.00 177.43 176.06 1p2g h ARG 413 N 0.13 0.52 -0.20 0.81 2.43 -1.20 -2.27 114.38 114.60 1p2g h ARG 413 Ca 0.01 -0.45 -0.10 0.00 -0.81 0.00 0.00 59.98 58.63 1p2g h ARG 413 Cb 0.77 0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.42 1p2g h ARG 413 CO 0.06 1.09 -0.25 0.28 -1.51 0.00 0.00 179.97 179.64 1p2g h VAL 414 N 0.34 1.33 -0.80 0.20 2.07 -1.14 -2.28 116.25 115.98 1p2g h VAL 414 Ca -0.05 -1.43 0.03 0.00 0.82 0.00 0.00 66.70 66.06 1p2g h VAL 414 Cb 1.40 1.79 -0.04 0.00 -1.52 0.00 0.00 31.29 32.91 1p2g h VAL 414 CO 0.14 0.44 0.53 0.00 0.02 0.00 0.00 177.57 178.70 1p2g h ALA 415 N 0.63 1.49 -0.11 1.67 0.00 -0.99 0.28 119.26 122.22 1p2g h ALA 415 Ca 0.03 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.73 1p2g h ALA 415 Cb 0.81 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1p2g h ALA 415 CO 0.06 0.45 -0.62 0.00 0.00 0.00 0.00 179.25 179.14 1p2g h ALA 416 N 1.52 0.72 0.07 0.00 0.00 -1.31 -2.61 119.26 117.65 1p2g h ALA 416 Ca 0.31 -0.55 -0.26 0.00 0.00 0.00 0.00 54.91 54.41 1p2g h ALA 416 Cb -0.02 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1p2g h ALA 416 CO -0.08 0.72 -1.23 0.00 0.00 0.00 0.00 179.25 178.66 1p2g h ALA 417 N 1.03 0.25 -2.14 0.00 0.00 -0.80 -3.38 119.26 114.22 1p2g h ALA 417 Ca -0.01 -0.96 -0.58 0.00 0.00 0.00 0.00 54.91 53.35 1p2g h ALA 417 Cb 1.16 0.02 -0.41 0.00 0.00 0.00 0.00 17.79 18.56 1p2g h ALA 417 CO 0.11 1.13 -0.76 1.19 0.00 0.00 0.00 179.25 180.93 1p2g n PHE 418 N -3.43 2.52 -1.61 0.00 3.72 0.91 -5.10 117.46 114.48 1p2g n PHE 418 Ca -0.07 -3.97 -0.48 0.00 -0.05 0.00 0.00 57.45 52.87 1p2g n PHE 418 Cb 1.00 -0.49 -0.04 0.00 -0.94 0.00 0.00 39.48 39.00 1p2g n PHE 418 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1p2g n PRO 419 N 0.84 1.46 -0.09 -1.08 -0.02 -0.99 -1.86 135.00 133.26 1p2g n PRO 419 Ca 0.28 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 1p2g n PRO 419 Cb 0.45 -2.11 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 1p2g n PRO 419 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1p2g n GLY 420 N 2.30 2.19 2.66 -1.23 0.00 -1.26 -4.91 105.19 104.94 1p2g n GLY 420 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1p2g n GLY 420 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1p2g n ASP 421 N 0.00 4.95 -0.10 1.61 4.64 -0.78 -4.73 116.55 122.14 1p2g n ASP 421 Ca 0.00 -2.82 0.17 0.00 -1.38 0.00 0.00 54.79 50.76 1p2g n ASP 421 Cb 0.00 -1.62 0.57 0.00 -1.04 0.00 0.00 41.12 39.03 1p2g n ASP 421 CO 0.00 0.00 0.00 0.58 -0.82 0.00 0.00 177.20 176.96 1p2g h VAL 422 N 3.77 0.78 -0.35 5.18 2.07 -1.91 -1.88 116.25 123.91 1p2g h VAL 422 Ca 0.62 -0.09 -0.14 0.00 0.82 0.00 0.00 66.70 67.90 1p2g h VAL 422 Cb 0.57 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 1p2g h VAL 422 CO 1.84 0.05 -0.36 -0.78 0.02 0.00 0.00 177.57 178.34 1p2g h ASP 423 N 0.26 0.85 -0.96 0.57 3.58 -1.99 -2.89 116.42 115.84 1p2g h ASP 423 Ca 0.32 -0.37 0.04 0.00 0.42 0.00 0.00 57.03 57.44 1p2g h ASP 423 Cb 0.89 -0.24 -0.06 0.00 1.72 0.00 0.00 39.33 41.64 1p2g h ASP 423 CO -0.07 1.12 0.63 -0.09 -2.88 0.00 0.00 179.24 177.95 1p2g h ARG 424 N 0.67 1.16 -0.59 0.28 2.43 -1.74 -1.90 114.38 114.68 1p2g h ARG 424 Ca 0.06 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1p2g h ARG 424 Cb 0.92 -0.26 -0.03 0.00 -0.42 0.00 0.00 29.97 30.18 1p2g h ARG 424 CO 0.08 0.77 0.36 -0.07 -1.51 0.00 0.00 179.97 179.60 1p2g h LEU 425 N 1.19 0.70 -0.45 3.80 3.38 -1.39 -0.69 115.31 121.86 1p2g h LEU 425 Ca 0.39 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.27 1p2g h LEU 425 Cb 0.03 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1p2g h LEU 425 CO -0.12 0.55 0.15 0.03 0.09 0.00 0.00 178.44 179.14 1p2g h ARG 426 N 0.79 0.69 -0.55 1.13 3.08 -1.32 -1.65 114.38 116.55 1p2g h ARG 426 Ca 0.21 -0.14 -0.04 0.00 0.07 0.00 0.00 59.98 60.08 1p2g h ARG 426 Cb -0.02 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 29.90 1p2g h ARG 426 CO -0.04 0.65 0.16 0.00 -1.07 0.00 0.00 179.97 179.67 1p2g h ARG 427 N 0.58 0.83 0.00 0.04 3.08 -1.07 -3.15 114.38 114.69 1p2g h ARG 427 Ca 0.15 -0.16 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1p2g h ARG 427 Cb 0.24 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.16 1p2g h ARG 427 CO -0.01 0.73 -0.80 0.52 -1.07 0.00 0.00 179.97 179.34 1p2g h MET 428 N 0.81 0.00 -6.47 0.04 2.86 -1.03 -3.48 114.93 107.66 1p2g h MET 428 Ca 0.18 0.00 -0.60 0.00 -2.06 0.00 0.00 59.70 57.22 1p2g h MET 428 Cb 0.25 0.00 0.12 0.00 0.06 0.00 0.00 31.60 32.04 1p2g h MET 428 CO -0.01 0.00 0.03 0.45 1.06 0.00 0.00 176.91 178.44 1p2g n SER 429 N -2.46 0.84 0.23 1.22 2.88 -0.63 -4.83 113.62 110.87 1p2g n SER 429 Ca 0.02 1.10 0.12 0.00 -1.33 0.00 0.00 58.87 58.78 1p2g n SER 429 Cb 0.50 -1.26 0.38 0.00 -0.75 0.00 0.00 64.21 63.08 1p2g n SER 429 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1p2g h LEU 430 N 1.66 0.00 -9.10 2.46 3.38 -1.91 -3.42 115.31 108.37 1p2g h LEU 430 Ca -0.40 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 56.96 1p2g h LEU 430 Cb 1.35 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.97 1p2g h LEU 430 CO 0.58 0.12 -0.35 -0.69 0.09 0.00 0.00 178.44 178.19 1p2g s VAL 431 N -3.43 5.28 -0.23 1.22 1.01 -1.26 -0.24 120.40 122.75 1p2g s VAL 431 Ca 0.03 0.45 -0.09 0.00 0.00 0.00 0.00 61.98 62.37 1p2g s VAL 431 Cb 0.08 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.80 1p2g s VAL 431 CO 0.63 0.29 0.12 -1.61 0.00 0.00 0.00 175.10 174.54 1p2g s GLU 432 N 1.23 3.98 0.87 2.72 2.02 -0.14 -4.98 118.70 124.39 1p2g s GLU 432 Ca 0.13 -0.32 -0.14 0.00 0.02 0.00 0.00 54.97 54.66 1p2g s GLU 432 Cb -0.14 -3.43 0.13 0.00 0.10 0.00 0.00 34.13 30.79 1p2g s GLU 432 CO 0.06 0.07 1.24 -1.21 0.02 0.00 0.00 175.26 175.44 1p2g s GLU 433 N 0.99 1.43 0.00 1.61 0.41 -1.26 -2.19 118.70 119.70 1p2g s GLU 433 Ca 0.06 -0.10 0.00 0.00 -0.41 0.00 0.00 54.97 54.52 1p2g s GLU 433 Cb -0.14 -1.91 0.00 0.00 -1.78 0.00 0.00 34.13 30.31 1p2g s GLU 433 CO 0.04 -1.93 0.00 0.41 -0.49 0.00 0.00 175.26 173.29 1p2g n GLY 434 N -3.50 0.90 0.24 -1.39 0.00 -1.26 -4.84 105.19 95.35 1p2g n GLY 434 Ca 0.11 -2.00 0.02 0.00 0.00 0.00 0.00 46.02 44.15 1p2g n GLY 434 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p2g h ALA 435 N 0.00 0.65 -3.19 4.61 0.00 -2.07 -3.35 119.26 115.92 1p2g h ALA 435 Ca 0.00 0.20 -0.67 0.00 0.00 0.00 0.00 54.91 54.44 1p2g h ALA 435 Cb 0.00 0.34 -0.33 0.00 0.00 0.00 0.00 17.79 17.79 1p2g h ALA 435 CO 0.00 -0.39 -0.81 0.08 0.00 0.00 0.00 179.25 178.13 1p2g s VAL 436 N -6.14 2.47 0.17 0.00 1.01 -1.26 -5.10 120.40 111.55 1p2g s VAL 436 Ca -0.13 -0.96 -0.30 0.00 0.00 0.00 0.00 61.98 60.58 1p2g s VAL 436 Cb 0.20 -2.15 -0.08 0.00 0.00 0.00 0.00 36.38 34.34 1p2g s VAL 436 CO 0.74 0.38 1.25 -0.54 0.00 0.00 0.00 175.10 176.93 1p2g s LYS 437 N 1.31 4.44 0.22 2.72 1.02 -1.26 -4.84 119.74 123.34 1p2g s LYS 437 Ca 0.02 1.94 0.04 0.00 0.02 0.00 0.00 55.97 57.99 1p2g s LYS 437 Cb -0.15 -3.24 -0.05 0.00 -0.52 0.00 0.00 37.83 33.87 1p2g s LYS 437 CO -0.09 -0.19 -0.03 1.03 -0.92 0.00 0.00 175.35 175.15 1p2g s ARG 438 N 0.08 1.30 -0.16 1.68 0.52 -0.93 -0.65 118.95 120.78 1p2g s ARG 438 Ca 0.56 -1.63 -0.02 0.00 -0.52 0.00 0.00 55.73 54.11 1p2g s ARG 438 Cb -0.34 -0.67 -0.02 0.00 0.52 0.00 0.00 34.95 34.44 1p2g s ARG 438 CO 0.36 -0.04 -0.07 0.42 0.02 0.00 0.00 175.30 175.98 1p2g s ILE 439 N -3.36 3.44 -0.52 1.52 -1.09 -0.04 -0.97 121.20 120.19 1p2g s ILE 439 Ca 0.26 -0.51 -0.22 0.00 -2.23 0.00 0.00 60.65 57.95 1p2g s ILE 439 Cb 0.05 -2.50 0.05 0.00 -1.58 0.00 0.00 42.46 38.48 1p2g s ILE 439 CO 0.07 0.49 0.79 0.21 -1.23 0.00 0.00 174.94 175.27 1p2g s ASN 440 N 0.62 6.29 0.37 3.58 3.84 0.67 -2.08 114.94 128.24 1p2g s ASN 440 Ca -0.05 -0.59 0.09 0.00 0.21 0.00 0.00 52.86 52.53 1p2g s ASN 440 Cb -0.15 -2.37 0.73 0.00 -0.55 0.00 0.00 41.25 38.91 1p2g s ASN 440 CO 0.03 -1.06 1.87 0.24 -2.79 0.00 0.00 177.10 175.39 1p2g h MET 441 N 9.15 0.21 -0.28 0.43 2.86 -1.78 -2.19 114.93 123.33 1p2g h MET 441 Ca -0.27 -0.06 -0.08 0.00 -2.06 0.00 0.00 59.70 57.24 1p2g h MET 441 Cb 1.08 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.71 1p2g h MET 441 CO 1.02 0.41 -0.16 0.00 1.06 0.00 0.00 176.91 179.24 1p2g h ALA 442 N 1.61 1.21 -0.16 6.32 0.00 -1.91 -0.39 119.26 125.94 1p2g h ALA 442 Ca 0.03 -0.29 -0.17 0.00 0.00 0.00 0.00 54.91 54.49 1p2g h ALA 442 Cb 0.47 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1p2g h ALA 442 CO 0.03 0.51 -0.60 0.45 0.00 0.00 0.00 179.25 179.64 1p2g h HIS 443 N 0.44 0.67 -0.66 0.00 3.86 -1.80 -2.34 115.15 115.32 1p2g h HIS 443 Ca 0.08 -0.25 -0.02 0.00 -1.16 0.00 0.00 60.37 59.01 1p2g h HIS 443 Cb 0.54 -0.12 -0.03 0.00 1.06 0.00 0.00 27.41 28.86 1p2g h HIS 443 CO 0.02 0.99 0.33 1.25 0.86 0.00 0.00 177.93 181.38 1p2g h LEU 444 N 0.39 0.85 -0.29 2.43 6.46 -0.82 -2.10 115.31 122.23 1p2g h LEU 444 Ca -0.00 -0.12 -0.03 0.00 -0.12 0.00 0.00 57.88 57.60 1p2g h LEU 444 Cb 1.15 -0.22 -0.01 0.00 -0.73 0.00 0.00 40.66 40.85 1p2g h LEU 444 CO 0.11 0.73 0.05 0.00 -0.62 0.00 0.00 178.44 178.70 1p2g h ILE 446 N 0.30 1.11 -0.71 0.00 2.04 -1.33 -1.86 117.51 117.07 1p2g h ILE 446 Ca 0.09 -0.21 -0.03 0.00 1.00 0.00 0.00 64.86 65.70 1p2g h ILE 446 Cb 0.34 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 36.93 1p2g h ILE 446 CO 0.01 0.11 0.31 0.00 0.00 0.00 0.00 178.15 178.58 1p2g h ALA 447 N 1.13 0.92 -0.51 1.87 0.00 -1.30 -3.16 119.26 118.21 1p2g h ALA 447 Ca 0.14 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1p2g h ALA 447 Cb -0.05 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.47 1p2g h ALA 447 CO -0.03 0.51 0.00 0.41 0.00 0.00 0.00 179.25 180.14 1p2g n GLY 448 N -0.91 2.06 3.28 0.00 0.00 -0.52 -4.92 105.19 104.17 1p2g n GLY 448 Ca 0.06 -0.65 -0.25 0.00 0.00 0.00 0.00 46.02 45.18 1p2g n GLY 448 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1p2g s SER 449 N -0.82 2.59 0.00 1.61 0.01 -0.72 -3.92 113.70 112.45 1p2g s SER 449 Ca 0.39 -0.63 0.27 0.00 1.31 0.00 0.00 55.95 57.29 1p2g s SER 449 Cb 0.25 -0.17 0.86 0.00 0.21 0.00 0.00 66.02 67.16 1p2g s SER 449 CO 0.20 0.11 1.64 0.00 0.41 0.00 0.00 173.24 175.60 1p2g n HIS 450 N 1.38 0.00 -3.75 2.43 1.44 -0.71 -4.84 115.22 111.16 1p2g n HIS 450 Ca -0.18 0.00 -0.12 0.00 -2.01 0.00 0.00 57.72 55.40 1p2g n HIS 450 Cb 0.53 -0.24 -0.12 0.00 0.12 0.00 0.00 29.99 30.29 1p2g n HIS 450 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1p2g s ALA 451 N -2.75 -0.74 -0.08 1.59 0.00 -1.26 -4.51 121.76 114.01 1p2g s ALA 451 Ca 0.19 0.96 -0.00 0.00 0.00 0.00 0.00 51.96 53.11 1p2g s ALA 451 Cb 0.19 -0.57 0.02 0.00 0.00 0.00 0.00 23.12 22.76 1p2g s ALA 451 CO 0.58 -0.17 -0.05 0.08 0.00 0.00 0.00 175.76 176.20 1p2g s VAL 452 N 0.55 0.74 0.10 0.00 1.01 0.54 -0.67 120.40 122.67 1p2g s VAL 452 Ca -0.03 -0.14 0.08 0.00 0.00 0.00 0.00 61.98 61.89 1p2g s VAL 452 Cb -0.05 -0.80 -0.03 0.00 0.00 0.00 0.00 36.38 35.50 1p2g s VAL 452 CO -0.03 0.31 -0.20 0.54 0.00 0.00 0.00 175.10 175.72 1p2g s ASN 453 N 1.60 2.41 0.64 3.32 4.22 -0.60 -0.54 114.94 125.99 1p2g s ASN 453 Ca 0.01 -0.68 0.02 0.00 -2.14 0.00 0.00 52.86 50.06 1p2g s ASN 453 Cb -0.13 -0.13 0.09 0.00 1.28 0.00 0.00 41.25 42.36 1p2g s ASN 453 CO -0.05 0.03 0.88 -0.83 -2.04 0.00 0.00 177.10 175.10 1p2g s GLY 454 N -1.92 1.78 0.00 0.45 0.00 -0.80 -1.50 107.32 105.34 1p2g s GLY 454 Ca 0.06 -1.66 0.11 0.00 0.00 0.00 0.00 44.72 43.22 1p2g s GLY 454 CO 0.04 -1.21 1.18 3.33 0.00 0.00 0.00 173.10 176.44 1p2g n VAL 455 N -2.56 0.78 -3.57 1.40 0.24 -1.26 -2.32 118.33 111.04 1p2g n VAL 455 Ca 0.13 -0.89 -0.15 0.00 -2.04 0.00 0.00 64.34 61.39 1p2g n VAL 455 Cb 0.60 0.66 -0.06 0.00 -1.47 0.00 0.00 33.84 33.57 1p2g n VAL 455 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1p2g s ALA 456 N -0.99 -1.81 0.20 2.33 0.00 -1.26 -1.06 121.76 119.15 1p2g s ALA 456 Ca 0.22 1.62 -0.16 0.00 0.00 0.00 0.00 51.96 53.63 1p2g s ALA 456 Cb 0.12 -0.57 0.18 0.00 0.00 0.00 0.00 23.12 22.85 1p2g s ALA 456 CO 0.16 -0.34 1.62 -0.09 0.00 0.00 0.00 175.76 177.11 1p2g h ARG 457 N 3.64 -0.07 -0.39 0.00 2.43 -1.91 0.35 114.38 118.44 1p2g h ARG 457 Ca -0.27 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 58.86 1p2g h ARG 457 Cb 1.15 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.70 1p2g h ARG 457 CO 0.25 -0.05 0.04 0.97 -1.51 0.00 0.00 179.97 179.68 1p2g h ILE 458 N -0.07 1.20 -0.36 1.20 2.10 -1.91 -1.70 117.51 117.97 1p2g h ILE 458 Ca 0.27 -0.76 -0.11 0.00 1.08 0.00 0.00 64.86 65.33 1p2g h ILE 458 Cb 0.49 0.85 -0.01 0.00 -1.09 0.00 0.00 36.82 37.06 1p2g h ILE 458 CO -0.63 0.27 -0.22 -0.74 -1.08 0.00 0.00 178.15 175.75 1p2g h HIS 459 N 0.58 0.92 -0.35 2.19 2.76 -1.38 -2.17 115.15 117.71 1p2g h HIS 459 Ca 0.13 -0.24 -0.07 0.00 -2.20 0.00 0.00 60.37 57.99 1p2g h HIS 459 Cb 0.30 -0.21 -0.02 0.00 1.55 0.00 0.00 27.41 29.04 1p2g h HIS 459 CO 0.01 1.00 -0.08 0.77 -1.30 0.00 0.00 177.93 178.33 1p2g h SER 460 N 0.58 0.56 -0.22 3.26 0.02 -0.65 -1.83 113.55 115.27 1p2g h SER 460 Ca 0.08 -0.14 -0.16 0.00 -0.84 0.00 0.00 61.79 60.73 1p2g h SER 460 Cb 0.78 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 63.17 1p2g h SER 460 CO 0.06 0.68 -0.46 -0.33 -1.14 0.00 0.00 176.83 175.65 1p2g h GLU 461 N 0.54 0.79 -0.09 3.45 4.39 -1.24 -2.75 114.58 119.67 1p2g h GLU 461 Ca 0.10 -0.45 -0.06 0.00 0.34 0.00 0.00 59.36 59.30 1p2g h GLU 461 Cb 0.47 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 1p2g h GLU 461 CO 0.02 1.08 -0.20 0.82 -1.16 0.00 0.00 179.01 179.57 1p2g h ILE 462 N 0.63 1.19 -0.43 3.13 2.04 -1.03 -0.16 117.51 122.87 1p2g h ILE 462 Ca 0.04 -0.89 -0.12 0.00 1.00 0.00 0.00 64.86 64.90 1p2g h ILE 462 Cb 1.03 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 38.45 1p2g h ILE 462 CO 0.10 0.27 -0.19 -0.07 0.00 0.00 0.00 178.15 178.25 1p2g h LEU 463 N 0.14 0.86 -0.23 1.44 3.38 -1.14 -0.34 115.31 119.42 1p2g h LEU 463 Ca 0.02 -0.30 -0.12 0.00 0.09 0.00 0.00 57.88 57.57 1p2g h LEU 463 Cb 0.44 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1p2g h LEU 463 CO 0.03 1.03 -0.57 0.11 0.09 0.00 0.00 178.44 179.14 1p2g h LYS 464 N 0.75 0.00 0.00 1.13 1.57 -1.11 -0.74 116.57 118.17 1p2g h LYS 464 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1p2g h LYS 464 Cb 0.72 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.03 1p2g h LYS 464 CO 0.06 0.57 -1.30 1.63 -0.57 0.00 0.00 179.45 179.83 1p2g n LYS 465 N -3.33 0.39 0.00 3.15 5.02 -0.13 -3.99 118.16 119.27 1p2g n LYS 465 Ca 0.01 -0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 1p2g n LYS 465 Cb 0.72 -1.59 0.00 0.00 -0.02 0.00 0.00 35.03 34.14 1p2g n LYS 465 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1p2g n THR 466 N -2.06 0.00 -0.31 -0.18 -1.04 -0.15 -4.76 114.28 105.78 1p2g n THR 466 Ca 0.00 0.00 0.14 0.00 -2.04 0.00 0.00 64.05 62.15 1p2g n THR 466 Cb 0.47 0.00 0.29 0.00 -1.82 