#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1abb h LYS 11 N 0.00 0.00 0.00 -0.14 1.79 -2.12 -2.52 116.57 113.58 1abb h LYS 11 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1abb h LYS 11 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1abb h LYS 11 CO 0.00 0.00 0.00 0.94 -1.08 0.00 0.00 179.45 179.31 1abb n GLN 12 N -2.98 0.07 -3.62 3.15 0.00 -1.26 -4.43 117.38 108.31 1abb n GLN 12 Ca -0.03 0.18 -0.39 0.00 -0.00 0.00 0.00 57.00 56.76 1abb n GLN 12 Cb 0.07 -1.50 -0.08 0.00 0.00 0.00 0.00 30.24 28.74 1abb n GLN 12 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 1abb s ILE 13 N -2.89 4.18 0.06 1.69 1.01 -0.95 -5.05 121.20 119.26 1abb s ILE 13 Ca 0.11 -2.70 0.02 0.00 0.00 0.00 0.00 60.65 58.08 1abb s ILE 13 Cb 0.11 -3.69 -0.03 0.00 0.01 0.00 0.00 42.46 38.86 1abb s ILE 13 CO 0.30 -0.90 -0.08 -0.55 0.00 0.00 0.00 174.94 173.72 1abb s SER 14 N 1.26 1.04 0.60 3.58 0.15 -1.26 -4.97 113.70 114.10 1abb s SER 14 Ca 0.16 -0.70 0.33 0.00 0.70 0.00 0.00 55.95 56.44 1abb s SER 14 Cb -0.19 0.04 1.95 0.00 -1.71 0.00 0.00 66.02 66.12 1abb s SER 14 CO -0.04 -0.27 2.27 0.58 1.20 0.00 0.00 173.24 176.98 1abb h VAL 15 N 4.00 0.39 0.07 4.45 2.07 -1.96 -3.42 116.25 121.85 1abb h VAL 15 Ca -0.36 -0.05 0.02 0.00 0.82 0.00 0.00 66.70 67.13 1abb h VAL 15 Cb 1.19 1.03 -0.04 0.00 -1.52 0.00 0.00 31.29 31.95 1abb h VAL 15 CO 0.48 0.01 -0.29 0.08 0.02 0.00 0.00 177.57 177.87 1abb h ARG 16 N 0.00 -0.46 -0.83 1.57 0.11 -1.98 -3.35 114.38 109.45 1abb h ARG 16 Ca -0.00 0.03 -0.05 0.00 0.10 0.00 0.00 59.98 60.06 1abb h ARG 16 Cb 0.03 0.10 -0.03 0.00 1.11 0.00 0.00 29.97 31.18 1abb h ARG 16 CO 0.00 -0.30 0.07 0.41 0.10 0.00 0.00 179.97 180.25 1abb n GLY 17 N -1.40 2.48 1.97 0.08 0.00 -1.26 -4.65 105.19 102.41 1abb n GLY 17 Ca -0.06 -0.50 -0.19 0.00 0.00 0.00 0.00 46.02 45.27 1abb n GLY 17 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1abb n LEU 18 N 0.19 5.99 -3.65 0.99 4.32 -1.26 -4.93 117.00 118.65 1abb n LEU 18 Ca 0.18 -3.18 -0.02 0.00 -0.02 0.00 0.00 56.01 52.96 1abb n LEU 18 Cb 0.82 -0.78 -0.01 0.00 -1.62 0.00 0.00 43.42 41.83 1abb n LEU 18 CO 0.20 0.95 0.88 0.00 -1.22 0.00 0.00 177.39 178.20 1abb s ALA 19 N -2.60 -1.94 0.00 -1.18 0.00 -1.26 -5.03 121.76 109.74 1abb s ALA 19 Ca 0.45 0.63 0.00 0.00 0.00 0.00 0.00 51.96 53.04 1abb s ALA 19 Cb 0.38 0.42 0.00 0.00 0.00 0.00 0.00 23.12 23.91 1abb s ALA 19 CO 0.08 -0.95 0.30 0.41 0.00 0.00 0.00 175.76 175.60 1abb n GLY 20 N -0.40 -0.85 5.50 0.00 0.00 -1.26 -5.15 105.19 103.03 1abb n GLY 20 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1abb n GLY 20 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1abb n VAL 21 N -0.02 0.00 -1.53 1.61 3.14 -1.26 -4.44 118.33 115.83 1abb n VAL 21 Ca 0.00 0.00 -0.14 0.00 -2.96 0.00 0.00 64.34 61.24 1abb n VAL 21 Cb 0.35 0.00 -0.11 0.00 -1.06 0.00 0.00 33.84 33.03 1abb n VAL 21 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1abb n GLU 22 N 10.09 0.36 -3.51 1.45 -0.58 -1.26 -4.59 120.64 122.61 1abb n GLU 22 Ca 0.00 -0.76 0.00 0.00 -0.42 0.00 0.00 57.16 55.98 1abb n GLU 22 Cb 0.00 -3.09 -0.04 0.00 -0.57 0.00 0.00 31.44 27.74 1abb n GLU 22 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 1abb s ASN 23 N 7.99 -0.83 0.17 1.62 3.84 -1.26 -5.05 114.94 121.43 1abb s ASN 23 Ca 0.95 1.14 0.01 0.00 0.21 0.00 0.00 52.86 55.17 1abb s ASN 23 Cb -0.26 1.95 0.04 0.00 -0.55 0.00 0.00 41.25 42.43 1abb s ASN 23 CO 0.19 -0.16 1.41 0.58 -2.79 0.00 0.00 177.10 176.33 1abb h VAL 24 N 5.72 1.45 0.00 -5.21 2.07 -1.83 -0.91 116.25 117.54 1abb h VAL 24 Ca -0.17 -2.41 -0.13 0.00 0.82 0.00 0.00 66.70 64.81 1abb h VAL 24 Cb 1.11 2.33 -0.02 0.00 -1.52 0.00 0.00 31.29 33.18 1abb h VAL 24 CO 0.09 0.71 -0.67 0.74 0.02 0.00 0.00 177.57 178.46 1abb h THR 25 N 0.16 1.05 0.21 2.57 2.02 -1.95 0.51 112.91 117.49 1abb h THR 25 Ca -0.04 -2.50 -0.34 0.00 0.77 0.00 0.00 66.41 64.30 1abb h THR 25 Cb 1.41 2.51 0.02 0.00 -1.74 0.00 0.00 68.15 70.35 1abb h THR 25 CO 0.13 0.60 -1.61 -0.33 0.37 0.00 0.00 175.52 174.68 1abb h GLU 26 N 0.00 0.45 -0.05 6.66 4.39 -1.87 -2.52 114.58 121.64 1abb h GLU 26 Ca -0.02 -0.76 -0.01 0.00 0.34 0.00 0.00 59.36 58.91 1abb h GLU 26 Cb 1.49 0.28 -0.00 0.00 -0.10 0.00 0.00 28.75 30.42 1abb h GLU 26 CO 0.08 1.36 -0.04 -0.07 -1.16 0.00 0.00 179.01 179.18 1abb h LEU 27 N 0.12 0.06 -0.31 1.33 3.38 -1.18 -1.60 115.31 117.11 1abb h LEU 27 Ca -0.29 -0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.56 1abb h LEU 27 Cb 2.12 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 42.85 1abb h LEU 27 CO 0.22 0.11 -0.24 0.11 0.09 0.00 0.00 178.44 178.73 1abb h LYS 28 N 0.07 0.71 -0.16 1.13 1.57 -0.84 -1.57 116.57 117.49 1abb h LYS 28 Ca 0.02 -0.35 -0.06 0.00 -1.87 0.00 0.00 60.65 58.38 1abb h LYS 28 Cb 0.11 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 1abb h LYS 28 CO 0.01 0.96 -0.18 -0.22 -0.57 0.00 0.00 179.45 179.45 1abb h LYS 29 N 0.47 0.26 0.00 3.15 3.64 -1.18 -0.51 116.57 122.41 1abb h LYS 29 Ca 0.06 -0.07 -0.16 0.00 -1.27 0.00 0.00 60.65 59.21 1abb h LYS 29 Cb 0.80 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.57 1abb h LYS 29 CO 0.06 0.45 -0.76 -0.91 -2.27 0.00 0.00 179.45 176.03 1abb h ASN 30 N 0.24 0.00 -0.37 4.20 2.35 -1.25 -2.13 115.58 118.63 1abb h ASN 30 Ca 0.04 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.74 1abb h ASN 30 Cb 0.47 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.83 1abb h ASN 30 CO 0.03 0.76 0.02 0.15 -1.65 0.00 0.00 177.43 176.73 1abb h PHE 31 N 0.00 0.69 -0.57 1.19 3.04 -0.54 -1.27 116.94 119.48 1abb h PHE 31 Ca -0.01 -0.11 -0.05 0.00 3.98 0.00 0.00 57.97 61.78 1abb h PHE 31 Cb 1.49 -0.18 -0.02 0.00 2.56 0.00 0.00 35.95 39.79 1abb h PHE 31 CO 0.00 0.72 0.17 -0.91 -2.02 0.00 0.00 178.31 176.27 1abb h ASN 32 N 0.46 0.85 -0.38 0.41 2.35 -1.16 -2.44 115.58 115.67 1abb h ASN 32 Ca 0.11 -0.22 0.04 0.00 -0.55 0.00 0.00 56.30 55.68 1abb h ASN 32 Cb 0.43 -0.22 -0.04 0.00 0.05 0.00 0.00 38.32 38.54 1abb h ASN 32 CO 0.02 0.84 0.14 0.03 -1.65 0.00 0.00 177.43 176.81 1abb h ARG 33 N 0.81 0.30 -0.10 0.81 3.08 -1.29 -3.03 114.38 114.96 1abb h ARG 33 Ca 0.18 -0.02 -0.24 0.00 0.07 0.00 0.00 59.98 59.98 1abb h ARG 33 Cb 0.30 -0.07 0.01 0.00 0.08 0.00 0.00 29.97 30.30 1abb h ARG 33 CO -0.00 0.20 -0.86 0.45 -1.07 0.00 0.00 179.97 178.69 1abb h HIS 34 N 0.31 1.06 -0.69 3.04 3.86 -1.03 0.37 115.15 122.07 1abb h HIS 34 Ca 0.17 -0.50 0.12 0.00 -1.16 0.00 0.00 60.37 59.00 1abb h HIS 34 Cb 0.13 -0.15 -0.09 0.00 1.06 0.00 0.00 27.41 28.37 1abb h HIS 34 CO -0.14 1.34 0.25 1.25 0.86 0.00 0.00 177.93 181.49 1abb h LEU 35 N 0.48 0.22 0.01 2.43 5.85 -1.45 0.16 115.31 123.00 1abb h LEU 35 Ca -0.08 0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 1abb h LEU 35 Cb 1.50 0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.61 1abb h LEU 35 CO 0.17 0.10 -0.00 0.45 -0.34 0.00 0.00 178.44 178.82 1abb h HIS 36 N 0.41 -0.01 0.00 1.25 3.86 -1.40 0.85 115.15 120.11 1abb h HIS 36 Ca 0.37 -0.00 -0.18 0.00 -1.16 0.00 0.00 60.37 59.40 1abb h HIS 36 Cb 0.52 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.96 1abb h HIS 36 CO -0.18 0.84 -1.79 1.19 0.86 0.00 0.00 177.93 178.85 1abb n PHE 37 N -4.68 0.51 -0.09 2.45 3.72 0.11 -2.49 117.46 116.99 1abb n PHE 37 Ca -0.09 0.17 -0.21 0.00 -0.05 0.00 0.00 57.45 57.26 1abb n PHE 37 Cb 0.41 -0.93 -0.12 0.00 -0.94 0.00 0.00 39.48 37.90 1abb n PHE 37 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1abb n THR 38 N -2.71 1.59 -0.02 4.37 -1.04 0.42 -4.55 114.28 112.34 1abb n THR 38 Ca -0.14 -0.52 -0.01 0.00 -2.04 0.00 0.00 64.05 61.33 1abb n THR 38 Cb 0.86 -1.64 -0.13 0.00 -1.82 0.00 0.00 70.33 67.60 1abb n THR 38 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1abb n LEU 39 N -3.58 0.40 -3.23 -4.42 4.32 -0.39 -5.00 117.00 105.09 1abb n LEU 39 Ca -0.42 0.18 -0.09 0.00 -0.02 0.00 0.00 56.01 55.65 1abb n LEU 39 Cb 0.97 0.20 0.02 0.00 -1.62 0.00 0.00 43.42 42.99 1abb n LEU 39 CO 0.27 0.23 0.17 0.52 -1.22 0.00 0.00 177.39 177.37 1abb n VAL 40 N -2.71 -8.93 -3.92 4.08 0.31 0.27 -4.95 118.33 102.48 1abb n VAL 40 Ca -0.16 -0.59 -0.10 0.00 -0.01 0.00 0.00 64.34 63.47 1abb n VAL 40 Cb 0.89 -6.24 -0.02 0.00 -0.91 0.00 0.00 33.84 27.56 1abb n VAL 40 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1abb n LYS 41 N -2.47 0.49 -3.76 5.55 4.76 -1.18 -5.04 118.16 116.51 1abb n LYS 41 Ca -0.06 -1.97 -0.06 0.00 -2.87 0.00 0.00 58.31 53.35 1abb n LYS 41 Cb 0.56 1.89 -0.02 0.00 -1.84 0.00 0.00 35.03 35.62 1abb n LYS 41 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1abb s ASP 42 N -2.53 -0.27 0.20 4.39 2.15 -1.26 -4.18 116.67 115.17 1abb s ASP 42 Ca 0.21 -0.44 0.25 0.00 0.43 0.00 0.00 52.55 52.99 1abb s ASP 42 Cb -0.01 0.61 0.90 0.00 -0.30 0.00 0.00 42.92 44.13 1abb s ASP 42 CO 0.15 -1.12 1.75 -2.11 -0.17 0.00 0.00 175.17 173.67 1abb n ARG 43 N -0.44 0.20 0.08 4.34 1.85 -1.26 -1.08 116.66 120.35 1abb n ARG 43 Ca -0.06 0.27 -0.05 0.00 -1.00 0.00 0.00 57.85 57.01 1abb n ARG 43 Cb 0.60 -1.79 -0.08 0.00 -1.05 0.00 0.00 32.46 30.15 1abb n ARG 43 CO 0.00 0.00 0.00 -0.91 -0.01 0.00 0.00 177.63 176.71 1abb h ASN 44 N 0.00 0.00 0.00 2.89 4.21 -2.04 -3.38 115.58 117.25 1abb h ASN 44 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1abb h ASN 44 Cb 0.55 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.75 1abb h ASN 44 CO 0.00 0.88 0.00 0.52 -1.29 0.00 0.00 177.43 177.54 1abb n VAL 45 N -3.33 0.39 -3.96 2.81 0.31 -0.97 -5.04 118.33 108.54 1abb n VAL 45 Ca 0.00 -0.68 -0.29 0.00 -0.01 0.00 0.00 64.34 63.36 1abb n VAL 45 Cb 0.89 0.82 -0.04 0.00 -0.91 0.00 0.00 33.84 34.60 1abb n VAL 45 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1abb s ALA 46 N -0.39 3.89 0.35 3.52 0.00 -0.24 -4.83 121.76 124.06 1abb s ALA 46 Ca 0.00 -0.97 0.07 0.00 0.00 0.00 0.00 51.96 51.06 1abb s ALA 46 Cb 0.00 -1.71 -0.01 0.00 0.00 0.00 0.00 23.12 21.39 1abb s ALA 46 CO 0.00 0.69 0.41 0.99 0.00 0.00 0.00 175.76 177.84 1abb s THR 47 N -1.60 3.72 0.39 0.00 2.01 -1.26 -4.95 115.64 113.94 1abb s THR 47 Ca 0.34 -1.15 0.13 0.00 0.31 0.00 0.00 61.69 61.32 1abb s THR 47 Cb -0.12 -3.27 0.35 0.00 0.01 0.00 0.00 72.50 69.47 1abb s THR 47 CO 0.27 -0.14 1.86 1.55 -0.69 0.00 0.00 174.62 177.47 1abb h PRO 48 N 1.01 0.52 -0.27 4.92 0.13 -1.98 -0.67 132.00 135.66 1abb h PRO 48 Ca -0.45 -0.03 -0.04 0.00 -0.87 0.00 0.00 66.00 64.61 1abb h PRO 48 Cb 1.26 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 1abb h PRO 48 CO 0.54 0.35 0.01 -0.09 -0.23 0.00 0.00 178.00 178.58 1abb h ARG 49 N 0.54 0.48 -0.71 0.86 2.43 -1.97 -2.60 114.38 113.41 1abb h ARG 49 Ca 0.46 -0.15 -0.01 0.00 -0.81 0.00 0.00 59.98 59.47 1abb h ARG 49 Cb 0.95 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.42 1abb h ARG 49 CO -0.20 0.63 0.40 -0.44 -1.51 0.00 0.00 179.97 178.85 1abb h ASP 50 N 0.27 0.87 1.44 -3.80 3.32 -1.88 -2.49 116.42 114.15 1abb h ASP 50 Ca 0.08 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1abb h ASP 50 Cb 0.41 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.73 1abb h ASP 50 CO 0.01 0.70 0.00 1.88 -1.72 0.00 0.00 179.24 180.11 1abb h TYR 51 N 0.99 0.00 0.03 4.55 0.05 -1.00 -1.80 116.97 119.79 1abb h TYR 51 Ca 0.25 0.00 -0.26 0.00 0.05 0.00 0.00 58.73 58.78 1abb h TYR 51 Cb 0.01 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.77 1abb h TYR 51 CO 0.01 0.00 -1.05 -0.92 -1.05 0.00 0.00 178.16 175.15 1abb h TYR 52 N 0.00 0.83 0.00 4.88 3.20 -1.05 -2.60 116.97 122.23 1abb h TYR 52 Ca 0.00 -0.47 -0.15 0.00 3.14 0.00 0.00 58.73 61.24 1abb h TYR 52 Cb 0.72 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.88 1abb h TYR 52 CO 0.00 1.31 -0.73 0.74 -1.64 0.00 0.00 178.16 177.84 1abb h PHE 53 N 0.29 0.00 0.63 -3.82 0.04 -1.28 0.60 116.94 113.40 1abb h PHE 53 Ca -0.12 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.62 1abb h PHE 53 Cb 1.70 0.00 0.01 0.00 2.20 0.00 0.00 35.95 39.86 1abb h PHE 53 CO 0.09 0.73 -0.30 0.00 -0.60 0.00 0.00 178.31 178.22 1abb h ALA 54 N 1.27 -0.85 -0.36 2.45 0.00 -1.34 -1.62 119.26 118.81 1abb h ALA 54 Ca -0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1abb h ALA 54 Cb 1.45 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 19.55 1abb h ALA 54 CO 0.09 -0.95 0.19 1.25 0.00 0.00 0.00 179.25 179.84 1abb h LEU 55 N -0.91 0.45 -0.87 0.00 5.85 -1.42 0.21 115.31 118.62 1abb h LEU 55 Ca -0.09 -0.09 0.15 0.00 0.84 0.00 0.00 57.88 58.69 1abb h LEU 55 Cb 0.67 -0.11 -0.09 0.00 0.37 0.00 0.00 40.66 41.49 1abb h LEU 55 CO 0.14 0.41 0.46 0.00 -0.34 0.00 0.00 178.44 179.12 1abb h ALA 56 N 1.05 1.32 -0.14 1.25 0.00 0.17 0.11 119.26 123.02 1abb h ALA 56 Ca 0.13 0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.97 1abb h ALA 56 Cb 0.07 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1abb h ALA 56 CO -0.02 -0.06 -0.48 0.45 0.00 0.00 0.00 179.25 179.14 1abb h HIS 57 N 0.66 0.76 -0.56 0.00 3.86 -0.32 -1.56 115.15 118.00 1abb h HIS 57 Ca 0.47 -0.31 0.07 0.00 -1.16 0.00 0.00 60.37 59.44 1abb h HIS 57 Cb 0.65 -0.13 -0.03 0.00 1.06 0.00 0.00 27.41 28.96 1abb h HIS 57 CO -0.08 1.09 0.37 1.15 0.86 0.00 0.00 177.93 181.32 1abb h THR 58 N 0.22 0.96 0.00 2.45 2.02 0.18 -0.56 112.91 118.18 1abb h THR 58 Ca -0.02 -0.16 -0.21 0.00 0.77 0.00 0.00 66.41 66.79 1abb h THR 58 Cb 1.11 0.45 -0.03 0.00 -1.74 0.00 0.00 68.15 67.94 1abb h THR 58 CO 0.10 0.09 -1.00 0.58 0.37 0.00 0.00 175.52 175.66 1abb h VAL 59 N 0.47 1.63 -0.56 3.16 2.07 -1.02 -3.32 116.25 118.66 1abb h VAL 59 Ca 0.25 -3.32 -0.06 0.00 0.82 0.00 0.00 66.70 64.39 1abb h VAL 59 Cb 0.37 2.80 -0.03 0.00 -1.52 0.00 0.00 31.29 32.92 1abb h VAL 59 CO -0.07 0.93 0.11 -0.09 0.02 0.00 0.00 177.57 178.47 1abb h ARG 60 N 0.00 0.89 -0.53 1.57 2.43 -0.05 -2.92 114.38 115.76 1abb h ARG 60 Ca -0.02 -0.20 0.11 0.00 -0.81 0.00 0.00 59.98 59.06 1abb h ARG 60 Cb 1.76 -0.12 -0.10 0.00 -0.42 0.00 0.00 29.97 31.08 1abb h ARG 60 CO 0.12 0.81 -0.17 -0.44 -1.51 0.00 0.00 179.97 178.79 1abb h ASP 61 N 0.85 -0.61 -0.76 -3.80 3.32 -1.52 -1.25 116.42 112.65 1abb h ASP 61 Ca 0.18 0.17 -0.03 0.00 0.02 0.00 0.00 57.03 57.37 1abb h ASP 61 Cb 0.34 0.37 -0.03 0.00 0.22 0.00 0.00 39.33 40.23 1abb h ASP 61 CO 0.00 -0.21 0.37 0.45 -1.72 0.00 0.00 179.24 178.13 1abb h HIS 62 N -0.04 1.10 0.14 4.55 3.86 -1.71 -1.71 115.15 121.34 1abb h HIS 62 Ca 0.25 -0.05 -0.01 0.00 -1.16 0.00 0.00 60.37 59.40 1abb h HIS 62 Cb 0.43 -0.34 0.00 0.00 1.06 0.00 0.00 27.41 28.56 1abb h HIS 62 CO -0.48 0.80 -0.07 1.25 0.86 0.00 0.00 177.93 180.30 1abb h LEU 63 N 1.07 -0.16 -0.95 2.43 6.46 -1.21 -3.10 115.31 119.85 1abb h LEU 63 Ca 0.26 -0.26 -0.09 0.00 -0.12 0.00 0.00 57.88 57.67 1abb h LEU 63 Cb 0.12 0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 40.07 1abb h LEU 63 CO -0.03 0.19 -0.20 -0.37 -0.62 0.00 0.00 178.44 177.41 1abb h VAL 64 N -0.52 1.25 -0.66 1.05 -1.51 -0.52 -1.32 116.25 114.02 1abb h VAL 64 Ca -0.02 -1.19 0.10 0.00 -1.23 0.00 0.00 66.70 64.36 1abb h VAL 64 Cb 0.41 1.25 -0.11 0.00 -2.13 0.00 0.00 31.29 30.71 1abb h VAL 64 CO 0.03 0.38 -0.44 1.23 -1.23 0.00 0.00 177.57 177.55 1abb h GLY 65 N 0.98 -0.42 2.00 5.19 0.00 -1.34 0.44 103.07 109.92 1abb h GLY 65 Ca 0.08 0.57 -0.06 0.00 0.00 0.00 0.00 47.33 47.92 1abb h GLY 65 CO 0.04 -0.15 -0.27 3.21 0.00 0.00 0.00 176.54 179.37 1abb h ARG 66 N -0.18 0.00 -0.69 4.80 3.08 -1.43 -1.18 114.38 118.78 1abb h ARG 66 Ca 0.20 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.22 1abb h ARG 66 Cb 0.56 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.57 1abb h ARG 66 CO -0.74 0.27 0.33 2.35 -1.07 0.00 0.00 179.97 181.12 1abb h TRP 67 N 0.00 0.99 0.00 3.04 7.01 0.84 -1.43 115.95 126.40 1abb h TRP 67 Ca -0.00 -0.05 0.00 0.00 2.11 0.00 0.00 58.89 60.95 1abb h TRP 67 Cb 0.61 -0.31 0.00 0.00 -2.10 0.00 0.00 29.16 27.36 1abb h TRP 67 CO 0.00 0.73 0.00 -0.89 -2.79 0.00 0.00 178.44 175.49 1abb n ILE 68 N -4.45 0.00 -0.41 2.65 2.08 0.11 -1.92 119.36 117.41 1abb n ILE 68 Ca 0.05 1.21 0.34 0.00 0.56 0.00 0.00 62.75 64.92 1abb n ILE 68 Cb 0.13 -2.17 0.64 0.00 -0.75 0.00 0.00 39.64 37.48 1abb n ILE 68 CO 0.00 0.00 0.00 0.03 0.56 0.00 0.00 176.55 177.14 1abb h ARG 69 N 0.00 0.15 -0.33 0.38 2.47 -1.52 0.63 114.38 116.16 1abb h ARG 69 Ca 0.00 -0.01 -0.05 0.00 -1.26 0.00 0.00 59.98 58.66 1abb h ARG 69 Cb 0.00 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.27 1abb h ARG 69 CO 0.00 0.10 -0.00 1.15 0.56 0.00 0.00 179.97 181.78 1abb h THR 70 N 0.16 1.26 0.02 2.04 2.02 -1.17 -1.30 112.91 115.94 1abb h THR 70 Ca 0.73 -0.97 -0.23 0.00 0.77 0.00 0.00 66.41 66.71 1abb h THR 70 Cb 2.31 1.23 0.00 0.00 -1.74 0.00 0.00 68.15 69.96 1abb h THR 70 CO -0.29 0.32 -0.99 1.56 0.37 0.00 0.00 175.52 176.49 1abb h GLN 71 N 0.39 0.39 0.55 6.66 1.08 0.93 -1.71 115.11 123.42 1abb h GLN 71 Ca 0.09 -0.45 -0.02 0.00 -1.45 0.00 0.00 58.65 56.82 1abb h GLN 71 Cb 0.45 0.13 -0.02 0.00 -0.05 0.00 0.00 27.48 28.00 1abb h GLN 71 CO 0.02 1.12 -0.48 1.96 -0.95 0.00 0.00 178.83 180.50 1abb h GLN 72 N 0.21 -0.98 0.00 1.46 4.20 -1.39 -1.20 115.11 117.41 1abb h GLN 72 Ca -0.09 0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1abb h GLN 72 Cb 1.63 0.22 0.00 0.00 0.30 0.00 0.00 27.48 29.64 1abb h GLN 72 CO 0.17 -0.65 0.23 1.58 -0.67 0.00 0.00 178.83 179.49 1abb n HIS 73 N -5.40 0.47 0.54 2.96 -0.00 -0.49 0.11 115.22 113.40 1abb n HIS 73 Ca -0.12 0.25 0.11 0.00 0.46 0.00 0.00 57.72 58.41 1abb n HIS 73 Cb 0.45 -0.73 -0.05 0.00 -0.12 0.00 0.00 29.99 29.54 1abb n HIS 73 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 1abb n TYR 74 N -2.05 0.16 -0.03 1.57 4.01 -0.53 -3.54 117.16 116.76 1abb n TYR 74 Ca -0.01 0.05 -0.15 0.00 -0.16 0.00 0.00 57.90 57.62 1abb n TYR 74 Cb 0.26 -0.36 -0.12 0.00 -0.31 0.00 0.00 39.34 38.80 1abb n TYR 74 CO 0.00 0.00 0.00 1.88 -0.46 0.00 0.00 176.86 178.28 1abb h TYR 75 N 0.00 0.18 0.00 -0.72 -1.99 0.15 -2.69 116.97 111.90 1abb h TYR 75 Ca 0.00 -0.11 0.00 0.00 2.00 0.00 0.00 58.73 60.62 1abb h TYR 75 Cb 0.74 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.45 1abb h TYR 75 CO 0.00 0.99 0.00 0.39 -0.00 0.00 0.00 178.16 179.54 1abb n GLU 76 N -4.51 0.19 -0.00 4.88 -0.58 -0.67 -2.20 120.64 117.75 1abb n GLU 76 Ca -0.10 0.46 0.03 0.00 -0.42 0.00 0.00 57.16 57.12 1abb n GLU 76 Cb 0.53 -1.90 0.03 0.00 -0.57 0.00 0.00 31.44 29.53 1abb n GLU 76 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 1abb n LYS 77 N -2.26 -0.14 -0.68 3.49 3.00 -1.23 -5.06 118.16 115.28 1abb n LYS 77 Ca 0.02 -0.86 0.00 0.00 -0.00 0.00 0.00 58.31 57.46 1abb n LYS 77 Cb 0.20 -1.11 0.00 0.00 0.00 0.00 0.00 35.03 34.12 1abb n LYS 77 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1abb n ASP 78 N 0.33 0.00 -4.57 3.14 2.03 -0.93 -4.92 116.55 111.62 1abb n ASP 78 Ca 0.03 0.00 -0.25 0.00 0.52 0.00 0.00 54.79 55.10 1abb n ASP 78 Cb 0.15 0.00 0.12 0.00 -0.72 0.00 0.00 41.12 40.67 1abb n ASP 78 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1abb s PRO 79 N -0.02 1.46 0.16 -0.67 0.04 -1.26 -5.04 135.00 129.68 1abb s PRO 79 Ca 0.00 -1.01 -0.30 0.00 0.04 0.00 