0.00 0.00 70.33 69.27 1p2g n THR 466 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1p2g h ILE 467 N 0.00 0.18 -0.12 12.58 1.08 -1.70 -2.16 117.51 127.38 1p2g h ILE 467 Ca 0.00 -0.03 -0.05 0.00 -0.39 0.00 0.00 64.86 64.39 1p2g h ILE 467 Cb 0.00 0.07 -0.03 0.00 -3.07 0.00 0.00 36.82 33.79 1p2g h ILE 467 CO 0.00 0.02 -0.24 0.49 -0.69 0.00 0.00 178.15 177.73 1p2g n PHE 468 N -5.35 0.37 -0.17 1.37 0.99 -0.29 -4.78 117.46 109.61 1p2g n PHE 468 Ca 0.22 -1.37 -0.02 0.00 -0.00 0.00 0.00 57.45 56.28 1p2g n PHE 468 Cb 0.72 -0.30 0.07 0.00 -1.00 0.00 0.00 39.48 38.96 1p2g n PHE 468 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.76 176.54 1p2g h LYS 469 N 0.86 0.12 -0.57 -1.08 3.64 -1.40 0.57 116.57 118.72 1p2g h LYS 469 Ca 0.06 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.46 1p2g h LYS 469 Cb 1.22 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.97 1p2g h LYS 469 CO 0.12 0.08 0.34 -0.44 -2.27 0.00 0.00 179.45 177.28 1p2g h ASP 470 N 0.13 0.54 -0.55 4.20 3.32 -1.86 -1.42 116.42 120.77 1p2g h ASP 470 Ca 0.26 0.01 -0.11 0.00 0.02 0.00 0.00 57.03 57.21 1p2g h ASP 470 Cb 0.40 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.83 1p2g h ASP 470 CO -0.43 0.37 -0.09 -0.26 -1.72 0.00 0.00 179.24 177.11 1p2g h PHE 471 N 0.66 1.15 -0.95 4.55 0.04 -1.75 -2.43 116.94 118.21 1p2g h PHE 471 Ca 0.23 -0.23 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1p2g h PHE 471 Cb 0.05 -0.29 -0.05 0.00 2.20 0.00 0.00 35.95 37.86 1p2g h PHE 471 CO -0.07 1.06 0.61 -0.92 -0.60 0.00 0.00 178.31 178.39 1p2g h TYR 472 N 0.91 1.22 0.00 -0.55 3.20 -0.47 0.57 116.97 121.85 1p2g h TYR 472 Ca 0.14 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 61.92 1p2g h TYR 472 Cb 0.66 -0.41 -0.02 0.00 1.54 0.00 0.00 36.73 38.51 1p2g h TYR 472 CO 0.05 0.79 -0.51 0.93 -1.64 0.00 0.00 178.16 177.77 1p2g h GLU 473 N 1.30 0.00 0.02 1.82 5.08 -1.10 0.12 114.58 121.82 1p2g h GLU 473 Ca 0.35 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.47 1p2g h GLU 473 Cb -0.11 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.16 1p2g h GLU 473 CO -0.07 0.51 -0.92 1.25 -1.00 0.00 0.00 179.01 178.78 1p2g h LEU 474 N 0.00 0.77 -5.95 1.33 7.12 -0.90 -3.40 115.31 114.29 1p2g h LEU 474 Ca -0.01 -0.76 -0.54 0.00 0.13 0.00 0.00 57.88 56.70 1p2g h LEU 474 Cb 0.92 -0.24 -0.37 0.00 -0.53 0.00 0.00 40.66 40.44 1p2g h LEU 474 CO 0.07 1.44 -1.07 -0.62 -0.13 0.00 0.00 178.44 178.13 1p2g n GLU 475 N -3.98 0.70 0.00 1.25 1.02 0.13 -4.98 120.64 114.79 1p2g n GLU 475 Ca -0.11 -3.13 0.22 0.00 -0.02 0.00 0.00 57.16 54.12 1p2g n GLU 475 Cb 0.83 -1.24 0.72 0.00 -0.02 0.00 0.00 31.44 31.74 1p2g n GLU 475 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1p2g h PRO 476 N 4.04 0.00 0.00 3.49 0.13 -0.97 -2.14 132.00 136.54 1p2g h PRO 476 Ca 0.06 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.15 1p2g h PRO 476 Cb 0.89 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.01 1p2g h PRO 476 CO 0.45 0.00 -0.17 1.12 -0.23 0.00 0.00 178.00 179.17 1p2g h HIS 477 N 0.00 0.00 -0.00 1.56 2.07 -1.94 -3.13 115.15 113.71 1p2g h HIS 477 Ca 0.26 0.00 -0.12 0.00 -2.85 0.00 0.00 60.37 57.67 1p2g h HIS 477 Cb 1.18 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.14 1p2g h HIS 477 CO 0.00 0.17 -0.55 0.87 -3.07 0.00 0.00 177.93 175.35 1p2g h LYS 478 N 0.00 0.01 -6.35 5.12 1.57 -1.61 -3.45 116.57 111.85 1p2g h LYS 478 Ca -0.00 -0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.23 1p2g h LYS 478 Cb 0.39 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.68 1p2g h LYS 478 CO 0.02 0.56 0.38 -0.06 -0.57 0.00 0.00 179.45 179.79 1p2g s PHE 479 N -3.76 3.63 0.26 -1.35 0.08 -1.19 -0.34 117.98 115.30 1p2g s PHE 479 Ca -0.02 1.65 0.01 0.00 0.12 0.00 0.00 56.93 58.69 1p2g s PHE 479 Cb 0.13 -3.11 -0.03 0.00 -0.57 0.00 0.00 43.02 39.44 1p2g s PHE 479 CO 0.75 -0.04 0.22 -0.65 -0.10 0.00 0.00 175.22 175.40 1p2g s GLN 480 N 1.18 1.46 0.02 0.44 -0.21 0.30 -4.94 119.66 117.90 1p2g s GLN 480 Ca 0.50 -1.76 0.06 0.00 0.02 0.00 0.00 55.36 54.19 1p2g s GLN 480 Cb -0.20 0.31 -0.02 0.00 1.00 0.00 0.00 33.01 34.10 1p2g s GLN 480 CO 0.25 -0.52 -0.19 1.21 -2.12 0.00 0.00 175.29 173.93 1p2g s ASN 481 N -3.23 2.24 -0.39 5.90 3.84 -1.26 -1.90 114.94 120.14 1p2g s ASN 481 Ca 0.38 -0.44 0.03 0.00 0.21 0.00 0.00 52.86 53.04 1p2g s ASN 481 Cb 0.05 -0.20 0.16 0.00 -0.55 0.00 0.00 41.25 40.70 1p2g s ASN 481 CO 0.18 0.17 0.37 -0.54 -2.79 0.00 0.00 177.10 174.49 1p2g s LYS 482 N -0.90 0.71 0.24 0.43 -0.14 -0.98 -4.91 119.74 114.19 1p2g s LYS 482 Ca 0.06 -1.19 -0.31 0.00 -1.36 0.00 0.00 55.97 53.17 1p2g s LYS 482 Cb -0.08 -0.89 -0.12 0.00 -1.68 0.00 0.00 37.83 35.05 1p2g s LYS 482 CO 0.01 -1.25 1.59 2.41 -0.76 0.00 0.00 175.35 177.35 1p2g n THR 483 N 3.83 0.59 -0.68 2.17 -1.04 -1.26 -4.34 114.28 113.56 1p2g n THR 483 Ca 0.15 -0.15 -0.29 0.00 -2.04 0.00 0.00 64.05 61.73 1p2g n THR 483 Cb 0.45 -1.79 0.22 0.00 -1.82 0.00 0.00 70.33 67.38 1p2g n THR 483 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1p2g s ASN 484 N 0.69 1.71 0.30 8.00 0.02 -0.23 -4.66 114.94 120.77 1p2g s ASN 484 Ca 0.70 1.64 -0.14 0.00 -1.02 0.00 0.00 52.86 54.05 1p2g s ASN 484 Cb -0.56 -2.33 0.02 0.00 0.02 0.00 0.00 41.25 38.40 1p2g s ASN 484 CO 0.43 -3.77 0.61 -0.83 0.02 0.00 0.00 177.10 173.56 1p2g s GLY 485 N -2.69 0.49 0.12 0.66 0.00 -1.26 -4.81 107.32 99.83 1p2g s GLY 485 Ca 0.67 -0.80 0.06 0.00 0.00 0.00 0.00 44.72 44.65 1p2g s GLY 485 CO 0.62 -0.47 -0.15 -0.26 0.00 0.00 0.00 173.10 172.84 1p2g s ILE 486 N -3.44 1.38 -0.12 0.90 -4.36 0.29 -4.45 121.20 111.40 1p2g s ILE 486 Ca 0.19 -1.70 -0.29 0.00 -0.26 0.00 0.00 60.65 58.59 1p2g s ILE 486 Cb -0.03 -1.53 -0.01 0.00 1.25 0.00 0.00 42.46 42.14 1p2g s ILE 486 CO 0.11 -0.38 0.98 0.28 0.24 0.00 0.00 174.94 176.18 1p2g s THR 487 N -2.03 4.79 -0.83 8.37 -1.32 -1.26 -1.32 115.64 122.05 1p2g s THR 487 Ca 0.09 1.99 0.18 0.00 -1.21 0.00 0.00 61.69 62.73 1p2g s THR 487 Cb -0.06 -4.29 0.16 0.00 -1.51 0.00 0.00 72.50 66.81 1p2g s THR 487 CO 0.03 0.00 1.56 -0.81 -2.21 0.00 0.00 174.62 173.19 1p2g n PRO 488 N 5.07 0.06 0.09 7.08 -0.04 -1.26 -1.74 135.00 144.27 1p2g n PRO 488 Ca 0.08 0.30 -0.04 0.00 -0.04 0.00 0.00 63.50 63.80 1p2g n PRO 488 Cb 0.49 -1.62 -0.02 0.00 -0.04 0.00 0.00 33.50 32.31 1p2g n PRO 488 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1p2g h ARG 489 N 0.00 -0.26 -0.37 0.54 -0.00 -1.91 -2.57 114.38 109.82 1p2g h ARG 489 Ca 0.00 0.02 -0.07 0.00 -0.50 0.00 0.00 59.98 59.43 1p2g h ARG 489 Cb 0.30 0.06 -0.01 0.00 0.00 0.00 0.00 29.97 30.31 1p2g h ARG 489 CO 0.00 -0.17 -0.03 -0.09 0.00 0.00 0.00 179.97 179.68 1p2g h ARG 490 N -0.49 0.66 -0.18 0.04 2.43 -1.97 -0.16 114.38 114.71 1p2g h ARG 490 Ca -0.03 -0.23 0.00 0.00 -0.81 0.00 0.00 59.98 58.92 1p2g h ARG 490 Cb 0.20 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 1p2g h ARG 490 CO 0.04 0.79 0.00 0.91 -1.51 0.00 0.00 179.97 180.20 1p2g n TRP 491 N -4.45 0.08 0.00 2.20 7.02 -0.71 -2.63 117.44 118.95 1p2g n TRP 491 Ca -0.02 -0.04 0.00 0.00 -1.02 0.00 0.00 57.50 56.43 1p2g n TRP 491 Cb 0.30 -0.02 0.00 0.00 -2.42 0.00 0.00 31.31 29.17 1p2g n TRP 491 CO 0.00 0.00 0.00 -0.11 -2.02 0.00 0.00 177.69 175.56 1p2g n LEU 492 N -0.29 0.00 0.01 -0.99 7.94 -1.00 -4.81 117.00 117.86 1p2g n LEU 492 Ca 0.02 0.00 -0.10 0.00 -1.11 0.00 0.00 56.01 54.82 1p2g n LEU 492 Cb 0.08 0.18 -0.03 0.00 0.53 0.00 0.00 43.42 44.18 1p2g n LEU 492 CO 0.01 -0.45 0.76 0.58 -1.11 0.00 0.00 177.39 177.18 1p2g h VAL 493 N 0.00 0.59 0.04 1.96 2.07 -1.21 0.48 116.25 120.19 1p2g h VAL 493 Ca 0.00 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 1p2g h VAL 493 Cb 0.00 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1p2g h VAL 493 CO 0.00 0.00 -0.02 0.25 0.02 0.00 0.00 177.57 177.82 1p2g h LEU 494 N -0.21 -0.05 0.00 2.57 6.46 -1.15 -3.08 115.31 119.85 1p2g h LEU 494 Ca 0.08 -0.34 0.00 0.00 -0.12 0.00 0.00 57.88 57.50 1p2g h LEU 494 Cb 0.33 0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.27 1p2g h LEU 494 CO -0.22 0.32 -0.59 0.00 -0.62 0.00 0.00 178.44 177.33 1p2g n ASN 496 N -2.01 0.27 0.12 0.00 2.85 0.17 -4.85 115.26 111.81 1p2g n ASN 496 Ca 0.04 -3.01 0.10 0.00 -0.11 0.00 0.00 54.58 51.60 1p2g n ASN 496 Cb 0.42 -0.32 0.59 0.00 1.24 0.00 0.00 39.78 41.72 1p2g n ASN 496 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1p2g h PRO 497 N 3.27 0.15 -0.70 1.20 0.13 -1.60 -1.61 132.00 132.85 1p2g h PRO 497 Ca 0.07 -0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 65.12 1p2g h PRO 497 Cb 0.96 -0.03 -0.03 0.00 0.13 0.00 0.00 31.00 32.03 1p2g h PRO 497 CO 0.45 0.10 0.18 0.78 -0.23 0.00 0.00 178.00 179.28 1p2g h GLY 498 N 0.15 1.19 1.54 1.56 0.00 -1.90 -0.78 103.07 104.83 1p2g h GLY 498 Ca 0.11 -0.73 -0.23 0.00 0.00 0.00 0.00 47.33 46.48 1p2g h GLY 498 CO -0.02 0.68 -0.98 -2.00 0.00 0.00 0.00 176.54 174.23 1p2g h LEU 499 N 1.04 0.53 -0.94 3.11 5.85 -1.73 -2.95 115.31 120.22 1p2g h LEU 499 Ca 0.22 -0.44 -0.03 0.00 0.84 0.00 0.00 57.88 58.46 1p2g h LEU 499 Cb 0.35 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.18 1p2g h LEU 499 CO -0.00 1.25 0.34 0.00 -0.34 0.00 0.00 178.44 179.69 1p2g h ALA 500 N 0.71 1.16 0.52 1.25 0.00 -1.13 -2.72 119.26 119.05 1p2g h ALA 500 Ca -0.09 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 1p2g h ALA 500 Cb 1.63 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 19.12 1p2g h ALA 500 CO 0.17 0.62 -0.25 1.49 0.00 0.00 0.00 179.25 181.28 1p2g h GLU 501 N 1.09 -0.67 -0.06 0.00 4.57 -1.14 -1.08 114.58 117.28 1p2g h GLU 501 Ca 0.26 0.05 0.02 0.00 -1.18 0.00 0.00 59.36 58.50 1p2g h GLU 501 Cb 0.15 0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 28.89 1p2g h GLU 501 CO -0.03 -0.37 0.10 -0.84 -1.18 0.00 0.00 179.01 176.70 1p2g h ILE 502 N -1.01 0.32 0.22 2.32 3.07 -1.52 0.17 117.51 121.08 1p2g h ILE 502 Ca -0.07 0.00 -0.30 0.00 1.55 0.00 0.00 64.86 66.04 1p2g h ILE 502 Cb 0.62 0.91 0.03 0.00 -0.27 0.00 0.00 36.82 38.11 1p2g h ILE 502 CO 0.12 0.00 -1.33 0.40 -1.05 0.00 0.00 178.15 176.29 1p2g h ILE 503 N 0.00 1.30 -0.50 0.16 2.04 -1.42 -3.29 117.51 115.81 1p2g h ILE 503 Ca 0.03 -2.63 -0.04 0.00 1.00 0.00 0.00 64.86 63.22 1p2g h ILE 503 Cb 0.24 3.05 -0.02 0.00 -0.74 0.00 0.00 36.82 39.34 1p2g h ILE 503 CO -0.00 0.79 0.14 0.00 0.00 0.00 0.00 178.15 179.08 1p2g h ALA 504 N 0.12 1.32 -0.18 1.87 0.00 0.30 -1.86 119.26 120.82 1p2g h ALA 504 Ca -0.24 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.55 1p2g h ALA 504 Cb 2.01 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.59 1p2g h ALA 504 CO 0.23 0.49 0.22 0.93 0.00 0.00 0.00 179.25 181.12 1p2g h GLU 505 N 0.72 0.00 0.00 0.00 5.08 -0.82 0.14 114.58 119.70 1p2g h GLU 505 Ca 0.16 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.25 1p2g h GLU 505 Cb 0.24 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.44 1p2g h GLU 505 CO -0.01 0.00 -2.03 0.54 -1.00 0.00 0.00 179.01 176.52 1p2g n ARG 506 N -3.68 0.45 -0.03 2.33 5.12 -0.92 -4.77 116.66 115.16 1p2g n ARG 506 Ca 0.02 0.11 0.03 0.00 -1.93 0.00 0.00 57.85 56.07 1p2g n ARG 506 Cb 0.34 -1.36 0.04 0.00 -1.16 0.00 0.00 32.46 30.32 1p2g n ARG 506 CO 0.00 0.00 0.00 0.44 -1.93 0.00 0.00 177.63 176.14 1p2g n ILE 507 N -3.04 0.35 -0.83 0.55 -5.35 -0.75 -5.13 119.36 105.17 1p2g n ILE 507 Ca -0.32 -0.68 0.00 0.00 -0.27 0.00 0.00 62.75 61.48 1p2g n ILE 507 Cb 0.84 0.90 0.00 0.00 -1.74 0.00 0.00 39.64 39.64 1p2g n ILE 507 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1p2g n GLY 508 N 0.19 -2.63 0.89 3.28 0.00 0.47 -4.64 105.19 102.75 1p2g n GLY 508 Ca 0.04 -1.86 0.08 0.00 0.00 0.00 0.00 46.02 44.28 1p2g n GLY 508 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1p2g n GLU 509 N -0.17 2.58 0.20 1.61 1.02 -1.26 -4.08 120.64 120.54 1p2g n GLU 509 Ca 0.00 -2.18 0.06 0.00 -0.02 0.00 0.00 57.16 55.02 1p2g n GLU 509 Cb 0.00 -1.38 0.43 0.00 -0.02 0.00 0.00 31.44 30.47 1p2g n GLU 509 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1p2g h GLU 510 N 2.98 0.00 -0.06 3.49 5.08 -1.96 -3.12 114.58 120.99 1p2g h GLU 510 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1p2g h GLU 510 Cb 0.81 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.06 1p2g h GLU 510 CO 0.00 0.32 -0.01 0.10 -1.00 0.00 0.00 179.01 178.42 1p2g h TYR 511 N 0.00 0.08 -1.08 4.33 -0.00 -1.81 -2.69 116.97 115.80 1p2g h TYR 511 Ca -0.00 -0.00 0.31 0.00 -0.00 0.00 0.00 58.73 59.04 1p2g h TYR 511 Cb 0.70 -0.03 -0.05 0.00 -0.00 0.00 0.00 36.73 37.35 1p2g h TYR 511 CO 0.00 0.11 0.77 0.82 -0.00 0.00 0.00 178.16 179.86 1p2g h ILE 512 N 0.09 0.46 -0.03 -0.90 2.04 -1.90 0.40 117.51 117.67 1p2g h ILE 512 Ca 0.02 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.87 1p2g h ILE 512 Cb 0.09 0.42 0.00 0.00 -0.74 0.00 0.00 36.82 36.58 1p2g h ILE 512 CO 0.00 0.01 0.00 -1.54 0.00 0.00 0.00 178.15 176.62 1p2g n SER 513 N -4.25 2.30 -2.78 1.72 3.41 -1.03 -4.65 113.62 108.33 1p2g n SER 513 Ca 0.23 -2.56 -0.08 0.00 -0.26 0.00 0.00 58.87 56.21 1p2g n SER 513 Cb 1.12 -0.24 0.03 0.00 -0.26 0.00 0.00 64.21 64.87 1p2g n SER 513 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1p2g n ASP 514 N -0.89 -2.91 0.25 4.04 4.64 0.13 -5.03 116.55 116.78 1p2g n ASP 514 Ca 0.09 -3.16 0.18 0.00 -1.38 0.00 0.00 54.79 50.52 1p2g n ASP 514 Cb 0.47 1.68 0.86 0.00 -1.04 0.00 0.00 41.12 43.09 1p2g n ASP 514 CO 0.00 0.00 0.00 -0.07 -0.82 0.00 0.00 177.20 176.31 1p2g h LEU 515 N 4.31 0.00 -1.87 -2.67 3.38 -1.52 -2.24 115.31 114.70 1p2g h LEU 515 Ca -0.07 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.00 1p2g h LEU 515 Cb 1.04 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.77 1p2g h LEU 515 CO 0.24 0.00 0.32 0.44 0.09 0.00 0.00 178.44 179.53 1p2g h ASP 516 N 0.00 0.13 0.00 -0.43 3.32 -1.86 0.29 116.42 117.88 1p2g h ASP 516 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1p2g h ASP 516 Cb 0.61 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.14 1p2g h ASP 516 CO -0.00 0.08 0.06 1.56 -1.72 0.00 0.00 179.24 179.22 1p2g h GLN 517 N 0.15 0.00 0.00 3.56 4.20 -1.74 -1.39 115.11 119.89 1p2g h GLN 517 Ca 0.21 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.92 1p2g h GLN 517 Cb 0.66 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.44 1p2g h GLN 517 CO -0.03 0.00 0.01 1.25 -0.67 0.00 0.00 178.83 179.40 1p2g h LEU 518 N 0.00 0.00 -2.13 1.46 5.85 -1.16 -1.02 115.31 118.31 1p2g h LEU 518 Ca 0.00 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1p2g h LEU 518 Cb 0.12 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.15 1p2g h LEU 518 CO 0.00 0.00 -0.05 0.03 -0.34 0.00 0.00 178.44 178.08 1p2g h ARG 519 N 0.00 0.00 0.00 1.25 3.08 -0.80 -1.49 114.38 116.43 1p2g h ARG 519 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 1p2g h ARG 519 Cb 0.03 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.08 1p2g h ARG 519 CO 0.00 0.05 -0.00 0.87 -1.07 0.00 0.00 179.97 179.82 1p2g h LYS 520 N 0.00 0.00 0.00 0.04 1.57 -1.42 0.12 116.57 116.88 1p2g h LYS 520 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1p2g h LYS 520 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1p2g h LYS 520 CO 0.01 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.17 1p2g n LEU 521 N -3.35 0.06 0.26 2.94 4.77 -0.56 -2.76 117.00 118.35 1p2g n LEU 521 Ca -0.03 0.51 0.09 0.00 -0.03 0.00 0.00 56.01 56.55 1p2g n LEU 521 Cb 0.09 -0.50 0.66 0.00 -2.33 0.00 0.00 43.42 41.33 1p2g n LEU 521 CO 0.23 -0.25 1.01 0.25 -1.33 0.00 0.00 177.39 177.30 1p2g h LEU 522 N 0.00 0.00 -2.38 2.23 5.85 -0.93 -1.78 115.31 118.30 1p2g h LEU 522 Ca 0.00 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 1p2g h LEU 522 Cb 0.28 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 1p2g h LEU 522 CO 0.00 0.07 0.03 -1.54 -0.34 0.00 0.00 178.44 176.67 1p2g n SER 523 N -4.23 3.44 0.00 1.25 3.41 -1.11 -3.27 113.62 113.11 1p2g n SER 523 Ca -0.03 -2.51 0.00 0.00 -0.26 0.00 0.00 58.87 56.07 1p2g n SER 523 Cb 0.16 -0.60 0.00 0.00 -0.26 0.00 0.00 64.21 63.50 1p2g n SER 523 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1p2g n TYR 524 N 0.26 0.00 0.27 7.33 4.01 -0.67 -4.72 117.16 123.64 1p2g n TYR 524 Ca 0.16 -0.14 0.16 0.00 -0.16 0.00 0.00 57.90 57.91 1p2g n TYR 524 Cb 0.77 -0.01 0.89 0.00 -0.31 0.00 0.00 39.34 40.68 1p2g n TYR 524 CO 0.00 0.00 0.00 -0.24 -0.46 0.00 0.00 176.86 176.16 1p2g h VAL 525 N 0.23 0.51 -0.38 -0.72 3.04 -1.62 0.03 116.25 117.33 1p2g h VAL 525 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 1p2g h VAL 525 Cb 0.23 0.96 0.00 0.00 -2.01 0.00 0.00 31.29 30.47 1p2g h VAL 525 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.57 177.03 1p2g n ASP 526 N -3.84 3.06 -4.60 3.17 10.43 -1.26 -4.87 116.55 118.64 1p2g n ASP 526 Ca -0.02 -1.93 -0.43 0.00 2.57 0.00 0.00 54.79 54.98 1p2g n ASP 526 Cb 0.14 -0.25 -0.03 0.00 1.84 0.00 0.00 41.12 42.82 1p2g n ASP 526 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 1p2g s ASP 527 N -1.05 6.67 0.31 -2.24 3.68 -0.01 -4.93 116.67 119.11 1p2g s ASP 527 Ca 0.29 0.53 0.03 0.00 2.13 0.00 0.00 52.55 55.52 1p2g s ASP 527 Cb 0.16 -2.50 0.60 0.00 -1.45 0.00 0.00 42.92 39.72 1p2g s ASP 527 CO 0.21 -1.03 1.88 -0.33 0.13 0.00 0.00 175.17 176.03 1p2g h GLU 528 N 8.78 0.92 -0.45 4.34 4.39 -1.92 -0.76 114.58 129.88 1p2g h GLU 528 Ca -0.23 -0.06 -0.12 0.00 0.34 0.00 0.00 59.36 59.29 1p2g h GLU 528 Cb 1.07 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 29.50 1p2g h GLU 528 CO 1.05 0.61 -0.21 0.00 -1.16 0.00 0.00 179.01 179.30 1p2g h ALA 529 N 1.54 0.63 -0.22 3.43 0.00 -1.95 -2.11 119.26 120.58 1p2g h ALA 529 Ca 0.43 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1p2g h ALA 529 Cb 0.38 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1p2g h ALA 529 CO -0.19 0.60 -0.06 0.35 0.00 0.00 0.00 179.25 179.95 1p2g h PHE 530 N 0.77 0.49 -0.68 0.00 -0.00 -1.72 -1.59 116.94 114.20 1p2g h PHE 530 Ca 0.10 -0.11 0.09 0.00 -0.00 0.00 0.00 57.97 58.05 1p2g h PHE 530 Cb 0.78 -0.12 -0.07 0.00 -0.00 0.00 0.00 35.95 36.54 1p2g h PHE 530 CO 0.06 0.68 0.32 0.82 -0.00 0.00 0.00 178.31 180.19 1p2g h ILE 531 N 0.15 0.84 -0.53 1.41 2.04 -1.11 0.68 117.51 120.99 1p2g h ILE 531 Ca 0.05 -0.19 -0.08 0.00 1.00 0.00 0.00 64.86 65.64 1p2g h ILE 531 Cb 0.53 0.23 -0.02 0.00 -0.74 0.00 0.00 36.82 36.82 1p2g h ILE 531 CO 0.02 0.10 -0.01 -0.09 0.00 0.00 0.00 178.15 178.18 1p2g h ARG 532 N 0.56 0.91 -0.15 2.37 2.43 -1.21 -2.09 114.38 117.19 1p2g h ARG 532 Ca 0.34 -0.27 -0.06 0.00 -0.81 0.00 0.00 59.98 59.18 1p2g h ARG 532 Cb 0.36 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.81 1p2g h ARG 532 CO -0.27 0.91 -0.13 -0.44 -1.51 0.00 0.00 179.97 178.52 1p2g h ASP 533 N 0.84 0.38 -0.41 -3.80 3.32 -0.24 -1.10 116.42 115.41 1p2g h ASP 533 Ca 0.16 -0.47 0.03 0.00 0.02 0.00 0.00 57.03 56.77 1p2g h ASP 533 Cb 0.51 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.92 1p2g h ASP 533 CO 0.03 0.77 0.20 0.58 -1.72 0.00 0.00 179.24 179.09 1p2g h VAL 534 N -0.01 0.97 -0.16 -1.35 2.07 -0.90 0.10 116.25 116.97 1p2g h VAL 534 Ca 0.03 -0.14 -0.06 0.00 0.82 0.00 0.00 66.70 67.35 1p2g h VAL 534 Cb 0.65 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 1p2g h VAL 534 CO 0.03 0.07 -0.16 0.00 0.02 0.00 0.00 177.57 177.54 1p2g h ALA 535 N 1.22 1.44 -0.07 1.67 0.00 -1.36 -2.63 119.26 119.53 1p2g h ALA 535 Ca 0.17 -0.23 -0.23 0.00 0.00 0.00 0.00 54.91 54.62 1p2g h ALA 535 Cb 0.09 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.80 1p2g h ALA 535 CO -0.13 0.39 -0.88 -0.22 0.00 0.00 0.00 179.25 178.41 1p2g h LYS 536 N 0.24 0.64 -0.32 0.00 3.64 -0.36 -2.17 116.57 118.24 1p2g h LYS 536 Ca 0.05 -0.60 -0.01 0.00 -1.27 0.00 0.00 60.65 58.81 1p2g h LYS 536 Cb 0.43 0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.38 1p2g h LYS 536 CO 0.03 1.21 0.16 0.28 -2.27 0.00 0.00 179.45 178.85 1p2g h VAL 537 N 0.41 1.16 -0.11 2.00 2.07 -0.82 -0.22 116.25 120.73 1p2g h VAL 537 Ca -0.08 -0.44 0.03 0.00 0.82 0.00 0.00 66.70 67.03 1p2g h VAL 537 Cb 1.51 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 32.11 1p2g h VAL 537 CO 0.17 0.16 -0.06 0.50 0.02 0.00 0.00 177.57 178.36 1p2g h LYS 538 N 0.39 -0.06 -0.83 1.57 1.63 -1.49 -0.34 116.57 117.43 1p2g h LYS 538 Ca 0.11 0.00 0.11 0.00 -0.85 0.00 0.00 60.65 60.02 1p2g h LYS 538 Cb 0.11 0.01 -0.08 0.00 -0.60 0.00 0.00 32.23 31.68 1p2g h LYS 538 CO -0.01 -0.04 0.47 0.37 -3.45 0.00 0.00 179.45 176.78 1p2g h GLN 539 N -0.06 0.73 -0.46 1.90 -0.00 -1.07 -0.08 115.11 116.07 1p2g h GLN 539 Ca 0.07 -0.04 -0.04 0.00 -0.00 0.00 0.00 58.65 58.63 1p2g h GLN 539 Cb 0.16 -0.17 -0.02 0.00 0.00 0.00 0.00 27.48 27.46 1p2g h GLN 539 CO -0.15 0.48 0.12 0.93 0.00 0.00 0.00 178.83 180.21 1p2g h GLU 540 N 0.75 0.74 -0.84 1.69 5.08 -0.29 -1.39 114.58 120.32 1p2g h GLU 540 Ca 0.41 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.59 1p2g h GLU 540 Cb 0.43 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.54 1p2g h GLU 540 CO -0.27 0.73 0.49 -0.91 -1.00 0.00 0.00 179.01 178.05 1p2g h ASN 541 N 0.62 1.02 -0.58 1.42 2.35 -0.04 -0.72 115.58 119.65 1p2g h ASN 541 Ca 0.15 -0.07 -0.08 0.00 -0.55 0.00 0.00 56.30 55.74 1p2g h ASN 541 Cb 0.31 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 1p2g h ASN 541 CO 0.00 0.79 0.07 0.11 -1.65 0.00 0.00 177.43 176.75 1p2g h LYS 542 N 1.15 1.01 -0.31 0.81 1.57 -0.80 -0.80 116.57 119.20 1p2g h LYS 542 Ca 0.30 -0.27 -0.05 0.00 -1.87 0.00 0.00 60.65 58.76 1p2g h LYS 542 Cb -0.03 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.16 1p2g h LYS 542 CO -0.05 0.94 0.01 -0.07 -0.57 0.00 0.00 179.45 179.71 1p2g h LEU 543 N 0.94 0.52 -0.69 2.94 3.38 -0.78 0.34 115.31 121.96 1p2g h LEU 543 Ca 0.18 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 1p2g h LEU 543 Cb 0.45 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 1p2g h LEU 543 CO 0.02 0.69 0.38 0.50 0.09 0.00 0.00 178.44 180.12 1p2g h LYS 544 N 0.34 0.97 -0.14 1.13 3.64 -0.96 -1.92 116.57 119.63 1p2g h LYS 544 Ca 0.09 -0.12 -0.19 0.00 -1.27 0.00 0.00 60.65 59.16 1p2g h LYS 544 Cb 0.42 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 1p2g h LYS 544 CO 0.01 0.73 -0.70 0.35 -2.27 0.00 0.00 179.45 177.58 1p2g h PHE 545 N 0.96 0.80 -0.19 1.91 3.57 -1.01 -2.11 116.94 120.87 1p2g h PHE 545 Ca 0.24 -0.33 -0.00 0.00 3.53 0.00 0.00 57.97 61.41 1p2g h PHE 545 Cb 0.05 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 1p2g h PHE 545 CO -0.00 1.12 0.11 0.00 -2.23 0.00 0.00 178.31 177.31 1p2g h ALA 546 N 0.80 1.84 0.02 2.41 0.00 -0.02 -1.71 119.26 122.59 1p2g h ALA 546 Ca -0.03 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 1p2g h ALA 546 Cb 1.29 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 19.01 1p2g h ALA 546 CO 0.13 0.14 -0.48 0.00 0.00 0.00 0.00 179.25 179.05 1p2g h ALA 547 N 1.86 0.03 -0.99 0.00 0.00 -1.24 -3.26 119.26 115.66 1p2g h ALA 547 Ca 0.07 -0.55 0.25 0.00 0.00 0.00 0.00 54.91 54.68 1p2g h ALA 547 Cb -0.00 0.03 -0.13 0.00 0.00 0.00 0.00 17.79 17.69 1p2g h ALA 547 CO -0.01 0.25 0.58 -0.92 0.00 0.00 0.00 179.25 179.14 1p2g h TYR 548 N -0.32 0.98 -0.21 0.00 5.03 -0.63 0.30 116.97 122.12 1p2g h TYR 548 Ca -0.07 0.04 -0.05 0.00 2.58 0.00 0.00 58.73 61.23 1p2g h TYR 548 Cb 1.24 -0.28 -0.01 0.00 1.55 0.00 0.00 36.73 39.23 1p2g h TYR 548 CO 0.17 0.04 -0.10 -0.07 -1.32 0.00 0.00 178.16 176.89 1p2g h LEU 549 N 0.55 0.31 0.19 2.82 4.07 -1.39 -2.91 115.31 118.96 1p2g h LEU 549 Ca 0.64 -0.06 -0.25 0.00 0.08 0.00 0.00 57.88 58.28 1p2g h LEU 549 Cb 1.23 -0.08 0.03 0.00 1.08 0.00 0.00 40.66 42.92 1p2g h LEU 549 CO -0.49 0.45 -1.12 -0.33 -1.08 0.00 0.00 178.44 175.88 1p2g h GLU 550 N 0.31 0.41 0.00 1.13 5.08 -0.54 -0.78 114.58 120.19 1p2g h GLU 550 Ca 0.06 -0.70 0.00 0.00 -1.00 0.00 0.00 59.36 57.72 1p2g h GLU 550 Cb 0.38 0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1p2g h GLU 550 CO 0.02 1.34 0.00 0.54 -1.00 0.00 0.00 179.01 179.90 1p2g n ARG 551 N -3.94 0.00 -0.17 2.33 1.74 -0.41 0.35 116.66 116.55 1p2g n ARG 551 Ca -0.15 0.58 0.09 0.00 -0.77 0.00 0.00 57.85 57.60 1p2g n ARG 551 Cb 0.95 -1.48 0.26 0.00 -1.02 0.00 0.00 32.46 31.17 1p2g n ARG 551 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1p2g n GLU 552 N -2.14 1.98 0.00 5.56 1.02 -1.11 -4.19 120.64 121.77 1p2g n GLU 552 Ca 0.00 -1.51 0.00 0.00 -0.02 0.00 0.00 57.16 55.63 1p2g n GLU 552 Cb 0.00 -1.38 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 1p2g n GLU 552 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1p2g n TYR 553 N 0.72 0.00 -2.27 -0.32 4.01 -0.98 -5.06 117.16 113.26 1p2g n TYR 553 Ca 0.16 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.78 1p2g n TYR 553 Cb 0.39 0.06 0.01 0.00 -0.31 0.00 0.00 39.34 39.49 1p2g n TYR 553 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1p2g n LYS 554 N 0.00 -0.60 0.00 -0.72 4.76 0.15 -4.76 118.16 116.99 1p2g n LYS 554 Ca 0.00 0.39 0.00 0.00 -2.87 0.00 0.00 58.31 55.83 1p2g n LYS 554 Cb 0.47 -0.70 0.00 0.00 -1.84 0.00 0.00 35.03 32.96 1p2g n LYS 554 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 1p2g n VAL 555 N -0.51 0.00 -2.70 -0.18 0.24 -1.00 -4.90 118.33 109.29 1p2g n VAL 555 Ca -0.06 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.22 1p2g n VAL 555 Cb 0.23 -0.18 0.09 0.00 -1.47 0.00 0.00 33.84 32.51 1p2g n VAL 555 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 1p2g n HIS 556 N 0.00 -0.85 -2.28 6.34 -0.00 -1.26 -4.67 115.22 112.49 1p2g n HIS 556 Ca 0.00 -1.78 -0.36 0.00 0.46 0.00 0.00 57.72 56.04 1p2g n HIS 556 Cb 0.00 0.90 -0.01 0.00 -0.12 0.00 0.00 29.99 30.76 1p2g n HIS 556 CO 0.00 0.00 0.00 0.96 0.46 0.00 0.00 176.34 177.76 1p2g s ILE 557 N -1.17 3.19 -0.39 3.57 -4.36 -1.26 -5.01 121.20 115.77 1p2g s ILE 557 Ca 0.15 0.83 -0.19 0.00 -0.26 0.00 0.00 60.65 61.18 1p2g s ILE 557 Cb 0.39 -3.39 0.01 0.00 1.25 0.00 0.00 42.46 40.72 1p2g s ILE 557 CO -0.10 -0.08 0.53 0.21 0.24 0.00 0.00 174.94 175.75 1p2g s ASN 558 N -1.55 6.29 0.00 4.36 2.47 -1.26 -4.96 114.94 120.29 1p2g s ASN 558 Ca 0.67 -0.26 0.09 0.00 0.42 0.00 0.00 52.86 53.78 1p2g s ASN 558 Cb -0.26 -2.27 0.46 0.00 -1.45 0.00 0.00 41.25 37.72 1p2g s ASN 558 CO 0.31 -0.58 1.17 -0.81 -3.72 0.00 0.00 177.10 173.46 1p2g n PRO 559 N 5.85 0.13 0.05 0.43 -0.04 -1.26 -2.21 135.00 137.94 1p2g n PRO 559 Ca -0.04 0.20 0.12 0.00 -0.04 0.00 0.00 63.50 63.73 1p2g n PRO 559 Cb 0.48 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.52 1p2g n PRO 559 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1p2g n ASN 560 N -1.29 0.65 -4.84 3.54 5.03 -1.26 -4.89 115.26 112.19 1p2g n ASN 560 Ca 0.04 -0.03 -0.29 0.00 0.87 0.00 0.00 54.58 55.17 1p2g n ASN 560 Cb 0.07 0.54 0.10 0.00 -1.02 0.00 0.00 39.78 39.47 1p2g n ASN 560 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 1p2g s SER 561 N -4.16 4.26 -0.02 6.41 1.04 -0.94 -4.97 113.70 115.31 1p2g s SER 561 Ca 0.04 0.96 -0.30 0.00 0.48 0.00 0.00 55.95 57.13 1p2g s SER 561 Cb 0.14 -1.55 -0.03 0.00 0.10 0.00 0.00 66.02 64.68 1p2g s SER 561 CO 0.77 -2.08 1.06 -0.22 0.98 0.00 0.00 173.24 173.75 1p2g s LEU 562 N -5.74 4.33 -0.59 2.42 0.20 -0.57 -4.81 118.68 113.92 1p2g s LEU 562 Ca 0.62 1.72 -0.23 0.00 0.69 0.00 0.00 54.13 56.93 1p2g s LEU 562 Cb -0.13 -3.57 0.05 0.00 -0.43 0.00 0.00 46.19 42.12 1p2g s LEU 562 CO 0.52 -0.40 0.93 -0.36 -0.29 0.00 0.00 176.35 176.75 1p2g s PHE 563 N 1.45 2.76 -0.48 5.38 2.99 -1.26 -0.59 117.98 128.23 1p2g s PHE 563 Ca 0.53 -0.26 -0.16 0.00 0.00 0.00 0.00 56.93 57.04 1p2g s PHE 563 Cb -0.23 -4.12 0.07 0.00 0.00 0.00 0.00 43.02 38.74 1p2g s PHE 563 CO 0.25 -1.45 0.44 0.34 -0.00 0.00 0.00 175.22 174.80 1p2g s ASP 564 N 3.15 6.16 -0.03 1.36 3.68 0.21 -1.35 116.67 129.85 1p2g s ASP 564 Ca 0.26 -1.21 0.04 0.00 2.13 0.00 0.00 52.55 53.77 1p2g s ASP 564 Cb -0.15 -2.21 -0.01 0.00 -1.45 0.00 0.00 42.92 39.11 1p2g s ASP 564 CO 0.15 -0.69 -0.16 0.54 0.13 0.00 0.00 175.17 175.14 1p2g s VAL 565 N 1.85 1.31 -0.30 1.11 0.11 -0.87 0.99 120.40 124.60 1p2g s VAL 565 Ca 0.06 -0.67 0.01 0.00 -2.93 0.00 0.00 61.98 58.45 1p2g s VAL 565 Cb -0.23 -1.11 0.09 0.00 -1.53 0.00 0.00 36.38 33.60 1p2g s VAL 565 CO 0.08 0.38 0.06 -1.58 -3.33 0.00 0.00 175.10 170.71 1p2g s GLN 566 N -0.13 1.03 -0.14 1.54 0.74 0.23 -2.27 119.66 120.67 1p2g s GLN 566 Ca 0.01 -1.24 0.01 0.00 0.05 0.00 0.00 55.36 54.19 1p2g s GLN 566 Cb -0.09 -2.39 0.02 0.00 1.10 0.00 0.00 33.01 31.64 1p2g s GLN 566 CO 0.01 -0.90 -0.17 0.14 -0.55 0.00 0.00 175.29 173.81 1p2g s VAL 567 N 1.41 1.75 0.00 1.34 -7.23 -1.26 -2.12 120.40 114.29 1p2g s VAL 567 Ca 0.07 -0.77 0.00 0.00 -1.81 0.00 0.00 61.98 59.47 1p2g s VAL 567 Cb -0.18 -1.59 0.00 0.00 0.56 0.00 0.00 36.38 35.17 1p2g s VAL 567 CO -0.17 0.49 0.00 2.29 -0.31 0.00 0.00 175.10 177.40 1p2g n LYS 568 N 4.38 -0.37 -1.76 4.82 2.85 -1.07 -4.99 118.16 122.02 1p2g n LYS 568 Ca -0.19 0.00 -0.40 0.00 -1.05 0.00 0.00 58.31 56.67 1p2g n LYS 568 Cb 0.51 0.00 0.02 0.00 -0.65 0.00 0.00 35.03 34.91 1p2g n LYS 568 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1p2g n ARG 569 N -0.06 2.20 -2.40 -1.58 5.12 -1.26 -4.02 116.66 114.66 1p2g n ARG 569 Ca 0.00 0.79 -0.43 0.00 -1.93 0.00 0.00 57.85 56.28 1p2g n ARG 569 Cb 0.00 -2.63 -0.02 0.00 -1.16 0.00 0.00 32.46 28.64 1p2g n ARG 569 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1p2g s ILE 570 N -1.20 4.22 -0.07 0.55 -1.09 -0.76 -4.90 121.20 117.95 1p2g s ILE 570 Ca 0.62 1.50 -0.22 0.00 -2.23 0.00 0.00 60.65 60.32 1p2g s ILE 570 Cb -0.44 -3.97 0.05 0.00 -1.58 0.00 0.00 42.46 36.52 1p2g s ILE 570 CO 0.57 -0.10 0.50 -2.28 -1.23 0.00 0.00 174.94 172.40 1p2g s HIS 571 N 3.18 -0.45 0.40 3.97 2.46 -1.26 -4.71 115.29 118.87 1p2g s HIS 571 Ca 0.56 0.84 0.07 0.00 0.47 0.00 