0.00 61.00 59.73 1abb s PRO 79 Cb 0.00 -2.24 -0.08 0.00 0.04 0.00 0.00 34.50 32.22 1abb s PRO 79 CO 0.00 -1.64 1.28 0.21 0.04 0.00 0.00 177.00 176.89 1abb s LYS 80 N -5.29 4.41 -0.12 4.56 2.20 -1.26 -4.90 119.74 119.34 1abb s LYS 80 Ca 0.68 1.98 -0.05 0.00 -0.36 0.00 0.00 55.97 58.21 1abb s LYS 80 Cb -0.05 -3.24 -0.04 0.00 -1.51 0.00 0.00 37.83 33.00 1abb s LYS 80 CO 0.46 -0.25 0.08 1.03 -0.36 0.00 0.00 175.35 176.31 1abb s ARG 81 N 0.26 3.40 -0.13 4.03 0.52 -0.17 -4.64 118.95 122.22 1abb s ARG 81 Ca 0.58 -0.27 0.03 0.00 -0.52 0.00 0.00 55.73 55.54 1abb s ARG 81 Cb -0.35 -3.06 0.00 0.00 0.52 0.00 0.00 34.95 32.07 1abb s ARG 81 CO 0.35 0.65 -0.22 -1.50 0.02 0.00 0.00 175.30 174.60 1abb s ILE 82 N -0.68 2.16 -0.64 1.52 -1.16 0.16 0.26 121.20 122.82 1abb s ILE 82 Ca 0.12 -0.96 -0.05 0.00 -0.51 0.00 0.00 60.65 59.25 1abb s ILE 82 Cb -0.12 -1.85 0.17 0.00 0.61 0.00 0.00 42.46 41.26 1abb s ILE 82 CO 0.02 0.55 0.47 -0.31 -2.81 0.00 0.00 174.94 172.87 1abb s TYR 83 N 0.63 3.46 -0.20 3.50 2.02 -0.65 -0.90 117.35 125.21 1abb s TYR 83 Ca -0.11 -2.58 -0.29 0.00 -0.37 0.00 0.00 57.07 53.72 1abb s TYR 83 Cb -0.16 -3.29 -0.01 0.00 -0.40 0.00 0.00 41.96 38.10 1abb s TYR 83 CO 0.02 -0.87 1.22 -0.47 -1.57 0.00 0.00 175.55 173.88 1abb s TYR 84 N 0.05 2.93 -0.52 2.71 5.04 0.25 -2.35 117.35 125.46 1abb s TYR 84 Ca 0.16 1.08 -0.08 0.00 -2.44 0.00 0.00 57.07 55.80 1abb s TYR 84 Cb -0.19 -3.52 0.14 0.00 0.35 0.00 0.00 41.96 38.73 1abb s TYR 84 CO -0.04 -1.43 0.39 -0.51 -1.34 0.00 0.00 175.55 172.61 1abb s LEU 85 N 3.57 5.70 -0.00 6.97 1.43 -0.98 -2.15 118.68 133.21 1abb s LEU 85 Ca 0.52 -2.15 0.06 0.00 -1.03 0.00 0.00 54.13 51.54 1abb s LEU 85 Cb -0.19 -1.99 -0.02 0.00 0.03 0.00 0.00 46.19 44.02 1abb s LEU 85 CO 0.14 -0.62 -0.20 -0.55 0.23 0.00 0.00 176.35 175.35 1abb s SER 86 N 2.25 2.36 -0.11 2.29 0.15 -1.20 -2.95 113.70 116.49 1abb s SER 86 Ca 0.09 -0.39 0.03 0.00 0.70 0.00 0.00 55.95 56.38 1abb s SER 86 Cb -0.23 -0.25 0.25 0.00 -1.71 0.00 0.00 66.02 64.07 1abb s SER 86 CO -0.02 0.23 1.08 -0.11 1.20 0.00 0.00 173.24 175.61 1abb n LEU 87 N 2.44 3.28 -3.64 3.45 7.94 -1.26 -4.33 117.00 124.88 1abb n LEU 87 Ca -0.15 -1.68 -0.07 0.00 -1.11 0.00 0.00 56.01 53.00 1abb n LEU 87 Cb 0.53 -0.58 -0.07 0.00 0.53 0.00 0.00 43.42 43.83 1abb n LEU 87 CO 0.24 0.51 0.46 -0.70 -1.11 0.00 0.00 177.39 176.78 1abb s GLU 88 N -1.35 0.63 -0.34 1.96 2.12 -1.26 -4.88 118.70 115.58 1abb s GLU 88 Ca 0.18 1.03 -0.01 0.00 0.36 0.00 0.00 54.97 56.53 1abb s GLU 88 Cb 0.14 0.16 0.13 0.00 0.26 0.00 0.00 34.13 34.83 1abb s GLU 88 CO 0.04 -0.12 0.19 -0.06 -0.54 0.00 0.00 175.26 174.77 1abb s PHE 89 N 1.34 0.60 -1.45 5.30 0.40 0.14 -4.54 117.98 119.78 1abb s PHE 89 Ca -0.08 -1.42 -0.13 0.00 -0.60 0.00 0.00 56.93 54.70 1abb s PHE 89 Cb -0.05 -0.90 -0.02 0.00 0.51 0.00 0.00 43.02 42.57 1abb s PHE 89 CO -0.16 -0.83 2.45 0.98 0.70 0.00 0.00 175.22 178.36 1abb n TYR 90 N 4.35 2.99 0.16 0.36 9.36 -0.91 -3.65 117.16 129.83 1abb n TYR 90 Ca 0.08 -2.91 -0.07 0.00 3.32 0.00 0.00 57.90 58.32 1abb n TYR 90 Cb 0.38 -2.45 -0.03 0.00 -0.63 0.00 0.00 39.34 36.61 1abb n TYR 90 CO 0.00 0.00 0.00 1.98 0.22 0.00 0.00 176.86 179.06 1abb h MET 91 N 5.81 -0.41 -2.38 2.98 4.05 -1.84 -3.41 114.93 119.73 1abb h MET 91 Ca 0.66 0.03 0.00 0.00 -0.28 0.00 0.00 59.70 60.11 1abb h MET 91 Cb 0.51 0.09 0.00 0.00 -0.80 0.00 0.00 31.60 31.40 1abb h MET 91 CO 1.85 -0.27 -0.61 0.41 0.23 0.00 0.00 176.91 178.51 1abb n GLY 92 N -1.21 -3.65 0.00 1.39 0.00 -1.25 -4.92 105.19 95.54 1abb n GLY 92 Ca -0.05 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 44.96 1abb n GLY 92 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1abb n ARG 93 N -2.10 0.00 -0.00 1.61 1.74 -1.26 -4.58 116.66 112.07 1abb n ARG 93 Ca 0.00 0.00 0.05 0.00 -0.77 0.00 0.00 57.85 57.13 1abb n ARG 93 Cb 0.28 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.65 1abb n ARG 93 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1abb n THR 94 N 0.38 0.00 0.29 0.55 -1.04 -1.26 -4.77 114.28 108.43 1abb n THR 94 Ca 0.00 -0.25 -0.12 0.00 -2.04 0.00 0.00 64.05 61.64 1abb n THR 94 Cb 0.00 0.65 -0.05 0.00 -1.82 0.00 0.00 70.33 69.10 1abb n THR 94 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1abb h LEU 95 N 0.00 -0.64 -1.34 -4.42 6.46 -1.93 -2.89 115.31 110.55 1abb h LEU 95 Ca 0.00 0.02 0.05 0.00 -0.12 0.00 0.00 57.88 57.84 1abb h LEU 95 Cb 0.36 0.16 -0.04 0.00 -0.73 0.00 0.00 40.66 40.41 1abb h LEU 95 CO 0.00 -0.37 0.49 -0.61 -0.62 0.00 0.00 178.44 177.33 1abb h GLN 96 N -0.93 0.80 -0.68 1.25 4.15 -1.95 -2.39 115.11 115.35 1abb h GLN 96 Ca -0.08 -0.05 -0.02 0.00 0.77 0.00 0.00 58.65 59.27 1abb h GLN 96 Cb 0.58 -0.18 -0.03 0.00 0.21 0.00 0.00 27.48 28.05 1abb h GLN 96 CO 0.13 0.53 0.34 -0.97 -1.93 0.00 0.00 178.83 176.93 1abb h ASN 97 N 0.82 0.88 -0.24 -0.69 -0.73 -1.85 0.12 115.58 113.90 1abb h ASN 97 Ca 0.31 -0.12 -0.13 0.00 1.87 0.00 0.00 56.30 58.23 1abb h ASN 97 Cb 0.19 -0.23 -0.01 0.00 0.27 0.00 0.00 38.32 38.54 1abb h ASN 97 CO -0.10 0.75 -0.31 0.74 -0.37 0.00 0.00 177.43 178.15 1abb h THR 98 N 0.95 1.28 -0.20 -3.57 2.02 -1.22 -0.03 112.91 112.13 1abb h THR 98 Ca 0.24 -1.45 -0.08 0.00 0.77 0.00 0.00 66.41 65.89 1abb h THR 98 Cb 0.09 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 67.83 1abb h THR 98 CO -0.03 0.47 -0.21 0.24 0.37 0.00 0.00 175.52 176.36 1abb h MET 99 N 0.63 0.36 0.01 6.66 2.86 -1.12 0.41 114.93 124.74 1abb h MET 99 Ca 0.07 -0.12 -0.21 0.00 -2.06 0.00 0.00 59.70 57.39 1abb h MET 99 Cb 0.83 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.45 1abb h MET 99 CO 0.07 0.56 -0.93 -0.39 1.06 0.00 0.00 176.91 177.28 1abb h VAL 100 N 0.33 1.48 -0.00 -2.22 -1.51 -0.77 0.34 116.25 113.90 1abb h VAL 100 Ca 0.06 -2.65 0.00 0.00 -1.23 0.00 0.00 66.70 62.87 1abb h VAL 100 Cb 0.56 2.51 0.00 0.00 -2.13 0.00 0.00 31.29 32.23 1abb h VAL 100 CO 0.04 0.78 -0.24 0.59 -1.23 0.00 0.00 177.57 177.51 1abb n ASN 101 N -3.65 0.38 -0.15 4.19 4.13 -0.05 -3.99 115.26 116.12 1abb n ASN 101 Ca -0.04 -0.16 0.04 0.00 1.68 0.00 0.00 54.58 56.10 1abb n ASN 101 Cb 0.84 -0.06 -0.01 0.00 -1.54 0.00 0.00 39.78 39.01 1abb n ASN 101 CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 1abb n LEU 102 N -1.30 0.96 0.00 3.41 7.94 0.11 -0.74 117.00 127.38 1abb n LEU 102 Ca 0.09 -0.72 0.00 0.00 -1.11 0.00 0.00 56.01 54.27 1abb n LEU 102 Cb 0.32 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.27 1abb n LEU 102 CO 0.29 0.20 0.00 0.00 -1.11 0.00 0.00 177.39 176.77 1abb n ALA 103 N -0.44 0.00 1.14 1.96 0.00 -0.93 -4.97 120.51 117.26 1abb n ALA 103 Ca 0.03 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.60 1abb n ALA 103 Cb 0.16 -0.13 0.21 0.00 0.00 0.00 0.00 19.45 19.70 1abb n ALA 103 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1abb n LEU 104 N 0.00 2.54 -0.17 0.00 4.77 0.11 -4.49 117.00 119.76 1abb n LEU 104 Ca 0.00 -0.85 -0.02 0.00 -0.03 0.00 0.00 56.01 55.11 1abb n LEU 104 Cb 0.00 -0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.16 1abb n LEU 104 CO 0.00 0.43 0.95 -0.08 -1.33 0.00 0.00 177.39 177.36 1abb h GLU 105 N 3.95 0.32 -0.42 3.23 4.81 -1.66 -0.03 114.58 124.78 1abb h GLU 105 Ca 0.00 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.13 1abb h GLU 105 Cb 0.85 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.14 1abb h GLU 105 CO 0.00 0.21 -0.05 -0.91 -0.73 0.00 0.00 179.01 177.53 1abb h ASN 106 N 0.33 0.69 0.72 1.04 2.35 -1.89 -1.50 115.58 117.32 1abb h ASN 106 Ca 0.25 -0.18 -0.21 0.00 -0.55 0.00 0.00 56.30 55.61 1abb h ASN 106 Cb 0.30 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.47 1abb h ASN 106 CO -0.28 0.80 -0.97 0.00 -1.65 0.00 0.00 177.43 175.33 1abb h ALA 107 N 1.28 0.41 -0.16 -0.83 0.00 -1.64 -2.67 119.26 115.64 1abb h ALA 107 Ca 0.12 -0.80 -0.00 0.00 0.00 0.00 0.00 54.91 54.23 1abb h ALA 107 Cb 0.49 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1abb h ALA 107 CO 0.03 1.02 0.10 0.00 0.00 0.00 0.00 179.25 180.39 1abb h ASP 109 N 0.18 0.74 -0.38 0.00 1.82 -1.32 0.51 116.42 117.97 1abb h ASP 109 Ca 0.06 -0.00 -0.04 0.00 -0.39 0.00 0.00 57.03 56.66 1abb h ASP 109 Cb 0.03 -0.16 -0.02 0.00 0.68 0.00 0.00 39.33 39.86 1abb h ASP 109 CO -0.01 0.52 0.10 -0.08 -1.61 0.00 0.00 179.24 178.15 1abb h GLU 110 N 0.88 0.61 -0.21 0.28 4.57 -1.42 -0.86 114.58 118.44 1abb h GLU 110 Ca 0.28 -0.15 -0.05 0.00 -1.18 0.00 0.00 59.36 58.27 1abb h GLU 110 Cb 0.00 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.51 1abb h GLU 110 CO -0.10 0.64 -0.05 0.00 -1.18 0.00 0.00 179.01 178.32 1abb h ALA 111 N 0.95 0.28 -0.40 2.92 0.00 -0.73 -0.86 119.26 121.41 1abb h ALA 111 Ca 0.12 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1abb h ALA 111 Cb 0.30 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1abb h ALA 111 CO 0.00 0.06 0.14 1.79 0.00 0.00 0.00 179.25 181.24 1abb h THR 112 N 0.12 1.21 -0.96 0.00 1.35 -0.89 -1.95 112.91 111.79 1abb h THR 112 Ca 0.05 -0.68 0.14 0.00 -0.55 0.00 0.00 66.41 65.38 1abb h THR 112 Cb 0.49 0.90 -0.08 0.00 -1.73 0.00 0.00 68.15 67.73 1abb h THR 112 CO 0.02 0.24 0.61 0.22 -0.25 0.00 0.00 175.52 176.36 1abb h TYR 113 N 0.51 0.98 -0.00 4.73 3.20 -1.07 0.83 116.97 126.15 1abb h TYR 113 Ca 0.13 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.03 1abb h TYR 113 Cb 0.24 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.20 1abb h TYR 113 CO 0.01 0.35 -0.05 1.04 -1.64 0.00 0.00 178.16 177.86 1abb n GLN 114 N -4.61 0.01 -0.76 1.82 6.02 -0.34 -2.62 117.38 116.90 1abb n GLN 114 Ca 0.19 -0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.26 1abb n GLN 114 Cb 0.45 -1.50 0.38 0.00 1.02 0.00 0.00 30.24 30.58 1abb n GLN 114 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1abb n LEU 115 N -1.50 5.19 -3.50 1.08 4.77 0.24 -4.98 117.00 118.31 1abb n LEU 115 Ca 0.07 -2.63 -0.18 0.00 -0.03 0.00 0.00 56.01 53.24 1abb n LEU 115 Cb 0.34 -0.64 0.08 0.00 -2.33 0.00 0.00 43.42 40.87 1abb n LEU 115 CO 0.28 0.69 0.08 0.61 -1.33 0.00 0.00 177.39 177.72 1abb n GLY 116 N 0.84 -0.36 2.32 -0.72 0.00 -0.92 -5.02 105.19 101.33 1abb n GLY 116 Ca 0.26 0.11 -0.14 0.00 0.00 0.00 0.00 46.02 46.25 1abb n GLY 116 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1abb n LEU 117 N -4.21 0.00 -3.69 0.99 4.77 -1.05 -5.03 117.00 108.78 1abb n LEU 117 Ca -0.27 -2.29 -0.21 0.00 -0.03 0.00 0.00 56.01 53.21 1abb n LEU 117 Cb 0.66 1.20 -0.18 0.00 -2.33 0.00 0.00 43.42 42.77 1abb n LEU 117 CO 0.63 -0.38 -0.35 -0.62 -1.33 0.00 0.00 177.39 175.34 1abb s ASP 118 N -2.69 1.26 0.22 -1.43 2.15 -1.26 -4.16 116.67 110.77 1abb s ASP 118 Ca 0.28 0.03 -0.09 0.00 0.43 0.00 0.00 52.55 53.21 1abb s ASP 118 Cb 0.01 -0.20 0.20 0.00 -0.30 0.00 0.00 42.92 42.64 1abb s ASP 118 CO 0.20 -0.24 1.89 -0.03 -0.17 0.00 0.00 175.17 176.82 1abb h MET 119 N 8.42 1.08 -0.39 4.34 1.85 -1.94 -0.85 114.93 127.43 1abb h MET 119 Ca -0.13 -0.06 0.02 0.00 -0.61 0.00 0.00 59.70 58.91 1abb h MET 119 Cb 1.12 -0.24 -0.02 0.00 0.43 0.00 0.00 31.60 32.89 1abb h MET 119 CO 0.17 0.71 0.26 0.93 -0.40 0.00 0.00 176.91 178.59 1abb h GLU 120 N 1.11 0.44 0.55 0.39 5.08 -1.99 0.62 114.58 120.79 1abb h GLU 120 Ca 0.31 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.62 1abb h GLU 120 Cb -0.10 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.05 1abb h GLU 120 CO -0.08 0.29 -0.32 0.93 -1.00 0.00 0.00 179.01 178.83 1abb h GLU 121 N 0.46 -0.80 -0.18 2.33 4.39 -1.61 -2.94 114.58 116.23 1abb h GLU 121 Ca 0.16 0.05 -0.06 0.00 0.34 0.00 0.00 59.36 59.85 1abb h GLU 121 Cb 0.06 0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 28.88 1abb h GLU 121 CO -0.04 -0.53 -0.15 -0.07 -1.16 0.00 0.00 179.01 177.06 1abb h LEU 122 N -0.83 0.28 -1.01 1.33 3.38 0.82 -0.57 115.31 118.71 1abb h LEU 122 Ca -0.07 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 1abb h LEU 122 Cb 0.66 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.30 1abb h LEU 122 CO 0.08 0.46 0.40 -0.33 0.09 0.00 0.00 178.44 179.14 1abb h GLU 123 N 0.28 1.10 0.00 1.13 5.08 -0.31 -0.46 114.58 121.39 1abb h GLU 123 Ca 0.05 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1abb h GLU 123 Cb 0.44 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1abb h GLU 123 CO 0.03 0.82 0.00 0.39 -1.00 0.00 0.00 179.01 179.25 1abb n GLU 124 N -4.33 0.82 0.06 2.33 -0.58 -0.23 -2.28 120.64 116.43 1abb n GLU 124 Ca 0.08 0.00 0.12 0.00 -0.42 0.00 0.00 57.16 56.94 1abb n GLU 124 Cb 0.12 -1.35 0.24 0.00 -0.57 0.00 0.00 31.44 29.87 1abb n GLU 124 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 1abb n ILE 125 N -0.85 0.32 -1.99 -3.67 2.08 -0.18 -4.93 119.36 110.14 1abb n ILE 125 Ca 0.14 -0.23 -0.41 0.00 0.56 0.00 0.00 62.75 62.81 1abb n ILE 125 Cb 0.06 -0.16 -0.02 0.00 -0.75 0.00 0.00 39.64 38.77 1abb n ILE 125 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 1abb s GLU 126 N -3.13 4.26 0.08 0.38 2.12 -0.97 -4.98 118.70 116.47 1abb s GLU 126 Ca 0.08 2.33 -0.22 0.00 0.36 0.00 0.00 54.97 57.52 1abb s GLU 126 Cb 0.14 -3.09 -0.07 0.00 0.26 0.00 0.00 34.13 31.38 1abb s GLU 126 CO 0.69 -0.41 0.64 -1.21 -0.54 0.00 0.00 175.26 174.44 1abb s GLU 127 N -0.72 4.34 0.29 4.30 0.41 -1.26 -4.90 118.70 121.16 1abb s GLU 127 Ca 0.58 0.87 -0.30 0.00 -0.41 0.00 0.00 54.97 55.71 1abb s GLU 127 Cb -0.42 -3.28 -0.11 0.00 -1.78 0.00 0.00 34.13 28.54 1abb s GLU 127 CO 0.46 0.54 1.54 -0.51 -0.49 0.00 0.00 175.26 176.80 1abb s ASP 128 N -0.85 6.44 -0.48 -0.19 1.11 -1.26 -4.43 116.67 117.02 1abb s ASP 128 Ca 0.32 2.89 -0.26 0.00 0.18 0.00 0.00 52.55 55.68 1abb s ASP 128 Cb -0.20 -2.64 -0.06 0.00 1.07 0.00 0.00 42.92 41.09 1abb s ASP 128 CO 0.21 -0.85 2.30 0.00 1.18 0.00 0.00 175.17 178.01 1abb s ALA 129 N -0.18 1.82 -0.75 5.23 0.00 -1.26 -4.82 121.76 121.80 1abb s ALA 129 Ca 0.61 -0.01 -0.05 0.00 0.00 0.00 0.00 51.96 52.50 1abb s ALA 129 Cb -0.46 -4.31 -0.05 0.00 0.00 0.00 0.00 23.12 18.30 1abb s ALA 129 CO 0.49 -4.21 1.91 0.41 0.00 0.00 0.00 175.76 174.36 1abb n GLY 130 N 5.93 2.84 0.26 0.00 0.00 -1.26 -3.94 105.19 109.01 1abb n GLY 130 Ca 0.33 -0.71 0.03 0.00 0.00 0.00 0.00 46.02 45.67 1abb n GLY 130 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1abb n LEU 131 N 4.46 1.77 -4.19 0.99 7.99 -1.26 -3.50 117.00 123.26 1abb n LEU 131 Ca 0.37 -1.29 -0.13 0.00 -0.01 0.00 0.00 56.01 54.95 1abb n LEU 131 Cb 0.12 -0.03 -0.09 0.00 -0.11 0.00 0.00 43.42 43.30 1abb n LEU 131 CO 0.68 0.40 -0.16 -0.83 -1.51 0.00 0.00 177.39 175.97 1abb s GLY 132 N -0.63 1.54 0.00 -0.72 0.00 -1.24 -0.68 107.32 105.58 1abb s GLY 132 Ca 0.08 -1.69 0.00 0.00 0.00 0.00 0.00 44.72 43.11 1abb s GLY 132 CO 0.08 -1.32 0.00 -2.01 0.00 0.00 0.00 173.10 169.84 1abb n ASN 133 N -0.59 1.02 0.00 1.64 5.15 -1.26 -4.72 115.26 116.50 1abb n ASN 133 Ca 0.03 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.01 1abb n ASN 133 Cb 0.65 0.20 0.00 0.00 -0.53 0.00 0.00 39.78 40.10 1abb n ASN 133 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1abb n GLY 134 N 0.52 2.79 0.18 8.20 0.00 -1.26 -5.05 105.19 110.57 1abb n GLY 134 Ca 0.00 0.04 -0.07 0.00 0.00 0.00 0.00 46.02 45.99 1abb n GLY 134 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1abb h GLY 135 N 0.00 -0.45 -0.89 -0.02 0.00 -2.00 -0.07 103.07 99.63 1abb h GLY 135 Ca 0.00 0.17 0.31 0.00 0.00 0.00 0.00 47.33 47.81 1abb h GLY 135 CO 0.00 -0.16 0.21 -2.00 0.00 0.00 0.00 176.54 174.59 1abb h LEU 136 N -0.59 -0.17 0.01 3.11 7.12 -1.98 0.40 115.31 123.21 1abb h LEU 136 Ca -0.04 0.26 -0.26 0.00 0.13 0.00 0.00 57.88 57.96 1abb h LEU 136 Cb 0.33 0.39 -0.04 0.00 -0.53 0.00 0.00 40.66 40.81 1abb h LEU 136 CO 0.07 -0.35 -1.44 1.23 -0.13 0.00 0.00 178.44 177.83 1abb h GLY 137 N 0.04 0.03 0.97 3.75 0.00 -1.80 -3.22 103.07 102.84 1abb h GLY 137 Ca 0.67 -0.07 0.02 0.00 0.00 0.00 0.00 47.33 47.94 1abb h GLY 137 CO -0.84 0.06 0.54 -0.09 0.00 0.00 0.00 176.54 176.22 1abb h ARG 138 N 0.01 1.06 -0.76 4.80 9.65 0.17 -2.37 114.38 126.94 1abb h ARG 138 Ca -0.18 -0.06 0.02 0.00 -1.10 0.00 0.00 59.98 58.65 1abb h ARG 138 Cb 1.93 -0.24 -0.04 0.00 -1.39 0.00 0.00 29.97 30.22 1abb h ARG 138 CO 0.10 0.70 0.49 1.25 2.80 0.00 0.00 179.97 185.32 1abb h LEU 139 N 1.09 0.83 -0.78 3.80 5.85 -1.37 -0.35 115.31 124.40 1abb h LEU 139 Ca 0.31 -0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.92 1abb h LEU 139 Cb -0.09 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.73 1abb h LEU 139 CO -0.08 0.59 -0.10 0.00 -0.34 0.00 0.00 178.44 178.51 1abb h ALA 140 N 1.30 0.96 0.00 1.25 0.00 -1.53 0.11 119.26 121.35 1abb h ALA 140 Ca 0.29 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1abb h ALA 140 Cb -0.06 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1abb h ALA 140 CO -0.08 0.61 -0.30 0.00 0.00 0.00 0.00 179.25 179.48 1abb h ALA 141 N 1.14 0.99 0.28 0.00 0.00 -1.37 0.18 119.26 120.48 1abb h ALA 141 Ca 0.13 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1abb h ALA 141 Cb 0.59 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1abb h ALA 141 CO 0.04 0.37 -0.14 0.00 0.00 0.00 0.00 179.25 179.52 1abb h PHE 143 N -0.76 0.61 -0.86 0.00 0.04 0.09 0.63 116.94 116.70 1abb h PHE 143 Ca -0.04 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.75 1abb h PHE 143 Cb 0.50 -0.20 -0.04 0.00 2.20 0.00 0.00 35.95 38.41 1abb h PHE 143 CO 0.03 0.35 0.53 -0.07 -0.60 0.00 0.00 178.31 178.56 1abb h LEU 144 N 0.63 1.01 -0.93 1.54 3.38 -0.75 0.33 115.31 120.52 1abb h LEU 144 Ca 0.23 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 58.08 1abb h LEU 144 Cb 0.13 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1abb h LEU 144 CO -0.06 0.76 0.07 -0.78 0.09 0.00 0.00 178.44 178.52 1abb h ASP 145 N 1.17 0.81 0.44 -0.43 3.58 0.31 0.10 116.42 122.40 1abb h ASP 145 Ca 0.31 -0.17 -0.02 0.00 0.42 0.00 0.00 57.03 57.56 1abb h ASP 145 Cb -0.08 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 40.76 1abb h ASP 145 CO -0.06 0.83 -0.21 0.28 -2.88 0.00 0.00 179.24 177.20 1abb h SER 146 N 0.81 -0.50 -0.50 2.28 0.02 -1.06 -2.28 113.55 112.32 1abb h SER 146 Ca 0.17 -0.09 0.10 0.00 -0.84 0.00 0.00 61.79 61.12 1abb h SER 146 Cb 0.39 0.13 -0.10 0.00 0.14 0.00 0.00 62.40 62.96 1abb h SER 146 CO 0.01 -0.17 -0.18 0.24 -1.14 0.00 0.00 176.83 175.59 1abb h MET 147 N -0.85 -0.07 -0.69 3.45 2.86 0.26 0.15 114.93 120.04 1abb h MET 147 Ca -0.06 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.53 1abb h MET 147 Cb 0.56 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.21 1abb h MET 147 CO 0.10 -0.05 0.20 0.00 1.06 0.00 0.00 176.91 178.22 1abb h ALA 148 N 1.33 1.06 -0.55 6.32 0.00 -0.81 -2.93 119.26 123.68 1abb h ALA 148 Ca 0.24 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 1abb h ALA 148 Cb 0.44 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1abb h ALA 148 CO -0.55 0.63 0.11 1.15 0.00 0.00 0.00 179.25 180.60 1abb h THR 149 N 1.02 1.25 0.00 0.00 2.02 -0.14 -3.08 112.91 113.98 1abb h THR 149 Ca 0.22 -0.92 -0.04 0.00 0.77 0.00 0.00 66.41 66.45 1abb h THR 149 Cb 0.31 0.79 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 