0.00 55.06 57.01 1p2g s HIS 571 Cb -0.23 0.24 0.82 0.00 -0.13 0.00 0.00 32.58 33.28 1p2g s HIS 571 CO 0.17 -0.45 2.01 0.93 -2.47 0.00 0.00 174.74 174.93 1p2g h GLU 572 N 3.82 0.47 0.00 2.88 5.08 -1.97 -2.03 114.58 122.83 1p2g h GLU 572 Ca -0.28 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 57.99 1p2g h GLU 572 Cb 1.16 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.31 1p2g h GLU 572 CO 0.35 0.38 -0.19 0.10 -1.00 0.00 0.00 179.01 178.65 1p2g h TYR 573 N 0.47 0.00 0.00 4.33 -0.00 -1.97 -2.44 116.97 117.36 1p2g h TYR 573 Ca 0.12 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 58.84 1p2g h TYR 573 Cb 0.08 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 36.81 1p2g h TYR 573 CO 0.00 0.19 -0.03 0.87 -0.00 0.00 0.00 178.16 179.20 1p2g h LYS 574 N 0.00 0.00 -5.90 0.10 1.79 -1.72 -3.10 116.57 107.74 1p2g h LYS 574 Ca -0.00 0.00 -0.38 0.00 -2.18 0.00 0.00 60.65 58.09 1p2g h LYS 574 Cb 0.80 0.00 0.10 0.00 -1.58 0.00 0.00 32.23 31.56 1p2g h LYS 574 CO 0.02 0.03 -0.81 0.54 -1.08 0.00 0.00 179.45 178.15 1p2g n ARG 575 N -3.12 -5.42 0.29 3.15 1.74 -0.92 -3.99 116.66 108.40 1p2g n ARG 575 Ca 0.02 0.71 0.14 0.00 -0.77 0.00 0.00 57.85 57.95 1p2g n ARG 575 Cb 0.40 -5.44 0.86 0.00 -1.02 0.00 0.00 32.46 27.26 1p2g n ARG 575 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1p2g h GLN 576 N -1.86 0.00 -0.46 5.56 7.50 -1.85 -1.28 115.11 122.72 1p2g h GLN 576 Ca -0.60 0.00 -0.05 0.00 0.50 0.00 0.00 58.65 58.50 1p2g h GLN 576 Cb 1.35 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.86 1p2g h GLN 576 CO 0.53 0.01 0.08 -0.07 -1.50 0.00 0.00 178.83 177.88 1p2g h LEU 577 N 0.00 0.66 -0.71 1.46 3.38 -1.91 -1.02 115.31 117.17 1p2g h LEU 577 Ca -0.00 -0.12 -0.06 0.00 0.09 0.00 0.00 57.88 57.79 1p2g h LEU 577 Cb 0.02 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1p2g h LEU 577 CO 0.00 0.68 0.22 0.25 0.09 0.00 0.00 178.44 179.68 1p2g h LEU 578 N 0.68 1.03 -0.47 1.67 5.85 -1.60 -1.12 115.31 121.36 1p2g h LEU 578 Ca 0.15 -0.21 0.02 0.00 0.84 0.00 0.00 57.88 58.68 1p2g h LEU 578 Cb 0.30 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 1p2g h LEU 578 CO 0.00 0.97 0.29 -1.13 -0.34 0.00 0.00 178.44 178.23 1p2g h ASN 579 N 1.04 0.48 -0.95 1.25 -0.73 -1.34 -2.16 115.58 113.17 1p2g h ASN 579 Ca 0.23 -0.00 0.05 0.00 1.87 0.00 0.00 56.30 58.45 1p2g h ASN 579 Cb 0.30 -0.11 -0.06 0.00 0.27 0.00 0.00 38.32 38.73 1p2g h ASN 579 CO -0.01 0.34 0.62 0.00 -0.37 0.00 0.00 177.43 178.01 1p2g h LEU 581 N 1.14 1.04 -0.36 0.00 3.38 -0.61 -1.33 115.31 118.57 1p2g h LEU 581 Ca 0.40 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 58.12 1p2g h LEU 581 Cb 0.11 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1p2g h LEU 581 CO -0.14 0.96 -0.01 -0.74 0.09 0.00 0.00 178.44 178.60 1p2g h HIS 582 N 1.08 0.71 -0.93 1.13 2.76 -0.85 -1.44 115.15 117.61 1p2g h HIS 582 Ca 0.24 -0.13 0.02 0.00 -2.20 0.00 0.00 60.37 58.31 1p2g h HIS 582 Cb 0.27 -0.18 -0.05 0.00 1.55 0.00 0.00 27.41 29.00 1p2g h HIS 582 CO 0.02 0.75 0.61 0.28 -1.30 0.00 0.00 177.93 178.29 1p2g h VAL 583 N 0.46 1.19 0.00 5.26 2.07 -0.96 -0.63 116.25 123.65 1p2g h VAL 583 Ca 0.10 -0.41 -0.09 0.00 0.82 0.00 0.00 66.70 67.12 1p2g h VAL 583 Cb 0.47 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 1p2g h VAL 583 CO 0.02 0.22 -0.43 0.40 0.02 0.00 0.00 177.57 177.80 1p2g h ILE 584 N 1.21 1.21 -0.09 4.57 2.04 -1.08 -2.23 117.51 123.14 1p2g h ILE 584 Ca 0.36 -1.53 -0.03 0.00 1.00 0.00 0.00 64.86 64.66 1p2g h ILE 584 Cb -0.07 1.85 -0.00 0.00 -0.74 0.00 0.00 36.82 37.86 1p2g h ILE 584 CO -0.10 0.42 -0.05 0.74 0.00 0.00 0.00 178.15 179.16 1p2g h THR 585 N 0.00 1.33 -0.56 -0.27 2.02 -0.11 -0.94 112.91 114.38 1p2g h THR 585 Ca -0.00 -1.10 0.07 0.00 0.77 0.00 0.00 66.41 66.14 1p2g h THR 585 Cb 0.81 1.88 -0.06 0.00 -1.74 0.00 0.00 68.15 69.04 1p2g h THR 585 CO 0.06 0.31 0.26 -0.07 0.37 0.00 0.00 175.52 176.44 1p2g h LEU 586 N -0.19 0.33 -0.11 2.58 4.07 -1.04 0.27 115.31 121.22 1p2g h LEU 586 Ca 0.02 0.05 0.00 0.00 0.08 0.00 0.00 57.88 58.03 1p2g h LEU 586 Cb 0.52 -0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.25 1p2g h LEU 586 CO 0.01 0.21 0.07 0.22 -1.08 0.00 0.00 178.44 177.88 1p2g h TYR 587 N 0.48 0.14 -0.39 1.13 5.03 -1.30 -0.98 116.97 121.08 1p2g h TYR 587 Ca 0.26 0.00 -0.04 0.00 2.58 0.00 0.00 58.73 61.54 1p2g h TYR 587 Cb 0.24 -0.05 -0.02 0.00 1.55 0.00 0.00 36.73 38.45 1p2g h TYR 587 CO -0.13 0.12 0.08 -0.91 -1.32 0.00 0.00 178.16 176.00 1p2g h ASN 588 N 0.13 0.54 -0.41 -2.11 2.35 -0.61 -1.55 115.58 113.92 1p2g h ASN 588 Ca 0.04 -0.08 -0.15 0.00 -0.55 0.00 0.00 56.30 55.55 1p2g h ASN 588 Cb 0.01 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.24 1p2g h ASN 588 CO -0.01 0.55 -0.35 0.03 -1.65 0.00 0.00 177.43 176.01 1p2g h ARG 589 N 0.57 0.96 -0.10 0.81 3.08 -0.63 -1.76 114.38 117.31 1p2g h ARG 589 Ca 0.13 -0.48 -0.00 0.00 0.07 0.00 0.00 59.98 59.69 1p2g h ARG 589 Cb 0.24 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.29 1p2g h ARG 589 CO -0.00 1.15 0.05 0.82 -1.07 0.00 0.00 179.97 180.92 1p2g h ILE 590 N 0.80 1.10 0.00 2.04 2.04 -0.79 -1.19 117.51 121.51 1p2g h ILE 590 Ca 0.07 -0.30 -0.00 0.00 1.00 0.00 0.00 64.86 65.64 1p2g h ILE 590 Cb 0.94 1.12 -0.00 0.00 -0.74 0.00 0.00 36.82 38.14 1p2g h ILE 590 CO 0.09 0.09 -0.01 0.11 0.00 0.00 0.00 178.15 178.44 1p2g h LYS 591 N 0.05 0.00 0.06 2.37 1.79 -1.21 0.13 116.57 119.77 1p2g h LYS 591 Ca 0.04 0.00 -0.23 0.00 -2.18 0.00 0.00 60.65 58.27 1p2g h LYS 591 Cb 0.10 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 30.77 1p2g h LYS 591 CO -0.00 0.01 -0.95 -0.22 -1.08 0.00 0.00 179.45 177.20 1p2g h LYS 592 N 0.00 0.54 -2.35 3.15 1.63 -0.60 -3.38 116.57 115.55 1p2g h LYS 592 Ca -0.00 -0.66 -0.59 0.00 -0.85 0.00 0.00 60.65 58.55 1p2g h LYS 592 Cb 0.01 0.21 -0.40 0.00 -0.60 0.00 0.00 32.23 31.45 1p2g h LYS 592 CO 0.00 1.27 -0.85 0.39 -3.45 0.00 0.00 179.45 176.82 1p2g n GLU 593 N -3.98 1.23 -0.33 1.90 1.02 -0.52 -4.99 120.64 114.98 1p2g n GLU 593 Ca -0.12 -3.80 0.10 0.00 -0.02 0.00 0.00 57.16 53.31 1p2g n GLU 593 Cb 0.85 -1.79 0.27 0.00 -0.02 0.00 0.00 31.44 30.75 1p2g n GLU 593 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 1p2g h PRO 594 N 4.74 0.71 -0.59 3.49 0.11 -0.95 -2.21 132.00 137.31 1p2g h PRO 594 Ca 0.17 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.24 1p2g h PRO 594 Cb 0.81 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.76 1p2g h PRO 594 CO 0.58 0.47 0.00 0.09 -0.21 0.00 0.00 178.00 178.93 1p2g n ASN 595 N -4.79 2.92 -4.88 -2.05 3.02 -1.26 -4.88 115.26 103.33 1p2g n ASN 595 Ca 0.20 -2.25 -0.32 0.00 -0.03 0.00 0.00 54.58 52.18 1p2g n ASN 595 Cb 0.48 -0.44 -0.05 0.00 -0.61 0.00 0.00 39.78 39.17 1p2g n ASN 595 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1p2g s LYS 596 N -1.71 3.77 0.21 3.52 2.20 -0.83 -5.06 119.74 121.83 1p2g s LYS 596 Ca 0.29 0.20 -0.26 0.00 -0.36 0.00 0.00 55.97 55.84 1p2g s LYS 596 Cb 0.19 -2.70 -0.08 0.00 -1.51 0.00 0.00 37.83 33.73 1p2g s LYS 596 CO 0.14 0.35 0.83 0.12 -0.36 0.00 0.00 175.35 176.43 1p2g s PHE 597 N -1.77 3.88 -0.07 4.03 5.36 -1.26 -5.06 117.98 123.09 1p2g s PHE 597 Ca 0.46 1.70 -0.08 0.00 -0.96 0.00 0.00 56.93 58.04 1p2g s PHE 597 Cb -0.11 -2.82 0.02 0.00 -0.34 0.00 0.00 43.02 39.76 1p2g s PHE 597 CO 0.22 0.45 0.22 0.14 -1.46 0.00 0.00 175.22 174.79 1p2g s VAL 598 N -1.24 0.02 -0.02 3.12 -7.23 -1.26 -5.12 120.40 108.67 1p2g s VAL 598 Ca 0.39 -0.14 -0.30 0.00 -1.81 0.00 0.00 61.98 60.12 1p2g s VAL 598 Cb -0.23 -0.37 -0.07 0.00 0.56 0.00 0.00 36.38 36.28 1p2g s VAL 598 CO 0.27 -0.08 1.75 -0.69 -0.31 0.00 0.00 175.10 176.05 1p2g s VAL 599 N -0.22 3.39 0.58 1.32 1.01 -1.26 -4.94 120.40 120.28 1p2g s VAL 599 Ca -0.03 0.48 -0.21 0.00 0.00 0.00 0.00 61.98 62.22 1p2g s VAL 599 Cb -0.03 -3.31 -0.04 0.00 0.00 0.00 0.00 36.38 33.00 1p2g s VAL 599 CO 0.01 -0.04 1.35 -2.16 0.00 0.00 0.00 175.10 174.26 1p2g s PRO 600 N 4.12 2.96 -0.05 2.72 0.04 -1.26 -4.92 135.00 138.61 1p2g s PRO 600 Ca 0.78 2.21 -0.08 0.00 0.04 0.00 0.00 61.00 63.95 1p2g s PRO 600 Cb -0.36 -2.14 0.02 0.00 0.04 0.00 0.00 34.50 32.05 1p2g s PRO 600 CO 0.33 -1.32 0.21 1.03 0.04 0.00 0.00 177.00 177.29 1p2g s ARG 601 N -3.04 0.37 -0.31 4.56 0.52 0.13 -1.51 118.95 119.67 1p2g s ARG 601 Ca 0.75 0.06 -0.03 0.00 -0.52 0.00 0.00 55.73 55.99 1p2g s ARG 601 Cb -0.40 0.17 0.05 0.00 0.52 0.00 0.00 34.95 35.28 1p2g s ARG 601 CO 0.46 -0.07 0.02 0.99 0.02 0.00 0.00 175.30 176.72 1p2g s THR 602 N -0.46 3.13 -0.26 0.02 2.01 0.24 -1.89 115.64 118.42 1p2g s THR 602 Ca -0.06 -1.33 -0.15 0.00 0.31 0.00 0.00 61.69 60.47 1p2g s THR 602 Cb -0.04 -2.79 -0.04 0.00 0.01 0.00 0.00 72.50 69.65 1p2g s THR 602 CO 0.01 -0.11 0.36 -0.69 -0.69 0.00 0.00 174.62 173.49 1p2g s VAL 603 N 1.28 5.19 -0.14 3.82 1.01 0.40 -0.62 120.40 131.33 1p2g s VAL 603 Ca -0.05 0.54 0.01 0.00 0.00 0.00 0.00 61.98 62.49 1p2g s VAL 603 Cb -0.20 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.50 1p2g s VAL 603 CO -0.00 0.18 -0.18 -0.04 0.00 0.00 0.00 175.10 175.05 1p2g s MET 604 N 1.97 3.15 -0.09 2.72 -1.94 0.28 -0.42 119.30 124.97 1p2g s MET 604 Ca 0.15 -0.79 0.00 0.00 -1.71 0.00 0.00 55.69 53.33 1p2g s MET 604 Cb -0.16 -2.52 0.02 0.00 2.01 0.00 0.00 34.83 34.19 1p2g s MET 604 CO 0.10 0.06 -0.07 0.42 -0.01 0.00 0.00 175.02 175.52 1p2g s ILE 605 N 0.68 0.86 0.11 2.53 1.01 -0.49 -0.60 121.20 125.30 1p2g s ILE 605 Ca -0.09 -0.22 0.00 0.00 0.00 0.00 0.00 60.65 60.35 1p2g s ILE 605 Cb -0.16 -0.88 -0.04 0.00 0.01 0.00 0.00 42.46 41.39 1p2g s ILE 605 CO 0.02 0.33 -0.01 -0.83 0.00 0.00 0.00 174.94 174.45 1p2g s GLY 606 N 1.47 0.87 0.00 6.18 0.00 -0.90 -1.15 107.32 113.79 1p2g s GLY 606 Ca -0.01 -1.41 0.00 0.00 0.00 0.00 0.00 44.72 43.31 1p2g s GLY 606 CO -0.04 -1.41 0.00 0.61 0.00 0.00 0.00 173.10 172.25 1p2g n GLY 607 N -0.07 4.09 3.89 0.20 0.00 -1.25 -2.59 105.19 109.45 1p2g n GLY 607 Ca -0.09 -1.05 -0.33 0.00 0.00 0.00 0.00 46.02 44.55 1p2g n GLY 607 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1p2g s LYS 608 N -2.92 3.61 -0.14 1.61 1.02 -1.26 -4.66 119.74 116.99 1p2g s LYS 608 Ca 0.00 -0.07 -0.05 0.00 0.02 0.00 0.00 55.97 55.87 1p2g s LYS 608 Cb 0.00 -3.00 -0.04 0.00 -0.52 0.00 0.00 37.83 34.27 1p2g s LYS 608 CO 0.00 0.58 0.03 0.00 -0.92 0.00 0.00 175.35 175.04 1p2g s ALA 609 N -1.43 3.31 0.31 5.17 0.00 -1.26 -1.82 121.76 126.04 1p2g s ALA 609 Ca 0.33 -0.77 -0.29 0.00 0.00 0.00 0.00 51.96 51.22 1p2g s ALA 609 Cb -0.13 -1.72 -0.11 0.00 0.00 0.00 0.00 23.12 21.17 1p2g s ALA 609 CO 0.20 0.33 1.49 0.00 0.00 0.00 0.00 175.76 177.78 1p2g s ALA 610 N -0.07 3.64 0.28 0.00 0.00 -1.26 -4.91 121.76 119.44 1p2g s ALA 610 Ca 0.05 1.48 -0.30 0.00 0.00 0.00 0.00 51.96 53.19 1p2g s ALA 610 Cb -0.12 -3.60 -0.11 0.00 0.00 0.00 0.00 23.12 19.29 1p2g s ALA 610 CO 0.02 -0.91 1.49 -2.14 0.00 0.00 0.00 175.76 174.22 1p2g s PRO 611 N -1.09 4.21 0.00 0.00 0.02 -1.26 -2.15 135.00 134.73 1p2g s PRO 611 Ca 0.58 2.42 0.00 0.00 0.02 0.00 0.00 61.00 64.02 1p2g s PRO 611 Cb -0.45 -3.06 0.00 0.00 0.02 0.00 0.00 34.50 31.00 1p2g s PRO 611 CO 0.52 -0.49 0.00 0.41 -0.33 0.00 0.00 177.00 177.10 1p2g n GLY 612 N 1.98 0.61 3.36 0.52 0.00 -1.26 -4.98 105.19 105.42 1p2g n GLY 612 Ca 0.06 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.63 1p2g n GLY 612 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1p2g s TYR 613 N -2.30 4.06 0.18 1.61 6.04 -0.91 -4.92 117.35 121.12 1p2g s TYR 613 Ca 0.00 -2.49 -0.22 0.00 0.04 0.00 0.00 57.07 54.41 1p2g s TYR 613 Cb 0.00 -3.93 0.11 0.00 -1.04 0.00 0.00 41.96 37.10 1p2g s TYR 613 CO 0.00 -1.05 1.58 1.25 -1.54 0.00 0.00 175.55 175.80 1p2g h HIS 614 N 6.93 -1.02 -0.74 4.97 -0.00 -1.94 -1.66 115.15 121.70 1p2g h HIS 614 Ca 0.19 0.08 0.10 0.00 -0.00 0.00 0.00 60.37 60.74 1p2g h HIS 614 Cb 0.90 0.53 -0.07 0.00 -0.00 0.00 0.00 27.41 28.77 1p2g h HIS 614 CO 0.86 -0.39 0.38 1.98 -0.00 0.00 0.00 177.93 180.76 1p2g h MET 615 N -0.17 0.62 -0.81 5.26 1.85 -1.99 -0.97 114.93 118.72 1p2g h MET 615 Ca 0.22 -0.04 0.01 0.00 -0.61 0.00 0.00 59.70 59.29 1p2g h MET 615 Cb 0.56 -0.14 -0.04 0.00 0.43 0.00 0.00 31.60 32.40 1p2g h MET 615 CO -0.69 0.41 0.54 0.00 -0.40 0.00 0.00 176.91 176.77 1p2g h ALA 616 N 1.44 1.44 0.00 0.39 0.00 -1.67 -1.51 119.26 119.35 1p2g h ALA 616 Ca 0.37 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.17 1p2g h ALA 616 Cb 0.39 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1p2g h ALA 616 CO -0.27 0.51 -0.28 0.87 0.00 0.00 0.00 179.25 180.08 1p2g h LYS 617 N 1.08 0.00 -0.04 0.00 1.57 -0.77 -3.03 116.57 115.38 1p2g h LYS 617 Ca 0.30 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.91 1p2g h LYS 617 Cb -0.09 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 1p2g h LYS 617 CO -0.07 0.28 -0.75 0.52 -0.57 0.00 0.00 179.45 178.86 1p2g h MET 618 N 0.00 0.27 -0.57 3.15 2.86 -0.26 -2.93 114.93 117.44 1p2g h MET 618 Ca -0.00 -0.23 -0.09 0.00 -2.06 0.00 0.00 59.70 57.31 1p2g h MET 618 Cb 1.07 0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.76 1p2g h MET 618 CO 0.04 0.90 -0.01 0.82 1.06 0.00 0.00 176.91 179.71 1p2g h ILE 619 N 0.17 1.26 -0.50 -1.22 2.04 -1.26 -0.01 117.51 117.99 1p2g h ILE 619 Ca -0.03 -1.14 -0.05 0.00 1.00 0.00 0.00 64.86 64.64 1p2g h ILE 619 Cb 1.32 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 38.22 1p2g h ILE 619 CO 0.12 0.41 0.11 0.40 0.00 0.00 0.00 178.15 179.19 1p2g h ILE 620 N 0.91 1.24 -0.64 -0.67 2.04 -1.51 -0.90 117.51 117.98 1p2g h ILE 620 Ca 0.16 -0.88 -0.03 0.00 1.00 0.00 0.00 64.86 65.12 1p2g h ILE 620 Cb 0.55 0.84 -0.03 0.00 -0.74 0.00 0.00 36.82 37.45 1p2g h ILE 620 CO 0.03 0.32 0.29 0.50 0.00 0.00 0.00 178.15 179.29 1p2g h LYS 621 N 0.70 0.94 -0.44 2.37 1.63 -1.30 -1.68 116.57 118.79 1p2g h LYS 621 Ca 0.16 -0.15 -0.01 0.00 -0.85 0.00 0.00 60.65 59.80 1p2g h LYS 621 Cb 0.35 -0.16 -0.02 0.00 -0.60 0.00 0.00 32.23 31.80 1p2g h LYS 621 CO 0.00 0.76 0.24 1.25 -3.45 0.00 0.00 179.45 178.25 1p2g h LEU 622 N 0.89 0.55 -0.06 5.20 7.12 -0.71 0.70 115.31 129.00 1p2g h LEU 622 Ca 0.22 -0.09 0.02 0.00 0.13 0.00 0.00 57.88 58.15 1p2g h LEU 622 Cb 0.15 -0.14 -0.02 0.00 -0.53 0.00 0.00 40.66 40.12 1p2g h LEU 622 CO -0.02 0.48 -0.05 0.40 -0.13 0.00 0.00 178.44 179.12 1p2g h ILE 623 N 0.57 0.84 -0.18 4.05 2.04 -0.84 0.54 117.51 124.53 1p2g h ILE 623 Ca 0.15 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.95 1p2g h ILE 623 Cb 0.06 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 1p2g h ILE 623 CO -0.02 0.00 -0.15 0.71 0.00 0.00 0.00 178.15 178.68 1p2g h THR 624 N -0.06 1.20 -0.52 -0.27 1.35 -1.14 -2.08 112.91 111.39 1p2g h THR 624 Ca 0.05 -0.91 -0.09 0.00 -0.55 0.00 0.00 66.41 64.91 1p2g h THR 624 Cb 0.13 1.23 -0.02 0.00 -1.73 0.00 0.00 68.15 67.76 1p2g h THR 624 CO -0.10 0.28 -0.03 0.00 -0.25 0.00 0.00 175.52 175.42 1p2g h ALA 625 N 1.57 0.97 -0.14 6.62 0.00 0.02 -0.99 119.26 127.30 1p2g h ALA 625 Ca 0.05 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 1p2g h ALA 625 Cb 0.44 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1p2g h ALA 625 CO 0.03 0.62 0.01 0.82 0.00 0.00 0.00 179.25 180.73 1p2g h ILE 626 N 0.83 1.23 -1.00 0.00 2.04 -0.49 -2.71 117.51 117.41 1p2g h ILE 626 Ca 0.15 -0.76 0.10 0.00 1.00 0.00 0.00 64.86 65.35 1p2g h ILE 626 Cb 0.53 1.46 -0.08 0.00 -0.74 0.00 0.00 36.82 38.00 1p2g h ILE 626 CO 0.03 0.22 0.64 1.23 0.00 0.00 0.00 178.15 180.27 1p2g h GLY 627 N 0.01 1.60 1.71 5.37 0.00 -1.16 0.23 103.07 110.83 1p2g h GLY 627 Ca 0.04 -0.44 -0.01 0.00 0.00 0.00 0.00 47.33 46.93 1p2g h GLY 627 CO 0.00 0.22 0.15 -0.55 0.00 0.00 0.00 176.54 176.36 1p2g h ASP 628 N 1.05 0.33 0.00 0.19 3.45 -0.91 0.34 116.42 120.88 1p2g h ASP 628 Ca 0.48 -0.02 -0.10 0.00 0.43 0.00 0.00 57.03 57.82 1p2g h ASP 628 Cb 0.39 -0.08 -0.01 0.00 -0.56 0.00 0.00 39.33 39.06 1p2g h ASP 628 CO -0.23 0.28 -0.57 0.58 -1.57 0.00 0.00 179.24 177.73 1p2g h VAL 629 N 0.39 1.12 -0.12 -1.35 2.07 -0.82 -3.36 116.25 114.18 1p2g h VAL 629 Ca 0.10 -2.04 -0.01 0.00 0.82 0.00 0.00 66.70 65.57 1p2g h VAL 629 Cb 0.03 2.31 -0.01 0.00 -1.52 0.00 0.00 31.29 32.10 1p2g h VAL 629 CO -0.02 0.38 0.05 0.58 0.02 0.00 0.00 177.57 178.58 1p2g h VAL 630 N -1.00 1.14 0.00 2.57 2.07 -0.56 -3.10 116.25 117.37 1p2g h VAL 630 Ca -0.15 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 66.95 1p2g h VAL 630 Cb 1.00 1.