1abb h THR 149 CO -0.01 0.33 -0.06 0.18 0.37 0.00 0.00 175.52 176.34 1abb n LEU 150 N -4.39 4.69 0.00 2.58 4.77 -0.51 -4.39 117.00 119.76 1abb n LEU 150 Ca 0.02 -2.28 0.00 0.00 -0.03 0.00 0.00 56.01 53.72 1abb n LEU 150 Cb 0.25 -1.05 0.00 0.00 -2.33 0.00 0.00 43.42 40.29 1abb n LEU 150 CO 0.41 1.01 0.00 0.61 -1.33 0.00 0.00 177.39 178.09 1abb n GLY 151 N 1.77 0.00 3.32 -0.72 0.00 -0.05 -2.42 105.19 107.09 1abb n GLY 151 Ca 0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 1abb n GLY 151 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1abb n LEU 152 N 0.00 -1.52 -4.16 0.99 4.77 -1.16 -4.93 117.00 110.99 1abb n LEU 152 Ca 0.00 0.36 -0.39 0.00 -0.03 0.00 0.00 56.01 55.95 1abb n LEU 152 Cb 0.00 -1.09 -0.06 0.00 -2.33 0.00 0.00 43.42 39.94 1abb n LEU 152 CO 0.00 -4.15 0.28 0.00 -1.33 0.00 0.00 177.39 172.19 1abb s ALA 153 N -2.19 4.00 0.25 -1.18 0.00 -1.26 -4.76 121.76 116.63 1abb s ALA 153 Ca 0.55 -3.54 0.09 0.00 0.00 0.00 0.00 51.96 49.06 1abb s ALA 153 Cb -0.24 -2.95 -0.05 0.00 0.00 0.00 0.00 23.12 19.88 1abb s ALA 153 CO 0.69 -2.16 -0.13 0.00 0.00 0.00 0.00 175.76 174.16 1abb s ALA 154 N -0.60 2.35 -0.04 0.00 0.00 -1.26 -0.66 121.76 121.56 1abb s ALA 154 Ca 0.22 -1.81 0.01 0.00 0.00 0.00 0.00 51.96 50.38 1abb s ALA 154 Cb -0.13 -0.05 0.03 0.00 0.00 0.00 0.00 23.12 22.96 1abb s ALA 154 CO -0.08 0.08 -0.01 0.71 0.00 0.00 0.00 175.76 176.46 1abb s TYR 155 N -2.85 0.45 -0.14 0.00 2.02 -0.08 -3.32 117.35 113.42 1abb s TYR 155 Ca 0.27 -0.06 -0.08 0.00 -0.37 0.00 0.00 57.07 56.83 1abb s TYR 155 Cb -0.00 -0.49 -0.04 0.00 -0.40 0.00 0.00 41.96 41.02 1abb s TYR 155 CO 0.11 -0.15 0.14 0.20 -1.57 0.00 0.00 175.55 174.27 1abb s GLY 156 N 1.03 2.12 -0.07 0.71 0.00 0.19 0.86 107.32 112.16 1abb s GLY 156 Ca -0.10 -0.66 0.00 0.00 0.00 0.00 0.00 44.72 43.97 1abb s GLY 156 CO -0.01 -0.22 -0.05 -0.19 0.00 0.00 0.00 173.10 172.63 1abb s TYR 157 N -0.60 1.00 0.30 1.90 2.02 -0.91 -0.07 117.35 120.98 1abb s TYR 157 Ca 0.13 -0.37 -0.12 0.00 -0.37 0.00 0.00 57.07 56.34 1abb s TYR 157 Cb -0.12 -0.90 0.05 0.00 -0.40 0.00 0.00 41.96 40.59 1abb s TYR 157 CO 0.02 -0.32 0.62 0.41 -1.57 0.00 0.00 175.55 174.71 1abb n GLY 158 N 4.56 1.19 3.84 0.71 0.00 -0.98 -3.21 105.19 111.29 1abb n GLY 158 Ca -0.16 -1.20 -0.32 0.00 0.00 0.00 0.00 46.02 44.33 1abb n GLY 158 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1abb s ILE 159 N -2.30 4.57 -0.19 -0.61 1.01 -1.26 0.13 121.20 122.55 1abb s ILE 159 Ca 0.13 1.14 -0.04 0.00 0.00 0.00 0.00 60.65 61.87 1abb s ILE 159 Cb -0.04 -3.62 -0.02 0.00 0.01 0.00 0.00 42.46 38.79 1abb s ILE 159 CO 0.09 -0.28 -0.03 -0.60 0.00 0.00 0.00 174.94 174.12 1abb s ARG 160 N -3.17 3.55 -0.23 2.79 3.52 -1.08 -4.59 118.95 119.75 1abb s ARG 160 Ca 0.57 -0.56 -0.09 0.00 -0.13 0.00 0.00 55.73 55.52 1abb s ARG 160 Cb -0.10 -2.98 -0.04 0.00 -1.56 0.00 0.00 34.95 30.27 1abb s ARG 160 CO 0.17 0.04 0.12 0.71 -0.81 0.00 0.00 175.30 175.54 1abb s TYR 161 N 0.88 3.25 0.16 5.12 2.02 -1.25 -4.66 117.35 122.88 1abb s TYR 161 Ca -0.00 0.07 -0.07 0.00 -0.37 0.00 0.00 57.07 56.70 1abb s TYR 161 Cb -0.14 -2.22 0.01 0.00 -0.40 0.00 0.00 41.96 39.21 1abb s TYR 161 CO 0.01 0.01 1.45 0.93 -1.57 0.00 0.00 175.55 176.39 1abb h GLU 162 N 7.47 0.72 -0.41 -0.62 5.08 -1.52 -3.35 114.58 121.96 1abb h GLU 162 Ca -0.38 -0.46 -0.18 0.00 -1.00 0.00 0.00 59.36 57.35 1abb h GLU 162 Cb 1.17 0.05 -0.11 0.00 0.50 0.00 0.00 28.75 30.37 1abb h GLU 162 CO 0.65 1.08 0.02 1.19 -1.00 0.00 0.00 179.01 180.95 1abb n PHE 163 N -3.98 1.29 0.00 4.33 3.72 -0.81 -4.29 117.46 117.72 1abb n PHE 163 Ca -0.04 -1.47 0.00 0.00 -0.05 0.00 0.00 57.45 55.89 1abb n PHE 163 Cb 0.62 -0.51 0.00 0.00 -0.94 0.00 0.00 39.48 38.65 1abb n PHE 163 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1abb n GLY 164 N -0.98 2.88 3.44 1.37 0.00 -1.22 -3.32 105.19 107.36 1abb n GLY 164 Ca 0.34 0.31 -0.15 0.00 0.00 0.00 0.00 46.02 46.51 1abb n GLY 164 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1abb s ILE 165 N 0.00 0.01 0.47 -0.61 -1.16 -1.26 -2.07 121.20 116.58 1abb s ILE 165 Ca 0.00 -0.10 -0.18 0.00 -0.51 0.00 0.00 60.65 59.86 1abb s ILE 165 Cb 0.00 -0.83 -0.15 0.00 0.61 0.00 0.00 42.46 42.09 1abb s ILE 165 CO 0.00 -0.06 -0.09 2.22 -2.81 0.00 0.00 174.94 174.20 1abb n PHE 166 N 1.76 -2.70 -3.38 3.50 -1.74 -1.26 -4.37 117.46 109.26 1abb n PHE 166 Ca -0.17 0.47 -0.33 0.00 -0.56 0.00 0.00 57.45 56.85 1abb n PHE 166 Cb 0.56 -1.65 -0.06 0.00 1.52 0.00 0.00 39.48 39.86 1abb n PHE 166 CO 0.00 0.00 0.00 -0.80 -0.56 0.00 0.00 176.76 175.40 1abb s ASN 167 N -0.97 6.72 -0.08 5.98 0.01 0.11 -4.82 114.94 121.88 1abb s ASN 167 Ca 0.56 1.00 -0.01 0.00 -0.71 0.00 0.00 52.86 53.70 1abb s ASN 167 Cb -0.50 -2.26 -0.03 0.00 0.41 0.00 0.00 41.25 38.87 1abb s ASN 167 CO 0.64 0.00 -0.02 -1.58 -1.51 0.00 0.00 177.10 174.63 1abb s GLN 168 N -2.43 2.92 -0.01 -0.60 0.74 -1.26 -1.10 119.66 117.93 1abb s GLN 168 Ca 0.43 -0.45 0.00 0.00 0.05 0.00 0.00 55.36 55.39 1abb s GLN 168 Cb -0.13 -2.74 0.02 0.00 1.10 0.00 0.00 33.01 31.26 1abb s GLN 168 CO 0.20 0.69 0.00 0.21 -0.55 0.00 0.00 175.29 175.84 1abb s LYS 169 N -0.84 0.11 -0.28 1.67 2.47 -0.98 -4.36 119.74 117.52 1abb s LYS 169 Ca 0.13 0.06 -0.07 0.00 -1.56 0.00 0.00 55.97 54.53 1abb s LYS 169 Cb -0.11 -0.25 -0.00 0.00 -1.46 0.00 0.00 37.83 36.01 1abb s LYS 169 CO 0.02 -0.08 0.08 0.42 0.16 0.00 0.00 175.35 175.96 1abb s ILE 170 N 0.59 4.12 -0.16 5.43 -1.09 -1.26 -0.46 121.20 128.36 1abb s ILE 170 Ca -0.05 -0.52 0.01 0.00 -2.23 0.00 0.00 60.65 57.85 1abb s ILE 170 Cb -0.08 -3.06 0.02 0.00 -1.58 0.00 0.00 42.46 37.76 1abb s ILE 170 CO -0.01 0.15 -0.16 0.00 -1.23 0.00 0.00 174.94 173.69 1abb n GLY 172 N 4.72 -0.47 2.57 0.00 0.00 -1.26 -0.82 105.19 109.93 1abb n GLY 172 Ca -0.18 0.05 -0.19 0.00 0.00 0.00 0.00 46.02 45.70 1abb n GLY 172 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1abb n GLY 173 N -1.32 1.76 3.62 -0.02 0.00 -1.26 -4.98 105.19 102.99 1abb n GLY 173 Ca -0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.55 1abb n GLY 173 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1abb s TRP 174 N -2.56 2.89 0.03 1.61 0.52 0.00 -3.68 118.94 117.75 1abb s TRP 174 Ca 0.00 -0.06 -0.25 0.00 0.02 0.00 0.00 56.10 55.81 1abb s TRP 174 Cb 0.00 -1.55 -0.05 0.00 -1.15 0.00 0.00 33.47 30.72 1abb s TRP 174 CO 0.00 0.42 0.77 -1.14 0.02 0.00 0.00 176.95 177.01 1abb s GLN 175 N -1.83 4.49 0.03 4.98 0.74 -1.26 -0.46 119.66 126.34 1abb s GLN 175 Ca 0.20 1.06 0.06 0.00 0.05 0.00 0.00 55.36 56.74 1abb s GLN 175 Cb -0.11 -3.37 -0.03 0.00 1.10 0.00 0.00 33.01 30.59 1abb s GLN 175 CO 0.12 0.25 -0.17 -1.64 -0.55 0.00 0.00 175.29 173.30 1abb s MET 176 N 0.05 2.16 -0.39 1.67 -1.94 0.39 -4.96 119.30 116.28 1abb s MET 176 Ca 0.39 -0.93 -0.09 0.00 -1.71 0.00 0.00 55.69 53.35 1abb s MET 176 Cb -0.20 -2.23 0.06 0.00 2.01 0.00 0.00 34.83 34.47 1abb s MET 176 CO 0.23 0.55 0.22 -1.83 -0.01 0.00 0.00 175.02 174.18 1abb s GLU 177 N -1.32 2.67 0.82 2.03 1.03 -1.26 -2.32 118.70 120.35 1abb s GLU 177 Ca 0.14 -1.30 -0.10 0.00 0.03 0.00 0.00 54.97 53.75 1abb s GLU 177 Cb -0.11 -3.71 0.13 0.00 -0.80 0.00 0.00 34.13 29.64 1abb s GLU 177 CO 0.05 -0.83 1.15 -1.21 -1.33 0.00 0.00 175.26 173.09 1abb s GLU 178 N 1.46 1.48 0.05 -4.83 2.02 -0.25 -4.84 118.70 113.79 1abb s GLU 178 Ca 0.02 -0.41 0.01 0.00 0.02 0.00 0.00 54.97 54.61 1abb s GLU 178 Cb -0.21 -2.04 -0.04 0.00 0.10 0.00 0.00 34.13 31.93 1abb s GLU 178 CO 0.04 -1.77 0.12 0.00 0.02 0.00 0.00 175.26 173.66 1abb s ALA 179 N -3.52 3.70 -0.93 5.21 0.00 -1.26 0.05 121.76 125.02 1abb s ALA 179 Ca 0.67 -0.93 -0.16 0.00 0.00 0.00 0.00 51.96 51.54 1abb s ALA 179 Cb -0.07 -1.59 0.18 0.00 0.00 0.00 0.00 23.12 21.65 1abb s ALA 179 CO 0.48 0.76 1.00 0.34 0.00 0.00 0.00 175.76 178.35 1abb s ASP 180 N -2.28 6.78 -0.91 0.00 2.15 -1.21 -4.54 116.67 116.66 1abb s ASP 180 Ca 0.30 -2.53 -0.12 0.00 0.43 0.00 0.00 52.55 50.63 1abb s ASP 180 Cb -0.12 -2.30 0.24 0.00 -0.30 0.00 0.00 42.92 40.43 1abb s ASP 180 CO 0.22 -0.77 0.86 1.51 -0.17 0.00 0.00 175.17 176.82 1abb s ASP 181 N 2.75 6.87 0.37 -0.34 -4.77 -1.26 -3.42 116.67 116.87 1abb s ASP 181 Ca 0.27 -2.98 0.09 0.00 -3.30 0.00 0.00 52.55 46.63 1abb s ASP 181 Cb -0.07 -2.19 0.71 0.00 -1.09 0.00 0.00 42.92 40.27 1abb s ASP 181 CO -0.08 -0.47 1.87 4.11 0.70 0.00 0.00 175.17 181.29 1abb h TRP 182 N 7.40 0.24 0.00 2.11 5.08 -1.92 -2.66 115.95 126.19 1abb h TRP 182 Ca 0.13 -0.04 0.00 0.00 1.08 0.00 0.00 58.89 60.06 1abb h TRP 182 Cb 0.99 -0.06 0.00 0.00 -3.00 0.00 0.00 29.16 27.08 1abb h TRP 182 CO 0.94 0.42 0.00 1.28 -1.28 0.00 0.00 178.44 179.80 1abb n LEU 183 N -4.21 0.00 -0.49 0.11 4.77 -1.26 -4.27 117.00 111.65 1abb n LEU 183 Ca -0.01 0.19 0.40 0.00 -0.03 0.00 0.00 56.01 56.56 1abb n LEU 183 Cb 0.32 -0.19 0.69 0.00 -2.33 0.00 0.00 43.42 41.91 1abb n LEU 183 CO 0.39 -0.06 1.27 -0.09 -1.33 0.00 0.00 177.39 177.56 1abb h ARG 184 N 0.00 0.04 -0.18 3.23 2.43 -1.84 -2.20 114.38 115.86 1abb h ARG 184 Ca 0.00 -0.00 -0.19 0.00 -0.81 0.00 0.00 59.98 58.98 1abb h ARG 184 Cb 0.12 -0.01 -0.27 0.00 -0.42 0.00 0.00 29.97 29.40 1abb h ARG 184 CO 0.00 0.03 -0.84 0.66 -1.51 0.00 0.00 179.97 178.31 1abb n TYR 185 N -4.60 0.62 0.00 2.20 4.01 -1.26 -5.11 117.16 113.02 1abb n TYR 185 Ca 0.39 -1.36 0.00 0.00 -0.16 0.00 0.00 57.90 56.77 1abb n TYR 185 Cb 1.56 -0.23 0.00 0.00 -0.31 0.00 0.00 39.34 40.36 1abb n TYR 185 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1abb n GLY 186 N -0.41 -0.15 2.59 2.72 0.00 -0.83 -4.93 105.19 104.19 1abb n GLY 186 Ca 0.16 -1.81 -0.27 0.00 0.00 0.00 0.00 46.02 44.11 1abb n GLY 186 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1abb s ASN 187 N -1.79 2.85 0.00 1.61 2.47 -1.26 -4.80 114.94 114.01 1abb s ASN 187 Ca 0.00 -0.92 0.13 0.00 0.42 0.00 0.00 52.86 52.48 1abb s ASN 187 Cb 0.00 -0.24 0.60 0.00 -1.45 0.00 0.00 41.25 40.17 1abb s ASN 187 CO 0.00 -0.39 1.36 -0.81 -3.72 0.00 0.00 177.10 173.54 1abb n PRO 188 N 5.27 0.11 0.00 0.43 -0.04 -1.26 -2.70 135.00 136.80 1abb n PRO 188 Ca -0.06 0.21 0.13 0.00 -0.04 0.00 0.00 63.50 63.74 1abb n PRO 188 Cb 0.46 -1.50 0.23 0.00 -0.04 0.00 0.00 33.50 32.64 1abb n PRO 188 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1abb n TRP 189 N -1.38 0.00 -4.28 0.54 7.02 -1.26 -4.86 117.44 113.22 1abb n TRP 189 Ca 0.05 0.00 -0.26 0.00 -1.02 0.00 0.00 57.50 56.26 1abb n TRP 189 Cb 0.12 -0.00 -0.09 0.00 -2.42 0.00 0.00 31.31 28.92 1abb n TRP 189 CO 0.00 0.00 0.00 -1.83 -2.02 0.00 0.00 177.69 173.84 1abb s GLU 190 N -2.02 2.12 -0.15 -0.99 -1.05 -1.10 -4.33 118.70 111.18 1abb s GLU 190 Ca 0.31 -1.27 -0.00 0.00 -0.15 0.00 0.00 54.97 53.86 1abb s GLU 190 Cb 0.20 -2.18 0.03 0.00 -0.44 0.00 0.00 34.13 31.75 1abb s GLU 190 CO 0.32 0.43 -0.08 0.21 0.95 0.00 0.00 175.26 177.09 1abb s LYS 191 N -2.92 1.64 0.07 -4.83 2.36 0.28 -4.97 119.74 111.37 1abb s LYS 191 Ca 0.26 -0.48 -0.31 0.00 -2.55 0.00 0.00 55.97 52.89 1abb s LYS 191 Cb -0.09 -1.94 -0.08 0.00 -1.05 0.00 0.00 37.83 34.67 1abb s LYS 191 CO 0.16 -0.36 1.69 0.00 1.55 0.00 0.00 175.35 178.39 1abb s ALA 192 N 1.61 3.69 -0.82 3.13 0.00 -1.26 -0.41 121.76 127.69 1abb s ALA 192 Ca 0.02 1.23 0.01 0.00 0.00 0.00 0.00 51.96 53.23 1abb s ALA 192 Cb -0.14 -3.71 0.24 0.00 0.00 0.00 0.00 23.12 19.50 1abb s ALA 192 CO -0.08 -1.15 0.85 0.54 0.00 0.00 0.00 175.76 175.92 1abb n ARG 193 N 5.75 2.81 -0.05 0.00 5.12 -0.58 -4.91 116.66 124.79 1abb n ARG 193 Ca 0.16 -4.56 0.09 0.00 -1.93 0.00 0.00 57.85 51.62 1abb n ARG 193 Cb 0.40 -2.36 0.48 0.00 -1.16 0.00 0.00 32.46 29.82 1abb n ARG 193 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 1abb h PRO 194 N 5.24 0.43 0.00 5.56 0.13 -1.96 -2.35 132.00 139.06 1abb h PRO 194 Ca 0.18 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1abb h PRO 194 Cb 0.72 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.75 1abb h PRO 194 CO 0.91 0.29 0.06 0.39 -0.23 0.00 0.00 178.00 179.42 1abb n GLU 195 N -4.47 0.09 -0.78 0.86 4.71 -1.26 -1.29 120.64 118.50 1abb n GLU 195 Ca 0.07 0.58 -0.01 0.00 -0.01 0.00 0.00 57.16 57.79 1abb n GLU 195 Cb 0.26 -1.86 0.19 0.00 -1.01 0.00 0.00 31.44 29.03 1abb n GLU 195 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 1abb n PHE 196 N -2.00 0.65 -1.71 -0.32 3.72 -0.88 -5.04 117.46 111.88 1abb n PHE 196 Ca -0.01 -1.61 -0.37 0.00 -0.05 0.00 0.00 57.45 55.41 1abb n PHE 196 Cb 0.08 -0.38 0.07 0.00 -0.94 0.00 0.00 39.48 38.31 1abb n PHE 196 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1abb n THR 197 N -1.10 4.81 -3.86 4.37 -1.04 -0.41 -4.56 114.28 112.48 1abb n THR 197 Ca 0.27 -0.50 -0.12 0.00 -2.04 0.00 0.00 64.05 61.67 1abb n THR 197 Cb 0.86 -1.45 -0.12 0.00 -1.82 0.00 0.00 70.33 67.80 1abb n THR 197 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1abb s LEU 198 N -4.05 1.71 0.41 -4.42 1.43 -0.71 -4.98 118.68 108.07 1abb s LEU 198 Ca 0.82 0.02 -0.26 0.00 -1.03 0.00 0.00 54.13 53.68 1abb s LEU 198 Cb -0.38 0.36 -0.09 0.00 0.03 0.00 0.00 46.19 46.11 1abb s LEU 198 CO 0.41 -0.13 1.29 -2.16 0.23 0.00 0.00 176.35 175.99 1abb s PRO 199 N -0.43 3.96 -0.04 1.29 0.04 -1.26 -1.70 135.00 136.85 1abb s PRO 199 Ca -0.05 2.13 0.05 0.00 0.04 0.00 0.00 61.00 63.17 1abb s PRO 199 Cb -0.03 -2.74 -0.00 0.00 0.04 0.00 0.00 34.50 31.76 1abb s PRO 199 CO 0.00 -0.49 -0.19 0.08 0.04 0.00 0.00 177.00 176.45 1abb s VAL 200 N -1.27 1.54 -0.26 -0.36 1.01 -0.29 -4.86 120.40 115.89 1abb s VAL 200 Ca 0.57 -0.78 -0.06 0.00 0.00 0.00 0.00 61.98 61.71 1abb s VAL 200 Cb -0.37 -1.31 -0.01 0.00 0.00 0.00 0.00 36.38 34.68 1abb s VAL 200 CO 0.48 0.44 0.05 -1.00 0.00 0.00 0.00 175.10 175.07 1abb s HIS 201 N -0.01 3.09 0.18 5.22 3.76 -1.26 -0.40 115.29 125.86 1abb s HIS 201 Ca -0.03 -0.81 0.09 0.00 -0.15 0.00 0.00 55.06 54.15 1abb s HIS 201 Cb -0.12 -2.21 -0.04 0.00 1.11 0.00 0.00 32.58 31.32 1abb s HIS 201 CO 0.02 -0.51 -0.10 -0.06 -0.85 0.00 0.00 174.74 173.25 1abb s PHE 202 N 1.53 2.63 0.00 1.40 0.08 0.71 -4.96 117.98 119.37 1abb s PHE 202 Ca 0.04 -0.22 0.00 0.00 0.12 0.00 0.00 56.93 56.87 1abb s PHE 202 Cb -0.16 -1.28 0.00 0.00 -0.57 0.00 0.00 43.02 41.01 1abb s PHE 202 CO 0.01 0.52 0.00 0.66 -0.10 0.00 0.00 175.22 176.31 1abb n TYR 203 N 0.02 -0.21 0.00 0.36 4.02 -0.85 -0.12 117.16 120.39 1abb n TYR 203 Ca -0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.78 1abb n TYR 203 Cb 0.56 0.10 0.00 0.00 -0.02 0.00 0.00 39.34 39.97 1abb n TYR 203 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1abb n GLY 204 N 0.00 -0.52 3.51 2.72 0.00 -1.21 -4.49 105.19 105.21 1abb n GLY 204 Ca 0.00 -2.17 -0.17 0.00 0.00 0.00 0.00 46.02 43.68 1abb n GLY 204 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1abb s ARG 205 N 0.00 1.08 -0.17 1.61 1.70 0.78 -4.90 118.95 119.05 1abb s ARG 205 Ca 0.00 0.18 -0.02 0.00 -0.47 0.00 0.00 55.73 55.42 1abb s ARG 205 Cb 0.00 0.51 -0.01 0.00 -0.57 0.00 0.00 34.95 34.87 1abb s ARG 205 CO 0.00 -0.35 -0.10 0.08 -1.08 0.00 0.00 175.30 173.85 1abb s VAL 206 N -1.47 3.16 -0.31 4.99 1.01 -1.26 -0.10 120.40 126.42 1abb s VAL 206 Ca -0.10 -0.60 -0.10 0.00 0.00 0.00 0.00 61.98 61.19 1abb s VAL 206 Cb -0.00 -2.37 -0.01 0.00 0.00 0.00 0.00 36.38 33.99 1abb s VAL 206 CO 0.07 0.49 0.16 -0.70 0.00 0.00 0.00 175.10 175.12 1abb s GLU 207 N 0.79 3.45 -0.77 2.72 2.12 -0.11 -4.91 118.70 121.99 1abb s GLU 207 Ca -0.04 -0.65 -0.23 0.00 0.36 0.00 0.00 54.97 54.42 1abb s GLU 207 Cb -0.15 -3.59 0.07 0.00 0.26 0.00 0.00 34.13 30.72 1abb s GLU 207 CO 0.01 -0.38 1.12 -1.01 -0.54 0.00 0.00 175.26 174.46 1abb s HIS 208 N 1.64 2.65 -0.31 5.30 3.76 -1.26 0.97 115.29 128.04 1abb s HIS 208 Ca 0.05 -0.63 -0.05 0.00 -0.15 0.00 0.00 55.06 54.28 1abb s HIS 208 Cb -0.17 -4.41 0.04 0.00 1.11 0.00 0.00 32.58 29.15 1abb s HIS 208 CO 0.07 -1.75 0.06 0.95 -0.85 0.00 0.00 174.74 173.23 1abb s THR 209 N 4.28 3.55 0.00 1.30 -4.23 0.74 -4.93 115.64 116.35 1abb s THR 209 Ca 0.29 -1.11 0.00 0.00 -1.18 0.00 0.00 61.69 59.70 1abb s THR 209 Cb -0.11 -2.97 0.00 0.00 1.34 0.00 0.00 72.50 70.76 1abb s THR 209 CO 0.05 -0.09 0.00 -1.54 -0.54 0.00 0.00 174.62 172.51 1abb n SER 210 N 4.76 0.00 -0.01 3.99 3.41 -1.26 -1.83 113.62 122.68 1abb n SER 210 Ca -0.13 0.00 0.10 0.00 -0.26 0.00 0.00 58.87 58.58 1abb n SER 210 Cb 0.45 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.26 1abb n SER 210 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 1abb n GLN 211 N 0.00 0.40 -0.92 4.33 -0.06 -1.26 -5.04 117.38 114.83 1abb n GLN 211 Ca 0.00 -0.10 0.00 0.00 -2.00 0.00 0.00 57.00 54.90 1abb n GLN 211 Cb 0.00 -1.50 0.00 0.00 -4.06 0.00 0.00 30.24 24.68 1abb n GLN 211 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1abb n GLY 212 N 1.38 2.17 3.97 1.69 0.00 -0.76 -5.11 105.19 108.53 1abb n GLY 212 Ca -0.00 -1.00 -0.20 0.00 0.00 0.00 0.00 46.02 44.81 1abb n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1abb s ALA 213 N -1.03 4.04 -0.01 4.61 0.00 -1.26 -0.18 121.76 127.92 1abb s ALA 213 Ca 0.00 -1.34 0.03 0.00 0.00 0.00 0.00 51.96 50.65 1abb s ALA 213 Cb 0.00 -1.68 -0.01 0.00 0.00 0.00 0.00 23.12 21.44 1abb s ALA 213 CO 0.00 0.13 -0.10 0.15 0.00 0.00 0.00 175.76 175.94 1abb s LYS 214 N -4.05 0.83 -0.42 0.00 1.02 0.27 -4.77 119.74 112.63 1abb s LYS 214 Ca 0.38 -0.34 -0.09 0.00 0.02 0.00 0.00 55.97 55.95 1abb s LYS 214 Cb -0.09 -0.80 0.08 0.00 -0.52 0.00 0.00 37.83 36.51 1abb s LYS 214 CO 0.30 0.19 0.26 -0.46 -0.92 0.00 0.00 175.35 174.71 1abb s TRP 215 N -0.13 3.36 0.52 3.18 -0.00 -1.26 -0.93 118.94 123.68 1abb s TRP 215 Ca 0.02 -1.63 0.07 0.00 -0.00 0.00 0.00 56.10 54.57 1abb s TRP 215 Cb -0.05 -3.02 0.04 0.00 -0.00 0.00 0.00 33.47 30.45 1abb s TRP 215 CO -0.00 -0.87 0.53 0.14 -0.00 0.00 0.00 176.95 176.74 1abb s VAL 216 N 1.40 2.08 -1.70 5.86 -7.23 0.85 -4.80 120.40 116.86 1abb s VAL 216 Ca 0.03 -1.28 -0.19 0.00 -1.81 0.00 0.00 61.98 58.73 1abb s VAL 216 Cb -0.23 -2.37 0.16 0.00 0.56 0.00 0.00 36.38 34.50 1abb s VAL 216 CO 0.01 0.00 0.81 0.47 -0.31 0.00 0.00 175.10 176.08 1abb n ASP 217 N -1.87 -3.43 -4.83 4.85 9.92 -1.26 -0.15 116.55 119.78 1abb n ASP 217 Ca 0.05 -1.00 -0.33 0.00 -0.53 0.00 0.00 54.79 52.98 1abb n ASP 217 Cb 0.63 -2.81 -0.07 0.00 -0.64 0.00 0.00 41.12 38.23 1abb n ASP 217 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1abb s THR 218 N -3.28 4.47 0.44 -3.53 -4.23 -1.26 -3.28 115.64 104.97 1abb s THR 218 Ca 0.75 1.35 -0.14 0.00 -1.18 0.00 0.00 61.69 62.46 1abb s THR 218 Cb -0.41 -3.64 -0.08 0.00 1.34 0.00 0.00 72.50 69.71 1abb s THR 218 CO 0.92 -0.22 0.87 -1.58 -0.54 0.00 0.00 174.62 174.07 1abb s GLN 219 N -2.99 3.92 -0.03 3.99 0.74 0.83 -4.88 119.66 121.25 1abb s GLN 219 Ca 0.58 0.75 0.05 0.00 0.05 0.00 0.00 55.36 56.79 1abb s GLN 219 Cb -0.10 -2.27 -0.01 0.00 1.10 0.00 0.00 33.01 31.73 1abb s GLN 219 CO 0.15 -0.11 -0.17 0.08 -0.55 0.00 0.00 175.29 174.70 1abb s VAL 220 N -2.41 1.37 0.28 1.34 1.01 -1.26 -0.21 120.40 120.52 1abb s VAL 220 Ca 0.56 -0.70 0.09 0.00 0.00 0.00 0.00 61.98 61.92 1abb s VAL 220 Cb -0.10 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 1abb s VAL 220 CO 0.28 0.39 0.06 -0.69 0.00 0.00 0.00 175.10 175.14 1abb s VAL 221 N -0.12 3.53 0.18 2.92 1.01 0.46 -4.71 120.40 123.68 1abb s VAL 221 Ca 0.00 -1.78 0.07 0.00 0.00 0.00 0.00 61.98 60.27 1abb s VAL 221 Cb -0.09 -2.97 -0.04 0.00 0.00 0.00 0.00 36.38 33.28 1abb s VAL 221 CO 0.01 -0.33 0.04 -0.76 0.00 0.00 0.00 175.10 174.06 1abb s LEU 222 N -3.74 3.45 -0.27 3.92 1.43 -0.27 -1.14 118.68 122.06 1abb s LEU 222 Ca 0.33 -0.34 0.02 0.00 -1.03 0.00 0.00 54.13 53.11 1abb s LEU 222 Cb -0.06 -2.08 0.07 0.00 0.03 0.00 0.00 46.19 44.16 1abb s LEU 222 CO 0.21 0.07 -0.04 0.00 0.23 0.00 0.00 176.35 176.83 1abb s ALA 223 N -1.80 2.37 -0.19 4.21 0.00 -0.69 -0.77 121.76 124.89 1abb s ALA 223 Ca 0.29 -1.82 -0.12 0.00 0.00 0.00 0.00 51.96 50.31 1abb s ALA 223 Cb -0.09 -1.63 -0.05 0.00 0.00 0.00 0.00 23.12 21.35 1abb s ALA 223 CO 0.20 -1.35 0.23 1.41 0.00 0.00 0.00 175.76 176.25 1abb s MET 224 N 1.19 4.19 0.25 0.00 1.75 0.77 -1.74 119.30 125.71 1abb s MET 224 Ca -0.02 -0.07 -0.04 0.00 -1.25 0.00 0.00 55.69 54.31 1abb s MET 224 Cb -0.19 -3.46 -0.05 0.00 2.84 0.00 0.00 34.83 33.97 1abb s MET 224 CO -0.08 0.19 0.50 -1.25 -0.65 0.00 0.00 175.02 173.73 1abb s PRO 225 N 0.65 3.62 -0.07 4.11 0.04 -1.26 -0.57 135.00 141.53 1abb s PRO 225 Ca 0.12 -0.05 0.01 0.00 0.04 0.00 0.00 61.00 61.12 1abb s PRO 225 Cb -0.13 -2.71 0.02 0.00 0.04 0.00 0.00 34.50 31.72 1abb s PRO 225 CO 0.02 0.29 -0.09 0.71 0.04 0.00 0.00 177.00 177.98 1abb s TYR 226 N -1.96 1.24 -0.30 0.56 2.02 0.12 -1.53 117.35 117.50 1abb s TYR 226 Ca 0.43 -0.47 -0.12 0.00 -0.37 0.00 0.00 57.07 56.54 1abb s TYR 226 Cb -0.11 -0.97 -0.04 0.00 -0.40 0.00 0.00 41.96 40.44 1abb s TYR 226 CO 0.28 -0.29 0.24 -0.51 -1.57 0.00 0.00 175.55 173.70 1abb s ASP 227 N 0.93 6.08 -0.11 2.29 1.01 0.45 -1.32 116.67 126.00 1abb s ASP 227 Ca -0.10 -0.07 0.03 0.00 0.71 0.00 0.00 52.55 53.12 1abb s ASP 227 Cb -0.15 -2.14 0.01 0.00 1.01 0.00 0.00 42.92 41.65 1abb s ASP 227 CO 0.01 -0.13 -0.21 -0.89 0.21 0.00 0.00 175.17 174.16 1abb s THR 228 N 1.82 1.84 0.14 -1.27 2.01 0.01 -0.56 115.64 119.63 1abb s THR 228 Ca 0.08 -0.88 -0.30 0.00 0.31 0.00 0.00 61.69 60.91 1abb s THR 228 Cb -0.16 -1.62 -0.06 0.00 0.01 0.00 0.00 72.50 70.66 1abb s THR 228 CO 0.11 0.51 1.01 -2.16 -0.69 0.00 0.00 174.62 173.40 1abb s PRO 229 N 0.59 4.66 -0.31 4.92 0.04 -1.26 -0.15 135.00 143.49 1abb s PRO 229 Ca -0.14 1.55 -0.09 0.00 0.04 0.00 0.00 61.00 62.36 1abb s PRO 229 Cb -0.17 -3.34 0.00 0.00 0.04 0.00 0.00 34.50 31.04 1abb s PRO 229 CO 0.04 0.16 0.14 0.14 0.04 0.00 0.00 177.00 177.52 1abb s VAL 230 N -0.09 4.40 0.67 -0.36 -7.23 -0.99 -4.90 120.40 111.91 1abb s VAL 230 Ca 0.48 -0.55 -0.06 0.00 -1.81 0.00 0.00 61.98 60.03 1abb s VAL 230 Cb -0.26 -3.28 0.05 0.00 0.56 0.00 0.00 36.38 33.45 1abb s VAL 230 CO 0.32 0.04 0.98 -2.16 -0.31 0.00 0.00 175.10 173.96 1abb s PRO 231 N 1.57 2.40 0.16 4.82 0.04 -1.26 -0.41 135.00 142.31 1abb s PRO 231 Ca 0.04 -0.20 0.08 0.00 0.04 0.00 0.00 61.00 60.96 1abb s PRO 231 Cb -0.17 -2.20 -0.04 0.00 0.04 0.00 0.00 34.50 32.12 1abb s PRO 231 CO 0.05 -1.09 -0.06 0.20 0.04 0.00 0.00 177.00 176.15 1abb s GLY 232 N -4.46 1.75 -0.55 0.56 0.00 -1.03 -4.76 107.32 98.83 1abb s GLY 232 Ca 0.58 -1.37 -0.14 0.00 0.00 0.00 0.00 44.72 43.79 1abb s GLY 232 CO 0.45 -1.38 1.57 2.98 0.00 0.00 0.00 173.10 176.71 1abb n TYR 233 N 0.12 0.45 -1.41 1.90 9.36 -1.26 -3.26 117.16 123.07 1abb n TYR 233 Ca -0.11 -0.08 -0.14 0.00 3.32 0.00 0.00 57.90 60.89 1abb n TYR 233 Cb 0.55 -1.57 -0.06 0.00 -0.63 0.00 0.00 39.34 37.63 1abb n TYR 233 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1abb n ARG 234 N 6.35 -1.62 -1.23 2.98 3.00 0.08 -4.82 116.66 121.40 1abb n ARG 234 Ca 0.21 0.99 -0.24 0.00 -0.01 0.00 0.00 57.85 58.80 1abb n ARG 234 Cb 0.48 -5.41 0.17 0.00 0.00 0.00 0.00 32.46 27.70 1abb n ARG 234 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 1abb n ASN 235 N -1.24 4.24 0.00 0.55 2.04 -1.20 -4.90 115.26 114.75 1abb n ASN 235 Ca -0.14 -3.65 0.00 0.00 -0.44 0.00 0.00 54.58 50.35 1abb n ASN 235 Cb 0.62 -0.84 0.00 0.00 -2.53 0.00 0.00 39.78 37.03 1abb n ASN 235 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 1abb n ASN 236 N -1.11 0.00 -4.93 0.53 3.02 -1.26 -3.39 115.26 108.11 1abb n ASN 236 Ca 0.59 0.00 -0.25 0.00 -0.03 0.00 0.00 54.58 54.88 1abb n ASN 236 Cb 1.49 -0.37 0.06 0.00 -0.61 0.00 0.00 39.78 40.35 1abb n ASN 236 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1abb s VAL 237 N -0.15 2.33 -0.19 2.41 -7.23 -1.26 -4.78 120.40 111.52 1abb s VAL 237 Ca 0.00 -0.31 -0.06 0.00 -1.81 0.00 0.00 61.98 59.80 1abb s VAL 237 Cb 0.00 -3.01 0.09 0.00 0.56 0.00 0.00 36.38 34.02 1abb s VAL 237 CO 0.00 -0.01 0.40 -0.69 -0.31 0.00 0.00 175.10 174.50 1abb s VAL 238 N -3.20 -0.63 0.00 1.32 1.01 -1.26 -2.46 120.40 115.19 1abb s VAL 238 Ca 0.60 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.75 1abb s VAL 238 Cb -0.11 -0.65 0.00 0.00 0.00 0.00 0.00 36.38 35.62 1abb s VAL 238 CO 0.44 0.07 0.00 0.59 0.00 0.00 0.00 175.10 176.20 1abb n ASN 239 N 5.39 0.00 -3.95 3.32 4.13 0.45 -4.71 115.26 119.88 1abb n ASN 239 Ca -0.08 0.00 -0.17 0.00 1.68 0.00 0.00 54.58 56.01 1abb n ASN 239 Cb 0.49 0.00 -0.15 0.00 -1.54 0.00 0.00 39.78 38.59 1abb n ASN 239 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1abb s THR 240 N 2.95 0.45 -0.22 3.41 2.01 -1.21 -2.35 115.64 120.68 1abb s THR 240 Ca 0.00 -0.21 -0.04 0.00 0.31 0.00 0.00 61.69 61.75 1abb s THR 240 Cb 0.00 -0.40 -0.01 0.00 0.01 0.00 0.00 72.50 72.10 1abb s THR 240 CO 0.00 0.14 -0.03 -0.32 -0.69 0.00 0.00 174.62 173.72 1abb s MET 241 N 0.05 3.44 -0.25 4.92 1.75 0.78 -0.64 119.30 129.35 1abb s MET 241 Ca -0.00 -0.60 0.02 0.00 -1.25 0.00 0.00 55.69 53.87 1abb s MET 241 Cb -0.04 -3.04 0.06 0.00 2.84 0.00 0.00 34.83 34.65 1abb s MET 241 CO -0.00 -0.15 -0.10 0.50 -0.65 0.00 0.00 175.02 174.62 1abb s ARG 242 N 1.38 2.09 -0.02 4.11 6.06 0.90 -0.81 118.95 132.66 1abb s ARG 242 Ca 0.05 -1.26 0.04 0.00 -2.50 0.00 0.00 55.73 52.05 1abb s ARG 242 Cb -0.14 -2.82 -0.03 0.00 0.06 0.00 0.00 34.95 32.02 1abb s ARG 242 CO -0.01 -0.58 -0.13 -0.51 -2.50 0.00 0.00 175.30 171.57 1abb s LEU 243 N 1.17 2.82 -0.27 -0.88 2.01 -0.43 -2.32 118.68 120.78 1abb s LEU 243 Ca -0.08 -0.23 -0.07 0.00 0.01 0.00 0.00 54.13 53.75 1abb s LEU 243 Cb -0.20 -1.61 -0.01 0.00 0.01 0.00 0.00 46.19 44.38 1abb s LEU 243 CO -0.05 0.31 0.08 0.26 1.01 0.00 0.00 176.35 177.96 1abb s TRP 244 N -0.84 3.11 -0.02 0.29 0.52 0.12 0.10 118.94 122.22 1abb s TRP 244 Ca 0.14 -0.68 -0.21 0.00 0.02 0.00 0.00 56.10 55.36 1abb s TRP 244 Cb -0.11 -2.25 -0.05 0.00 -1.15 0.00 0.00 33.47 29.91 1abb s TRP 244 CO 0.03 -0.47 0.63 -1.12 0.02 0.00 0.00 176.95 176.05 1abb s SER 245 N 1.56 6.98 0.09 2.95 0.01 0.27 -2.63 113.70 122.93 1abb s SER 245 Ca 0.05 1.17 -0.19 0.00 1.31 0.00 0.00 55.95 58.30 1abb s SER 245 Cb -0.16 -2.38 -0.07 0.00 0.21 0.00 0.00 66.02 63.62 1abb s SER 245 CO 0.03 0.04 0.57 0.00 0.41 0.00 0.00 173.24 174.29 1abb s ALA 246 N 0.10 3.58 -0.02 1.44 0.00 -1.26 -0.16 121.76 125.44 1abb s ALA 246 Ca 0.33 0.01 -0.02 0.00 0.00 0.00 0.00 51.96 52.29 1abb s ALA 246 Cb -0.18 -2.62 0.01 0.00 0.00 0.00 0.00 23.12 20.33 1abb s ALA 246 CO 0.18 0.41 0.06 0.15 0.00 0.00 0.00 175.76 176.55 1abb s LYS 247 N -1.25 0.05 0.35 0.00 1.02 0.05 -4.56 119.74 115.40 1abb s LYS 247 Ca 0.30 0.12 -0.28 0.00 0.02 0.00 0.00 55.97 56.14 1abb s LYS 247 Cb -0.19 -0.02 -0.12 0.00 -0.52 0.00 0.00 37.83 36.98 1abb s LYS 247 CO 0.19 -0.04 1.27 0.00 -0.92 0.00 0.00 175.35 175.85 1abb n ALA 248 N 3.30 1.23 -1.77 5.17 0.00 -1.26 -1.11 120.51 126.08 1abb n ALA 248 Ca -0.15 0.35 -0.40 0.00 0.00 0.00 0.00 53.44 53.24 1abb n ALA 248 Cb 0.58 -2.25 0.01 0.00 0.00 0.00 0.00 19.45 17.79 1abb n ALA 248 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1abb s PRO 249 N -1.91 3.75 -0.27 0.00 0.02 -1.26 -4.90 135.00 130.43 1abb s PRO 249 Ca 0.56 2.38 0.08 0.00 0.02 0.00 0.00 61.00 64.05 1abb s PRO 249 Cb -0.57 -2.68 0.45 0.00 0.02 0.00 0.00 34.50 31.72 1abb s PRO 249 CO 0.62 -0.75 1.28 0.09 -0.33 0.00 0.00 177.00 177.90 1abb n ASN 250 N -0.12 3.40 0.11 2.53 5.03 -1.26 -4.45 115.26 120.50 1abb n ASN 250 Ca 0.05 -3.82 -0.03 0.00 0.87 0.00 0.00 54.58 51.64 1abb n ASN 250 Cb 0.42 -0.48 0.11 0.00 -1.02 0.00 0.00 39.78 38.80 1abb n ASN 250 CO 0.00 0.00 0.00 0.44 -1.83 0.00 0.00 177.26 175.87 1abb h ASP 251 N 1.53 0.06 -0.37 6.41 5.19 -1.92 -3.43 116.42 123.90 1abb h ASP 251 Ca 0.21 -0.04 -0.10 0.00 -0.62 0.00 0.00 57.03 56.48 1abb h ASP 251 Cb 1.31 -0.02 -0.02 0.00 0.18 0.00 0.00 39.33 40.78 1abb h ASP 251 CO 0.44 0.73 0.46 0.49 -3.12 0.00 0.00 179.24 178.24 1abb n PHE 252 N -3.74 1.00 0.00 4.55 3.72 -1.25 -2.16 117.46 119.57 1abb n PHE 252 Ca -0.01 -0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 1abb n PHE 252 Cb 0.67 -2.30 0.00 0.00 -0.94 0.00 0.00 39.48 36.92 1abb n PHE 252 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 1abb n ASN 253 N 16.43 0.00 0.00 4.37 0.23 -1.26 -4.96 115.26 130.06 1abb n ASN 253 Ca 0.50 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.55 1abb n ASN 253 Cb 0.39 0.15 0.00 0.00 -2.08 0.00 0.00 39.78 38.24 1abb n ASN 253 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1abb n LEU 254 N -1.58 1.23 -4.59 -4.53 4.32 -1.21 -3.38 117.00 107.26 1abb n LEU 254 Ca 0.00 0.00 -0.42 0.00 -0.02 0.00 0.00 56.01 55.57 1abb n LEU 254 Cb 0.00 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 41.78 1abb n LEU 254 CO 0.00 0.16 1.32 -0.75 -1.22 0.00 0.00 177.39 176.90 1abb s LYS 255 N -1.59 3.40 0.00 3.23 2.20 -0.92 -2.59 119.74 123.47 1abb s LYS 255 Ca 0.00 0.87 0.00 0.00 -0.36 0.00 0.00 55.97 56.48 1abb s LYS 255 Cb 0.00 -4.10 0.00 0.00 -1.51 0.00 0.00 37.83 32.22 1abb s LYS 255 CO 0.00 -1.79 0.00 -3.47 -0.36 0.00 0.00 175.35 169.73 1abb n ASP 256 N 9.54 0.00 -1.17 1.43 2.03 -1.26 -3.96 116.55 123.16 1abb n ASP 256 Ca 0.17 0.00 -0.15 0.00 0.52 0.00 0.00 54.79 55.33 1abb n ASP 256 Cb 0.48 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.83 1abb n ASP 256 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1abb n PHE 257 N 0.00 -0.06 -0.02 -0.67 3.01 -1.07 -4.80 117.46 113.85 1abb n PHE 257 Ca 0.00 0.00 -0.19 0.00 1.01 0.00 0.00 57.45 58.27 1abb n PHE 257 Cb 0.00 -2.64 -0.13 0.00 -0.01 0.00 0.00 39.48 36.70 1abb n PHE 257 CO 0.00 0.00 0.00 -2.95 1.01 0.00 0.00 176.76 174.82 1abb h ASN 258 N 0.00 0.24 -1.44 4.37 7.08 -1.90 -3.49 115.58 120.44 1abb h ASN 258 Ca -0.30 -0.84 0.00 0.00 -3.08 0.00 0.00 56.30 52.07 1abb h ASN 258 Cb 0.98 -0.08 0.00 0.00 -2.08 0.00 0.00 38.32 37.14 1abb h ASN 258 CO 0.44 1.41 0.00 1.33 -2.08 0.00 0.00 177.43 178.52 1abb n VAL 259 N -4.22 0.00 0.00 6.14 0.24 -1.26 -3.97 118.33 115.26 1abb n VAL 259 Ca -0.21 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.09 1abb n VAL 259 Cb 0.75 -0.95 0.00 0.00 -1.47 0.00 0.00 33.84 32.17 1abb n VAL 259 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1abb n GLY 260 N 2.38 2.37 0.08 7.63 0.00 -1.22 -4.30 105.19 112.13 1abb n GLY 260 Ca 0.00 -0.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.88 1abb n GLY 260 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1abb h GLY 261 N 0.00 -0.11 -6.50 -0.02 0.00 -1.93 -3.41 103.07 91.09 1abb h GLY 261 Ca 0.00 0.04 -0.21 0.00 0.00 0.00 0.00 47.33 47.16 1abb h GLY 261 CO 0.00 -0.04 -0.52 -0.47 0.00 0.00 0.00 176.54 175.50 1abb s TYR 262 N -5.72 -0.54 -1.65 5.60 6.14 -1.26 -4.98 117.35 114.94 1abb s TYR 262 Ca -0.14 0.79 0.00 0.00 0.64 0.00 0.00 57.07 58.36 1abb s TYR 262 Cb 0.05 -0.07 0.00 0.00 0.42 0.00 0.00 41.96 42.36 1abb s TYR 262 CO 0.65 -0.55 0.75 0.44 0.64 0.00 0.00 175.55 177.48 1abb n ILE 263 N 5.35 0.00 0.31 3.14 -5.35 -1.26 -3.84 119.36 117.72 1abb n ILE 263 Ca -0.05 0.00 0.03 0.00 -0.27 0.00 0.00 62.75 62.46 1abb n ILE 263 Cb 0.50 -0.19 0.17 0.00 -1.74 0.00 0.00 39.64 38.37 1abb n ILE 263 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1abb n GLN 264 N -0.31 0.10 -0.19 6.28 10.64 -1.26 -0.39 117.38 132.25 1abb n GLN 264 Ca 0.00 0.21 0.00 0.00 -1.83 0.00 0.00 57.00 55.38 1abb n GLN 264 Cb 0.08 -1.50 0.00 0.00 -0.86 0.00 0.00 30.24 27.96 1abb n GLN 264 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1abb n ALA 265 N -1.27 3.03 0.13 2.61 0.00 -1.25 -2.50 120.51 121.26 1abb n ALA 265 Ca 0.03 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.58 1abb n ALA 265 Cb 0.05 -1.02 0.04 0.00 0.00 0.00 0.00 19.45 18.53 1abb n ALA 265 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1abb h VAL 266 N 0.44 0.02 -0.12 0.00 2.07 -1.07 -3.38 116.25 114.22 1abb h VAL 266 Ca 0.00 -1.03 -0.06 0.00 0.82 0.00 0.00 66.70 66.43 1abb h VAL 266 Cb 0.96 1.65 -0.00 0.00 -1.52 0.00 0.00 31.29 32.38 1abb h VAL 266 CO 0.00 0.01 -0.16 -0.07 0.02 0.00 0.00 177.57 177.37 1abb h LEU 267 N 0.00 0.34 -0.71 2.57 3.38 -1.73 -2.68 115.31 116.47 1abb h LEU 267 Ca -0.00 -0.51 0.07 0.00 0.09 0.00 0.00 57.88 57.53 1abb h LEU 267 Cb 1.02 -0.10 -0.10 0.00 0.09 0.00 0.00 40.66 41.56 1abb h LEU 267 CO 0.00 0.79 -0.56 -0.78 0.09 0.00 0.00 178.44 177.98 1abb h ASP 268 N -0.09 -1.96 -0.98 -0.43 1.82 -1.80 0.30 116.42 113.27 1abb h ASP 268 Ca 0.01 0.29 0.10 0.00 -0.39 0.00 0.00 57.03 57.04 1abb h ASP 268 Cb 0.71 0.85 -0.13 0.00 0.68 0.00 0.00 39.33 41.44 1abb h ASP 268 CO 0.04 -0.32 -0.55 -0.09 -1.61 0.00 0.00 179.24 176.71 1abb h ARG 269 N -0.19 -0.01 0.00 0.28 1.12 -1.73 0.65 114.38 114.50 1abb h ARG 269 Ca 0.13 0.00 -0.02 0.00 -1.11 0.00 0.00 59.98 58.98 1abb h ARG 269 Cb 0.51 0.00 -0.00 0.00 -0.01 0.00 0.00 29.97 30.47 1abb h ARG 269 CO -0.78 -0.01 -0.13 -0.91 -3.11 0.00 0.00 179.97 175.04 1abb h ASN 270 N -0.01 0.00 -0.05 -3.80 2.35 -1.07 -1.84 115.58 111.16 1abb h ASN 270 Ca 0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 1abb h ASN 270 Cb 0.45 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.82 1abb h ASN 270 CO -0.94 0.11 0.00 0.18 -1.65 0.00 0.00 177.43 175.13 1abb n LEU 271 N -3.12 1.70 -0.06 1.61 4.77 0.05 -2.76 117.00 119.19 1abb n LEU 271 Ca 0.03 -0.59 -0.04 0.00 -0.03 0.00 0.00 56.01 55.38 1abb n LEU 271 Cb 0.58 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.63 1abb n LEU 271 CO 0.36 0.30 -0.29 0.00 -1.33 0.00 0.00 177.39 176.42 1abb h ALA 272 N 4.35 0.00 0.00 -1.18 0.00 0.95 -3.39 119.26 119.99 1abb h ALA 272 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1abb h ALA 272 Cb 0.55 0.43 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1abb h ALA 272 CO 0.00 0.43 0.39 0.93 0.00 0.00 0.00 179.25 180.99 1abb h GLU 273 N -0.86 0.00 -0.65 0.00 5.08 -1.48 -2.60 114.58 114.08 1abb h GLU 273 Ca 0.00 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.01 1abb h GLU 273 Cb 0.43 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 29.47 1abb h GLU 273 CO 0.00 0.00 0.22 0.27 -1.00 0.00 0.00 179.01 178.50 1abb n ASN 274 N -2.45 3.28 0.07 1.42 2.04 -1.11 -3.66 115.26 114.85 1abb n ASN 274 Ca -0.01 -3.73 -0.12 0.00 -0.44 0.00 0.00 54.58 50.28 1abb n ASN 274 Cb 0.42 -0.72 -0.13 0.00 -2.53 0.00 0.00 39.78 36.81 1abb n ASN 274 CO 0.00 0.00 0.00 0.40 -0.44 0.00 0.00 177.26 177.22 1abb h ILE 275 N 1.04 1.45 -0.02 1.53 2.04 -1.72 -3.25 117.51 118.58 1abb h ILE 275 Ca 0.41 -3.11 0.00 0.00 1.00 0.00 0.00 64.86 63.16 1abb h ILE 275 Cb 2.08 2.83 0.00 0.00 -0.74 0.00 0.00 36.82 40.99 1abb h ILE 275 CO 0.74 0.87 -0.20 -0.24 0.00 0.00 0.00 178.15 179.32 1abb n SER 276 N -3.41 2.48 -0.01 1.72 2.88 -1.24 -4.63 113.62 111.40 1abb n SER 276 Ca -0.08 -1.74 -0.12 0.00 -1.33 0.00 0.00 58.87 55.61 1abb n SER 276 Cb 1.00 0.21 -0.14 0.00 -0.75 0.00 0.00 64.21 64.53 1abb n SER 276 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 1abb h ARG 277 N 3.51 0.07 -3.44 -1.46 2.43 -1.63 -2.46 114.38 111.39 1abb h ARG 277 Ca 0.00 -0.12 -0.15 0.00 -0.81 0.00 0.00 59.98 58.90 1abb h ARG 277 Cb 0.85 0.04 -0.22 0.00 -0.42 0.00 0.00 29.97 30.22 1abb h ARG 277 CO 0.00 0.69 -0.48 0.54 -1.51 0.00 0.00 179.97 179.21 1abb s VAL 278 N -2.59 0.07 0.64 0.20 0.11 -1.26 -1.92 120.40 115.64 1abb s VAL 278 Ca -0.08 -0.55 -0.13 0.00 -2.93 0.00 0.00 61.98 58.29 1abb s VAL 278 Cb 0.08 -0.41 -0.02 0.00 -1.53 0.00 0.00 36.38 34.50 1abb s VAL 278 CO 0.81 -0.30 1.05 -0.22 -3.33 0.00 0.00 175.10 173.11 1abb s LEU 279 N -1.11 3.30 -0.20 2.54 0.20 -0.88 -4.98 118.68 117.55 1abb s LEU 279 Ca -0.12 1.65 0.01 0.00 0.69 0.00 0.00 54.13 56.37 1abb s LEU 279 Cb -0.06 -4.51 0.03 0.00 -0.43 0.00 0.00 46.19 41.22 1abb s LEU 279 CO 0.01 -1.22 -0.18 -0.31 -0.29 0.00 0.00 176.35 174.37 1abb s TYR 280 N -2.84 2.88 0.00 5.38 2.02 -1.26 -4.89 117.35 118.64 1abb s TYR 280 Ca 0.59 -1.78 0.00 0.00 -0.37 0.00 0.00 57.07 55.52 1abb s TYR 280 Cb -0.14 -1.93 0.00 0.00 -0.40 0.00 0.00 41.96 39.49 1abb s TYR 280 CO 0.47 -0.82 0.00 -0.35 -1.57 0.00 0.00 175.55 173.28 1abb n PRO 281 N 4.58 1.41 0.00 -1.71 -0.04 -1.26 -5.15 135.00 132.84 1abb n PRO 281 Ca -0.19 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.27 1abb n PRO 281 Cb 0.48 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.94 1abb n PRO 281 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1abb n ASN 282 N 0.00 0.00 -1.34 3.54 5.15 -1.26 -5.01 115.26 116.34 1abb n ASN 282 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 1abb n ASN 282 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 1abb n ASN 282 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1abb n GLU 287 N 0.00 1.39 -2.51 1.20 4.71 -1.26 -5.58 120.64 118.59 1abb n GLU 287 Ca 0.00 0.00 -0.40 0.00 -0.01 0.00 0.00 57.16 56.75 1abb n GLU 287 Cb 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 31.44 30.41 1abb n GLU 287 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 1abb s GLY 288 N -0.84 1.31 -0.12 0.62 0.00 -1.26 -4.95 107.32 102.08 1abb s GLY 288 Ca 0.00 -2.51 -0.02 0.00 0.00 0.00 0.00 44.72 42.19 1abb s GLY 288 CO 0.00 2.80 -0.03 1.25 0.00 0.00 0.00 173.10 177.12 1abb s LYS 289 N 4.84 3.27 0.42 2.90 2.20 -1.26 -4.99 119.74 127.11 1abb s LYS 289 Ca 0.52 -0.49 0.18 0.00 -0.36 0.00 0.00 55.97 55.83 1abb s LYS 289 Cb 0.01 -2.81 1.10 0.00 -1.51 0.00 0.00 37.83 34.62 1abb s LYS 289 CO 0.00 0.48 1.85 0.93 -0.36 0.00 0.00 175.35 178.24 1abb h GLU 290 N 5.91 0.38 -0.30 4.03 5.08 -2.00 -2.72 114.58 124.96 1abb h GLU 290 Ca -0.41 -0.02 -0.18 0.00 -1.00 0.00 0.00 59.36 57.75 1abb h GLU 290 Cb 1.19 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.35 1abb h GLU 290 CO 0.58 0.25 -0.52 1.25 -1.00 0.00 0.00 179.01 179.57 1abb h LEU 291 N 0.39 0.95 0.27 1.33 6.46 -1.98 -1.12 115.31 121.62 1abb h LEU 291 Ca 0.48 -0.50 0.00 0.00 -0.12 0.00 0.00 57.88 57.75 1abb h LEU 291 Cb 1.23 -0.27 -0.03 0.00 -0.73 0.00 0.00 40.66 40.86 1abb h LEU 291 CO -0.18 1.29 -0.32 0.03 -0.62 0.00 0.00 178.44 178.64 1abb h ARG 292 N 0.67 -0.61 -0.03 1.25 3.08 -1.85 0.12 114.38 117.00 1abb h ARG 292 Ca 0.02 0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.09 1abb h ARG 292 Cb 1.12 0.14 -0.01 0.00 0.08 0.00 0.00 29.97 31.31 1abb h ARG 292 CO 