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.97 1p2g h VAL 630 CO -0.09 0.13 0.00 0.59 0.02 0.00 0.00 177.57 178.22 1p2g n ASN 631 N -4.91 0.42 -0.39 0.57 5.03 0.12 -2.64 115.26 113.45 1p2g n ASN 631 Ca -0.05 0.64 0.08 0.00 0.87 0.00 0.00 54.58 56.12 1p2g n ASN 631 Cb 0.11 -0.71 0.18 0.00 -1.02 0.00 0.00 39.78 38.34 1p2g n ASN 631 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.26 176.84 1p2g n HIS 632 N -2.00 0.30 -3.41 3.10 8.25 -1.18 -4.97 115.22 115.32 1p2g n HIS 632 Ca 0.01 -1.06 -0.41 0.00 -0.26 0.00 0.00 57.72 56.00 1p2g n HIS 632 Cb 0.13 -0.22 -0.09 0.00 1.12 0.00 0.00 29.99 30.92 1p2g n HIS 632 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1p2g s ASP 633 N -2.67 6.17 0.35 0.41 -1.08 -1.08 -4.96 116.67 113.81 1p2g s ASP 633 Ca 0.36 -0.30 0.08 0.00 -0.52 0.00 0.00 52.55 52.17 1p2g s ASP 633 Cb 0.31 -2.19 0.79 0.00 -1.46 0.00 0.00 42.92 40.37 1p2g s ASP 633 CO 0.03 -0.35 1.88 -0.65 0.52 0.00 0.00 175.17 176.60 1p2g h PRO 634 N 8.49 0.70 0.00 4.34 0.11 -1.93 -1.70 132.00 142.01 1p2g h PRO 634 Ca -0.30 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.71 1p2g h PRO 634 Cb 1.14 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 1p2g h PRO 634 CO 0.70 0.46 -0.30 0.28 -0.21 0.00 0.00 178.00 178.93 1p2g h VAL 635 N 0.72 1.18 0.01 3.15 2.07 -1.97 -2.84 116.25 118.57 1p2g h VAL 635 Ca 0.43 -1.05 -0.19 0.00 0.82 0.00 0.00 66.70 66.71 1p2g h VAL 635 Cb 0.64 1.57 -0.01 0.00 -1.52 0.00 0.00 31.29 31.97 1p2g h VAL 635 CO -0.19 0.30 -0.87 0.58 0.02 0.00 0.00 177.57 177.40 1p2g h VAL 636 N 0.00 1.53 0.00 2.57 2.07 -1.65 -3.49 116.25 117.27 1p2g h VAL 636 Ca -0.00 -2.70 0.00 0.00 0.82 0.00 0.00 66.70 64.82 1p2g h VAL 636 Cb 0.55 2.50 0.00 0.00 -1.52 0.00 0.00 31.29 32.81 1p2g h VAL 636 CO 0.04 0.78 0.00 0.61 0.02 0.00 0.00 177.57 179.02 1p2g n GLY 637 N 0.88 1.57 2.28 2.17 0.00 -1.07 -2.18 105.19 108.84 1p2g n GLY 637 Ca -0.03 -0.53 -0.31 0.00 0.00 0.00 0.00 46.02 45.15 1p2g n GLY 637 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1p2g n ASP 638 N -1.93 6.32 0.09 1.61 5.68 -1.26 -4.27 116.55 122.79 1p2g n ASP 638 Ca 0.00 -3.73 0.07 0.00 -0.50 0.00 0.00 54.79 50.63 1p2g n ASP 638 Cb 0.00 -0.92 -0.02 0.00 -1.14 0.00 0.00 41.12 39.04 1p2g n ASP 638 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 1p2g h ARG 639 N 1.66 0.00 -2.85 0.11 3.08 -1.78 -3.44 114.38 111.16 1p2g h ARG 639 Ca 0.61 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 60.47 1p2g h ARG 639 Cb 1.51 0.00 -0.31 0.00 0.08 0.00 0.00 29.97 31.25 1p2g h ARG 639 CO 1.42 0.14 -0.49 -1.17 -1.07 0.00 0.00 179.97 178.79 1p2g s LEU 640 N -5.64 -0.19 -0.01 3.04 2.96 -1.26 -0.69 118.68 116.89 1p2g s LEU 640 Ca -0.01 0.64 0.03 0.00 -0.22 0.00 0.00 54.13 54.57 1p2g s LEU 640 Cb 0.09 0.80 -0.01 0.00 0.50 0.00 0.00 46.19 47.58 1p2g s LEU 640 CO 0.79 -0.22 -0.11 -0.13 -1.32 0.00 0.00 176.35 175.36 1p2g s ARG 641 N 2.17 0.97 -0.21 1.98 1.81 -0.79 -4.64 118.95 120.23 1p2g s ARG 641 Ca -0.02 -0.39 0.01 0.00 -1.72 0.00 0.00 55.73 53.61 1p2g s ARG 641 Cb -0.12 -0.92 0.03 0.00 -0.45 0.00 0.00 34.95 33.49 1p2g s ARG 641 CO -0.09 0.21 -0.14 0.08 -0.68 0.00 0.00 175.30 174.68 1p2g s VAL 642 N -0.13 2.35 -0.05 3.52 1.01 -1.26 -0.46 120.40 125.37 1p2g s VAL 642 Ca 0.02 -1.07 0.06 0.00 0.00 0.00 0.00 61.98 60.99 1p2g s VAL 642 Cb -0.06 -2.12 -0.01 0.00 0.00 0.00 0.00 36.38 34.19 1p2g s VAL 642 CO -0.00 0.34 -0.24 -0.63 0.00 0.00 0.00 175.10 174.57 1p2g s ILE 643 N 1.27 1.97 -0.37 2.22 -1.09 0.44 -4.58 121.20 121.06 1p2g s ILE 643 Ca 0.01 -1.02 -0.11 0.00 -2.23 0.00 0.00 60.65 57.30 1p2g s ILE 643 Cb -0.15 -1.67 0.02 0.00 -1.58 0.00 0.00 42.46 39.08 1p2g s ILE 643 CO -0.09 0.55 0.21 0.12 -1.23 0.00 0.00 174.94 174.50 1p2g s PHE 644 N -0.15 3.24 -0.47 3.97 2.19 -1.26 -1.40 117.98 124.10 1p2g s PHE 644 Ca -0.03 -0.87 -0.27 0.00 0.33 0.00 0.00 56.93 56.08 1p2g s PHE 644 Cb -0.13 -2.45 -0.02 0.00 -1.31 0.00 0.00 43.02 39.11 1p2g s PHE 644 CO 0.03 -0.62 1.84 -0.51 1.83 0.00 0.00 175.22 177.80 1p2g s LEU 645 N 1.58 3.40 0.42 6.12 1.02 -0.30 -4.95 118.68 125.97 1p2g s LEU 645 Ca 0.03 0.83 -0.24 0.00 0.02 0.00 0.00 54.13 54.76 1p2g s LEU 645 Cb -0.19 -3.01 -0.08 0.00 0.02 0.00 0.00 46.19 42.93 1p2g s LEU 645 CO 0.07 -2.07 1.16 -0.70 0.02 0.00 0.00 176.35 174.83 1p2g s GLU 646 N 6.40 3.97 -1.41 1.70 2.12 -1.26 -3.87 118.70 126.35 1p2g s GLU 646 Ca 0.74 1.80 -0.01 0.00 0.36 0.00 0.00 54.97 57.86 1p2g s GLU 646 Cb -0.17 -2.58 0.00 0.00 0.26 0.00 0.00 34.13 31.64 1p2g s GLU 646 CO 0.27 -0.38 0.39 -1.71 -0.54 0.00 0.00 175.26 173.29 1p2g n ASN 647 N -0.11 -0.41 -4.72 -1.70 5.15 -1.23 -4.87 115.26 107.36 1p2g n ASN 647 Ca 0.05 -1.04 -0.43 0.00 -0.60 0.00 0.00 54.58 52.57 1p2g n ASN 647 Cb 0.47 -2.90 -0.02 0.00 -0.53 0.00 0.00 39.78 36.80 1p2g n ASN 647 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1p2g n TYR 648 N -4.42 2.70 -3.81 1.20 9.36 -1.26 -4.89 117.16 116.04 1p2g n TYR 648 Ca -0.30 0.18 -0.09 0.00 3.32 0.00 0.00 57.90 61.01 1p2g n TYR 648 Cb 0.68 -2.61 0.02 0.00 -0.63 0.00 0.00 39.34 36.80 1p2g n TYR 648 CO 0.00 0.00 0.00 -0.98 0.22 0.00 0.00 176.86 176.10 1p2g s ARG 649 N 0.31 2.20 0.17 2.98 1.70 -1.26 -4.75 118.95 120.31 1p2g s ARG 649 Ca 0.70 -1.40 -0.18 0.00 -0.47 0.00 0.00 55.73 54.38 1p2g s ARG 649 Cb -0.53 0.62 0.11 0.00 -0.57 0.00 0.00 34.95 34.59 1p2g s ARG 649 CO 0.41 -1.03 1.64 0.28 -1.08 0.00 0.00 175.30 175.52 1p2g h VAL 650 N 2.00 0.47 -0.07 4.99 2.07 -1.96 0.96 116.25 124.71 1p2g h VAL 650 Ca -0.31 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.17 1p2g h VAL 650 Cb 1.25 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.48 1p2g h VAL 650 CO 0.39 0.00 -0.13 0.77 0.02 0.00 0.00 177.57 178.62 1p2g h SER 651 N -0.08 0.10 0.40 0.57 4.64 -1.97 -1.55 113.55 115.67 1p2g h SER 651 Ca 0.21 -0.02 -0.23 0.00 -0.47 0.00 0.00 61.79 61.28 1p2g h SER 651 Cb 0.39 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1p2g h SER 651 CO -0.48 0.24 -0.97 0.25 -0.87 0.00 0.00 176.83 175.01 1p2g h LEU 652 N 0.10 0.49 -0.92 5.97 5.85 -1.59 -3.17 115.31 122.04 1p2g h LEU 652 Ca 0.02 -0.41 -0.01 0.00 0.84 0.00 0.00 57.88 58.32 1p2g h LEU 652 Cb 0.30 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 1p2g h LEU 652 CO 0.02 1.22 0.55 0.00 -0.34 0.00 0.00 178.44 179.88 1p2g h ALA 653 N 0.74 1.18 0.00 1.25 0.00 -0.13 -0.42 119.26 121.88 1p2g h ALA 653 Ca -0.08 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1p2g h ALA 653 Cb 1.62 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1p2g h ALA 653 CO 0.17 0.65 0.00 0.93 0.00 0.00 0.00 179.25 180.99 1p2g h GLU 654 N 1.28 0.00 0.00 0.00 5.08 -1.28 -2.04 114.58 117.61 1p2g h GLU 654 Ca 0.33 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.42 1p2g h GLU 654 Cb -0.04 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.17 1p2g h GLU 654 CO -0.06 0.00 -1.72 1.63 -1.00 0.00 0.00 179.01 177.86 1p2g n LYS 655 N -2.98 0.56 0.00 2.33 5.02 -0.31 -4.47 118.16 118.31 1p2g n LYS 655 Ca -0.02 0.37 -0.07 0.00 -2.02 0.00 0.00 58.31 56.57 1p2g n LYS 655 Cb 0.10 -1.57 0.11 0.00 -0.02 0.00 0.00 35.03 33.65 1p2g n LYS 655 CO 0.00 0.00 0.00 -0.24 -0.52 0.00 0.00 177.40 176.64 1p2g h VAL 656 N -1.00 1.30 0.00 -0.18 3.04 -1.14 -3.30 116.25 114.97 1p2g h VAL 656 Ca -0.41 -1.58 -0.00 0.00 -1.01 0.00 0.00 66.70 63.70 1p2g h VAL 656 Cb 1.31 1.58 0.00 0.00 -2.01 0.00 0.00 31.29 32.16 1p2g h VAL 656 CO -0.25 0.49 -0.00 0.40 -1.01 0.00 0.00 177.57 177.20 1p2g h ILE 657 N 0.44 1.05 -0.03 3.17 2.04 -1.60 -2.31 117.51 120.26 1p2g h ILE 657 Ca 0.04 -0.15 0.01 0.00 1.00 0.00 0.00 64.86 65.76 1p2g h ILE 657 Cb 0.90 1.15 -0.00 0.00 -0.74 0.00 0.00 36.82 38.13 1p2g h ILE 657 CO 0.08 0.04 0.04 -0.65 0.00 0.00 0.00 178.15 177.66 1p2g h PRO 658 N -0.07 0.00 -0.02 2.37 0.11 -1.78 -1.68 132.00 130.93 1p2g h PRO 658 Ca -0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1p2g h PRO 658 Cb 0.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.17 1p2g h PRO 658 CO 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.79 1p2g n ALA 659 N -2.29 2.56 -2.10 -0.75 0.00 -0.91 -4.79 120.51 112.23 1p2g n ALA 659 Ca -0.02 -0.49 -0.33 0.00 0.00 0.00 0.00 53.44 52.60 1p2g n ALA 659 Cb 0.13 -1.11 -0.06 0.00 0.00 0.00 0.00 19.45 18.41 1p2g n ALA 659 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1p2g s ALA 660 N -1.99 3.30 -0.14 0.00 0.00 -0.63 -4.58 121.76 117.70 1p2g s ALA 660 Ca 0.36 0.09 0.05 0.00 0.00 0.00 0.00 51.96 52.46 1p2g s ALA 660 Cb 0.21 -2.81 -0.12 0.00 0.00 0.00 0.00 23.12 20.40 1p2g s ALA 660 CO 0.33 0.31 -0.08 -0.25 0.00 0.00 0.00 175.76 176.07 1p2g n ASP 661 N -0.29 2.50 -4.09 0.00 8.00 -0.79 -4.20 116.55 117.68 1p2g n ASP 661 Ca 0.03 -0.06 -0.30 0.00 0.71 0.00 0.00 54.79 55.18 1p2g n ASP 661 Cb 0.53 0.11 -0.17 0.00 -0.02 0.00 0.00 41.12 41.58 1p2g n ASP 661 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1p2g s LEU 662 N -5.57 1.84 -0.30 0.64 0.20 -0.46 -0.20 118.68 114.83 1p2g s LEU 662 Ca -0.16 -0.49 -0.11 0.00 0.69 0.00 0.00 54.13 54.06 1p2g s LEU 662 Cb 0.05 -1.21 -0.03 0.00 -0.43 0.00 0.00 46.19 44.57 1p2g s LEU 662 CO 0.41 0.03 0.19 -0.55 -0.29 0.00 0.00 176.35 176.14 1p2g s SER 663 N 0.98 5.84 -0.45 3.68 0.15 0.62 -2.06 113.70 122.48 1p2g s SER 663 Ca -0.06 -0.27 -0.22 0.00 0.70 0.00 0.00 55.95 56.10 1p2g s SER 663 Cb -0.15 -2.08 0.03 0.00 -1.71 0.00 0.00 66.02 62.11 1p2g s SER 663 CO -0.03 -0.14 0.73 -1.61 1.20 0.00 0.00 173.24 173.40 1p2g s GLU 664 N 1.70 3.36 -0.55 5.44 0.41 -0.96 -1.86 118.70 126.24 1p2g s GLU 664 Ca 0.06 -0.21 0.06 0.00 -0.41 0.00 0.00 54.97 54.48 1p2g s GLU 664 Cb -0.17 -3.94 0.23 0.00 -1.78 0.00 0.00 34.13 28.46 1p2g s GLU 664 CO 0.09 -1.08 0.58 1.04 -0.49 0.00 0.00 175.26 175.40 1p2g n GLN 665 N 6.55 1.54 -1.60 1.61 1.13 -0.82 -4.76 117.38 121.04 1p2g n GLN 665 Ca 0.01 -4.00 -0.27 0.00 -1.94 0.00 0.00 57.00 50.80 1p2g n GLN 665 Cb 0.48 -1.87 0.07 0.00 0.11 0.00 0.00 30.24 29.03 1p2g n GLN 665 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 1p2g n ILE 666 N 1.48 3.00 -2.28 5.09 -5.35 -1.26 -2.69 119.36 117.35 1p2g n ILE 666 Ca 0.26 -3.50 -0.35 0.00 -0.27 0.00 0.00 62.75 58.89 1p2g n ILE 666 Cb 0.45 -1.05 -0.00 0.00 -1.74 0.00 0.00 39.64 37.29 1p2g n ILE 666 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1p2g s SER 667 N -2.72 5.82 0.23 7.28 1.04 -1.26 -4.63 113.70 119.47 1p2g s SER 667 Ca 0.56 2.18 -0.32 0.00 0.48 0.00 0.00 55.95 58.85 1p2g s SER 667 Cb 0.45 -2.58 -0.12 0.00 0.10 0.00 0.00 66.02 63.87 1p2g s SER 667 CO 0.02 -1.15 1.67 0.41 0.98 0.00 0.00 173.24 175.16 1p2g n THR 668 N -1.17 0.33 -1.63 2.02 -1.04 -1.17 -4.68 114.28 106.94 1p2g n THR 668 Ca 0.11 -0.08 -0.53 0.00 -2.04 0.00 0.00 64.05 61.50 1p2g n THR 668 Cb 0.51 -1.93 -0.06 0.00 -1.82 0.00 0.00 70.33 67.02 1p2g n THR 668 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1p2g n ALA 669 N 3.33 -0.58 -0.07 2.41 0.00 -1.26 -2.16 120.51 122.18 1p2g n ALA 669 Ca 0.14 0.47 0.00 0.00 0.00 0.00 0.00 53.44 54.04 1p2g n ALA 669 Cb 0.35 -2.15 0.00 0.00 0.00 0.00 0.00 19.45 17.65 1p2g n ALA 669 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p2g n GLY 670 N 3.14 0.51 0.09 0.00 0.00 -1.26 -4.70 105.19 102.96 1p2g n GLY 670 Ca 0.21 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.12 1p2g n GLY 670 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1p2g n THR 671 N -2.00 1.11 -2.97 2.61 -2.24 -0.92 -4.86 114.28 105.01 1p2g n THR 671 Ca 0.00 -0.56 -0.43 0.00 -2.27 0.00 0.00 64.05 60.79 1p2g n THR 671 Cb 0.00 -0.87 -0.05 0.00 -2.10 0.00 0.00 70.33 67.31 1p2g n THR 671 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1p2g s GLU 672 N -2.39 3.25 0.19 -0.78 2.56 -1.26 -4.73 118.70 115.54 1p2g s GLU 672 Ca -0.17 -0.50 -0.20 0.00 0.00 0.00 0.00 54.97 54.11 1p2g s GLU 672 Cb 0.06 -4.06 0.15 0.00 2.00 0.00 0.00 34.13 32.27 1p2g s GLU 672 CO 0.56 -1.36 1.59 0.00 -0.56 0.00 0.00 175.26 175.49 1p2g h ALA 673 N 9.17 0.02 0.00 6.30 0.00 -1.89 -2.91 119.26 129.95 1p2g h ALA 673 Ca -0.27 0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1p2g h ALA 673 Cb 1.08 0.77 0.00 0.00 0.00 0.00 0.00 17.79 19.65 1p2g h ALA 673 CO 1.03 -0.65 0.00 0.45 0.00 0.00 0.00 179.25 180.08 1p2g n SER 674 N -5.44 -0.92 0.00 0.00 2.88 -1.26 -4.28 113.62 104.60 1p2g n SER 674 Ca 0.05 0.51 0.00 0.00 -1.33 0.00 0.00 58.87 58.10 1p2g n SER 674 Cb 0.36 1.04 0.00 0.00 -0.75 0.00 0.00 64.21 64.86 1p2g n SER 674 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1p2g n GLY 675 N 0.87 -0.49 0.00 0.46 0.00 -1.26 -1.26 105.19 103.51 1p2g n GLY 675 Ca 0.00 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 44.53 1p2g n GLY 675 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1p2g n THR 676 N 0.15 0.00 -0.20 2.61 -2.24 -1.26 -4.74 114.28 108.60 1p2g n THR 676 Ca 0.00 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.79 1p2g n THR 676 Cb 0.00 -0.03 0.25 0.00 -2.10 0.00 0.00 70.33 68.46 1p2g n THR 676 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1p2g h GLY 677 N 0.00 1.03 0.70 3.38 0.00 -1.95 -1.54 103.07 104.69 1p2g h GLY 677 Ca 0.00 -0.39 0.10 0.00 0.00 0.00 0.00 47.33 47.04 1p2g h GLY 677 CO 0.00 0.38 0.59 3.45 0.00 0.00 0.00 176.54 180.96 1p2g h ASN 678 N 0.99 0.83 0.00 0.19 -0.00 -1.94 -0.54 115.58 