0.12 -0.41 -0.11 1.25 -1.07 0.00 0.00 179.97 179.75 1abb h LEU 293 N -0.64 0.04 -0.62 3.04 5.85 -1.53 0.23 115.31 121.68 1abb h LEU 293 Ca -0.01 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 1abb h LEU 293 Cb 0.60 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 1abb h LEU 293 CO -0.09 0.16 0.28 0.11 -0.34 0.00 0.00 178.44 178.56 1abb h LYS 294 N 0.04 0.91 -0.42 1.25 1.57 0.19 -1.06 116.57 119.05 1abb h LYS 294 Ca 0.01 -0.15 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1abb h LYS 294 Cb 0.22 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 1abb h LYS 294 CO 0.01 0.75 0.25 1.96 -0.57 0.00 0.00 179.45 181.85 1abb h GLN 295 N 0.86 0.58 -0.24 3.15 4.20 0.19 0.63 115.11 124.49 1abb h GLN 295 Ca 0.21 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.82 1abb h GLN 295 Cb 0.15 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.81 1abb h GLN 295 CO -0.02 0.43 -0.04 0.93 -0.67 0.00 0.00 178.83 179.46 1abb h GLU 296 N 0.56 0.45 -0.00 1.46 5.08 -1.19 -0.80 114.58 120.13 1abb h GLU 296 Ca 0.15 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1abb h GLU 296 Cb 0.01 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.23 1abb h GLU 296 CO -0.03 0.67 0.00 -0.92 -1.00 0.00 0.00 179.01 177.73 1abb h TYR 297 N 0.19 0.00 0.11 4.33 3.20 -1.04 -1.99 116.97 121.77 1abb h TYR 297 Ca 0.06 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.95 1abb h TYR 297 Cb 0.49 -0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.72 1abb h TYR 297 CO 0.05 0.13 -0.36 0.35 -1.64 0.00 0.00 178.16 176.69 1abb h PHE 298 N -0.12 -0.99 -0.49 -3.82 3.04 -0.74 0.40 116.94 114.22 1abb h PHE 298 Ca 0.00 0.02 0.01 0.00 3.98 0.00 0.00 57.97 61.99 1abb h PHE 298 Cb 0.13 0.42 -0.03 0.00 2.56 0.00 0.00 35.95 39.03 1abb h PHE 298 CO -0.03 -0.46 0.32 -0.24 -2.02 0.00 0.00 178.31 175.88 1abb h VAL 299 N -0.58 1.10 -0.27 1.41 3.04 -1.14 -2.44 116.25 117.37 1abb h VAL 299 Ca 0.03 -0.21 -0.16 0.00 -1.01 0.00 0.00 66.70 65.35 1abb h VAL 299 Cb 0.62 0.43 -0.00 0.00 -2.01 0.00 0.00 31.29 30.32 1abb h VAL 299 CO -0.22 0.11 -0.47 0.58 -1.01 0.00 0.00 177.57 176.57 1abb h VAL 300 N 0.62 1.29 -0.07 1.51 2.07 -0.56 -3.16 116.25 117.95 1abb h VAL 300 Ca 0.18 -1.66 -0.04 0.00 0.82 0.00 0.00 66.70 66.00 1abb h VAL 300 Cb -0.01 1.67 -0.00 0.00 -1.52 0.00 0.00 31.29 31.43 1abb h VAL 300 CO -0.04 0.54 -0.12 0.00 0.02 0.00 0.00 177.57 177.97 1abb h ALA 301 N 0.67 0.11 0.00 1.67 0.00 0.15 -2.75 119.26 119.11 1abb h ALA 301 Ca 0.02 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 1abb h ALA 301 Cb 1.07 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 1abb h ALA 301 CO 0.11 -0.02 -0.06 0.00 0.00 0.00 0.00 179.25 179.28 1abb h ALA 302 N 0.51 0.99 -0.06 0.00 0.00 -1.56 -2.53 119.26 116.60 1abb h ALA 302 Ca 0.01 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1abb h ALA 302 Cb 0.68 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 1abb h ALA 302 CO 0.03 0.07 -0.07 1.15 0.00 0.00 0.00 179.25 180.43 1abb h THR 303 N 0.00 1.38 -0.41 0.00 2.02 -1.56 -3.24 112.91 111.10 1abb h THR 303 Ca -0.00 -1.24 0.04 0.00 0.77 0.00 0.00 66.41 65.98 1abb h THR 303 Cb 0.71 2.06 -0.02 0.00 -1.74 0.00 0.00 68.15 69.16 1abb h THR 303 CO 0.01 0.34 0.27 -0.07 0.37 0.00 0.00 175.52 176.44 1abb h LEU 304 N -0.29 0.34 0.61 2.58 4.07 -1.14 0.06 115.31 121.55 1abb h LEU 304 Ca 0.01 -0.00 -0.03 0.00 0.08 0.00 0.00 57.88 57.94 1abb h LEU 304 Cb 0.58 -0.08 0.01 0.00 1.08 0.00 0.00 40.66 42.25 1abb h LEU 304 CO 0.02 0.23 -0.30 1.56 -1.08 0.00 0.00 178.44 178.87 1abb h GLN 305 N 0.40 -0.80 -0.93 1.13 4.20 -1.66 -2.02 115.11 115.43 1abb h GLN 305 Ca 0.17 0.05 0.27 0.00 0.06 0.00 0.00 58.65 59.20 1abb h GLN 305 Cb 0.18 0.18 -0.15 0.00 0.30 0.00 0.00 27.48 27.99 1abb h GLN 305 CO -0.04 -0.52 0.33 0.22 -0.67 0.00 0.00 178.83 178.15 1abb h ASP 306 N -1.20 0.13 0.00 1.46 3.58 -1.38 0.37 116.42 119.37 1abb h ASP 306 Ca -0.08 0.20 0.00 0.00 0.42 0.00 0.00 57.03 57.57 1abb h ASP 306 Cb 0.64 0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.94 1abb h ASP 306 CO 0.14 -0.17 0.00 -0.38 -2.88 0.00 0.00 179.24 175.95 1abb n ILE 307 N -5.19 0.00 -0.38 2.25 5.41 -0.07 -2.52 119.36 118.87 1abb n ILE 307 Ca 0.25 1.46 0.37 0.00 1.00 0.00 0.00 62.75 65.83 1abb n ILE 307 Cb 0.80 -2.44 0.75 0.00 -0.71 0.00 0.00 39.64 38.04 1abb n ILE 307 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1abb h ILE 308 N 0.00 0.35 0.30 1.39 2.04 -0.35 -1.26 117.51 119.98 1abb h ILE 308 Ca 0.00 -0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 1abb h ILE 308 Cb 0.00 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 36.42 1abb h ILE 308 CO 0.00 0.00 -0.14 -0.09 0.00 0.00 0.00 178.15 177.92 1abb h ARG 309 N 0.01 -0.39 -0.53 2.37 2.43 -0.24 -1.62 114.38 116.42 1abb h ARG 309 Ca 0.62 0.03 0.15 0.00 -0.81 0.00 0.00 59.98 59.97 1abb h ARG 309 Cb 2.45 0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 32.07 1abb h ARG 309 CO -0.02 -0.26 0.44 0.00 -1.51 0.00 0.00 179.97 178.62 1abb h ARG 310 N -0.47 0.00 0.52 0.20 3.08 -0.97 0.41 114.38 117.15 1abb h ARG 310 Ca -0.04 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.98 1abb h ARG 310 Cb 0.31 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.36 1abb h ARG 310 CO 0.07 0.00 -0.25 0.35 -1.07 0.00 0.00 179.97 179.07 1abb h PHE 311 N 0.00 -0.65 0.91 3.04 3.57 -0.99 0.20 116.94 123.02 1abb h PHE 311 Ca 0.25 -0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.69 1abb h PHE 311 Cb 1.13 0.21 0.01 0.00 2.79 0.00 0.00 35.95 40.09 1abb h PHE 311 CO 0.00 -0.32 -0.47 0.87 -2.23 0.00 0.00 178.31 176.16 1abb h LYS 312 N -0.95 -1.21 -0.20 1.11 1.57 -0.37 -3.34 116.57 113.18 1abb h LYS 312 Ca -0.07 0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1abb h LYS 312 Cb 0.62 0.28 -0.01 0.00 0.08 0.00 0.00 32.23 33.19 1abb h LYS 312 CO 0.12 -0.81 0.11 0.66 -0.57 0.00 0.00 179.45 178.96 1abb h SER 313 N -1.26 0.25 -0.12 0.86 4.64 -0.27 0.87 113.55 118.52 1abb h SER 313 Ca -0.12 -0.08 -0.39 0.00 -0.47 0.00 0.00 61.79 60.73 1abb h SER 313 Cb 0.98 -0.06 0.05 0.00 -0.31 0.00 0.00 62.40 63.05 1abb h SER 313 CO 0.18 0.25 1.14 -1.20 -0.87 0.00 0.00 176.83 176.34 1abb n SER 314 N -4.90 1.84 0.00 4.97 7.64 0.70 -4.09 113.62 119.79 1abb n SER 314 Ca -0.03 -2.58 0.00 0.00 1.01 0.00 0.00 58.87 57.27 1abb n SER 314 Cb 0.07 -1.22 0.00 0.00 -1.01 0.00 0.00 64.21 62.05 1abb n SER 314 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1abb n LYS 315 N 7.88 0.00 0.01 1.43 4.01 -1.26 -4.66 118.16 125.57 1abb n LYS 315 Ca 0.46 0.00 0.09 0.00 -0.51 0.00 0.00 58.31 58.35 1abb n LYS 315 Cb 0.44 -3.49 0.40 0.00 -0.51 0.00 0.00 35.03 31.87 1abb n LYS 315 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 1abb n PHE 316 N -1.13 0.06 -0.02 2.13 -0.00 -1.25 -2.00 117.46 115.26 1abb n PHE 316 Ca 0.00 0.02 -0.11 0.00 -0.00 0.00 0.00 57.45 57.36 1abb n PHE 316 Cb 0.00 -0.54 -0.05 0.00 -0.00 0.00 0.00 39.48 38.89 1abb n PHE 316 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.76 177.54 1abb h GLY 317 N 3.16 0.19 1.58 7.13 0.00 0.61 -2.61 103.07 113.12 1abb h GLY 317 Ca 0.00 -0.08 -0.20 0.00 0.00 0.00 0.00 47.33 47.05 1abb h GLY 317 CO 0.00 0.08 -0.84 0.00 0.00 0.00 0.00 176.54 175.78 1abb n ARG 319 N -3.78 3.40 -0.07 0.00 0.00 -0.84 -4.55 116.66 110.81 1abb n ARG 319 Ca -0.05 -2.09 -0.14 0.00 -0.00 0.00 0.00 57.85 55.57 1abb n ARG 319 Cb 0.77 -2.76 -0.06 0.00 0.00 0.00 0.00 32.46 30.41 1abb n ARG 319 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.63 177.85 1abb h ASP 320 N 5.27 0.61 0.00 6.15 1.82 -1.37 -3.43 116.42 125.47 1abb h ASP 320 Ca 0.80 -0.50 0.00 0.00 -0.39 0.00 0.00 57.03 56.95 1abb h ASP 320 Cb 0.28 -0.17 0.00 0.00 0.68 0.00 0.00 39.33 40.11 1abb h ASP 320 CO 1.74 0.98 0.00 -2.65 -1.61 0.00 0.00 179.24 177.70 1abb n PRO 321 N -4.36 0.00 -3.46 0.28 -0.02 -1.26 -2.21 135.00 123.97 1abb n PRO 321 Ca -0.05 0.00 0.01 0.00 -2.02 0.00 0.00 63.50 61.44 1abb n PRO 321 Cb 0.45 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 33.89 1abb n PRO 321 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1abb s VAL 322 N -0.00 -0.71 -0.21 -1.45 0.11 -1.26 -4.99 120.40 111.89 1abb s VAL 322 Ca 0.00 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.05 1abb s VAL 322 Cb 0.00 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.85 1abb s VAL 322 CO 0.00 0.00 0.00 0.54 -3.33 0.00 0.00 175.10 172.31 1abb n ARG 323 N 5.20 -1.92 -3.38 1.54 5.12 -1.26 0.10 116.66 122.07 1abb n ARG 323 Ca -0.09 0.45 -0.20 0.00 -1.93 0.00 0.00 57.85 56.08 1abb n ARG 323 Cb 0.51 -4.51 0.01 0.00 -1.16 0.00 0.00 32.46 27.32 1abb n ARG 323 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 1abb n THR 324 N -1.59 -6.52 -2.15 0.55 -1.04 -1.25 -4.65 114.28 97.64 1abb n THR 324 Ca -0.02 0.12 -0.42 0.00 -2.04 0.00 0.00 64.05 61.69 1abb n THR 324 Cb 0.40 -4.83 -0.03 0.00 -1.82 0.00 0.00 70.33 64.05 1abb n THR 324 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1abb s ASN 325 N -2.54 6.80 0.00 8.00 3.84 0.29 -4.83 114.94 126.50 1abb s ASN 325 Ca 0.14 2.29 0.01 0.00 0.21 0.00 0.00 52.86 55.51 1abb s ASN 325 Cb -0.02 -2.58 0.05 0.00 -0.55 0.00 0.00 41.25 38.14 1abb s ASN 325 CO 0.83 -0.70 0.70 0.49 -2.79 0.00 0.00 177.10 175.64 1abb n PHE 326 N 4.47 0.00 -0.10 0.43 3.72 -1.26 0.67 117.46 125.38 1abb n PHE 326 Ca 0.12 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.40 1abb n PHE 326 Cb 0.42 -0.16 -0.04 0.00 -0.94 0.00 0.00 39.48 38.77 1abb n PHE 326 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1abb h ASP 327 N 0.00 0.67 -0.54 4.37 3.32 -1.90 -3.04 116.42 119.29 1abb h ASP 327 Ca 0.00 -0.41 -0.10 0.00 0.02 0.00 0.00 57.03 56.54 1abb h ASP 327 Cb 0.00 -0.18 -0.06 0.00 0.22 0.00 0.00 39.33 39.31 1abb h ASP 327 CO 0.00 0.93 0.12 0.00 -1.72 0.00 0.00 179.24 178.57 1abb n ALA 328 N -2.45 3.95 0.09 3.45 0.00 0.21 -4.44 120.51 121.32 1abb n ALA 328 Ca -0.03 -1.72 -0.05 0.00 0.00 0.00 0.00 53.44 51.64 1abb n ALA 328 Cb 0.38 -1.16 -0.02 0.00 0.00 0.00 0.00 19.45 18.65 1abb n ALA 328 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1abb h PHE 329 N 2.65 -0.27 -0.09 0.00 3.57 -1.40 -3.06 116.94 118.33 1abb h PHE 329 Ca 0.12 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.64 1abb h PHE 329 Cb 1.89 0.09 -0.00 0.00 2.79 0.00 0.00 35.95 40.71 1abb h PHE 329 CO 0.98 -0.17 0.11 -1.00 -2.23 0.00 0.00 178.31 175.99 1abb h PRO 330 N -0.83 0.00 -0.10 6.41 0.13 -1.78 0.04 132.00 135.87 1abb h PRO 330 Ca -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 1abb h PRO 330 Cb 0.23 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.35 1abb h PRO 330 CO 0.05 0.00 0.06 -0.44 -0.23 0.00 0.00 178.00 177.44 1abb h ASP 331 N 0.00 0.10 -0.73 1.44 5.19 -1.80 -3.19 116.42 117.43 1abb h ASP 331 Ca 0.04 -0.00 -0.30 0.00 -0.62 0.00 0.00 57.03 56.15 1abb h ASP 331 Cb 0.25 -0.02 -0.18 0.00 0.18 0.00 0.00 39.33 39.56 1abb h ASP 331 CO -0.00 0.07 0.33 0.29 -3.12 0.00 0.00 179.24 176.81 1abb n LYS 332 N -5.03 2.84 -3.72 3.56 4.01 -0.02 -4.68 118.16 115.12 1abb n LYS 332 Ca -0.05 -3.07 -0.14 0.00 -0.51 0.00 0.00 58.31 54.55 1abb n LYS 332 Cb 0.03 -2.11 -0.09 0.00 -0.51 0.00 0.00 35.03 32.35 1abb n LYS 332 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 1abb s VAL 333 N -3.14 0.02 0.07 -0.18 1.01 -1.07 -1.00 120.40 116.11 1abb s VAL 333 Ca 0.53 -0.13 0.02 0.00 0.00 0.00 0.00 61.98 62.40 1abb s VAL 333 Cb 0.44 -0.63 -0.03 0.00 0.00 0.00 0.00 36.38 36.16 1abb s VAL 333 CO 0.10 -0.07 -0.07 0.00 0.00 0.00 0.00 175.10 175.06 1abb s ALA 334 N -0.29 0.78 -0.09 5.51 0.00 0.14 -4.70 121.76 123.10 1abb s ALA 334 Ca -0.04 -1.07 -0.01 0.00 0.00 0.00 0.00 51.96 50.83 1abb s ALA 334 Cb -0.03 0.11 0.03 0.00 0.00 0.00 0.00 23.12 23.22 1abb s ALA 334 CO 0.02 -0.13 -0.00 0.42 0.00 0.00 0.00 175.76 176.07 1abb s ILE 335 N -2.55 0.49 -0.23 0.00 1.01 -1.24 -1.64 121.20 117.04 1abb s ILE 335 Ca 0.01 -0.03 -0.12 0.00 0.00 0.00 0.00 60.65 60.51 1abb s ILE 335 Cb -0.02 -0.67 -0.05 0.00 0.01 0.00 0.00 42.46 41.73 1abb s ILE 335 CO -0.02 0.21 0.23 -1.10 0.00 0.00 0.00 174.94 174.25 1abb s GLN 336 N 1.92 4.09 -0.53 2.79 -1.52 -0.99 -2.40 119.66 123.01 1abb s GLN 336 Ca 0.04 -0.15 -0.11 0.00 -1.95 0.00 0.00 55.36 53.19 1abb s GLN 336 Cb -0.13 -3.55 0.13 0.00 -0.22 0.00 0.00 33.01 29.24 1abb s GLN 336 CO -0.06 0.01 0.43 -0.51 -0.25 0.00 0.00 175.29 174.91 1abb s LEU 337 N 1.19 5.91 -0.87 2.90 1.02 -0.24 -2.32 118.68 126.27 1abb s LEU 337 Ca 0.11 -2.00 -0.25 0.00 0.02 0.00 0.00 54.13 52.01 1abb s LEU 337 Cb -0.14 -2.07 0.00 0.00 0.02 0.00 0.00 46.19 44.00 1abb s LEU 337 CO 0.06 -0.71 1.65 0.21 0.02 0.00 0.00 176.35 177.57 1abb s ASN 338 N 2.77 5.81 0.05 2.29 2.47 -1.15 -2.15 114.94 125.04 1abb s ASN 338 Ca 0.07 -0.76 0.00 0.00 0.42 0.00 0.00 52.86 52.59 1abb s ASN 338 Cb -0.26 -2.56 0.00 0.00 -1.45 0.00 0.00 41.25 36.99 1abb s ASN 338 CO -0.01 -2.10 0.00 -0.67 -3.72 0.00 0.00 177.10 170.61 1abb n ASP 339 N 11.21 -0.92 0.00 -4.21 2.03 -0.86 -4.39 116.55 119.42 1abb n ASP 339 Ca 0.28 0.11 0.00 0.00 0.52 0.00 0.00 54.79 55.71 1abb n ASP 339 Cb 0.50 -0.50 0.00 0.00 -0.72 0.00 0.00 41.12 40.39 1abb n ASP 339 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1abb n THR 340 N -2.66 0.00 0.10 5.18 -2.24 -1.26 -3.93 114.28 109.48 1abb n THR 340 Ca -0.00 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.80 1abb n THR 340 Cb 0.07 -1.00 0.41 0.00 -2.10 0.00 0.00 70.33 67.71 1abb n THR 340 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1abb h HIS 341 N 0.00 0.29 -0.77 4.78 3.86 -1.93 0.03 115.15 121.42 1abb h HIS 341 Ca 0.00 -0.02 -0.29 0.00 -1.16 0.00 0.00 60.37 58.90 1abb h HIS 341 Cb 0.00 -0.09 -0.17 0.00 1.06 0.00 0.00 27.41 28.21 1abb h HIS 341 CO 0.00 0.35 0.37 -2.30 0.86 0.00 0.00 177.93 177.20 1abb n PRO 342 N -4.33 3.12 -0.35 2.45 -0.02 -1.25 -4.72 135.00 129.90 1abb n PRO 342 Ca -0.00 -2.82 0.04 0.00 -2.02 0.00 0.00 63.50 58.70 1abb n PRO 342 Cb 0.22 -2.14 0.21 0.00 -0.02 0.00 0.00 33.50 31.78 1abb n PRO 342 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1abb h SER 343 N 2.01 0.97 0.04 2.55 4.64 -1.26 0.35 113.55 122.86 1abb h SER 343 Ca 0.36 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 1abb h SER 343 Cb 2.39 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 64.30 1abb h SER 343 CO 0.80 0.59 0.00 0.18 -0.87 0.00 0.00 176.83 177.53 1abb n LEU 344 N -4.53 0.00 0.17 5.97 4.77 -1.26 -0.94 117.00 121.18 1abb n LEU 344 Ca 0.16 0.26 0.13 0.00 -0.03 0.00 0.00 56.01 56.53 1abb n LEU 344 Cb 0.24 -0.26 0.58 0.00 -2.33 0.00 0.00 43.42 41.65 1abb n LEU 344 CO 0.31 -0.24 0.88 0.00 -1.33 0.00 0.00 177.39 177.00 1abb h ALA 345 N 2.12 1.00 0.12 -1.18 0.00 -0.64 -1.07 119.26 119.60 1abb h ALA 345 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1abb h ALA 345 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1abb h ALA 345 CO 0.00 0.00 -0.06 0.82 0.00 0.00 0.00 179.25 180.01 1abb h ILE 346 N 0.00 0.00 0.00 0.00 2.04 -1.25 -2.08 117.51 116.22 1abb h ILE 346 Ca 0.00 -0.38 -0.03 0.00 1.00 0.00 0.00 64.86 65.45 1abb h ILE 346 Cb 0.22 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.30 1abb h ILE 346 CO 0.00 0.00 -0.15 1.55 0.00 0.00 0.00 178.15 179.55 1abb h PRO 347 N -0.54 0.00 -0.26 2.37 0.13 -1.76 -0.90 132.00 131.05 1abb h PRO 347 Ca -0.02 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.04 1abb h PRO 347 Cb 0.12 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.24 1abb h PRO 347 CO 0.03 0.15 -0.18 1.49 -0.23 0.00 0.00 178.00 179.26 1abb h GLU 348 N 0.00 0.45 -0.28 0.86 4.57 -1.29 0.13 114.58 119.02 1abb h GLU 348 Ca -0.00 -0.14 -0.15 0.00 -1.18 0.00 0.00 59.36 57.89 1abb h GLU 348 Cb 0.29 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 28.83 1abb h GLU 348 CO 0.02 0.62 -0.40 1.25 -1.18 0.00 0.00 179.01 179.31 1abb h LEU 349 N 0.41 0.84 -0.18 1.64 5.85 -0.46 -1.14 115.31 122.27 1abb h LEU 349 Ca 0.07 -0.51 -0.02 0.00 0.84 0.00 0.00 57.88 58.26 1abb h LEU 349 Cb 0.55 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 1abb h LEU 349 CO 0.04 1.18 0.02 0.24 -0.34 0.00 0.00 178.44 179.58 1abb h MET 350 N 0.52 0.30 -0.14 1.25 2.86 -0.64 -0.04 114.93 119.03 1abb h MET 350 Ca 0.03 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 1abb h MET 350 Cb 1.00 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.62 1abb h MET 350 CO 0.09 0.49 0.05 -0.09 1.06 0.00 0.00 176.91 178.52 1abb h ARG 351 N 0.08 0.22 -0.93 1.72 2.43 -0.82 0.16 114.38 117.23 1abb h ARG 351 Ca 0.05 -0.04 0.09 0.00 -0.81 0.00 0.00 59.98 59.28 1abb h ARG 351 Cb 0.34 -0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 29.78 1abb h ARG 351 CO 0.01 0.32 0.57 0.28 -1.51 0.00 0.00 179.97 179.64 1abb h VAL 352 N 0.07 0.96 0.01 0.20 2.07 -0.88 -2.53 116.25 116.15 1abb h VAL 352 Ca 0.05 -0.33 -0.08 0.00 0.82 0.00 0.00 66.70 67.16 1abb h VAL 352 Cb 0.19 -0.08 0.01 0.00 -1.52 0.00 0.00 31.29 29.88 1abb h VAL 352 CO -0.00 0.18 -0.30 -0.07 0.02 0.00 0.00 177.57 177.40 1abb h LEU 353 N 0.96 0.25 0.25 2.57 3.38 0.43 -0.58 115.31 122.56 1abb h LEU 353 Ca 0.44 -0.80 -0.01 0.00 0.09 0.00 0.00 57.88 57.60 1abb h LEU 353 Cb 0.35 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1abb h LEU 353 CO -0.23 1.02 -0.12 0.58 0.09 0.00 0.00 178.44 179.78 1abb h VAL 354 N -0.49 0.00 0.18 1.22 2.07 -0.77 0.11 116.25 118.57 1abb h VAL 354 Ca -0.04 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 1abb h VAL 354 Cb 1.07 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 1abb h VAL 354 CO 0.06 0.00 -0.09 0.44 0.02 0.00 0.00 177.57 178.00 1abb h ASP 355 N -0.34 -0.20 0.15 0.57 3.32 -1.61 -3.00 116.42 115.30 1abb h ASP 355 Ca -0.03 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 1abb h ASP 355 Cb 0.25 0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.86 1abb h ASP 355 CO 0.06 0.17 -0.07 -0.07 -1.72 0.00 0.00 179.24 177.60 1abb h LEU 356 N -0.87 -0.17 0.00 1.55 4.07 -1.01 -3.39 115.31 115.49 1abb h LEU 356 Ca -0.02 -0.36 0.00 0.00 0.08 0.00 0.00 57.88 57.58 1abb h LEU 356 Cb 0.19 0.04 0.00 0.00 1.08 0.00 0.00 40.66 41.97 1abb h LEU 356 CO 0.04 0.33 0.00 -0.62 -1.08 0.00 0.00 178.44 177.11 1abb n GLU 357 N -4.95 0.00 0.00 1.13 -0.58 -0.77 -5.02 120.64 110.45 1abb n GLU 357 Ca -0.08 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.66 1abb n GLU 357 Cb 0.26 -0.72 0.00 0.00 -0.57 0.00 0.00 31.44 30.42 1abb n GLU 357 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 1abb n ARG 358 N -0.40 0.00 -1.86 3.49 3.00 -0.01 -5.01 116.66 115.87 1abb n ARG 358 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 57.85 57.52 1abb n ARG 358 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 32.46 32.50 1abb n ARG 358 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1abb s LEU 359 N 0.00 3.44 1.04 6.15 1.43 -0.97 -4.94 118.68 124.84 1abb s LEU 359 Ca 0.00 1.99 -0.16 0.00 -1.03 0.00 0.00 54.13 54.93 1abb s LEU 359 Cb 0.00 -4.55 0.21 0.00 0.03 0.00 0.00 46.19 41.88 1abb s LEU 359 CO 0.00 -1.51 1.17 1.51 0.23 0.00 0.00 176.35 177.74 1abb s ASP 360 N -2.54 2.38 0.31 2.29 -4.77 -1.26 -4.37 116.67 108.71 1abb s ASP 360 Ca 0.67 0.70 0.02 0.00 -3.30 0.00 0.00 52.55 50.64 1abb s ASP 360 Cb -0.20 -1.04 0.51 0.00 -1.09 0.00 0.00 42.92 41.09 1abb s ASP 360 CO 0.39 -3.23 1.84 -0.25 0.70 0.00 0.00 175.17 174.62 1abb h TRP 361 N -1.97 0.66 0.13 2.11 7.01 -1.96 -2.54 115.95 119.39 1abb h TRP 361 Ca -0.48 -0.07 -0.32 0.00 2.11 0.00 0.00 58.89 60.13 1abb h TRP 361 Cb 1.30 -0.19 -0.01 0.00 -2.10 0.00 0.00 29.16 28.16 1abb h TRP 361 CO -0.92 0.62 -1.64 -0.44 -2.79 0.00 0.00 178.44 173.27 1abb h ASP 362 N 0.61 0.43 -0.75 2.65 3.32 -1.99 -0.83 116.42 119.86 1abb h ASP 362 Ca 0.13 -0.65 -0.04 0.00 0.02 0.00 0.00 57.03 56.50 1abb h ASP 362 Cb 0.35 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.72 1abb h ASP 362 CO 0.01 1.55 0.33 0.50 -1.72 0.00 0.00 179.24 179.91 1abb h LYS 363 N 0.08 1.11 -0.57 3.56 1.63 -1.89 -1.62 116.57 118.87 1abb h LYS 363 Ca -0.29 -0.18 -0.08 0.00 -0.85 0.00 0.00 60.65 59.26 1abb h LYS 363 Cb 2.04 -0.19 -0.02 0.00 -0.60 0.00 0.00 32.23 33.45 1abb h LYS 363 CO 0.16 0.88 0.06 0.00 -3.45 0.00 0.00 179.45 177.10 1abb h ALA 364 N 1.27 0.76 -0.80 5.00 0.00 -1.45 -2.85 119.26 121.18 1abb h ALA 364 Ca 0.26 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1abb h ALA 364 Cb 0.16 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 1abb h ALA 364 CO -0.03 0.54 0.47 2.35 0.00 0.00 0.00 179.25 182.58 1abb h TRP 365 N 0.86 1.07 0.27 0.00 -0.00 -0.24 -0.50 115.95 117.40 1abb h TRP 365 Ca 0.17 -0.01 -0.01 0.00 -0.00 0.00 0.00 58.89 59.05 1abb h TRP 365 Cb 0.46 -0.35 -0.02 0.00 -0.00 0.00 0.00 29.16 29.26 1abb h TRP 365 CO 0.03 0.72 -0.30 1.49 -0.00 0.00 0.00 178.44 180.38 1abb h GLU 366 N 1.11 -0.56 -0.37 2.65 4.81 -1.29 -0.61 114.58 120.33 1abb h GLU 366 Ca 0.29 0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.60 1abb h GLU 366 Cb -0.02 0.13 -0.07 0.00 0.63 0.00 0.00 28.75 29.41 1abb h GLU 366 CO -0.05 -0.37 -0.47 0.28 -0.73 0.00 0.00 179.01 177.66 1abb h VAL 367 N -0.58 0.00 -0.16 0.32 2.07 -1.11 -1.88 116.25 114.92 1abb h VAL 367 Ca -0.03 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.51 1abb h VAL 367 Cb 0.51 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.24 1abb h VAL 367 CO -0.06 0.00 -0.27 0.74 0.02 0.00 0.00 177.57 178.00 1abb h THR 368 N -0.32 0.00 -0.02 2.57 2.02 -0.79 0.32 112.91 116.69 1abb h THR 368 Ca 0.06 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.25 1abb h THR 368 Cb 0.49 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 66.90 1abb h THR 368 CO -0.51 0.00 0.02 0.58 0.37 0.00 0.00 175.52 175.97 1abb h VAL 369 N -0.22 0.67 0.00 3.16 2.07 -1.03 0.23 116.25 121.13 1abb h VAL 369 Ca 0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.55 1abb h VAL 369 Cb 0.30 0.99 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 1abb h VAL 369 CO -0.26 0.00 -0.11 0.11 0.02 0.00 0.00 177.57 177.33 1abb h LYS 370 N 0.00 0.00 0.02 1.57 1.57 -0.46 0.71 116.57 119.98 1abb h LYS 370 Ca 0.01 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.45 1abb h LYS 370 Cb 0.04 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.30 1abb h LYS 370 CO -0.00 0.00 -1.84 2.41 -0.57 0.00 0.00 179.45 179.45 1abb n THR 371 N -2.32 1.57 -2.82 -0.16 -1.04 0.10 -4.84 114.28 104.77 1abb n THR 371 Ca 0.05 -0.26 -0.39 0.00 -2.04 0.00 0.00 64.05 61.41 1abb n THR 371 Cb 0.44 -1.90 -0.06 0.00 -1.82 0.00 0.00 70.33 66.99 1abb n THR 371 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1abb s ALA 373 N -1.32 0.69 -0.13 0.00 0.00 -1.01 -1.31 121.76 118.69 1abb s ALA 373 Ca 0.43 -0.59 -0.00 0.00 0.00 0.00 0.00 51.96 51.79 1abb s ALA 373 Cb -0.23 -0.07 0.02 0.00 0.00 0.00 0.00 23.12 22.84 1abb s ALA 373 CO 0.28 0.09 -0.10 -0.47 0.00 0.00 0.00 175.76 175.57 1abb s TYR 374 N -0.79 1.71 0.05 0.00 5.04 -1.05 -1.08 117.35 121.23 1abb s TYR 374 Ca -0.03 -0.90 -0.24 0.00 -2.44 0.00 0.00 57.07 53.46 1abb s TYR 374 Cb -0.07 -1.35 -0.06 0.00 0.35 0.00 0.00 41.96 40.84 1abb s TYR 374 CO 0.00 -0.57 0.74 0.99 -1.34 0.00 0.00 175.55 175.38 1abb s THR 375 N 1.64 4.73 -0.09 4.34 2.01 -0.92 -2.82 115.64 124.54 1abb s THR 375 Ca 0.05 1.57 -0.02 0.00 0.31 0.00 0.00 61.69 63.60 1abb s THR 375 Cb -0.13 -4.08 -0.03 0.00 0.01 0.00 0.00 72.50 68.27 1abb s THR 375 CO -0.09 0.39 -0.02 0.21 -0.69 0.00 0.00 174.62 174.42 1abb s ASN 376 N -0.16 5.06 -0.02 3.53 3.84 -0.49 -2.03 114.94 124.67 1abb s ASN 376 Ca 0.37 0.07 0.03 0.00 0.21 0.00 0.00 52.86 53.55 1abb s ASN 376 Cb -0.20 -1.45 0.05 0.00 -0.55 0.00 0.00 41.25 39.09 1abb s ASN 376 CO 0.22 0.35 0.90 1.41 -2.79 0.00 0.00 177.10 177.19 1abb n HIS 377 N 2.35 0.00 -4.51 0.43 8.25 -1.26 -3.97 115.22 116.51 1abb n HIS 377 Ca -0.18 -0.20 -0.30 0.00 -0.26 0.00 0.00 57.72 56.78 1abb n HIS 377 Cb 0.53 -0.05 -0.13 0.00 1.12 0.00 0.00 29.99 31.46 1abb n HIS 377 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1abb s THR 378 N -0.54 2.52 -0.04 1.59 -4.23 -1.26 -4.85 115.64 108.83 1abb s THR 378 Ca 0.05 -1.50 -0.02 0.00 -1.18 0.00 0.00 61.69 59.03 1abb s THR 378 Cb 0.05 -2.10 -0.02 0.00 1.34 0.00 0.00 72.50 71.77 1abb s THR 378 CO 0.00 0.19 -0.06 0.55 -0.54 0.00 0.00 174.62 174.77 1abb n VAL 379 N 1.16 0.36 -2.28 2.29 3.14 -1.26 -5.00 118.33 116.74 1abb n VAL 379 Ca -0.17 -0.02 -0.42 0.00 -2.96 0.00 0.00 64.34 60.77 1abb n VAL 379 Cb 0.53 -1.58 -0.03 0.00 -1.06 0.00 0.00 33.84 31.70 1abb n VAL 379 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 1abb s ILE 380 N -2.09 3.80 0.51 1.55 1.09 -1.26 -4.87 121.20 119.92 1abb s ILE 380 Ca -0.06 1.21 0.17 0.00 -1.10 0.00 0.00 60.65 60.86 1abb s ILE 380 Cb 0.02 -3.77 0.26 0.00 -1.06 0.00 0.00 42.46 37.91 1abb s ILE 380 CO 0.08 0.02 2.12 -0.65 -0.10 0.00 0.00 174.94 176.41 1abb h PRO 381 N 7.52 0.00 0.00 2.79 0.11 -1.99 -1.91 132.00 138.51 1abb h PRO 381 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1abb h PRO 381 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1abb h PRO 381 CO 0.88 0.05 0.31 0.93 -0.21 0.00 0.00 178.00 179.96 1abb h GLU 382 N 0.00 0.00 -0.15 1.05 3.07 -2.03 -1.76 114.58 114.76 1abb h GLU 382 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1abb h GLU 382 Cb 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.00 1abb h GLU 382 CO 0.01 0.00 0.00 0.00 -1.40 0.00 0.00 179.01 177.62 1abb n ALA 383 N -1.62 2.54 -2.28 3.43 0.00 -0.72 -5.03 120.51 116.82 1abb n ALA 383 Ca -0.01 -2.17 -0.36 0.00 0.00 0.00 0.00 53.44 50.90 1abb n ALA 383 Cb 0.33 -0.49 -0.06 0.00 0.00 0.00 0.00 19.45 19.23 1abb n ALA 383 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1abb s LEU 384 N -2.46 4.35 0.51 0.00 1.02 -0.66 -4.99 118.68 116.44 1abb s LEU 384 Ca 0.32 1.19 -0.22 0.00 0.02 0.00 0.00 54.13 55.44 1abb s LEU 384 Cb 0.26 -3.33 -0.07 0.00 0.02 0.00 0.00 46.19 43.08 1abb s LEU 384 CO 0.07 0.10 1.21 1.21 0.02 0.00 0.00 176.35 178.95 1abb n GLU 385 N 0.85 1.54 -3.11 1.70 2.13 -1.26 -4.94 120.64 117.56 1abb n GLU 385 Ca -0.05 0.56 0.03 0.00 0.66 0.00 0.00 57.16 58.37 1abb n GLU 385 Cb 0.51 -2.38 -0.00 0.00 0.27 0.00 0.00 31.44 29.85 1abb n GLU 385 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1abb s ARG 386 N -2.58 0.46 0.08 5.31 0.52 -1.26 -1.82 118.95 119.66 1abb s ARG 386 Ca 0.69 0.17 -0.27 0.00 -0.52 0.00 0.00 55.73 55.79 1abb s ARG 386 Cb -0.46 0.14 -0.06 0.00 0.52 0.00 0.00 34.95 35.09 1abb s ARG 386 CO 0.52 -0.78 0.86 -1.58 0.02 0.00 0.00 175.30 174.35 1abb s TRP 387 N 2.50 3.77 0.69 -0.53 0.23 -1.09 -4.81 118.94 119.72 1abb s TRP 387 Ca 0.16 1.64 -0.16 0.00 -2.03 0.00 0.00 56.10 55.71 1abb s TRP 387 Cb -0.05 -2.94 0.02 0.00 0.03 0.00 0.00 33.47 30.53 1abb s TRP 387 CO -0.19 0.24 1.21 -2.14 0.96 0.00 0.00 176.95 177.02 1abb s PRO 388 N -0.02 2.37 0.02 4.98 0.02 -1.26 -0.97 135.00 140.14 1abb s PRO 388 Ca 0.43 1.76 -0.14 0.00 0.02 0.00 0.00 61.00 63.07 1abb s PRO 388 Cb -0.22 -1.86 -0.34 0.00 0.02 0.00 0.00 34.50 32.10 1abb s PRO 388 CO 0.26 -1.66 0.97 -0.39 -0.33 0.00 0.00 177.00 175.85 1abb h VAL 389 N -0.00 1.25 -1.07 3.83 -1.51 -1.66 -2.85 116.25 114.24 1abb h VAL 389 Ca -0.48 -2.72 0.28 0.00 -1.23 0.00 0.00 66.70 62.56 1abb h VAL 389 Cb 1.29 2.99 -0.10 0.00 -2.13 0.00 0.00 31.29 33.35 1abb h VAL 389 CO 0.51 0.83 0.69 1.12 -1.23 0.00 0.00 177.57 179.49 1abb h HIS 390 N 0.13 0.62 -0.41 5.19 2.07 -1.94 1.25 115.15 122.07 1abb h HIS 390 Ca -0.26 0.02 -0.07 0.00 -2.85 0.00 0.00 60.37 57.22 1abb h HIS 390 Cb 2.14 -0.18 -0.01 0.00 2.57 0.00 0.00 27.41 31.93 1abb h HIS 390 CO 0.12 0.03 -0.01 1.25 -3.07 0.00 0.00 177.93 176.25 1abb h LEU 391 N 0.35 0.71 -0.89 6.12 7.12 -1.90 -0.20 115.31 126.61 1abb h LEU 391 Ca 0.61 -0.31 -0.12 0.00 0.13 0.00 0.00 57.88 58.20 1abb h LEU 391 Cb 1.63 -0.19 -0.01 0.00 -0.53 0.00 0.00 40.66 41.55 1abb h LEU 391 CO -0.30 0.85 -0.48 -0.07 -0.13 0.00 0.00 178.44 178.31 1abb h LEU 392 N 0.55 0.17 0.47 2.25 4.07 0.15 -2.11 115.31 120.86 1abb h LEU 392 Ca 0.11 -0.08 -0.02 0.00 0.08 0.00 0.00 57.88 57.97 1abb h LEU 392 Cb 0.49 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.18 1abb h LEU 392 CO 0.02 0.63 -0.23 -0.33 -1.08 0.00 0.00 178.44 177.46 1abb h GLU 393 N 0.13 -0.61 0.68 1.13 5.08 0.13 0.11 114.58 121.24 1abb h GLU 393 Ca 0.01 0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 1abb h GLU 393 Cb 0.91 0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.30 1abb h GLU 393 CO 0.07 -0.36 -0.36 1.15 -1.00 0.00 0.00 179.01 178.51 1abb h THR 394 N -0.72 0.27 -0.02 1.13 2.02 -0.96 -2.82 112.91 111.81 1abb h THR 394 Ca -0.06 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.12 1abb h THR 394 Cb 0.53 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 67.21 1abb h THR 394 CO 0.11 0.00 -0.20 0.00 0.37 0.00 0.00 175.52 175.80 1abb n LEU 395 N -5.51 2.35 -3.29 2.58 -0.00 -0.81 -4.53 117.00 107.79 1abb n LEU 395 Ca -0.14 -0.89 -0.25 0.00 -0.00 0.00 0.00 56.01 54.74 1abb n LEU 395 Cb 0.39 0.00 -0.08 0.00 -0.00 0.00 0.00 43.42 43.73 1abb n LEU 395 CO 0.37 0.42 -0.28 0.18 -0.00 0.00 0.00 177.39 178.07 1abb n LEU 396 N 0.60 -0.47 -0.29 1.47 7.99 0.39 -2.01 117.00 124.68 1abb n LEU 396 Ca 0.10 -4.38 -0.05 0.00 -0.01 0.00 0.00 56.01 51.67 1abb n LEU 396 Cb 0.48 0.59 -0.00 0.00 -0.11 0.00 0.00 43.42 44.38 1abb n LEU 396 CO 0.19 1.93 0.58 1.55 -1.51 0.00 0.00 177.39 180.13 1abb h PRO 397 N 5.06 -0.11 0.00 3.23 0.13 -1.53 -2.15 132.00 136.63 1abb h PRO 397 Ca 0.19 0.01 -0.13 0.00 -0.87 0.00 0.00 66.00 65.19 1abb h PRO 397 Cb 0.91 0.02 -0.02 0.00 0.13 0.00 0.00 31.00 32.05 1abb h PRO 397 CO 0.38 -0.07 -0.64 -0.09 -0.23 0.00 0.00 178.00 177.35 1abb h ARG 398 N -0.11 0.00 0.01 0.86 9.65 -1.91 -2.19 114.38 120.69 1abb h ARG 398 Ca 0.25 0.00 -0.23 0.00 -1.10 0.00 0.00 59.98 58.90 1abb h ARG 398 Cb 0.56 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.14 1abb h ARG 398 CO -0.82 0.64 -0.95 0.45 2.80 0.00 0.00 179.97 182.09 1abb h HIS 399 N 0.00 0.59 0.00 2.20 3.86 -1.90 -1.19 115.15 118.71 1abb h HIS 399 Ca -0.01 -0.32 -0.04 0.00 -1.16 0.00 0.00 60.37 58.84 1abb h HIS 399 Cb 1.24 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 29.64 1abb h HIS 399 CO 0.00 1.15 -0.19 1.25 0.86 0.00 0.00 177.93 181.00 1abb h LEU 400 N 0.22 0.00 0.39 2.43 6.46 -1.16 -1.02 115.31 122.63 1abb h LEU 400 Ca -0.08 0.00 -0.02 0.00 -0.12 0.00 0.00 57.88 57.66 1abb h LEU 400 Cb 1.59 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.53 1abb h LEU 400 CO 0.16 0.19 -0.19 1.56 -0.62 0.00 0.00 178.44 179.54 1abb h GLN 401 N 0.00 -0.51 -0.21 1.25 4.20 -0.89 -2.14 115.11 116.80 1abb h GLN 401 Ca -0.00 0.03 0.02 0.00 0.06 0.00 0.00 58.65 58.77 1abb h GLN 401 Cb 0.37 0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.25 1abb h GLN 401 CO 0.02 -0.29 0.07 0.82 -0.67 0.00 0.00 178.83 178.78 1abb h ILE 402 N -0.61 0.94 -0.82 2.54 2.04 -1.05 -2.22 117.51 118.33 1abb h ILE 402 Ca -0.05 -0.06 0.03 0.00 1.00 0.00 0.00 64.86 65.78 1abb h ILE 402 Cb 0.45 0.76 -0.04 0.00 -0.74 0.00 0.00 36.82 37.25 1abb h ILE 402 CO 0.09 0.03 0.54 0.40 0.00 0.00 0.00 178.15 179.21 1abb h ILE 403 N 0.16 1.16 0.00 -0.67 2.04 -1.25 0.72 117.51 119.68 1abb h ILE 403 Ca 0.09 -0.36 -0.07 0.00 1.00 0.00 0.00 64.86 65.53 1abb h ILE 403 Cb 0.07 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.15 1abb h ILE 403 CO -0.10 0.19 -0.31 1.88 0.00 0.00 0.00 178.15 179.81 1abb h TYR 404 N 1.05 0.00 0.14 1.37 0.05 -0.81 -0.89 116.97 117.88 1abb h TYR 404 Ca 0.32 0.00 -0.24 0.00 0.05 0.00 0.00 58.73 58.86 1abb h TYR 404 Cb -0.02 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.73 1abb h TYR 404 CO -0.00 0.31 -1.12 1.49 -1.05 0.00 0.00 178.16 177.79 1abb h GLU 405 N 0.00 0.29 -0.41 4.88 4.57 -0.61 -1.59 114.58 121.70 1abb h GLU 405 Ca -0.00 -0.50 0.09 0.00 -1.18 0.00 0.00 59.36 57.76 1abb h GLU 405 Cb 0.58 0.19 -0.09 0.00 -0.16 0.00 0.00 28.75 29.26 1abb h GLU 405 CO 0.04 1.24 -0.20 0.82 -1.18 0.00 0.00 179.01 179.73 1abb h ILE 406 N -0.31 0.40 -0.25 2.32 2.04 -0.94 -1.99 117.51 118.79 1abb h ILE 406 Ca -0.22 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.63 1abb h ILE 406 Cb 1.73 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 38.20 1abb h ILE 406 CO 0.12 0.00 0.13 -1.13 0.00 0.00 0.00 178.15 177.27 1abb h ASN 407 N -0.13 0.33 -0.37 1.72 -1.24 -1.15 -1.55 115.58 113.19 1abb h ASN 407 Ca 0.20 -0.11 0.03 0.00 0.71 0.00 0.00 56.30 57.13 1abb h ASN 407 Cb 0.44 -0.08 -0.03 0.00 0.73 0.00 0.00 38.32 39.37 1abb h ASN 407 CO -0.49 0.34 0.18 -0.61 -1.29 0.00 0.00 177.43 175.57 1abb h GLN 408 N 0.28 0.36 0.44 6.67 4.15 -0.73 -0.64 115.11 125.65 1abb h GLN 408 Ca 0.09 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.48 1abb h GLN 408 Cb 0.10 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 27.69 1abb h GLN 408 CO -0.01 0.24 -0.37 0.00 -1.93 0.00 0.00 178.83 176.76 1abb h ARG 409 N 0.37 -0.78 -0.16 1.69 3.08 -1.36 -2.33 114.38 114.91 1abb h ARG 409 Ca 0.16 0.05 0.05 0.00 0.07 0.00 0.00 59.98 60.31 1abb h ARG 409 Cb 0.07 0.18 -0.06 0.00 0.08 0.00 0.00 29.97 30.24 1abb h ARG 409 CO -0.11 -0.52 -0.21 0.35 -1.07 0.00 0.00 179.97 178.41 1abb h PHE 410 N -0.81 -0.56 0.00 3.04 3.57 -0.74 0.37 116.94 121.82 1abb h PHE 410 Ca -0.04 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 1abb h PHE 410 Cb 0.70 0.27 -0.00 0.00 2.79 0.00 0.00 35.95 39.71 1abb h PHE 410 CO -0.17 -0.29 -0.01 -0.07 -2.23 0.00 0.00 178.31 175.54 1abb h LEU 411 N -0.26 0.00 0.09 0.59 3.38 -1.04 -1.09 115.31 116.99 1abb h LEU 411 Ca 0.11 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.95 1abb h LEU 411 Cb 0.42 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.18 1abb h LEU 411 CO -0.30 0.01 -0.60 0.78 0.09 0.00 0.00 178.44 178.42 1abb h ASN 412 N 0.00 0.31 -0.86 -0.43 -0.26 0.22 -2.13 115.58 112.43 1abb h ASN 412 Ca -0.00 -0.96 0.16 0.00 -0.56 0.00 0.00 56.30 54.95 1abb h ASN 412 Cb 0.03 -0.10 -0.16 0.00 -1.06 0.00 0.00 38.32 37.04 1abb h ASN 412 CO 0.00 1.28 -0.26 0.03 -1.06 0.00 0.00 177.43 177.42 1abb h ARG 413 N -0.58 -0.02 -0.28 0.81 3.08 -0.08 0.49 114.38 117.79 1abb h ARG 413 Ca -0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.94 1abb h ARG 413 Cb 1.44 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.48 1abb h ARG 413 CO 0.09 -0.01 0.19 0.28 -1.07 0.00 0.00 179.97 179.44 1abb h VAL 414 N -0.02 1.07 0.00 2.04 2.07 -1.15 0.21 116.25 120.46 1abb h VAL 414 Ca 0.38 -0.13 -0.12 0.00 0.82 0.00 0.00 66.70 67.65 1abb h VAL 414 Cb 0.62 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 1abb h VAL 414 CO -0.89 0.07 -0.56 0.00 0.02 0.00 0.00 177.57 176.22 1abb h ALA 415 N 1.82 0.87 0.00 1.67 0.00 0.56 0.82 119.26 125.00 1abb h ALA 415 Ca 0.10 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1abb h ALA 415 Cb -0.04 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1abb h ALA 415 CO -0.02 0.69 0.00 0.00 0.00 0.00 0.00 179.25 179.92 1abb h ALA 416 N 1.44 1.00 0.00 0.00 0.00 0.16 -3.28 119.26 118.58 1abb h ALA 416 Ca -0.01 0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.58 1abb h ALA 416 Cb 1.13 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.87 1abb h ALA 416 CO 0.07 0.00 -2.11 0.00 0.00 0.00 0.00 179.25 177.21 1abb n ALA 417 N -1.92 1.67 -3.15 0.00 0.00 -0.75 -4.82 120.51 111.55 1abb n ALA 417 Ca 0.00 -0.80 -0.27 0.00 0.00 0.00 0.00 53.44 52.38 1abb n ALA 417 Cb 0.20 0.19 -0.06 0.00 0.00 0.00 0.00 19.45 19.79 1abb n ALA 417 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1abb n PHE 418 N -3.67 3.61 -1.80 0.00 3.01 0.21 -5.06 117.46 113.76 1abb n PHE 418 Ca -0.38 -4.04 -0.39 0.00 1.01 0.00 0.00 57.45 53.65 1abb n PHE 418 Cb 0.80 -0.51 0.02 0.00 -0.01 0.00 0.00 39.48 39.78 1abb n PHE 418 CO 0.00 0.00 0.00 -2.14 1.01 0.00 0.00 176.76 175.63 1abb s PRO 419 N -2.98 3.53 0.00 -1.08 0.02 -1.24 -0.89 135.00 132.38 1abb s PRO 419 Ca 0.45 2.36 0.00 0.00 0.02 0.00 0.00 61.00 63.83 1abb s PRO 419 Cb 0.23 -2.54 0.00 0.00 0.02 0.00 0.00 34.50 32.20 1abb s PRO 419 CO -0.09 -0.92 0.00 0.41 -0.33 0.00 0.00 177.00 176.08 1abb n GLY 420 N 0.62 3.36 3.56 0.52 0.00 -1.26 -4.98 105.19 107.01 1abb n GLY 420 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 1abb n GLY 420 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1abb s ASP 421 N -0.95 6.44 -0.18 1.61 -1.08 -0.06 -4.79 116.67 117.66 1abb s ASP 421 Ca 0.00 0.05 -0.23 0.00 -0.52 0.00 0.00 52.55 51.85 1abb s ASP 421 Cb 0.00 -2.37 -0.20 0.00 -1.46 0.00 0.00 42.92 38.89 1abb s ASP 421 CO 0.00 -0.77 0.37 0.58 0.52 0.00 0.00 175.17 175.87 1abb h VAL 422 N 5.83 1.14 0.00 1.11 2.07 -1.93 -3.35 116.25 121.12 1abb h VAL 422 Ca -0.25 -2.16 0.00 0.00 0.82 0.00 0.00 66.70 65.11 1abb h VAL 422 Cb 1.09 2.46 0.00 0.00 -1.52 0.00 0.00 31.29 33.32 1abb h VAL 422 CO 0.91 0.39 0.00 -0.78 0.02 0.00 0.00 177.57 178.11 1abb h ASP 423 N -1.00 0.00 0.15 0.57 3.58 -1.97 0.79 116.42 118.53 1abb h ASP 423 Ca -0.21 0.00 -0.26 0.00 0.42 0.00 0.00 57.03 56.98 1abb h ASP 423 Cb 1.14 0.00 0.02 0.00 1.72 0.00 0.00 39.33 42.21 1abb h ASP 423 CO -0.13 0.00 -1.04 -0.09 -2.88 0.00 0.00 179.24 175.10 1abb h ARG 424 N 0.00 0.59 -0.41 0.28 2.43 -1.96 -3.03 114.38 112.27 1abb h ARG 424 Ca 0.00 -0.66 0.02 0.00 -0.81 0.00 0.00 59.98 58.53 1abb h ARG 424 Cb 0.25 0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.96 1abb h ARG 424 CO 0.00 1.26 0.24 -0.07 -1.51 0.00 0.00 179.97 179.89 1abb h LEU 425 N 0.32 0.39 0.00 3.80 -0.00 0.42 0.34 115.31 120.58 1abb h LEU 425 Ca -0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.76 1abb h LEU 425 Cb 1.69 -0.08 0.00 0.00 -0.00 0.00 0.00 40.66 42.28 1abb h LEU 425 CO 0.20 0.28 0.00 -2.11 -0.00 0.00 0.00 178.44 176.81 1abb n ARG 426 N -4.86 0.68 -0.07 1.13 1.85 -0.67 -3.00 116.66 111.72 1abb n ARG 426 Ca 0.01 0.00 -0.11 0.00 -1.00 0.00 0.00 57.85 56.76 1abb n ARG 426 Cb 0.06 -1.50 -0.06 0.00 -1.05 0.00 0.00 32.46 29.91 1abb n ARG 426 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1abb n ARG 427 N -1.01 0.33 -0.10 2.89 1.74 0.17 -4.74 116.66 115.95 1abb n ARG 427 Ca 0.16 0.09 0.02 