115.10 1p2g h ASN 678 Ca 0.27 0.02 -0.15 0.00 -0.00 0.00 0.00 56.30 56.44 1p2g h ASN 678 Cb -0.10 -0.15 -0.01 0.00 -0.00 0.00 0.00 38.32 38.06 1p2g h ASN 678 CO -0.06 0.49 -0.50 0.24 -0.00 0.00 0.00 177.43 177.60 1p2g h MET 679 N 0.91 0.56 -0.30 4.14 2.86 -1.60 -2.59 114.93 118.91 1p2g h MET 679 Ca 0.42 -0.33 -0.00 0.00 -2.06 0.00 0.00 59.70 57.73 1p2g h MET 679 Cb 0.40 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.07 1p2g h MET 679 CO -0.18 0.93 0.19 0.87 1.06 0.00 0.00 176.91 179.77 1p2g h LYS 680 N 0.44 0.41 -0.66 1.72 1.57 -0.66 -2.10 116.57 117.30 1p2g h LYS 680 Ca 0.02 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.73 1p2g h LYS 680 Cb 1.03 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.22 1p2g h LYS 680 CO 0.10 0.31 0.28 0.74 -0.57 0.00 0.00 179.45 180.30 1p2g h PHE 681 N 0.39 0.98 -0.79 -1.35 0.04 -1.28 -2.63 116.94 112.30 1p2g h PHE 681 Ca 0.11 -0.07 -0.04 0.00 2.80 0.00 0.00 57.97 60.77 1p2g h PHE 681 Cb 0.00 -0.30 -0.04 0.00 2.20 0.00 0.00 35.95 37.82 1p2g h PHE 681 CO -0.04 0.76 0.34 1.98 -0.60 0.00 0.00 178.31 180.74 1p2g h MET 682 N 0.92 1.18 0.00 1.51 4.05 -1.32 -2.12 114.93 119.14 1p2g h MET 682 Ca 0.22 -0.20 -0.05 0.00 -0.28 0.00 0.00 59.70 59.39 1p2g h MET 682 Cb 0.18 -0.20 -0.01 0.00 -0.80 0.00 0.00 31.60 30.78 1p2g h MET 682 CO -0.02 0.94 -0.22 1.25 0.23 0.00 0.00 176.91 179.09 1p2g h LEU 683 N 1.15 0.00 -2.93 3.39 5.85 -1.24 -3.19 115.31 118.34 1p2g h LEU 683 Ca 0.27 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.99 1p2g h LEU 683 Cb 0.19 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.22 1p2g h LEU 683 CO -0.03 0.22 0.00 0.59 -0.34 0.00 0.00 178.44 178.88 1p2g n ASN 684 N -3.46 4.27 0.00 1.25 3.02 -0.97 -4.92 115.26 114.46 1p2g n ASN 684 Ca -0.00 -2.20 0.00 0.00 -0.03 0.00 0.00 54.58 52.35 1p2g n ASN 684 Cb 0.40 -0.52 0.00 0.00 -0.61 0.00 0.00 39.78 39.05 1p2g n ASN 684 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1p2g n GLY 685 N 1.37 1.00 3.65 7.41 0.00 -1.11 -4.82 105.19 112.68 1p2g n GLY 685 Ca 0.25 -0.54 -0.28 0.00 0.00 0.00 0.00 46.02 45.45 1p2g n GLY 685 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p2g s ALA 686 N -2.00 3.16 0.21 4.61 0.00 -0.84 -4.77 121.76 122.13 1p2g s ALA 686 Ca 0.00 -1.31 -0.02 0.00 0.00 0.00 0.00 51.96 50.62 1p2g s ALA 686 Cb 0.00 -0.99 -0.05 0.00 0.00 0.00 0.00 23.12 22.08 1p2g s ALA 686 CO 0.00 0.55 0.43 -0.51 0.00 0.00 0.00 175.76 176.23 1p2g s LEU 687 N -2.70 4.19 -0.15 0.00 1.02 0.73 -4.41 118.68 117.35 1p2g s LEU 687 Ca 0.26 0.51 -0.03 0.00 0.02 0.00 0.00 54.13 54.90 1p2g s LEU 687 Cb -0.10 -3.29 -0.02 0.00 0.02 0.00 0.00 46.19 42.80 1p2g s LEU 687 CO 0.17 -0.07 -0.06 -0.89 0.02 0.00 0.00 176.35 175.53 1p2g s THR 688 N -1.89 3.67 -0.18 5.49 2.01 -1.26 -0.27 115.64 123.21 1p2g s THR 688 Ca 0.40 -0.44 -0.02 0.00 0.31 0.00 0.00 61.69 61.95 1p2g s THR 688 Cb -0.11 -2.59 -0.01 0.00 0.01 0.00 0.00 72.50 69.80 1p2g s THR 688 CO 0.28 0.50 -0.10 -0.51 -0.69 0.00 0.00 174.62 174.11 1p2g s ILE 689 N 0.37 3.07 0.11 1.82 2.07 -0.78 -1.31 121.20 126.56 1p2g s ILE 689 Ca -0.06 -0.62 -0.25 0.00 -1.41 0.00 0.00 60.65 58.32 1p2g s ILE 689 Cb -0.15 -2.35 0.08 0.00 0.13 0.00 0.00 42.46 40.18 1p2g s ILE 689 CO 0.04 0.48 1.13 -0.83 -1.91 0.00 0.00 174.94 173.84 1p2g s GLY 690 N 1.03 0.01 0.54 1.50 0.00 -0.81 -1.94 107.32 107.64 1p2g s GLY 690 Ca -0.00 -0.16 0.00 0.00 0.00 0.00 0.00 44.72 44.56 1p2g s GLY 690 CO -0.01 3.33 0.77 -0.51 0.00 0.00 0.00 173.10 176.68 1p2g s THR 691 N -2.16 3.00 -1.33 0.90 -4.23 -1.09 -2.16 115.64 108.56 1p2g s THR 691 Ca 0.24 -0.58 -0.15 0.00 -1.18 0.00 0.00 61.69 60.01 1p2g s THR 691 Cb -0.02 -3.13 0.09 0.00 1.34 0.00 0.00 72.50 70.78 1p2g s THR 691 CO 0.03 -0.09 1.86 0.23 -0.54 0.00 0.00 174.62 176.11 1p2g n MET 692 N -2.32 3.17 -4.20 3.99 2.81 -1.26 -4.69 117.12 114.61 1p2g n MET 692 Ca 0.06 -3.18 -0.16 0.00 -1.81 0.00 0.00 57.70 52.61 1p2g n MET 692 Cb 0.59 -3.30 -0.11 0.00 -0.71 0.00 0.00 33.22 29.69 1p2g n MET 692 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1p2g s ASP 693 N 3.30 1.69 0.16 7.83 3.68 -1.26 -4.63 116.67 127.44 1p2g s ASP 693 Ca 0.48 -0.80 0.00 0.00 2.13 0.00 0.00 52.55 54.37 1p2g s ASP 693 Cb 0.07 -0.03 0.00 0.00 -1.45 0.00 0.00 42.92 41.51 1p2g s ASP 693 CO 0.01 -0.20 0.00 0.61 0.13 0.00 0.00 175.17 175.71 1p2g n GLY 694 N 0.59 2.14 0.13 2.66 0.00 -1.10 -1.09 105.19 108.52 1p2g n GLY 694 Ca -0.16 -0.12 0.12 0.00 0.00 0.00 0.00 46.02 45.86 1p2g n GLY 694 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p2g n ALA 695 N 6.63 1.88 -0.31 4.61 0.00 -0.39 -3.13 120.51 129.80 1p2g n ALA 695 Ca 0.00 0.05 0.13 0.00 0.00 0.00 0.00 53.44 53.62 1p2g n ALA 695 Cb 0.00 -1.42 0.31 0.00 0.00 0.00 0.00 19.45 18.34 1p2g n ALA 695 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1p2g h ASN 696 N 0.00 0.44 -0.26 0.00 4.21 -1.32 0.27 115.58 118.91 1p2g h ASN 696 Ca 0.00 0.14 0.02 0.00 1.21 0.00 0.00 56.30 57.67 1p2g h ASN 696 Cb 0.50 0.09 -0.03 0.00 -1.12 0.00 0.00 38.32 37.77 1p2g h ASN 696 CO 0.00 0.06 0.11 0.58 -1.29 0.00 0.00 177.43 176.88 1p2g h VAL 697 N 0.48 0.96 0.00 2.81 2.07 -1.56 -1.33 116.25 119.68 1p2g h VAL 697 Ca 0.56 -0.08 -0.12 0.00 0.82 0.00 0.00 66.70 67.88 1p2g h VAL 697 Cb 1.02 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.48 1p2g h VAL 697 CO -0.49 0.04 -0.58 -0.33 0.02 0.00 0.00 177.57 176.24 1p2g h GLU 698 N 0.23 0.00 0.07 1.57 5.08 -1.33 -2.10 114.58 118.10 1p2g h GLU 698 Ca 0.11 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1p2g h GLU 698 Cb 0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.31 1p2g h GLU 698 CO -0.10 0.58 -0.03 0.52 -1.00 0.00 0.00 179.01 178.97 1p2g h MET 699 N 0.00 -0.09 -0.23 2.33 2.86 -0.69 -1.15 114.93 117.96 1p2g h MET 699 Ca -0.01 0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1p2g h MET 699 Cb 1.10 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.76 1p2g h MET 699 CO 0.08 0.30 0.09 0.00 1.06 0.00 0.00 176.91 178.43 1p2g h ALA 700 N 0.38 1.72 -0.32 6.32 0.00 -1.28 0.02 119.26 126.10 1p2g h ALA 700 Ca -0.01 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 1p2g h ALA 700 Cb 0.43 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1p2g h ALA 700 CO 0.02 0.23 -0.25 1.49 0.00 0.00 0.00 179.25 180.74 1p2g h GLU 701 N 0.33 0.62 0.09 0.00 4.81 -1.20 0.37 114.58 119.59 1p2g h GLU 701 Ca 0.08 -0.25 -0.26 0.00 -0.13 0.00 0.00 59.36 58.80 1p2g h GLU 701 Cb 0.08 -0.03 0.01 0.00 0.63 0.00 0.00 28.75 29.44 1p2g h GLU 701 CO -0.01 0.81 -1.14 0.93 -0.73 0.00 0.00 179.01 178.87 1p2g h GLU 702 N 0.54 0.37 0.00 1.92 4.39 0.14 -3.33 114.58 118.62 1p2g h GLU 702 Ca 0.08 -0.52 -0.07 0.00 0.34 0.00 0.00 59.36 59.19 1p2g h GLU 702 Cb 0.71 0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.53 1p2g h GLU 702 CO 0.05 1.20 -1.24 0.00 -1.16 0.00 0.00 179.01 177.87 1p2g n ALA 703 N -2.56 2.30 0.00 3.43 0.00 -0.15 -4.86 120.51 118.67 1p2g n ALA 703 Ca -0.09 -0.38 0.00 0.00 0.00 0.00 0.00 53.44 52.97 1p2g n ALA 703 Cb 0.95 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 19.39 1p2g n ALA 703 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p2g n GLY 704 N 1.27 1.58 0.52 0.00 0.00 0.13 -4.59 105.19 104.10 1p2g n GLY 704 Ca -0.04 -1.29 0.34 0.00 0.00 0.00 0.00 46.02 45.02 1p2g n GLY 704 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1p2g h GLU 705 N 0.00 0.02 0.00 1.61 5.08 -1.83 0.28 114.58 119.74 1p2g h GLU 705 Ca 0.00 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1p2g h GLU 705 Cb 0.00 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1p2g h GLU 705 CO 0.00 0.01 0.00 0.93 -1.00 0.00 0.00 179.01 178.95 1p2g h GLU 706 N 0.02 0.00 -0.72 2.33 3.07 -1.89 -2.28 114.58 115.10 1p2g h GLU 706 Ca 0.55 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.41 1p2g h GLU 706 Cb 2.18 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 30.09 1p2g h GLU 706 CO -0.02 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.68 1p2g n ASN 707 N -2.87 4.18 -4.29 1.42 3.02 0.98 -4.91 115.26 112.79 1p2g n ASN 707 Ca 0.01 -2.12 -0.21 0.00 -0.03 0.00 0.00 54.58 52.24 1p2g n ASN 707 Cb 0.27 -0.52 -0.11 0.00 -0.61 0.00 0.00 39.78 38.80 1p2g n ASN 707 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1p2g s PHE 708 N -1.23 1.65 -0.91 3.10 5.36 -0.86 -4.79 117.98 120.31 1p2g s PHE 708 Ca 0.50 -0.49 -0.01 0.00 -0.96 0.00 0.00 56.93 55.97 1p2g s PHE 708 Cb 0.28 -0.85 0.26 0.00 -0.34 0.00 0.00 43.02 42.37 1p2g s PHE 708 CO 0.31 0.24 1.04 1.19 -1.46 0.00 0.00 175.22 176.54 1p2g n PHE 709 N 0.51 3.47 -3.01 10.12 3.72 -0.43 -4.95 117.46 126.90 1p2g n PHE 709 Ca -0.15 -3.60 -0.39 0.00 -0.05 0.00 0.00 57.45 53.27 1p2g n PHE 709 Cb 0.56 -1.06 -0.06 0.00 -0.94 0.00 0.00 39.48 37.98 1p2g n PHE 709 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1p2g s ILE 710 N -2.16 4.42 0.35 4.37 -1.09 -1.26 -1.93 121.20 123.90 1p2g s ILE 710 Ca 0.32 1.60 -0.10 0.00 -2.23 0.00 0.00 60.65 60.25 1p2g s ILE 710 Cb 0.03 -4.06 0.02 0.00 -1.58 0.00 0.00 42.46 36.87 1p2g s ILE 710 CO -0.01 0.44 0.62 0.72 -1.23 0.00 0.00 174.94 175.47 1p2g s PHE 711 N -1.25 0.56 0.07 3.97 -0.71 -0.92 -4.96 117.98 114.74 1p2g s PHE 711 Ca 0.38 -0.99 0.00 0.00 -1.04 0.00 0.00 56.93 55.27 1p2g s PHE 711 Cb -0.21 0.36 0.00 0.00 -1.21 0.00 0.00 43.02 41.96 1p2g s PHE 711 CO 0.25 -1.31 0.00 0.41 -1.34 0.00 0.00 175.22 173.22 1p2g n GLY 712 N -0.53 -2.15 3.76 1.99 0.00 -1.26 -4.28 105.19 102.72 1p2g n GLY 712 Ca -0.03 -1.44 -0.36 0.00 0.00 0.00 0.00 46.02 44.19 1p2g n GLY 712 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1p2g s MET 713 N -1.14 3.27 0.52 1.61 -1.94 -1.26 -4.91 119.30 115.44 1p2g s MET 713 Ca 0.00 1.78 0.06 0.00 -1.71 0.00 0.00 55.69 55.82 1p2g s MET 713 Cb 0.00 -2.08 0.05 0.00 2.01 0.00 0.00 34.83 34.81 1p2g s MET 713 CO 0.00 -0.96 0.71 1.03 -0.01 0.00 0.00 175.02 175.80 1p2g s ARG 714 N -3.15 2.52 0.18 2.03 1.81 -1.26 -4.53 118.95 116.55 1p2g s ARG 714 Ca 0.73 -1.24 -0.17 0.00 -1.72 0.00 0.00 55.73 53.33 1p2g s ARG 714 Cb -0.29 -2.63 0.13 0.00 -0.45 0.00 0.00 34.95 31.71 1p2g s ARG 714 CO 0.33 -0.63 1.63 0.28 -0.68 0.00 0.00 175.30 176.23 1p2g h VAL 715 N 0.29 0.42 -0.66 3.52 2.07 -1.84 -1.49 116.25 118.56 1p2g h VAL 715 Ca -0.37 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.20 1p2g h VAL 715 Cb 1.28 0.42 -0.04 0.00 -1.52 0.00 0.00 31.29 31.43 1p2g h VAL 715 CO 0.45 0.00 0.43 -0.08 0.02 0.00 0.00 177.57 178.39 1p2g h GLU 716 N -0.08 0.67 -0.40 1.57 4.81 -1.95 -1.41 114.58 117.79 1p2g h GLU 716 Ca 0.22 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.35 1p2g h GLU 716 Cb 0.42 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 1p2g h GLU 716 CO -0.52 0.44 -0.00 -0.44 -0.73 0.00 0.00 179.01 177.76 1p2g h ASP 717 N 0.69 0.60 -0.24 1.04 3.45 -1.66 -1.40 116.42 118.91 1p2g h ASP 717 Ca 0.28 -0.13 -0.14 0.00 0.43 0.00 0.00 57.03 57.47 1p2g h ASP 717 Cb 0.22 -0.16 -0.01 0.00 -0.56 0.00 0.00 39.33 38.82 1p2g h ASP 717 CO -0.08 0.68 -0.36 0.58 -1.57 0.00 0.00 179.24 178.49 1p2g h VAL 718 N 0.60 1.28 -0.13 -1.35 2.07 -0.85 -2.89 116.25 114.98 1p2g h VAL 718 Ca 0.12 -1.52 -0.00 0.00 0.82 0.00 0.00 66.70 66.12 1p2g h VAL 718 Cb 0.39 1.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 1p2g h VAL 718 CO 0.01 0.50 0.07 0.44 0.02 0.00 0.00 177.57 178.61 1p2g h ASP 719 N 0.64 0.16 -0.00 0.57 3.32 -0.65 -2.15 116.42 118.31 1p2g h ASP 719 Ca 0.06 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1p2g h ASP 719 Cb 0.90 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.41 1p2g h ASP 719 CO 0.08 0.22 0.00 -2.11 -1.72 0.00 0.00 179.24 175.71 1p2g n ARG 720 N -4.94 1.03 0.00 3.56 1.85 -0.61 -2.12 116.66 115.44 1p2g n ARG 720 Ca -0.05 -0.05 -0.16 0.00 -1.00 0.00 0.00 57.85 56.59 1p2g n ARG 720 Cb 0.08 -1.47 -0.14 0.00 -1.05 0.00 0.00 32.46 29.88 1p2g n ARG 720 CO 0.00 0.00 0.00 1.25 -0.01 0.00 0.00 177.63 178.87 1p2g h LEU 721 N 0.12 0.25 -0.16 2.89 6.46 -1.25 -3.21 115.31 120.41 1p2g h LEU 721 Ca 0.00 -0.54 -0.15 0.00 -0.12 0.00 0.00 57.88 57.07 1p2g h LEU 721 Cb 0.03 -0.08 0.00 0.00 -0.73 0.00 0.00 40.66 39.88 1p2g h LEU 721 CO 0.00 1.48 -0.48 0.44 -0.62 0.00 0.00 178.44 179.26 1p2g h ASP 722 N 0.04 0.69 -0.36 1.25 3.32 -1.07 0.30 116.42 120.59 1p2g h ASP 722 Ca -0.35 -0.59 0.02 0.00 0.02 0.00 0.00 57.03 56.13 1p2g h ASP 722 Cb 2.03 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 41.36 1p2g h ASP 722 CO 0.09 1.17 0.24 1.56 -1.72 0.00 0.00 179.24 180.58 1p2g h GLN 723 N 0.25 0.39 0.06 3.56 4.20 -1.58 -2.20 115.11 119.79 1p2g h GLN 723 Ca -0.02 -0.02 -0.30 0.00 0.06 0.00 0.00 58.65 58.38 1p2g h GLN 723 Cb 1.10 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.76 1p2g h GLN 723 CO 0.10 0.26 -1.59 -0.09 -0.67 0.00 0.00 178.83 176.84 1p2g h ARG 724 N 0.40 0.13 0.00 1.46 2.43 -1.53 -3.51 114.38 113.76 1p2g h ARG 724 Ca 0.14 -0.21 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1p2g h ARG 724 Cb 0.08 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 1p2g h ARG 724 CO -0.03 0.88 0.00 0.41 -1.51 0.00 0.00 179.97 179.72 1p2g n GLY 725 N 1.63 2.55 3.63 2.80 0.00 0.11 -5.03 105.19 110.88 1p2g n GLY 725 Ca -0.16 -1.25 -0.41 0.00 0.00 0.00 0.00 46.02 44.19 1p2g n GLY 725 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1p2g s TYR 726 N 0.00 3.29 -0.44 1.61 5.04 -1.22 -4.85 117.35 120.78 1p2g s TYR 726 Ca 0.00 1.00 0.04 0.00 -2.44 0.00 0.00 57.07 55.67 1p2g s TYR 726 Cb 0.00 -2.97 0.12 0.00 0.35 0.00 0.00 41.96 39.45 1p2g s TYR 726 CO 0.00 -0.38 0.17 1.21 -1.34 0.00 0.00 175.55 175.21 1p2g s ASN 727 N 1.40 4.49 0.44 4.32 3.04 -1.26 -4.97 114.94 122.40 1p2g s ASN 727 Ca 0.31 -2.66 0.16 0.00 0.04 0.00 0.00 52.86 50.72 1p2g s ASN 727 Cb -0.15 -1.63 1.08 0.00 -1.54 0.00 0.00 41.25 39.01 1p2g s ASN 727 CO 0.08 -0.29 1.95 0.00 -3.04 0.00 0.00 177.10 175.79 1p2g h ALA 728 N 6.96 2.12 -0.88 1.71 0.00 -1.87 -1.68 119.26 125.62 1p2g h ALA 728 Ca -0.06 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 54.97 1p2g h ALA 728 Cb 0.94 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.61 1p2g h ALA 728 CO 0.62 -0.30 0.57 0.37 0.00 0.00 0.00 179.25 180.51 1p2g h GLN 729 N 0.37 0.72 -0.96 0.00 5.75 -1.92 -1.46 115.11 117.61 1p2g h GLN 729 Ca 0.33 -0.04 0.08 0.00 -0.15 0.00 0.00 58.65 58.86 1p2g h GLN 729 Cb 0.76 -0.16 -0.07 0.00 1.07 0.00 0.00 27.48 29.09 1p2g h GLN 729 CO -0.09 0.47 0.62 1.49 -2.65 0.00 0.00 178.83 178.67 1p2g h GLU 730 N 0.74 1.04 -0.10 1.69 4.81 -1.72 -0.16 114.58 120.88 1p2g h GLU 730 Ca 0.43 -0.06 -0.23 0.00 -0.13 0.00 0.00 59.36 59.37 1p2g h GLU 730 Cb 0.62 -0.23 0.01 0.00 0.63 0.00 0.00 28.75 29.78 1p2g h GLU 730 CO -0.19 0.69 -0.85 1.88 -0.73 0.00 0.00 179.01 179.80 1p2g h TYR 731 N 1.07 0.98 -0.73 0.92 -1.99 -1.42 -2.71 116.97 113.09 1p2g h TYR 731 Ca 0.43 -0.46 -0.01 0.00 2.00 0.00 0.00 58.73 60.69 1p2g h TYR 731 Cb 0.25 -0.14 -0.04 0.00 2.00 0.00 0.00 36.73 38.81 1p2g h TYR 731 CO -0.00 1.29 0.43 -0.92 -0.00 0.00 0.00 178.16 178.95 1p2g h TYR 732 N 0.46 0.96 0.00 4.88 5.03 -0.92 -1.21 116.97 126.16 1p2g h TYR 732 Ca -0.07 -0.00 -0.15 0.00 2.58 0.00 0.00 58.73 61.09 1p2g h TYR 732 Cb 1.48 -0.31 -0.02 0.00 1.55 0.00 0.00 36.73 39.42 1p2g h TYR 732 CO 0.08 0.65 -0.69 -0.44 -1.32 0.00 0.00 178.16 176.44 1p2g h ASP 733 N 1.00 0.00 0.07 -2.11 3.32 -1.05 -3.34 116.42 114.32 1p2g h ASP 733 Ca 0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.31 1p2g h ASP 733 Cb -0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.53 1p2g h ASP 733 CO -0.05 0.69 -0.71 0.54 -1.72 0.00 0.00 179.24 178.00 1p2g n ARG 734 N -3.48 0.47 -3.90 3.56 1.74 -1.00 -4.80 116.66 109.25 1p2g n ARG 734 Ca 0.00 -0.37 -0.30 0.00 -0.77 0.00 0.00 57.85 56.40 1p2g n ARG 734 Cb 0.74 -1.49 -0.15 0.00 -1.02 0.00 0.00 32.46 30.54 1p2g n ARG 734 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1p2g s ILE 735 N -2.79 1.87 0.22 0.55 1.01 -0.49 -5.00 121.20 116.58 1p2g s ILE 735 Ca 0.13 -2.28 -0.11 0.00 0.00 0.00 0.00 60.65 58.39 1p2g s ILE 735 Cb 0.17 -2.37 0.24 0.00 0.01 0.00 0.00 42.46 40.52 1p2g s ILE 735 CO 0.72 -0.68 1.63 -0.65 0.00 0.00 0.00 174.94 175.96 1p2g h PRO 736 N 7.47 0.04 -0.69 2.79 0.11 -1.87 -0.37 132.00 139.48 1p2g h PRO 736 Ca -0.07 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.01 1p2g h PRO 736 Cb 0.99 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.06 1p2g h PRO 736 CO 0.53 0.03 0.32 0.93 -0.21 0.00 0.00 178.00 179.59 1p2g h GLU 737 N 0.04 0.99 -0.45 1.05 5.08 -1.96 -1.56 114.58 117.77 1p2g h GLU 737 Ca 0.33 -0.14 -0.13 0.00 -1.00 0.00 0.00 59.36 58.42 1p2g h GLU 737 Cb 0.54 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1p2g h GLU 737 CO -0.64 0.78 -0.23 1.25 -1.00 0.00 0.00 179.01 179.16 1p2g h LEU 738 N 0.98 0.99 -0.40 1.33 5.85 -1.55 -2.76 115.31 119.75 1p2g h LEU 738 Ca 0.24 -0.41 0.00 0.00 0.84 0.00 0.00 57.88 58.55 1p2g h LEU 738 Cb 0.12 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 1p2g h LEU 738 CO -0.03 1.18 0.26 -0.09 -0.34 0.00 0.00 178.44 179.42 1p2g h ARG 739 N 0.80 0.53 -0.67 1.25 2.43 -0.75 -2.16 114.38 115.81 1p2g h ARG 739 Ca 0.10 -0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.26 1p2g h ARG 739 Cb 0.81 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 30.21 1p2g h ARG 739 CO 0.07 0.35 0.43 0.37 -1.51 0.00 0.00 179.97 179.68 1p2g h GLN 740 N 0.54 0.82 -0.42 0.20 4.15 -1.21 -1.16 115.11 118.03 1p2g h GLN 740 Ca 0.15 -0.05 0.01 0.00 0.77 0.00 0.00 58.65 59.52 1p2g h GLN 740 Cb -0.06 -0.19 -0.02 0.00 0.21 0.00 0.00 27.48 27.43 1p2g h GLN 740 CO -0.03 0.55 0.27 0.82 -1.93 0.00 0.00 178.83 178.51 1p2g h ILE 741 N 0.85 1.10 -0.82 2.39 2.04 -1.19 -0.71 117.51 121.18 1p2g h ILE 741 Ca 0.26 -0.19 -0.04 0.00 1.00 0.00 0.00 64.86 65.89 1p2g h ILE 741 Cb -0.02 0.49 -0.04 0.00 -0.74 0.00 0.00 36.82 36.51 1p2g h ILE 741 CO -0.09 0.10 0.37 0.40 0.00 0.00 0.00 178.15 178.93 1p2g h ILE 742 N 0.56 1.26 -0.32 -0.67 1.08 -0.99 -1.84 117.51 116.59 1p2g h ILE 742 Ca 0.15 -0.75 -0.08 0.00 -0.39 0.00 0.00 64.86 63.79 1p2g h ILE 742 Cb -0.06 0.23 -0.02 0.00 -3.07 0.00 0.00 36.82 33.91 1p2g h ILE 742 CO -0.04 0.32 -0.16 -0.33 -0.69 0.00 0.00 178.15 177.25 1p2g h GLU 743 N 1.17 0.57 -0.53 2.37 5.08 -0.81 -1.49 114.58 120.94 1p2g h GLU 743 Ca 0.28 -0.18 -0.11 0.00 -1.00 0.00 0.00 59.36 58.34 1p2g h GLU 743 Cb 0.15 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 1p2g h GLU 743 CO -0.03 0.71 -0.10 1.96 -1.00 0.00 0.00 179.01 180.55 1p2g h GLN 744 N 0.51 1.00 -0.54 2.33 4.20 -0.57 0.89 115.11 122.93 1p2g h GLN 744 Ca 0.09 -0.37 -0.10 0.00 0.06 0.00 0.00 58.65 58.33 1p2g h GLN 744 Cb 0.57 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.27 1p2g h GLN 744 CO 0.04 1.05 -0.06 -0.07 -0.67 0.00 0.00 178.83 179.11 1p2g h LEU 745 N 0.87 0.95 -0.09 1.46 3.38 -1.09 -0.95 115.31 119.84 1p2g h LEU 745 Ca 0.14 -0.29 -0.23 0.00 0.09 0.00 0.00 57.88 57.59 1p2g h LEU 745 Cb 0.66 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 41.17 1p2g h LEU 745 CO 0.05 1.04 -0.85 0.28 0.09 0.00 0.00 178.44 179.05 1p2g h SER 746 N 0.88 0.90 0.92 -0.43 0.02 -1.13 -3.26 113.55 111.45 1p2g h SER 746 Ca 0.15 -0.67 0.00 0.00 -0.84 0.00 0.00 61.79 60.42 1p2g h SER 746 Cb 0.60 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.87 1p2g h SER 746 CO 0.04 1.44 0.00 0.77 -1.14 0.00 0.00 176.83 177.94 1p2g h SER 747 N 0.44 0.00 0.00 3.07 4.64 -0.79 -3.43 113.55 117.48 1p2g h SER 747 Ca -0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 1p2g h SER 747 Cb 1.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.58 1p2g h SER 747 CO 0.17 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.74 1p2g n GLY 748 N 0.18 0.90 0.30 -0.77 0.00 -1.03 -4.84 105.19 99.93 1p2g n GLY 748 Ca 0.02 -0.13 0.12 0.00 0.00 0.00 0.00 46.02 46.04 1p2g n GLY 748 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1p2g h PHE 749 N 0.00 0.00 -0.28 1.61 3.04 -1.45 -1.16 116.94 118.70 1p2g h PHE 749 Ca 0.00 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.95 1p2g h PHE 749 Cb 0.00 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.51 1p2g h PHE 749 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 178.31 177.48 1p2g n PHE 750 N -4.48 0.35 -2.92 0.41 3.72 -1.26 -4.62 117.46 108.66 1p2g n PHE 750 Ca 0.02 -0.22 -0.14 0.00 -0.05 0.00 0.00 57.45 57.05 1p2g n PHE 750 Cb 0.28 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.81 1p2g n PHE 750 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1p2g n SER 751 N 1.13 -1.74 -0.22 4.37 3.41 -0.49 -4.80 113.62 115.28 1p2g n SER 751 Ca 0.15 -3.05 0.03 0.00 -0.26 0.00 0.00 58.87 55.73 1p2g n SER 751 Cb 0.51 0.88 0.14 0.00 -0.26 0.00 0.00 64.21 65.47 1p2g n SER 751 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1p2g h PRO 752 N 4.05 0.25 0.00 4.33 0.11 -1.68 -1.70 132.00 137.35 1p2g h PRO 752 Ca -0.06 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.04 1p2g h PRO 752 Cb 0.97 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.03 1p2g h PRO 752 CO 0.37 0.16 -0.11 1.63 -0.21 0.00 0.00 178.00 179.85 1p2g n LYS 753 N -5.15 0.23 -3.31 1.05 5.02 -1.26 -4.23 118.16 110.51 1p2g n LYS 753 Ca 0.11 0.17 -0.25 0.00 -2.02 0.00 0.00 58.31 56.32 1p2g n LYS 753 Cb 0.38 -1.75 -0.08 0.00 -0.02 0.00 0.00 35.03 33.56 1p2g n LYS 753 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1p2g n GLN 754 N -2.14 0.82 -0.33 1.97 6.02 -0.69 -5.01 117.38 118.02 1p2g n GLN 754 Ca 0.05 -3.43 0.25 0.00 -0.01 0.00 0.00 57.00 53.87 1p2g n GLN 754 Cb 0.42 -1.51 0.48 0.00 1.02 0.00 0.00 30.24 30.66 1p2g n GLN 754 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.06 174.70 1p2g h PRO 755 N 4.54 0.11 -0.57 -1.09 0.11 -1.58 -0.43 132.00 133.09 1p2g h PRO 755 Ca 0.14 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 66.10 1p2g h PRO 755 Cb 0.86 -0.03 -0.08 0.00 0.11 0.00 0.00 31.00 31.86 1p2g h PRO 755 CO 0.49 0.08 0.14 -0.40 -0.21 0.00 0.00 178.00 178.10 1p2g n ASP 756 N -5.23 4.44 -0.29 -2.05 3.85 -1.26 -3.29 116.55 112.71 1p2g n ASP 756 Ca 0.32 -3.22 0.11 0.00 -0.71 0.00 0.00 54.79 51.29 1p2g n ASP 756 Cb 1.06 -0.68 0.34 0.00 -1.35 0.00 0.00 41.12 40.49 1p2g n ASP 756 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.20 176.44 1p2g h LEU 757 N 2.40 0.73 -3.69 -2.12 5.85 -1.39 -2.23 115.31 114.86 1p2g h LEU 757 Ca 0.17 0.04 -0.27 0.00 0.84 0.00 0.00 57.88 58.66 1p2g h LEU 757 Cb 2.02 -0.10 -0.16 0.00 0.37 0.00 0.00 40.66 42.79 1p2g h LEU 757 CO 0.56 0.38 0.28 0.49 -0.34 0.00 0.00 178.44 179.81 1p2g n PHE 758 N -4.58 2.21 0.04 1.25 3.01 -1.26 -4.58 117.46 113.55 1p2g n PHE 758 Ca 0.18 -1.43 0.04 0.00 1.01 0.00 0.00 57.45 57.25 1p2g n PHE 758 Cb 0.43 -0.69 0.44 0.00 -0.01 0.00 0.00 39.48 39.66 1p2g n PHE 758 CO 0.00 0.00 0.00 1.57 1.01 0.00 0.00 176.76 179.34 1p2g h LYS 759 N 1.79 0.46 -0.22 -1.08 2.10 -1.71 -2.07 116.57 115.85 1p2g h LYS 759 Ca 0.33 -0.03 -0.14 0.00 -2.00 0.00 0.00 60.65 58.81 1p2g h LYS 759 Cb 2.27 -0.10 -0.01 0.00 -0.90 0.00 0.00 32.23 33.49 1p2g h LYS 759 CO 0.72 0.33 -0.46 -0.44 -2.00 0.00 0.00 179.45 177.60 1p2g h ASP 760 N 0.47 0.60 0.43 7.07 3.32 -1.83 -1.03 116.42 125.46 1p2g h ASP 760 Ca 0.13 -0.29 -0.02 0.00 0.02 0.00 0.00 57.03 56.86 1p2g h ASP 760 Cb -0.02 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.37 1p2g h ASP 760 CO -0.02 0.98 -0.21 0.40 -1.72 0.00 0.00 179.24 178.67 1p2g h ILE 761 N 0.45 0.56 -0.54 0.35 1.08 -1.73 -1.25 117.51 116.43 1p2g h ILE 761 Ca 0.03 -0.26 0.04 0.00 -0.39 0.00 0.00 64.86 64.27 1p2g h ILE 761 Cb 0.98 0.69 -0.04 0.00 -3.07 0.00 0.00 36.82 35.38 1p2g h ILE 761 CO 0.09 0.05 0.30 0.58 -0.69 0.00 0.00 178.15 178.47 1p2g h VAL 762 N -0.74 1.00 -0.37 1.67 2.07 -1.47 -0.70 116.25 117.71 1p2g h VAL 762 Ca -0.06 -0.20 0.04 0.00 0.82 0.00 0.00 66.70 67.30 1p2g h VAL 762 Cb 0.52 0.37 -0.04 0.00 -1.52 0.00 0.00 31.29 30.62 1p2g h VAL 762 CO 0.10 0.11 0.13 -1.13 0.02 0.00 0.00 177.57 176.79 1p2g h ASN 763 N 0.58 0.14 -0.58 0.57 -0.73 -1.10 0.76 115.58 115.21 1p2g h ASN 763 Ca 0.23 0.04 -0.06 0.00 1.87 0.00 0.00 56.30 58.38 1p2g h ASN 763 Cb 0.09 0.03 -0.02 0.00 0.27 0.00 0.00 38.32 38.68 1p2g h ASN 763 CO -0.13 0.12 0.12 -0.03 -0.37 0.00 0.00 177.43 177.13 1p2g h MET 764 N 0.28 0.95 -0.66 6.67 4.05 -0.83 0.90 114.93 126.30 1p2g h MET 764 Ca 0.17 -0.24 -0.05 0.00 -0.28 0.00 0.00 59.70 59.30 1p2g h MET 764 Cb 0.15 -0.12 -0.03 0.00 -0.80 0.00 0.00 31.60 30.80 1p2g h MET 764 CO -0.17 0.89 0.21 -0.07 0.23 0.00 0.00 176.91 178.00 1p2g h LEU 765 N 0.85 0.95 0.13 3.39 4.07 -0.69 0.26 115.31 124.28 1p2g h LEU 765 Ca 0.18 -0.20 -0.28 0.00 0.08 0.00 0.00 57.88 57.65 1p2g h LEU 765 Cb 0.38 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 41.88 1p2g h LEU 765 CO 0.01 0.90 -1.30 0.24 -1.08 0.00 0.00 178.44 177.21 1p2g h MET 766 N 0.95 0.28 0.00 1.13 2.86 -0.72 -3.41 114.93 116.02 1p2g h MET 766 Ca 0.21 -0.48 0.00 0.00 -2.06 0.00 0.00 59.70 57.37 1p2g h MET 766 Cb 0.29 0.18 0.00 0.00 0.06 0.00 0.00 31.60 32.12 1p2g h MET 766 CO -0.01 1.21 -0.96 0.72 1.06 0.00 0.00 176.91 178.93 1p2g n HIS 767 N -3.53 0.00 -2.70 -0.22 8.25 0.30 -4.36 115.22 112.97 1p2g n HIS 767 Ca -0.10 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.25 1p2g n HIS 767 Cb 1.03 0.00 0.02 0.00 1.12 0.00 0.00 29.99 32.16 1p2g n HIS 767 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1p2g n HIS 768 N -1.62 1.22 -3.11 4.41 8.25 -0.22 -5.03 115.22 119.13 1p2g n HIS 768 Ca 0.00 -2.91 -0.45 0.00 -0.26 0.00 0.00 57.72 54.11 1p2g n HIS 768 Cb 0.17 -0.37 -0.04 0.00 1.12 0.00 0.00 29.99 30.87 1p2g n HIS 768 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1p2g s ASP 769 N -3.09 6.24 0.54 0.41 3.68 -0.09 -4.80 116.67 119.56 1p2g s ASP 769 Ca 0.30 -1.53 0.35 0.00 2.13 0.00 0.00 52.55 53.79 1p2g s ASP 769 Cb 0.45 -2.31 1.57 0.00 -1.45 0.00 0.00 42.92 41.18 1p2g s ASP 769 CO 0.01 -1.09 2.04 0.03 0.13 0.00 0.00 175.17 176.29 1p2g h ARG 770 N 9.10 0.00 -0.55 4.34 3.08 -1.96 -3.12 114.38 125.27 1p2g h ARG 770 Ca -0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.80 1p2g h ARG 770 Cb 1.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.13 1p2g h ARG 770 CO 1.09 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 181.18 1p2g n PHE 771 N -2.97 0.85 -3.94 3.04 3.72 -1.26 -5.01 117.46 111.89 1p2g n PHE 771 Ca -0.00 -0.53 -0.32 0.00 -0.05 0.00 0.00 57.45 56.55 1p2g n PHE 771 Cb 0.23 -0.06 -0.00 0.00 -0.94 0.00 0.00 39.48 38.71 1p2g n PHE 771 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1p2g n LYS 772 N 1.03 -1.84 -0.18 -1.08 5.02 -1.18 -4.75 118.16 115.18 1p2g n LYS 772 Ca 0.20 0.32 -0.06 0.00 -2.02 0.00 0.00 58.31 56.75 1p2g n LYS 772 Cb 0.60 -3.93 0.04 0.00 -0.02 0.00 0.00 35.03 31.71 1p2g n LYS 772 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1p2g h VAL 773 N -2.00 1.07 -0.54 -0.18 2.07 -1.93 -2.72 116.25 112.02 1p2g h VAL 773 Ca -0.66 -0.22 -0.04 0.00 0.82 0.00 0.00 66.70 66.60 1p2g h VAL 773 Cb 1.38 0.37 -0.03 0.00 -1.52 0.00 0.00 31.29 31.49 1p2g h VAL 773 CO 0.57 0.12 0.18 -0.26 0.02 0.00 0.00 177.57 178.20 1p2g h PHE 774 N 0.64 0.81 -0.51 1.57 0.05 -1.91 -2.98 116.94 114.61 1p2g h PHE 774 Ca 0.21 -0.05 0.15 0.00 3.82 0.00 0.00 57.97 62.09 1p2g h PHE 774 Cb 0.00 -0.25 -0.02 0.00 2.00 0.00 0.00 35.95 37.69 1p2g h PHE 774 CO -0.06 0.65 0.38 0.00 -0.18 0.00 0.00 178.31 179.10 1p2g h ALA 775 N 1.42 2.46 -0.10 2.45 0.00 -1.86 -2.09 119.26 121.54 1p2g h ALA 775 Ca 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1p2g h ALA 775 Cb 0.21 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1p2g h ALA 775 CO -0.01 -0.64 0.00 -0.25 0.00 0.00 0.00 179.25 178.35 1p2g n ASP 776 N -4.34 2.47 0.26 0.00 8.00 -1.13 -4.71 116.55 117.09 1p2g n ASP 776 Ca 0.09 -1.71 -0.16 0.00 0.71 0.00 0.00 54.79 53.72 1p2g n ASP 776 Cb 0.60 -0.05 -0.08 0.00 -0.02 0.00 0.00 41.12 41.56 1p2g n ASP 776 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1p2g h TYR 777 N 3.02 -1.06 -0.06 1.24 5.03 -1.29 -0.73 116.97 123.12 1p2g h TYR 777 Ca 0.00 0.00 0.04 0.00 2.58 0.00 0.00 58.73 61.35 1p2g h TYR 777 Cb 0.68 0.41 -0.05 0.00 1.55 0.00 0.00 36.73 39.32 1p2g h TYR 777 CO 0.05 -0.55 -0.22 0.93 -1.32 0.00 0.00 178.16 177.05 1p2g h GLU 778 N -0.83 -0.31 -0.23 1.82 5.08 -1.84 -1.13 114.58 117.15 1p2g h GLU 778 Ca -0.04 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 1p2g h GLU 778 Cb 0.73 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 1p2g h GLU 778 CO -0.04 -0.21 0.01 1.49 -1.00 0.00 0.00 179.01 179.26 1p2g h GLU 779 N -0.32 0.33 0.08 2.33 4.81 -1.87 -2.24 114.58 117.71 1p2g h GLU 779 Ca 0.08 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.25 1p2g h GLU 779 Cb 0.43 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.75 1p2g h GLU 779 CO -0.25 0.35 -0.04 -0.92 -0.73 0.00 0.00 179.01 177.43 1p2g h TYR 780 N 0.33 -0.10 -0.55 0.92 3.20 -0.48 -1.69 116.97 118.60 1p2g h TYR 780 Ca 0.08 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.99 1p2g h TYR 780 Cb 0.20 0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.46 1p2g h TYR 780 CO 0.00 0.21 0.29 0.28 -1.64 0.00 0.00 178.16 177.30 1p2g h VAL 781 N -0.41 0.98 -0.34 1.81 2.07 -1.03 -0.10 116.25 119.23 1p2g h VAL 781 Ca -0.01 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.30 1p2g h VAL 781 Cb 0.35 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.47 1p2g h VAL 781 CO 0.02 0.10 0.15 0.11 0.02 0.00 0.00 177.57 177.97 1p2g h LYS 782 N 0.57 0.49 -0.64 1.57 1.57 -1.40 -2.06 116.57 116.67 1p2g h LYS 782 Ca 0.24 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 1p2g h LYS 782 Cb 0.12 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.31 