0.00 -0.77 0.00 0.00 57.85 57.35 1abb n ARG 427 Cb 0.08 -1.21 0.06 0.00 -1.02 0.00 0.00 32.46 30.37 1abb n ARG 427 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1abb n MET 428 N -3.07 1.44 -2.38 5.56 2.81 0.96 -4.87 117.12 117.56 1abb n MET 428 Ca -0.25 -0.47 -0.38 0.00 -1.81 0.00 0.00 57.70 54.79 1abb n MET 428 Cb 0.74 -1.32 -0.03 0.00 -0.71 0.00 0.00 33.22 31.90 1abb n MET 428 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1abb s SER 429 N -0.63 6.61 0.02 7.83 0.15 -1.16 -4.87 113.70 121.66 1abb s SER 429 Ca 0.09 2.24 0.14 0.00 0.70 0.00 0.00 55.95 59.11 1abb s SER 429 Cb 0.05 -2.60 0.60 0.00 -1.71 0.00 0.00 66.02 62.36 1abb s SER 429 CO 0.04 -0.61 1.45 0.18 1.20 0.00 0.00 173.24 175.51 1abb n LEU 430 N 0.04 0.06 -4.21 3.45 4.77 -1.26 -4.75 117.00 115.10 1abb n LEU 430 Ca 0.04 0.52 -0.35 0.00 -0.03 0.00 0.00 56.01 56.19 1abb n LEU 430 Cb 0.48 -0.51 -0.14 0.00 -2.33 0.00 0.00 43.42 40.92 1abb n LEU 430 CO 0.49 -0.30 -0.36 -0.69 -1.33 0.00 0.00 177.39 175.20 1abb s VAL 431 N -3.03 3.13 -0.04 4.08 1.01 -1.26 -1.80 120.40 122.48 1abb s VAL 431 Ca 0.06 -1.14 -0.17 0.00 0.00 0.00 0.00 61.98 60.73 1abb s VAL 431 Cb 0.09 -2.69 -0.05 0.00 0.00 0.00 0.00 36.38 33.72 1abb s VAL 431 CO 0.25 0.03 0.46 -0.70 0.00 0.00 0.00 175.10 175.14 1abb s GLU 432 N 1.32 4.16 0.06 2.72 2.12 -0.85 -4.92 118.70 123.31 1abb s GLU 432 Ca -0.02 0.48 0.03 0.00 0.36 0.00 0.00 54.97 55.82 1abb s GLU 432 Cb -0.18 -3.32 -0.04 0.00 0.26 0.00 0.00 34.13 30.85 1abb s GLU 432 CO -0.02 0.44 0.01 -1.21 -0.54 0.00 0.00 175.26 173.94 1abb s GLU 433 N -0.29 2.67 0.00 4.30 0.41 -1.26 -1.93 118.70 122.60 1abb s GLU 433 Ca 0.25 -0.74 0.00 0.00 -0.41 0.00 0.00 54.97 54.07 1abb s GLU 433 Cb -0.16 -2.61 0.00 0.00 -1.78 0.00 0.00 34.13 29.58 1abb s GLU 433 CO 0.13 0.57 0.00 0.41 -0.49 0.00 0.00 175.26 175.88 1abb n GLY 434 N 0.83 1.07 3.62 -1.39 0.00 -1.26 -4.99 105.19 103.06 1abb n GLY 434 Ca -0.12 0.02 -0.38 0.00 0.00 0.00 0.00 46.02 45.54 1abb n GLY 434 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1abb s ALA 435 N -1.00 3.56 -0.02 4.61 0.00 -1.26 -4.65 121.76 123.00 1abb s ALA 435 Ca 0.00 -0.82 -0.01 0.00 0.00 0.00 0.00 51.96 51.14 1abb s ALA 435 Cb 0.00 -2.61 0.00 0.00 0.00 0.00 0.00 23.12 20.52 1abb s ALA 435 CO 0.00 -0.51 0.02 0.28 0.00 0.00 0.00 175.76 175.55 1abb n VAL 436 N 4.84 -3.74 -2.47 0.00 0.31 -1.26 -5.03 118.33 110.98 1abb n VAL 436 Ca -0.10 0.25 -0.41 0.00 -0.01 0.00 0.00 64.34 64.07 1abb n VAL 436 Cb 0.51 -3.92 -0.04 0.00 -0.91 0.00 0.00 33.84 29.48 1abb n VAL 436 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1abb s LYS 437 N -0.78 4.61 0.37 5.55 2.20 -1.26 -4.83 119.74 125.60 1abb s LYS 437 Ca -0.02 1.79 0.03 0.00 -0.36 0.00 0.00 55.97 57.40 1abb s LYS 437 Cb 0.00 -3.22 -0.01 0.00 -1.51 0.00 0.00 37.83 33.09 1abb s LYS 437 CO 0.08 0.14 0.09 0.54 -0.36 0.00 0.00 175.35 175.84 1abb n ARG 438 N 1.69 0.72 -4.91 4.03 1.74 -0.81 -1.83 116.66 117.28 1abb n ARG 438 Ca 0.01 -2.96 -0.27 0.00 -0.77 0.00 0.00 57.85 53.85 1abb n ARG 438 Cb 0.45 1.40 -0.16 0.00 -1.02 0.00 0.00 32.46 33.13 1abb n ARG 438 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1abb s ILE 439 N -2.77 1.55 -0.38 0.55 -1.09 -0.14 -2.01 121.20 116.91 1abb s ILE 439 Ca 0.13 -0.78 -0.08 0.00 -2.23 0.00 0.00 60.65 57.70 1abb s ILE 439 Cb 0.01 -1.33 0.06 0.00 -1.58 0.00 0.00 42.46 39.62 1abb s ILE 439 CO 0.09 0.44 0.19 0.21 -1.23 0.00 0.00 174.94 174.64 1abb s ASN 440 N 0.01 5.48 0.14 3.58 3.84 -0.74 -2.65 114.94 124.60 1abb s ASN 440 Ca -0.04 -1.37 0.17 0.00 0.21 0.00 0.00 52.86 51.83 1abb s ASN 440 Cb -0.12 -1.93 0.75 0.00 -0.55 0.00 0.00 41.25 39.41 1abb s ASN 440 CO 0.03 -0.44 1.53 0.23 -2.79 0.00 0.00 177.10 175.65 1abb n MET 441 N 4.85 0.09 0.04 0.43 2.81 -0.75 -2.15 117.12 122.44 1abb n MET 441 Ca -0.10 0.40 -0.02 0.00 -1.81 0.00 0.00 57.70 56.16 1abb n MET 441 Cb 0.44 -1.70 -0.01 0.00 -0.71 0.00 0.00 33.22 31.23 1abb n MET 441 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1abb h ALA 442 N 2.28 -0.44 -1.06 3.04 0.00 -1.92 -2.71 119.26 118.45 1abb h ALA 442 Ca 0.00 -0.03 0.28 0.00 0.00 0.00 0.00 54.91 55.16 1abb h ALA 442 Cb 0.23 0.05 -0.10 0.00 0.00 0.00 0.00 17.79 17.97 1abb h ALA 442 CO 0.00 -0.43 0.68 0.45 0.00 0.00 0.00 179.25 179.94 1abb h HIS 443 N -0.26 0.69 0.15 0.00 3.86 -1.79 0.48 115.15 118.28 1abb h HIS 443 Ca -0.01 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1abb h HIS 443 Cb 0.10 -0.20 -0.01 0.00 1.06 0.00 0.00 27.41 28.36 1abb h HIS 443 CO 0.07 0.03 -0.23 1.25 0.86 0.00 0.00 177.93 179.91 1abb h LEU 444 N 0.38 -0.66 -1.07 2.43 6.46 -1.56 -2.16 115.31 119.13 1abb h LEU 444 Ca 0.62 0.06 0.28 0.00 -0.12 0.00 0.00 57.88 58.73 1abb h LEU 444 Cb 1.58 0.23 -0.13 0.00 -0.73 0.00 0.00 40.66 41.61 1abb h LEU 444 CO -0.33 -0.28 0.61 0.00 -0.62 0.00 0.00 178.44 177.82 1abb h ILE 446 N 0.44 0.95 -0.52 0.00 2.04 -1.32 -3.11 117.51 115.99 1abb h ILE 446 Ca 0.68 -0.67 -0.06 0.00 1.00 0.00 0.00 64.86 65.80 1abb h ILE 446 Cb 1.49 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 38.89 1abb h ILE 446 CO -0.50 0.15 0.07 0.00 0.00 0.00 0.00 178.15 177.87 1abb h ALA 447 N 0.18 1.13 -0.25 1.87 0.00 -0.25 -1.99 119.26 119.95 1abb h ALA 447 Ca -0.02 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1abb h ALA 447 Cb 0.43 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1abb h ALA 447 CO 0.04 0.57 0.00 0.41 0.00 0.00 0.00 179.25 180.27 1abb n GLY 448 N -0.73 0.19 3.32 0.00 0.00 0.11 -4.93 105.19 103.15 1abb n GLY 448 Ca 0.03 -0.27 -0.17 0.00 0.00 0.00 0.00 46.02 45.62 1abb n GLY 448 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1abb s SER 449 N -0.99 1.87 -0.17 1.61 0.01 -0.75 -3.26 113.70 112.03 1abb s SER 449 Ca 0.17 -1.17 0.13 0.00 1.31 0.00 0.00 55.95 56.38 1abb s SER 449 Cb 0.09 -0.00 0.66 0.00 0.21 0.00 0.00 66.02 66.98 1abb s SER 449 CO 0.11 -0.46 1.52 0.00 0.41 0.00 0.00 173.24 174.82 1abb n HIS 450 N -0.38 1.60 0.00 2.43 1.44 0.24 -4.94 115.22 115.62 1abb n HIS 450 Ca -0.06 -0.57 0.00 0.00 -2.01 0.00 0.00 57.72 55.08 1abb n HIS 450 Cb 0.63 -0.38 0.00 0.00 0.12 0.00 0.00 29.99 30.36 1abb n HIS 450 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1abb n ALA 451 N 0.63 0.00 -2.83 1.59 0.00 -1.26 -4.89 120.51 113.75 1abb n ALA 451 Ca 0.23 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.39 1abb n ALA 451 Cb 0.96 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 20.25 1abb n ALA 451 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1abb s VAL 452 N 0.00 1.61 -0.11 0.00 1.01 -0.82 -2.51 120.40 119.57 1abb s VAL 452 Ca 0.00 -0.82 -0.05 0.00 0.00 0.00 0.00 61.98 61.11 1abb s VAL 452 Cb 0.00 -1.37 0.05 0.00 0.00 0.00 0.00 36.38 35.06 1abb s VAL 452 CO 0.00 0.46 0.24 0.54 0.00 0.00 0.00 175.10 176.34 1abb s ASN 453 N -0.05 0.02 1.00 3.32 4.22 -1.13 0.45 114.94 122.78 1abb s ASN 453 Ca -0.03 0.53 0.00 0.00 -2.14 0.00 0.00 52.86 51.22 1abb s ASN 453 Cb -0.12 0.50 0.00 0.00 1.28 0.00 0.00 41.25 42.91 1abb s ASN 453 CO 0.02 -0.20 0.00 0.61 -2.04 0.00 0.00 177.10 175.50 1abb n GLY 454 N 4.70 -1.86 0.00 0.45 0.00 -1.25 -1.40 105.19 105.82 1abb n GLY 454 Ca -0.17 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.30 1abb n GLY 454 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1abb n VAL 455 N -2.28 0.50 -3.68 1.61 3.14 -1.25 -2.44 118.33 113.93 1abb n VAL 455 Ca 0.00 -0.53 -0.15 0.00 -2.96 0.00 0.00 64.34 60.70 1abb n VAL 455 Cb 0.00 0.81 -0.08 0.00 -1.06 0.00 0.00 33.84 33.51 1abb n VAL 455 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1abb s ALA 456 N -0.50 -1.16 0.18 1.55 0.00 -1.26 -0.43 121.76 120.15 1abb s ALA 456 Ca 0.00 0.84 -0.10 0.00 0.00 0.00 0.00 51.96 52.70 1abb s ALA 456 Cb 0.00 -0.14 0.08 0.00 0.00 0.00 0.00 23.12 23.06 1abb s ALA 456 CO 0.00 -0.28 1.68 0.00 0.00 0.00 0.00 175.76 177.15 1abb h ARG 457 N 3.95 1.04 -0.03 0.00 3.08 -1.92 0.83 114.38 121.32 1abb h ARG 457 Ca -0.28 -0.27 -0.07 0.00 0.07 0.00 0.00 59.98 59.42 1abb h ARG 457 Cb 1.17 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 31.08 1abb h ARG 457 CO 0.35 0.96 -0.33 -0.84 -1.07 0.00 0.00 179.97 179.04 1abb h ILE 458 N 0.95 1.25 0.39 2.04 3.07 -1.92 -0.09 117.51 123.20 1abb h ILE 458 Ca 0.19 -1.18 -0.02 0.00 1.55 0.00 0.00 64.86 65.41 1abb h ILE 458 Cb 0.42 1.59 0.00 0.00 -0.27 0.00 0.00 36.82 38.56 1abb h ILE 458 CO 0.01 0.34 -0.19 -0.74 -1.05 0.00 0.00 178.15 176.52 1abb h HIS 459 N 0.05 -0.49 -0.96 0.16 2.76 -1.73 -1.46 115.15 113.49 1abb h HIS 459 Ca 0.01 -0.01 0.24 0.00 -2.20 0.00 0.00 60.37 58.40 1abb h HIS 459 Cb 0.61 0.16 -0.07 0.00 1.55 0.00 0.00 27.41 29.66 1abb h HIS 459 CO 0.00 -0.30 0.64 0.77 -1.30 0.00 0.00 177.93 177.74 1abb h SER 460 N -1.00 0.35 0.70 3.26 0.02 -0.73 0.52 113.55 116.66 1abb h SER 460 Ca -0.05 0.05 -0.26 0.00 -0.84 0.00 0.00 61.79 60.68 1abb h SER 460 Cb 0.40 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.92 1abb h SER 460 CO 0.09 0.11 -1.27 -0.33 -1.14 0.00 0.00 176.83 174.29 1abb h GLU 461 N 0.33 0.15 0.00 3.45 4.39 -1.08 -2.62 114.58 119.20 1abb h GLU 461 Ca 0.51 -0.26 0.00 0.00 0.34 0.00 0.00 59.36 59.95 1abb h GLU 461 Cb 1.40 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 30.14 1abb h GLU 461 CO -0.18 1.06 0.00 -0.84 -1.16 0.00 0.00 179.01 177.88 1abb h ILE 462 N 0.04 0.00 0.16 3.13 3.07 0.11 -0.86 117.51 123.16 1abb h ILE 462 Ca -0.13 -0.59 -0.01 0.00 1.55 0.00 0.00 64.86 65.68 1abb h ILE 462 Cb 1.92 1.54 0.00 0.00 -0.27 0.00 0.00 36.82 40.01 1abb h ILE 462 CO 0.16 0.00 -0.08 -0.07 -1.05 0.00 0.00 178.15 177.11 1abb h LEU 463 N 0.00 -0.19 -0.86 0.16 3.38 -0.73 0.24 115.31 117.31 1abb h LEU 463 Ca 0.00 0.01 0.21 0.00 0.09 0.00 0.00 57.88 58.19 1abb h LEU 463 Cb 0.66 0.05 -0.16 0.00 0.09 0.00 0.00 40.66 41.30 1abb h LEU 463 CO 0.00 -0.13 -0.01 0.11 0.09 0.00 0.00 178.44 178.49 1abb h LYS 464 N -0.22 0.06 0.00 1.13 1.57 -1.40 0.12 116.57 117.84 1abb h LYS 464 Ca -0.02 -0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.57 1abb h LYS 464 Cb 0.17 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.44 1abb h LYS 464 CO 0.04 0.04 -0.86 0.87 -0.57 0.00 0.00 179.45 178.97 1abb h LYS 465 N 0.06 0.00 0.00 3.15 1.57 -1.03 -3.13 116.57 117.19 1abb h LYS 465 Ca 0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.26 1abb h LYS 465 Cb 0.90 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.21 1abb h LYS 465 CO -0.79 0.86 -0.33 0.25 -0.57 0.00 0.00 179.45 178.87 1abb n THR 466 N -3.48 0.00 0.10 -0.16 -2.24 0.84 -4.73 114.28 104.62 1abb n THR 466 Ca -0.00 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.71 1abb n THR 466 Cb 0.83 -0.82 -0.04 0.00 -2.10 0.00 0.00 70.33 68.20 1abb n THR 466 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1abb h ILE 467 N 0.00 0.21 -0.84 2.28 5.03 -1.40 -3.37 117.51 119.42 1abb h ILE 467 Ca 0.00 -0.83 -0.46 0.00 -0.12 0.00 0.00 64.86 63.45 1abb h ILE 467 Cb 0.33 0.37 -0.26 0.00 -3.03 0.00 0.00 36.82 34.22 1abb h ILE 467 CO 0.00 0.06 0.47 0.49 -0.68 0.00 0.00 178.15 178.49 1abb n PHE 468 N -5.01 2.62 -0.14 1.37 3.72 0.36 -4.82 117.46 115.56 1abb n PHE 468 Ca -0.06 -1.94 -0.04 0.00 -0.05 0.00 0.00 57.45 55.36 1abb n PHE 468 Cb 0.19 -0.89 0.04 0.00 -0.94 0.00 0.00 39.48 37.88 1abb n PHE 468 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 1abb h LYS 469 N 1.15 0.24 0.00 -1.08 2.10 -1.60 0.82 116.57 118.19 1abb h LYS 469 Ca 0.53 -0.01 -0.05 0.00 -2.00 0.00 0.00 60.65 59.12 1abb h LYS 469 Cb 2.32 -0.05 -0.01 0.00 -0.90 0.00 0.00 32.23 33.59 1abb h LYS 469 CO 0.99 0.16 -0.24 -0.44 -2.00 0.00 0.00 179.45 177.91 1abb h ASP 470 N 0.24 0.00 1.29 7.07 3.32 -1.87 0.32 116.42 126.78 1abb h ASP 470 Ca 0.21 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.22 1abb h ASP 470 Cb 0.25 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 1abb h ASP 470 CO -0.26 0.24 -0.19 -0.26 -1.72 0.00 0.00 179.24 177.05 1abb h PHE 471 N 0.00 0.00 0.00 4.55 -1.00 -1.25 -1.36 116.94 117.88 1abb h PHE 471 Ca -0.00 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.78 1abb h PHE 471 Cb 0.47 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.03 1abb h PHE 471 CO 0.00 0.19 -0.00 -0.92 -1.61 0.00 0.00 178.31 175.97 1abb h TYR 472 N 0.00 -0.00 0.60 -0.55 3.20 0.43 -1.20 116.97 119.44 1abb h TYR 472 Ca -0.00 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 1abb h TYR 472 Cb 0.88 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.14 1abb h TYR 472 CO 0.00 0.88 -0.50 0.93 -1.64 0.00 0.00 178.16 177.83 1abb h GLU 473 N -0.91 -1.03 -0.09 1.82 5.08 -0.76 0.65 114.58 119.34 1abb h GLU 473 Ca -0.00 0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.40 1abb h GLU 473 Cb 0.88 0.23 -0.01 0.00 0.50 0.00 0.00 28.75 30.36 1abb h GLU 473 CO 0.00 -0.69 -0.08 1.25 -1.00 0.00 0.00 179.01 178.50 1abb h LEU 474 N -1.07 0.12 -5.92 1.33 7.12 -1.35 -3.32 115.31 112.23 1abb h LEU 474 Ca -0.08 -0.02 -0.49 0.00 0.13 0.00 0.00 57.88 57.42 1abb h LEU 474 Cb 0.90 -0.03 -0.37 0.00 -0.53 0.00 0.00 40.66 40.63 1abb h LEU 474 CO -0.01 0.22 -1.10 -0.62 -0.13 0.00 0.00 178.44 176.81 1abb n GLU 475 N -4.37 0.85 -0.17 1.25 1.02 -0.45 -4.97 120.64 113.79 1abb n GLU 475 Ca -0.01 -3.18 0.14 0.00 -0.02 0.00 0.00 57.16 54.09 1abb n GLU 475 Cb 0.20 -1.45 0.47 0.00 -0.02 0.00 0.00 31.44 30.64 1abb n GLU 475 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1abb h PRO 476 N 3.48 0.47 -0.03 3.49 0.13 0.22 -1.50 132.00 138.26 1abb h PRO 476 Ca 0.07 -0.03 0.01 0.00 -0.87 0.00 0.00 66.00 65.18 1abb h PRO 476 Cb 0.94 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 31.96 1abb h PRO 476 CO 0.46 0.31 0.19 1.12 -0.23 0.00 0.00 178.00 179.85 1abb h HIS 477 N 0.48 0.00 0.16 1.56 2.07 -1.93 -3.23 115.15 114.26 1abb h HIS 477 Ca 0.37 0.00 -0.22 0.00 -2.85 0.00 0.00 60.37 57.67 1abb h HIS 477 Cb 0.75 0.00 0.02 0.00 2.57 0.00 0.00 27.41 30.76 1abb h HIS 477 CO -0.00 0.00 -0.97 0.87 -3.07 0.00 0.00 177.93 174.76 1abb h LYS 478 N 0.00 0.33 -5.22 5.12 1.57 -1.61 -3.44 116.57 113.32 1abb h LYS 478 Ca 0.02 -0.57 -0.20 0.00 -1.87 0.00 0.00 60.65 58.02 1abb h LYS 478 Cb 0.40 0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.92 1abb h LYS 478 CO -0.00 1.27 0.64 1.19 -0.57 0.00 0.00 179.45 181.99 1abb n PHE 479 N -4.05 1.72 -0.41 -1.35 3.01 -1.22 -1.94 117.46 113.23 1abb n PHE 479 Ca -0.15 -0.83 0.00 0.00 1.01 0.00 0.00 57.45 57.48 1abb n PHE 479 Cb 0.87 -2.50 0.00 0.00 -0.01 0.00 0.00 39.48 37.85 1abb n PHE 479 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1abb n GLN 480 N 8.14 0.41 -3.47 -1.08 6.02 0.17 -4.97 117.38 122.62 1abb n GLN 480 Ca 0.43 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 57.28 1abb n GLN 480 Cb 0.46 0.00 -0.04 0.00 1.02 0.00 0.00 30.24 31.69 1abb n GLN 480 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1abb s ASN 481 N -1.13 -0.61 -0.24 1.08 3.84 -1.26 -3.92 114.94 112.71 1abb s ASN 481 Ca 0.00 0.32 -0.03 0.00 0.21 0.00 0.00 52.86 53.35 1abb s ASN 481 Cb 0.00 0.57 0.13 0.00 -0.55 0.00 0.00 41.25 41.40 1abb s ASN 481 CO 0.00 -0.80 0.39 -0.54 -2.79 0.00 0.00 177.10 173.35 1abb s LYS 482 N -2.60 0.35 0.23 0.43 -0.14 -1.02 -4.91 119.74 112.07 1abb s LYS 482 Ca -0.04 0.62 -0.30 0.00 -1.36 0.00 0.00 55.97 54.90 1abb s LYS 482 Cb -0.01 -0.33 -0.09 0.00 -1.68 0.00 0.00 37.83 35.73 1abb s LYS 482 CO -0.03 -0.58 1.14 0.99 -0.76 0.00 0.00 175.35 176.11 1abb s THR 483 N 2.56 3.57 0.86 2.17 2.01 -1.26 -3.93 115.64 121.62 1abb s THR 483 Ca 0.11 1.44 -0.14 0.00 0.31 0.00 0.00 61.69 63.41 1abb s THR 483 Cb -0.15 -3.92 0.00 0.00 0.01 0.00 0.00 72.50 68.44 1abb s THR 483 CO -0.15 0.29 0.44 0.59 -0.69 0.00 0.00 174.62 175.10 1abb n ASN 484 N 1.84 -1.76 -3.76 3.53 3.02 0.43 -4.65 115.26 113.91 1abb n ASN 484 Ca 0.01 0.44 -0.09 0.00 -0.03 0.00 0.00 54.58 54.91 1abb n ASN 484 Cb 0.45 -1.21 -0.03 0.00 -0.61 0.00 0.00 39.78 38.38 1abb n ASN 484 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1abb s GLY 485 N -1.77 0.34 0.10 7.41 0.00 -1.26 -4.80 107.32 107.33 1abb s GLY 485 Ca 0.60 -0.69 0.04 0.00 0.00 0.00 0.00 44.72 44.67 1abb s GLY 485 CO 0.64 -0.41 -0.10 -0.42 0.00 0.00 0.00 173.10 172.81 1abb s ILE 486 N -3.70 0.95 -0.12 0.90 1.09 -0.56 -4.54 121.20 115.22 1abb s ILE 486 Ca 0.18 -1.64 -0.12 0.00 -1.10 0.00 0.00 60.65 57.97 1abb s ILE 486 Cb -0.03 -1.36 -0.05 0.00 -1.06 0.00 0.00 42.46 39.96 1abb s ILE 486 CO 0.09 -0.56 0.26 0.28 -0.10 0.00 0.00 174.94 174.92 1abb s THR 487 N -2.44 5.31 -0.16 2.92 -1.32 -1.26 0.11 115.64 118.80 1abb s THR 487 Ca 0.05 0.48 0.24 0.00 -1.21 0.00 0.00 61.69 61.25 1abb s THR 487 Cb -0.03 -3.57 0.24 0.00 -1.51 0.00 0.00 72.50 67.63 1abb s THR 487 CO 0.00 0.51 1.72 1.55 -2.21 0.00 0.00 174.62 176.19 1abb h PRO 488 N 5.73 0.00 0.00 7.08 0.13 -1.92 -2.94 132.00 140.08 1abb h PRO 488 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1abb h PRO 488 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1abb h PRO 488 CO 0.67 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 178.98 1abb n ARG 489 N -2.32 0.00 -0.34 0.86 3.00 -1.26 -1.72 116.66 114.88 1abb n ARG 489 Ca -0.01 0.25 0.12 0.00 -0.01 0.00 0.00 57.85 58.19 1abb n ARG 489 Cb 0.06 -0.75 0.32 0.00 0.00 0.00 0.00 32.46 32.09 1abb n ARG 489 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.63 177.54 1abb h ARG 490 N 0.00 0.77 -0.61 5.56 2.43 -1.97 -1.05 114.38 119.51 1abb h ARG 490 Ca 0.00 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1abb h ARG 490 Cb 0.00 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.38 1abb h ARG 490 CO 0.00 0.51 0.00 0.91 -1.51 0.00 0.00 179.97 179.88 1abb n TRP 491 N -4.70 1.04 0.18 2.20 5.03 -1.11 -1.88 117.44 118.20 1abb n TRP 491 Ca 0.22 -0.41 0.00 0.00 3.03 0.00 0.00 57.50 60.34 1abb n TRP 491 Cb 0.52 -0.19 0.00 0.00 -1.03 0.00 0.00 31.31 30.62 1abb n TRP 491 CO 0.00 0.00 0.00 -0.11 -0.03 0.00 0.00 177.69 177.55 1abb n LEU 492 N 0.70 -3.19 -0.09 -0.99 0.00 -1.06 -4.85 117.00 107.52 1abb n LEU 492 Ca 0.18 0.70 -0.11 0.00 0.00 0.00 0.00 56.01 56.78 1abb n LEU 492 Cb 0.65 3.08 -0.04 0.00 0.00 0.00 0.00 43.42 47.12 1abb n LEU 492 CO 0.17 0.13 0.80 0.58 0.00 0.00 0.00 177.39 179.06 1abb h VAL 493 N 0.00 1.24 0.03 1.96 2.07 -0.33 -2.12 116.25 119.09 1abb h VAL 493 Ca 0.00 -0.81 -0.00 0.00 0.82 0.00 0.00 66.70 66.70 1abb h VAL 493 Cb 0.00 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 1abb h VAL 493 CO 0.00 0.26 -0.01 0.25 0.02 0.00 0.00 177.57 178.09 1abb h LEU 494 N 0.26 -0.03 0.00 2.57 6.46 -1.52 -3.12 115.31 119.93 1abb h LEU 494 Ca 0.08 -0.67 0.00 0.00 -0.12 0.00 0.00 57.88 57.17 1abb h LEU 494 Cb 0.35 0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.29 1abb h LEU 494 CO 0.01 0.77 -0.14 0.00 -0.62 0.00 0.00 178.44 178.46 1abb n ASN 496 N -2.86 2.28 -0.16 0.00 2.85 -0.79 -4.86 115.26 111.71 1abb n ASN 496 Ca 0.04 -3.17 -0.09 0.00 -0.11 0.00 0.00 54.58 51.25 1abb n ASN 496 Cb 0.51 -0.64 0.05 0.00 1.24 0.00 0.00 39.78 40.94 1abb n ASN 496 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1abb h PRO 497 N 