1p2g h LYS 782 CO -0.15 0.47 0.37 0.00 -0.57 0.00 0.00 179.45 179.57 1p2g h GLN 784 N 0.89 0.06 -0.35 0.00 1.08 -0.52 -1.99 115.11 114.28 1p2g h GLN 784 Ca 0.23 -0.01 -0.15 0.00 -1.45 0.00 0.00 58.65 57.27 1p2g h GLN 784 Cb -0.01 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.40 1p2g h GLN 784 CO -0.04 0.21 -0.37 0.93 -0.95 0.00 0.00 178.83 178.60 1p2g h GLU 785 N 0.06 0.82 0.00 1.46 5.08 -0.44 -2.36 114.58 119.19 1p2g h GLU 785 Ca 0.01 -0.42 -0.05 0.00 -1.00 0.00 0.00 59.36 57.91 1p2g h GLU 785 Cb 0.29 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 1p2g h GLU 785 CO 0.02 1.05 -0.24 0.00 -1.00 0.00 0.00 179.01 178.84 1p2g h ARG 786 N 0.68 0.00 -0.15 2.33 3.08 -1.05 -1.13 114.38 118.13 1p2g h ARG 786 Ca 0.06 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.05 1p2g h ARG 786 Cb 0.93 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.98 1p2g h ARG 786 CO 0.09 0.24 -0.16 0.28 -1.07 0.00 0.00 179.97 179.35 1p2g h VAL 787 N 0.00 1.35 -0.87 2.04 2.07 -1.14 -2.31 116.25 117.39 1p2g h VAL 787 Ca -0.00 -1.33 -0.02 0.00 0.82 0.00 0.00 66.70 66.17 1p2g h VAL 787 Cb 0.58 1.88 -0.04 0.00 -1.52 0.00 0.00 31.29 32.18 1p2g h VAL 787 CO 0.03 0.39 0.45 0.28 0.02 0.00 0.00 177.57 178.74 1p2g h SER 788 N 0.00 1.12 -0.76 0.57 0.02 -0.97 -1.25 113.55 112.28 1p2g h SER 788 Ca 0.02 -0.12 -0.04 0.00 -0.84 0.00 0.00 61.79 60.82 1p2g h SER 788 Cb 0.69 -0.29 -0.03 0.00 0.14 0.00 0.00 62.40 62.91 1p2g h SER 788 CO 0.04 0.92 0.34 0.00 -1.14 0.00 0.00 176.83 176.98 1p2g h ALA 789 N 1.26 0.99 -0.07 3.77 0.00 -1.16 -2.65 119.26 121.40 1p2g h ALA 789 Ca 0.30 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.91 1p2g h ALA 789 Cb 0.07 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1p2g h ALA 789 CO -0.04 0.58 -0.54 1.25 0.00 0.00 0.00 179.25 180.50 1p2g h LEU 790 N 1.09 0.21 -1.45 0.00 5.85 -0.89 -2.96 115.31 117.16 1p2g h LEU 790 Ca 0.26 -0.11 -0.06 0.00 0.84 0.00 0.00 57.88 58.81 1p2g h LEU 790 Cb 0.16 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 1p2g h LEU 790 CO -0.03 0.71 -0.28 0.22 -0.34 0.00 0.00 178.44 178.73 1p2g h TYR 791 N 0.15 0.00 0.00 1.25 3.20 -0.90 -1.53 116.97 119.15 1p2g h TYR 791 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1p2g h TYR 791 Cb 1.00 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.27 1p2g h TYR 791 CO 0.02 0.28 0.00 0.87 -1.64 0.00 0.00 178.16 177.68 1p2g h LYS 792 N 0.00 0.00 -2.96 1.82 1.57 -1.32 -3.28 116.57 112.40 1p2g h LYS 792 Ca -0.00 0.00 -0.67 0.00 -1.87 0.00 0.00 60.65 58.11 1p2g h LYS 792 Cb 0.52 0.00 -0.38 0.00 0.08 0.00 0.00 32.23 32.45 1p2g h LYS 792 CO 0.04 0.00 -0.25 -1.71 -0.57 0.00 0.00 179.45 176.95 1p2g n ASN 793 N -2.66 3.99 -0.29 0.86 2.85 -0.57 -4.97 115.26 114.46 1p2g n ASN 793 Ca -0.01 -3.25 -0.01 0.00 -0.11 0.00 0.00 54.58 51.20 1p2g n ASN 793 Cb 0.15 -0.91 0.03 0.00 1.24 0.00 0.00 39.78 40.30 1p2g n ASN 793 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 1p2g n PRO 794 N 1.78 -0.18 -0.18 1.20 -0.02 -1.24 -1.07 135.00 135.29 1p2g n PRO 794 Ca 0.24 1.15 -0.05 0.00 -2.02 0.00 0.00 63.50 62.82 1p2g n PRO 794 Cb 0.37 -1.71 0.05 0.00 -0.02 0.00 0.00 33.50 32.19 1p2g n PRO 794 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1p2g h ARG 795 N 0.00 0.60 -0.01 -0.52 2.43 -1.93 -1.22 114.38 113.72 1p2g h ARG 795 Ca 0.26 -0.04 -0.17 0.00 -0.81 0.00 0.00 59.98 59.22 1p2g h ARG 795 Cb 0.44 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 1p2g h ARG 795 CO -0.74 0.39 -0.77 0.93 -1.51 0.00 0.00 179.97 178.27 1p2g h GLU 796 N 0.61 0.13 -0.07 0.20 4.39 -1.43 -1.95 114.58 116.47 1p2g h GLU 796 Ca 0.22 -0.13 -0.00 0.00 0.34 0.00 0.00 59.36 59.79 1p2g h GLU 796 Cb 0.05 0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1p2g h GLU 796 CO -0.11 0.84 0.03 2.35 -1.16 0.00 0.00 179.01 180.95 1p2g h TRP 797 N 0.08 0.10 -0.23 4.33 2.91 -0.94 -2.07 115.95 120.13 1p2g h TRP 797 Ca -0.02 -0.01 -0.03 0.00 1.13 0.00 0.00 58.89 59.96 1p2g h TRP 797 Cb 1.35 -0.03 -0.01 0.00 -0.51 0.00 0.00 29.16 29.96 1p2g h TRP 797 CO 0.02 0.23 0.02 1.15 -1.03 0.00 0.00 178.44 178.82 1p2g h THR 798 N -0.05 1.14 -0.09 2.65 2.02 -1.17 -1.00 112.91 116.40 1p2g h THR 798 Ca 0.02 -0.51 -0.14 0.00 0.77 0.00 0.00 66.41 66.54 1p2g h THR 798 Cb 0.17 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.52 1p2g h THR 798 CO -0.00 0.18 -0.58 0.03 0.37 0.00 0.00 175.52 175.52 1p2g h ARG 799 N 0.33 0.29 -0.26 6.66 3.08 -1.12 -0.75 114.38 122.61 1p2g h ARG 799 Ca 0.08 -0.19 -0.17 0.00 0.07 0.00 0.00 59.98 59.77 1p2g h ARG 799 Cb 0.20 0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.27 1p2g h ARG 799 CO 0.00 0.79 -0.52 1.98 -1.07 0.00 0.00 179.97 181.15 1p2g h MET 800 N 0.22 0.76 -0.50 0.04 4.05 -0.75 -2.66 114.93 116.09 1p2g h MET 800 Ca -0.00 -0.46 0.02 0.00 -0.28 0.00 0.00 59.70 58.98 1p2g h MET 800 Cb 1.08 0.05 -0.03 0.00 -0.80 0.00 0.00 31.60 31.89 1p2g h MET 800 CO 0.09 1.09 0.29 0.28 0.23 0.00 0.00 176.91 178.89 1p2g h VAL 801 N 0.59 1.04 -0.70 -5.77 2.07 -0.88 -1.50 116.25 111.10 1p2g h VAL 801 Ca 0.02 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1p2g h VAL 801 Cb 1.10 0.41 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 1p2g h VAL 801 CO 0.11 0.11 0.45 0.40 0.02 0.00 0.00 177.57 178.66 1p2g h ILE 802 N 0.59 1.19 0.00 4.57 2.04 -1.01 -1.01 117.51 123.87 1p2g h ILE 802 Ca 0.20 -0.36 -0.06 0.00 1.00 0.00 0.00 64.86 65.64 1p2g h ILE 802 Cb 0.03 0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 36.27 1p2g h ILE 802 CO -0.10 0.18 -0.27 0.03 0.00 0.00 0.00 178.15 178.00 1p2g h ARG 803 N 0.96 0.00 0.02 2.37 3.08 -0.95 -0.06 114.38 119.80 1p2g h ARG 803 Ca 0.26 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.30 1p2g h ARG 803 Cb -0.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.96 1p2g h ARG 803 CO -0.05 0.27 -0.01 -0.91 -1.07 0.00 0.00 179.97 178.20 1p2g h ASN 804 N 0.00 -0.02 -0.64 7.04 -0.26 -0.53 -3.20 115.58 117.96 1p2g h ASN 804 Ca -0.00 -0.72 0.07 0.00 -0.56 0.00 0.00 56.30 55.09 1p2g h ASN 804 Cb 0.61 0.01 -0.06 0.00 -1.06 0.00 0.00 38.32 37.82 1p2g h ASN 804 CO 0.04 0.79 0.32 0.40 -1.06 0.00 0.00 177.43 177.92 1p2g h ILE 805 N -0.92 0.90 0.00 2.81 2.04 -1.17 -1.60 117.51 119.57 1p2g h ILE 805 Ca -0.00 -0.20 -0.00 0.00 1.00 0.00 0.00 64.86 65.66 1p2g h ILE 805 Cb 0.74 0.27 -0.00 0.00 -0.74 0.00 0.00 36.82 37.09 1p2g h ILE 805 CO 0.00 0.11 -0.01 0.00 0.00 0.00 0.00 178.15 178.25 1p2g h ALA 806 N 1.37 1.10 -0.16 1.87 0.00 -1.11 -2.68 119.26 119.64 1p2g h ALA 806 Ca 0.30 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1p2g h ALA 806 Cb 0.26 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1p2g h ALA 806 CO -0.22 0.01 0.00 0.25 0.00 0.00 0.00 179.25 179.29 1p2g n THR 807 N -3.23 1.49 1.58 0.00 -2.24 -0.64 -2.26 114.28 108.97 1p2g n THR 807 Ca -0.03 -1.47 0.11 0.00 -2.27 0.00 0.00 64.05 60.39 1p2g n THR 807 Cb 0.10 0.17 0.49 0.00 -2.10 0.00 0.00 70.33 68.99 1p2g n THR 807 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1p2g n SER 808 N -0.40 0.96 -0.35 3.42 3.41 -0.95 -4.25 113.62 115.47 1p2g n SER 808 Ca 0.12 -1.54 0.10 0.00 -0.26 0.00 0.00 58.87 57.29 1p2g n SER 808 Cb 0.53 -0.05 0.29 0.00 -0.26 0.00 0.00 64.21 64.72 1p2g n SER 808 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1p2g h GLY 809 N 5.13 1.66 1.88 5.00 0.00 -1.79 -2.06 103.07 112.89 1p2g h GLY 809 Ca 0.00 -0.39 0.01 0.00 0.00 0.00 0.00 47.33 46.95 1p2g h GLY 809 CO 0.00 0.06 0.05 1.70 0.00 0.00 0.00 176.54 178.35 1p2g h LYS 810 N 0.87 0.00 -0.84 4.80 3.64 -1.89 -2.84 116.57 120.31 1p2g h LYS 810 Ca 0.53 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.83 1p2g h LYS 810 Cb 0.69 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.46 1p2g h LYS 810 CO -0.31 0.00 0.10 1.19 -2.27 0.00 0.00 179.45 178.16 1p2g n PHE 811 N -3.78 1.28 -2.95 1.91 3.01 -0.77 -4.76 117.46 111.39 1p2g n PHE 811 Ca -0.02 -0.63 -0.40 0.00 1.01 0.00 0.00 57.45 57.41 1p2g n PHE 811 Cb 0.14 -0.41 -0.05 0.00 -0.01 0.00 0.00 39.48 39.15 1p2g n PHE 811 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1p2g s SER 812 N -0.36 7.19 0.06 4.37 0.15 -1.07 -0.55 113.70 123.49 1p2g s SER 812 Ca 0.30 1.43 0.08 0.00 0.70 0.00 0.00 55.95 58.46 1p2g s SER 812 Cb 0.23 -2.47 0.38 0.00 -1.71 0.00 0.00 66.02 62.45 1p2g s SER 812 CO 0.08 -0.06 1.25 -1.54 1.20 0.00 0.00 173.24 174.17 1p2g n SER 813 N 3.21 0.13 -0.14 5.45 3.41 -0.43 -1.39 113.62 123.85 1p2g n SER 813 Ca -0.01 0.55 -0.12 0.00 -0.26 0.00 0.00 58.87 59.03 1p2g n SER 813 Cb 0.51 -0.57 -0.02 0.00 -0.26 0.00 0.00 64.21 63.87 1p2g n SER 813 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1p2g h ASP 814 N 0.00 0.93 -0.01 4.04 3.32 -1.91 0.17 116.42 122.96 1p2g h ASP 814 Ca 0.00 -0.42 -0.00 0.00 0.02 0.00 0.00 57.03 56.63 1p2g h ASP 814 Cb 0.08 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.37 1p2g h ASP 814 CO 0.00 1.15 0.00 -0.09 -1.72 0.00 0.00 179.24 178.58 1p2g h ARG 815 N 0.72 0.01 -0.27 3.56 1.12 -1.55 -1.00 114.38 116.97 1p2g h ARG 815 Ca 0.09 -0.00 0.06 0.00 -1.11 0.00 0.00 59.98 59.02 1p2g h ARG 815 Cb 0.81 -0.00 -0.07 0.00 -0.01 0.00 0.00 29.97 30.70 1p2g h ARG 815 CO 0.07 0.26 -0.20 1.15 -3.11 0.00 0.00 179.97 178.14 1p2g h THR 816 N -0.24 0.46 -0.63 0.20 2.02 -1.45 -1.46 112.91 111.81 1p2g h THR 816 Ca 0.00 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.13 1p2g h THR 816 Cb 0.26 0.46 -0.03 0.00 -1.74 0.00 0.00 68.15 67.10 1p2g h THR 816 CO 0.00 0.00 0.18 0.40 0.37 0.00 0.00 175.52 176.47 1p2g h ILE 817 N -0.19 1.24 -0.20 3.11 1.08 -0.87 -1.85 117.51 119.83 1p2g h ILE 817 Ca 0.15 -0.85 -0.02 0.00 -0.39 0.00 0.00 64.86 63.75 1p2g h ILE 817 Cb 0.41 0.57 -0.01 0.00 -3.07 0.00 0.00 36.82 34.72 1p2g h ILE 817 CO -0.38 0.33 0.02 0.00 -0.69 0.00 0.00 178.15 177.43 1p2g h ALA 818 N 1.26 1.68 -0.05 1.87 0.00 -0.60 0.14 119.26 123.56 1p2g h ALA 818 Ca 0.20 -0.10 -0.23 0.00 0.00 0.00 0.00 54.91 54.78 1p2g h ALA 818 Cb 0.29 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.01 1p2g h ALA 818 CO -0.00 0.25 -0.86 1.96 0.00 0.00 0.00 179.25 180.59 1p2g h GLN 819 N 0.28 0.67 -0.26 0.00 4.20 -0.52 -2.41 115.11 117.07 1p2g h GLN 819 Ca 0.07 -0.65 0.00 0.00 0.06 0.00 0.00 58.65 58.12 1p2g h GLN 819 Cb 0.15 0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 1p2g h GLN 819 CO 0.00 1.25 0.16 1.88 -0.67 0.00 0.00 178.83 181.46 1p2g h TYR 820 N 0.34 0.33 -0.23 2.96 0.05 -0.99 0.43 116.97 119.87 1p2g h TYR 820 Ca -0.09 0.00 0.04 0.00 0.05 0.00 0.00 58.73 58.73 1p2g h TYR 820 Cb 1.51 -0.11 -0.03 0.00 1.01 0.00 0.00 36.73 39.11 1p2g h TYR 820 CO 0.11 0.23 0.01 0.00 -1.05 0.00 0.00 178.16 177.46 1p2g h ALA 821 N 1.07 0.21 0.18 3.88 0.00 -0.98 0.12 119.26 123.74 1p2g h ALA 821 Ca 0.09 0.06 -0.31 0.00 0.00 0.00 0.00 54.91 54.75 1p2g h ALA 821 Cb -0.01 0.10 0.03 0.00 0.00 0.00 0.00 17.79 17.90 1p2g h ALA 821 CO -0.02 -0.41 -1.35 0.00 0.00 0.00 0.00 179.25 177.47 1p2g h ARG 822 N 0.08 0.52 0.00 0.00 3.08 -1.35 0.56 114.38 117.27 1p2g h ARG 822 Ca 0.11 -0.81 0.00 0.00 0.07 0.00 0.00 59.98 59.35 1p2g h ARG 822 Cb 0.13 0.29 0.00 0.00 0.08 0.00 0.00 29.97 30.47 1p2g h ARG 822 CO -0.17 1.37 -0.79 0.39 -1.07 0.00 0.00 179.97 179.70 1p2g n GLU 823 N -3.71 0.02 0.00 0.04 1.02 0.13 -4.30 120.64 113.84 1p2g n GLU 823 Ca -0.14 -0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.00 1p2g n GLU 823 Cb 1.05 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.96 1p2g n GLU 823 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1p2g n ILE 824 N -1.53 0.00 0.11 -3.67 5.41 0.26 -4.87 119.36 115.07 1p2g n ILE 824 Ca 0.04 0.00 0.08 0.00 1.00 0.00 0.00 62.75 63.87 1p2g n ILE 824 Cb 0.34 -0.94 0.00 0.00 -0.71 0.00 0.00 39.64 38.33 1p2g n ILE 824 CO 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 176.55 176.05 1p2g h TRP 825 N 0.00 0.00 -3.41 1.39 6.55 -1.07 -3.49 115.95 115.92 1p2g h TRP 825 Ca 0.00 0.00 -0.16 0.00 0.95 0.00 0.00 58.89 59.68 1p2g h TRP 825 Cb 0.58 0.00 0.07 0.00 -0.86 0.00 0.00 29.16 28.95 1p2g h TRP 825 CO 0.00 0.20 -0.33 0.41 -1.05 0.00 0.00 178.44 177.67 1p2g n GLY 826 N 1.23 0.18 3.00 1.49 0.00 0.17 -4.96 105.19 106.30 1p2g n GLY 826 Ca -0.02 -0.24 -0.13 0.00 0.00 0.00 0.00 46.02 45.63 1p2g n GLY 826 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1p2g s VAL 827 N -3.15 0.40 -0.19 1.61 -7.23 0.25 -5.00 120.40 107.08 1p2g s VAL 827 Ca 0.12 -0.72 -0.15 0.00 -1.81 0.00 0.00 61.98 59.42 1p2g s VAL 827 Cb -0.05 -0.43 -0.04 0.00 0.56 0.00 0.00 36.38 36.41 1p2g s VAL 827 CO 0.33 -0.23 0.37 -1.61 -0.31 0.00 0.00 175.10 173.65 1p2g s GLU 828 N -1.02 4.19 0.61 4.82 0.41 -1.26 -3.56 118.70 122.88 1p2g s GLU 828 Ca -0.07 0.17 -0.16 0.00 -0.41 0.00 0.00 54.97 54.50 1p2g s GLU 828 Cb -0.07 -3.52 -0.03 0.00 -1.78 0.00 0.00 34.13 28.74 1p2g s GLU 828 CO -0.00 0.01 1.07 -1.25 -0.49 0.00 0.00 175.26 174.60 1p2g s PRO 829 N 1.15 3.21 -0.01 0.39 0.04 -1.26 -4.94 135.00 133.57 1p2g s PRO 829 Ca 0.18 1.25 -0.03 0.00 0.04 0.00 0.00 61.00 62.45 1p2g s PRO 829 Cb -0.14 -2.01 -0.00 0.00 0.04 0.00 0.00 34.50 32.38 1p2g s PRO 829 CO 0.07 -0.91 0.05 -1.54 0.04 0.00 0.00 177.00 174.72 1p2g s SER 830 N -2.72 0.05 0.00 6.66 1.04 -0.35 -5.02 113.70 113.35 1p2g s SER 830 Ca 0.64 -0.14 0.16 0.00 0.48 0.00 0.00 55.95 57.10 1p2g s SER 830 Cb -0.17 0.14 0.32 0.00 0.10 0.00 0.00 66.02 66.41 1p2g s SER 830 CO 0.38 -0.19 1.23 0.54 0.98 0.00 0.00 173.24 176.18 1p2g n ARG 831 N 2.24 2.16 -1.69 4.02 5.12 -1.26 -3.15 116.66 124.10 1p2g n ARG 831 Ca -0.18 -1.97 -0.42 0.00 -1.93 0.00 0.00 57.85 53.35 1p2g n ARG 831 Cb 0.57 -1.37 -0.03 0.00 -1.16 0.00 0.00 32.46 30.47 1p2g n ARG 831 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1p2g n GLN 832 N 0.98 2.80 -2.15 5.56 1.13 -1.26 -4.94 117.38 119.51 1p2g n GLN 832 Ca 0.14 1.02 -0.39 0.00 -1.94 0.00 0.00 57.00 55.83 1p2g n GLN 832 Cb 0.47 -2.92 -0.01 0.00 0.11 0.00 0.00 30.24 27.89 1p2g n GLN 832 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1p2g s ARG 833 N 2.92 4.10 0.15 -1.09 3.00 -1.26 -4.97 118.95 121.80 1p2g s ARG 833 Ca 0.83 2.07 -0.13 0.00 0.00 0.00 0.00 55.73 58.49 1p2g s ARG 833 Cb -0.48 -2.82 -0.07 0.00 0.00 0.00 0.00 34.95 31.58 1p2g s ARG 833 CO 0.38 -0.35 0.54 -1.17 0.00 0.00 0.00 175.30 174.69 1p2g s LEU 834 N -2.27 4.32 0.25 2.53 2.96 -0.10 -5.01 118.68 121.36 1p2g s LEU 834 Ca 0.55 1.04 -0.30 0.00 -0.22 0.00 0.00 54.13 55.19 1p2g s LEU 834 Cb -0.36 -3.29 -0.14 0.00 0.50 0.00 0.00 46.19 42.90 1p2g s LEU 834 CO 0.47 0.09 1.19 -0.81 -1.32 0.00 0.00 176.35 175.97 1p2g n PRO 835 N 0.71 1.57 0.00 0.98 -0.04 -1.26 -4.65 135.00 132.32 1p2g n PRO 835 Ca -0.05 0.56 0.13 0.00 -0.04 0.00 0.00 63.50 64.10 1p2g n PRO 835 Cb 0.52 -2.06 0.80 0.00 -0.04 0.00 0.00 33.50 32.71 1p2g n PRO 835 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46