3.81 0.96 0.20 1.20 0.13 -1.68 -2.33 132.00 134.29 1abb h PRO 497 Ca 0.13 -0.35 0.01 0.00 -0.87 0.00 0.00 66.00 64.93 1abb h PRO 497 Cb 0.75 -0.06 -0.04 0.00 0.13 0.00 0.00 31.00 31.78 1abb h PRO 497 CO 0.67 1.01 -0.43 0.78 -0.23 0.00 0.00 178.00 179.80 1abb h GLY 498 N 0.95 -0.92 1.34 1.56 0.00 -1.89 0.19 103.07 104.30 1abb h GLY 498 Ca 0.13 0.51 0.07 0.00 0.00 0.00 0.00 47.33 48.05 1abb h GLY 498 CO 0.05 -0.29 0.28 -2.00 0.00 0.00 0.00 176.54 174.58 1abb h LEU 499 N -0.72 0.23 -0.42 3.11 5.85 -1.90 -2.00 115.31 119.46 1abb h LEU 499 Ca 0.00 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.61 1abb h LEU 499 Cb 0.71 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.68 1abb h LEU 499 CO -0.20 0.15 -0.19 0.00 -0.34 0.00 0.00 178.44 177.86 1abb h ALA 500 N 1.78 0.59 0.10 1.25 0.00 -0.18 -2.49 119.26 120.31 1abb h ALA 500 Ca 0.19 -0.37 0.02 0.00 0.00 0.00 0.00 54.91 54.75 1abb h ALA 500 Cb 0.40 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 1abb h ALA 500 CO -0.04 0.55 -0.41 1.49 0.00 0.00 0.00 179.25 180.84 1abb h GLU 501 N 0.70 -0.61 -0.14 0.00 4.81 -0.02 0.57 114.58 119.90 1abb h GLU 501 Ca 0.10 0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.32 1abb h GLU 501 Cb 0.75 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.26 1abb h GLU 501 CO 0.06 -0.40 -0.14 -0.84 -0.73 0.00 0.00 179.01 176.95 1abb h ILE 502 N -0.63 1.18 -0.50 2.32 3.07 -1.58 0.65 117.51 122.02 1abb h ILE 502 Ca 0.03 -0.79 -0.12 0.00 1.55 0.00 0.00 64.86 65.52 1abb h ILE 502 Cb 0.67 1.23 -0.02 0.00 -0.27 0.00 0.00 36.82 38.43 1abb h ILE 502 CO -0.25 0.25 -0.16 0.40 -1.05 0.00 0.00 178.15 177.33 1abb h ILE 503 N 0.21 1.27 -0.15 0.16 2.04 -0.54 -2.43 117.51 118.07 1abb h ILE 503 Ca 0.04 -1.32 -0.02 0.00 1.00 0.00 0.00 64.86 64.56 1abb h ILE 503 Cb 0.38 1.06 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 1abb h ILE 503 CO 0.02 0.46 -0.01 0.00 0.00 0.00 0.00 178.15 178.62 1abb h ALA 504 N 0.95 0.20 -0.94 1.87 0.00 0.25 -1.63 119.26 119.96 1abb h ALA 504 Ca 0.12 -0.20 0.34 0.00 0.00 0.00 0.00 54.91 55.18 1abb h ALA 504 Cb 0.73 -0.05 -0.17 0.00 0.00 0.00 0.00 17.79 18.29 1abb h ALA 504 CO 0.06 -0.09 0.33 0.39 0.00 0.00 0.00 179.25 179.93 1abb n GLU 505 N -4.75 -0.06 -0.00 0.00 1.02 0.10 0.27 120.64 117.22 1abb n GLU 505 Ca -0.05 1.34 -0.00 0.00 -0.02 0.00 0.00 57.16 58.42 1abb n GLU 505 Cb 0.22 -2.29 -0.00 0.00 -0.02 0.00 0.00 31.44 29.35 1abb n GLU 505 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1abb h ARG 506 N 0.00 0.00 -0.64 3.49 2.47 -1.24 -3.44 114.38 115.02 1abb h ARG 506 Ca 0.71 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.43 1abb h ARG 506 Cb 1.77 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 30.09 1abb h ARG 506 CO -0.78 0.00 0.00 0.44 0.56 0.00 0.00 179.97 180.19 1abb n ILE 507 N -2.25 1.58 -2.99 2.04 -5.35 -0.63 -5.09 119.36 106.66 1abb n ILE 507 Ca -0.00 -1.16 0.00 0.00 -0.27 0.00 0.00 62.75 61.32 1abb n ILE 507 Cb 0.01 0.24 0.00 0.00 -1.74 0.00 0.00 39.64 38.15 1abb n ILE 507 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1abb n GLY 508 N 1.16 -2.09 0.21 3.28 0.00 0.14 -4.64 105.19 103.25 1abb n GLY 508 Ca 0.24 -1.55 -0.10 0.00 0.00 0.00 0.00 46.02 44.61 1abb n GLY 508 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1abb h GLU 509 N 0.00 0.56 -0.55 1.61 4.81 -1.93 -3.36 114.58 115.72 1abb h GLU 509 Ca 0.00 -0.38 0.16 0.00 -0.13 0.00 0.00 59.36 59.01 1abb h GLU 509 Cb 0.00 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 1abb h GLU 509 CO 0.00 1.00 0.55 1.49 -0.73 0.00 0.00 179.01 181.32 1abb h GLU 510 N 0.42 0.00 -0.96 1.92 4.81 -1.97 0.31 114.58 119.11 1abb h GLU 510 Ca -0.00 0.00 0.26 0.00 -0.13 0.00 0.00 59.36 59.48 1abb h GLU 510 Cb 1.16 0.00 -0.13 0.00 0.63 0.00 0.00 28.75 30.41 1abb h GLU 510 CO 0.11 0.00 0.50 0.10 -0.73 0.00 0.00 179.01 178.99 1abb h TYR 511 N 0.00 0.82 -0.70 0.92 -0.00 -1.82 -1.01 116.97 115.18 1abb h TYR 511 Ca 0.26 0.04 0.14 0.00 0.00 0.00 0.00 58.73 59.17 1abb h TYR 511 Cb 1.36 -0.21 -0.04 0.00 0.00 0.00 0.00 36.73 37.84 1abb h TYR 511 CO 0.00 -0.06 0.47 0.82 -0.00 0.00 0.00 178.16 179.39 1abb h ILE 512 N 0.42 0.81 -0.32 -0.90 2.04 -0.72 -0.35 117.51 118.49 1abb h ILE 512 Ca 0.64 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 66.37 1abb h ILE 512 Cb 1.30 0.40 0.00 0.00 -0.74 0.00 0.00 36.82 37.77 1abb h ILE 512 CO -0.55 0.07 0.00 -0.24 0.00 0.00 0.00 178.15 177.43 1abb n SER 513 N -4.47 3.59 -2.68 1.72 2.88 -0.44 -4.57 113.62 109.66 1abb n SER 513 Ca 0.13 -2.58 -0.04 0.00 -1.33 0.00 0.00 58.87 55.04 1abb n SER 513 Cb 0.50 -0.42 0.11 0.00 -0.75 0.00 0.00 64.21 63.64 1abb n SER 513 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1abb n ASP 514 N 0.01 -1.46 0.00 -3.46 -0.08 -0.19 -5.08 116.55 106.28 1abb n ASP 514 Ca 0.18 -2.21 0.00 0.00 -1.51 0.00 0.00 54.79 51.25 1abb n ASP 514 Cb 0.71 1.27 0.02 0.00 2.34 0.00 0.00 41.12 45.46 1abb n ASP 514 CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21 1abb n LEU 515 N 0.57 0.00 0.07 -2.67 7.94 -0.89 -2.25 117.00 119.78 1abb n LEU 515 Ca -0.03 0.00 0.12 0.00 -1.11 0.00 0.00 56.01 54.99 1abb n LEU 515 Cb 0.74 0.00 0.21 0.00 0.53 0.00 0.00 43.42 44.90 1abb n LEU 515 CO -0.08 0.00 0.44 0.44 -1.11 0.00 0.00 177.39 177.08 1abb h ASP 516 N 0.00 0.00 0.00 1.96 3.32 -1.88 -3.12 116.42 116.69 1abb h ASP 516 Ca 0.00 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 56.88 1abb h ASP 516 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1abb h ASP 516 CO 0.00 0.08 0.15 -0.61 -1.72 0.00 0.00 179.24 177.15 1abb h GLN 517 N 0.00 0.00 0.00 3.56 4.15 -1.81 -2.50 115.11 118.51 1abb h GLN 517 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1abb h GLN 517 Cb 0.75 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.44 1abb h GLN 517 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 178.83 176.83 1abb h LEU 518 N 0.00 0.00 -2.52 -2.39 3.38 -1.78 -2.77 115.31 109.22 1abb h LEU 518 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1abb h LEU 518 Cb 0.31 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 1abb h LEU 518 CO 0.00 0.00 -0.01 0.03 0.09 0.00 0.00 178.44 178.55 1abb h ARG 519 N 0.00 0.00 -0.27 1.13 3.08 -0.25 -2.21 114.38 115.86 1abb h ARG 519 Ca 0.00 0.00 0.08 0.00 0.07 0.00 0.00 59.98 60.13 1abb h ARG 519 Cb 0.33 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 1abb h ARG 519 CO 0.00 0.01 0.32 0.87 -1.07 0.00 0.00 179.97 180.10 1abb h LYS 520 N 0.00 0.00 -0.03 0.04 1.57 -1.75 -2.01 116.57 114.38 1abb h LYS 520 Ca -0.00 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1abb h LYS 520 Cb 0.02 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 1abb h LYS 520 CO 0.00 0.00 0.04 -0.07 -0.57 0.00 0.00 179.45 178.85 1abb h LEU 521 N 0.00 0.00 -2.10 2.94 4.07 -1.65 -2.48 115.31 116.09 1abb h LEU 521 Ca 0.13 0.00 0.03 0.00 0.08 0.00 0.00 57.88 58.12 1abb h LEU 521 Cb 0.77 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.50 1abb h LEU 521 CO -0.00 0.00 0.08 -0.07 -1.08 0.00 0.00 178.44 177.37 1abb h LEU 522 N 0.00 0.00 -1.85 1.67 -0.00 -1.60 -1.12 115.31 112.41 1abb h LEU 522 Ca 0.02 0.00 0.18 0.00 -0.00 0.00 0.00 57.88 58.08 1abb h LEU 522 Cb 0.10 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 40.72 1abb h LEU 522 CO -0.00 0.00 0.49 0.28 -0.00 0.00 0.00 178.44 179.21 1abb h SER 523 N 0.00 0.14 -0.40 -0.43 0.02 -1.67 -0.42 113.55 110.78 1abb h SER 523 Ca 0.05 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1abb h SER 523 Cb 0.20 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.72 1abb h SER 523 CO -0.00 0.07 0.00 -1.22 -1.14 0.00 0.00 176.83 174.54 1abb n TYR 524 N -4.39 0.52 -0.20 3.45 4.01 -0.43 -4.53 117.16 115.59 1abb n TYR 524 Ca 0.14 -0.26 0.14 0.00 -0.16 0.00 0.00 57.90 57.75 1abb n TYR 524 Cb 0.67 0.00 0.45 0.00 -0.31 0.00 0.00 39.34 40.15 1abb n TYR 524 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1abb h VAL 525 N 3.13 0.82 -0.39 -0.72 2.07 -1.10 0.43 116.25 120.48 1abb h VAL 525 Ca 0.00 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1abb h VAL 525 Cb 0.70 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 1abb h VAL 525 CO 0.00 0.10 0.00 0.47 0.02 0.00 0.00 177.57 178.16 1abb n ASP 526 N -4.51 3.14 -4.63 0.57 8.00 -1.26 -4.86 116.55 112.99 1abb n ASP 526 Ca 0.15 -1.92 -0.43 0.00 0.71 0.00 0.00 54.79 53.30 1abb n ASP 526 Cb 0.49 -0.26 -0.02 0.00 -0.02 0.00 0.00 41.12 41.32 1abb n ASP 526 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1abb s ASP 527 N -1.10 6.89 0.58 -2.24 2.15 0.14 -4.90 116.67 118.19 1abb s ASP 527 Ca 0.31 0.99 0.33 0.00 0.43 0.00 0.00 52.55 54.61 1abb s ASP 527 Cb 0.17 -2.54 1.81 0.00 -0.30 0.00 0.00 42.92 42.06 1abb s ASP 527 CO 0.23 -0.93 2.20 -0.33 -0.17 0.00 0.00 175.17 176.17 1abb h GLU 528 N 8.24 0.00 0.32 4.34 4.39 -1.92 0.63 114.58 130.58 1abb h GLU 528 Ca -0.21 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.48 1abb h GLU 528 Cb 1.06 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.71 1abb h GLU 528 CO 1.04 0.04 -0.15 0.00 -1.16 0.00 0.00 179.01 178.78 1abb h ALA 529 N 1.96 -0.43 -0.16 3.43 0.00 -1.95 0.03 119.26 122.14 1abb h ALA 529 Ca -0.00 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 54.80 1abb h ALA 529 Cb 0.17 0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.06 1abb h ALA 529 CO 0.01 -0.44 -0.40 0.35 0.00 0.00 0.00 179.25 178.77 1abb h PHE 530 N -1.04 -1.13 -0.84 0.00 3.57 -1.67 0.22 116.94 116.05 1abb h PHE 530 Ca -0.04 0.05 0.09 0.00 3.53 0.00 0.00 57.97 61.59 1abb h PHE 530 Cb 0.46 0.52 -0.06 0.00 2.79 0.00 0.00 35.95 39.66 1abb h PHE 530 CO 0.03 -0.46 0.54 0.82 -2.23 0.00 0.00 178.31 177.02 1abb h ILE 531 N -0.46 0.97 -0.19 1.41 2.04 -0.94 0.20 117.51 120.54 1abb h ILE 531 Ca 0.09 -0.28 -0.17 0.00 1.00 0.00 0.00 64.86 65.50 1abb h ILE 531 Cb 0.61 0.08 -0.00 0.00 -0.74 0.00 0.00 36.82 36.77 1abb h ILE 531 CO -0.40 0.15 -0.58 0.08 0.00 0.00 0.00 178.15 177.39 1abb h ARG 532 N 0.82 0.61 0.27 2.37 0.11 0.14 -3.19 114.38 115.51 1abb h ARG 532 Ca 0.38 -0.41 -0.01 0.00 0.10 0.00 0.00 59.98 60.04 1abb h ARG 532 Cb 0.40 0.05 0.00 0.00 1.11 0.00 0.00 29.97 31.54 1abb h ARG 532 CO -0.15 1.02 -0.13 -0.44 0.10 0.00 0.00 179.97 180.37 1abb h ASP 533 N 0.46 -0.31 -0.62 0.08 3.32 0.18 0.24 116.42 119.77 1abb h ASP 533 Ca 0.00 -0.12 0.11 0.00 0.02 0.00 0.00 57.03 57.04 1abb h ASP 533 Cb 1.15 0.08 -0.08 0.00 0.22 0.00 0.00 39.33 40.69 1abb h ASP 533 CO 0.11 -0.05 0.16 0.58 -1.72 0.00 0.00 179.24 178.33 1abb h VAL 534 N -0.56 0.66 -0.91 -1.35 2.07 -1.24 -1.15 116.25 113.78 1abb h VAL 534 Ca -0.04 -0.10 0.04 0.00 0.82 0.00 0.00 66.70 67.42 1abb h VAL 534 Cb 0.41 0.33 -0.05 0.00 -1.52 0.00 0.00 31.29 30.46 1abb h VAL 534 CO 0.06 0.06 0.59 0.00 0.02 0.00 0.00 177.57 178.29 1abb h ALA 535 N 1.48 1.20 -0.17 1.67 0.00 -1.47 -1.89 119.26 120.09 1abb h ALA 535 Ca 0.32 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 1abb h ALA 535 Cb 0.47 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1abb h ALA 535 CO -0.38 0.44 0.02 -0.22 0.00 0.00 0.00 179.25 179.11 1abb h LYS 536 N 1.13 0.28 -0.51 0.00 1.63 0.23 -1.37 116.57 117.96 1abb h LYS 536 Ca 0.36 -0.08 -0.00 0.00 -0.85 0.00 0.00 60.65 60.09 1abb h LYS 536 Cb 0.02 -0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 31.59 1abb h LYS 536 CO -0.12 0.45 0.31 0.28 -3.45 0.00 0.00 179.45 176.92 1abb h VAL 537 N 0.06 1.15 -0.54 2.00 2.07 -0.90 0.35 116.25 120.44 1abb h VAL 537 Ca 0.05 -0.33 -0.08 0.00 0.82 0.00 0.00 66.70 67.16 1abb h VAL 537 Cb 0.31 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 1abb h VAL 537 CO 0.00 0.15 0.02 0.50 0.02 0.00 0.00 177.57 178.27 1abb h LYS 538 N 0.68 0.90 -0.11 1.57 1.63 -1.24 -1.57 116.57 118.44 1abb h LYS 538 Ca 0.18 -0.25 -0.02 0.00 -0.85 0.00 0.00 60.65 59.72 1abb h LYS 538 Cb -0.02 -0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 31.50 1abb h LYS 538 CO -0.04 0.89 -0.00 0.37 -3.45 0.00 0.00 179.45 177.22 1abb h GLN 539 N 0.84 0.15 0.65 1.90 4.15 0.42 0.17 115.11 123.39 1abb h GLN 539 Ca 0.16 -0.02 -0.03 0.00 0.77 0.00 0.00 58.65 59.53 1abb h GLN 539 Cb 0.47 -0.03 0.01 0.00 0.21 0.00 0.00 27.48 28.14 1abb h GLN 539 CO 0.02 0.17 -0.31 0.93 -1.93 0.00 0.00 178.83 177.71 1abb h GLU 540 N 0.15 -0.85 -0.41 1.69 3.07 0.26 -2.79 114.58 115.71 1abb h GLU 540 Ca 0.04 0.06 0.03 0.00 -0.50 0.00 0.00 59.36 58.99 1abb h GLU 540 Cb 0.11 0.19 -0.03 0.00 -0.84 0.00 0.00 28.75 28.18 1abb h GLU 540 CO 0.00 -0.53 0.20 -0.91 -1.40 0.00 0.00 179.01 176.38 1abb h ASN 541 N -1.02 0.29 -0.43 1.42 -0.26 -0.68 -1.37 115.58 113.53 1abb h ASN 541 Ca -0.09 0.02 0.04 0.00 -0.56 0.00 0.00 56.30 55.71 1abb h ASN 541 Cb 0.71 -0.03 -0.04 0.00 -1.06 0.00 0.00 38.32 37.89 1abb h ASN 541 CO 0.15 0.21 0.21 0.11 -1.06 0.00 0.00 177.43 177.05 1abb h LYS 542 N 0.41 0.40 -0.76 0.81 1.57 -1.06 -1.39 116.57 116.56 1abb h LYS 542 Ca 0.17 -0.02 0.08 0.00 -1.87 0.00 0.00 60.65 59.01 1abb h LYS 542 Cb 0.08 -0.09 -0.07 0.00 0.08 0.00 0.00 32.23 32.23 1abb h LYS 542 CO -0.12 0.27 0.42 -0.07 -0.57 0.00 0.00 179.45 179.37 1abb h LEU 543 N 0.41 0.59 -0.48 2.94 -0.00 -1.06 0.33 115.31 118.04 1abb h LEU 543 Ca 0.19 0.05 -0.14 0.00 -0.00 0.00 0.00 57.88 57.98 1abb h LEU 543 Cb 0.11 -0.07 -0.01 0.00 -0.00 0.00 0.00 40.66 40.70 1abb h LEU 543 CO -0.15 0.35 -0.26 0.11 -0.00 0.00 0.00 178.44 178.49 1abb h LYS 544 N 0.72 0.97 0.00 1.13 1.57 -0.83 -0.55 116.57 119.58 1abb h LYS 544 Ca 0.36 -0.44 -0.09 0.00 -1.87 0.00 0.00 60.65 58.61 1abb h LYS 544 Cb 0.31 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 1abb h LYS 544 CO -0.23 1.11 -0.44 0.35 -0.57 0.00 0.00 179.45 179.67 1abb h PHE 545 N 0.83 0.00 -0.34 -1.35 3.57 -0.52 -2.05 116.94 117.07 1abb h PHE 545 Ca 0.10 0.00 -0.13 0.00 3.53 0.00 0.00 57.97 61.47 1abb h PHE 545 Cb 0.84 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.57 1abb h PHE 545 CO 0.05 0.44 -0.32 0.00 -2.23 0.00 0.00 178.31 176.26 1abb h ALA 546 N 1.56 0.81 0.31 2.41 0.00 -0.06 -1.28 119.26 123.00 1abb h ALA 546 Ca -0.00 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 1abb h ALA 546 Cb 1.02 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1abb h ALA 546 CO 0.06 0.65 -0.15 0.00 0.00 0.00 0.00 179.25 179.81 1abb h ALA 547 N 1.02 -0.41 -0.43 0.00 0.00 -0.70 -2.08 119.26 116.67 1abb h ALA 547 Ca 0.07 -0.10 0.08 0.00 0.00 0.00 0.00 54.91 54.97 1abb h ALA 547 Cb 0.84 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1abb h ALA 547 CO 0.07 -0.72 0.29 -0.92 0.00 0.00 0.00 179.25 177.97 1abb h TYR 548 N -0.43 0.22 0.00 0.00 5.03 -1.29 -1.72 116.97 118.79 1abb h TYR 548 Ca -0.04 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.27 1abb h TYR 548 Cb 0.33 -0.07 0.00 0.00 1.55 0.00 0.00 36.73 38.53 1abb h TYR 548 CO -0.05 0.11 0.00 -0.11 -1.32 0.00 0.00 178.16 176.79 1abb n LEU 549 N -4.46 0.00 -0.01 2.82 7.94 -0.49 -2.12 117.00 120.68 1abb n LEU 549 Ca 0.06 0.00 -0.02 0.00 -1.11 0.00 0.00 56.01 54.95 1abb n LEU 549 Cb 0.35 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.29 1abb n LEU 549 CO 0.35 0.00 -0.55 -0.62 -1.11 0.00 0.00 177.39 175.46 1abb n GLU 550 N -0.69 0.03 0.09 1.96 -0.58 -0.71 -2.20 120.64 118.53 1abb n GLU 550 Ca 0.05 0.01 0.11 0.00 -0.42 0.00 0.00 57.16 56.91 1abb n GLU 550 Cb 0.02 -0.58 0.44 0.00 -0.57 0.00 0.00 31.44 30.76 1abb n GLU 550 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 1abb n ARG 551 N -3.04 0.14 -3.23 3.49 0.63 -0.80 -4.14 116.66 109.71 1abb n ARG 551 Ca -0.03 0.32 -0.03 0.00 -0.92 0.00 0.00 57.85 57.19 1abb n ARG 551 Cb 0.52 -1.75 -0.03 0.00 0.45 0.00 0.00 32.46 31.65 1abb n ARG 551 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 1abb s GLU 552 N -3.19 0.49 0.00 -0.14 2.02 -0.90 -5.02 118.70 111.96 1abb s GLU 552 Ca 0.06 0.30 0.00 0.00 0.02 0.00 0.00 54.97 55.35 1abb s GLU 552 Cb 0.10 -0.06 0.00 0.00 0.10 0.00 0.00 34.13 34.28 1abb s GLU 552 CO 0.40 -1.05 0.00 0.66 0.02 0.00 0.00 175.26 175.29 1abb n TYR 553 N 5.35 0.00 -3.89 1.61 4.01 -1.26 -4.62 117.16 118.36 1abb n TYR 553 Ca 0.03 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.66 1abb n TYR 553 Cb 0.51 0.00 -0.12 0.00 -0.31 0.00 0.00 39.34 39.43 1abb n TYR 553 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 1abb s LYS 554 N -2.01 0.24 0.00 -0.72 3.01 -1.25 -3.73 119.74 115.29 1abb s LYS 554 Ca 0.00 -0.22 0.00 0.00 -1.01 0.00 0.00 55.97 54.74 1abb s LYS 554 Cb 0.00 0.10 0.00 0.00 -1.01 0.00 0.00 37.83 36.92 1abb s LYS 554 CO 0.00 -0.05 0.00 1.33 0.51 0.00 0.00 175.35 177.14 1abb n VAL 555 N 2.27 0.00 -1.87 3.17 0.24 -0.93 -4.90 118.33 116.30 1abb n VAL 555 Ca -0.18 0.00 -0.00 0.00 -2.04 0.00 0.00 64.34 62.12 1abb n VAL 555 Cb 0.57 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.94 1abb n VAL 555 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 1abb n HIS 556 N -1.09 -0.73 -2.08 6.34 -0.00 -1.26 -5.08 115.22 111.31 1abb n HIS 556 Ca 0.00 0.28 -0.33 0.00 0.46 0.00 0.00 57.72 58.13 1abb n HIS 556 Cb 0.00 -2.13 0.01 0.00 -0.12 0.00 0.00 29.99 27.75 1abb n HIS 556 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 1abb s ILE 557 N -2.83 3.89 -0.18 3.57 -1.09 -1.26 -5.04 121.20 118.25 1abb s ILE 557 Ca 0.01 0.89 -0.06 0.00 -2.23 0.00 0.00 60.65 59.26 1abb s ILE 557 Cb -0.00 -3.42 -0.03 0.00 -1.58 0.00 0.00 42.46 37.43 1abb s ILE 557 CO 0.18 -0.53 0.02 0.21 -1.23 0.00 0.00 174.94 173.59 1abb s ASN 558 N -2.83 5.22 0.41 3.58 3.84 -1.26 -4.98 114.94 118.91 1abb s ASN 558 Ca 0.63 -0.04 0.29 0.00 0.21 0.00 0.00 52.86 53.95 1abb s ASN 558 Cb -0.15 -1.88 1.19 0.00 -0.55 0.00 0.00 41.25 39.85 1abb s ASN 558 CO 0.36 0.15 1.85 -0.65 -2.79 0.00 0.00 177.10 176.03 1abb h PRO 559 N 6.85 0.00 0.00 0.43 0.11 -1.96 -3.27 132.00 134.16 1abb h PRO 559 Ca -0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1abb h PRO 559 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1abb h PRO 559 CO 0.66 0.00 -1.10 0.09 -0.21 0.00 0.00 178.00 177.44 1abb n ASN 560 N -2.67 0.70 -4.69 -2.05 5.03 -1.26 -4.80 115.26 105.52 1abb n ASN 560 Ca 0.01 -0.57 -0.29 0.00 0.87 0.00 0.00 54.58 54.61 1abb n ASN 560 Cb 0.27 1.02 0.17 0.00 -1.02 0.00 0.00 39.78 40.21 1abb n ASN 560 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 1abb s SER 561 N -3.46 2.80 -0.59 6.41 1.04 -1.24 -4.91 113.70 113.74 1abb s SER 561 Ca 0.05 1.26 -0.28 0.00 0.48 0.00 0.00 55.95 57.46 1abb s SER 561 Cb 0.15 -1.93 0.03 0.00 0.10 0.00 0.00 66.02 64.37 1abb s SER 561 CO 0.84 -3.03 1.24 -0.22 0.98 0.00 0.00 173.24 173.05 1abb s LEU 562 N -6.41 3.41 -0.79 2.42 0.20 -0.03 -4.81 118.68 112.67 1abb s LEU 562 Ca 0.65 0.08 -0.25 0.00 0.69 0.00 0.00 54.13 55.29 1abb s LEU 562 Cb -0.18 -3.08 -0.01 0.00 -0.43 0.00 0.00 46.19 42.48 1abb s LEU 562 CO 0.57 -1.56 1.74 -0.36 -0.29 0.00 0.00 176.35 176.46 1abb s PHE 563 N 5.23 1.93 -0.46 5.38 0.40 -1.26 -0.74 117.98 128.46 1abb s PHE 563 Ca 0.44 0.37 -0.25 0.00 -0.60 0.00 0.00 56.93 56.89 1abb s PHE 563 Cb -0.08 -4.25 0.03 0.00 0.51 0.00 0.00 43.02 39.23 1abb s PHE 563 CO 0.24 -2.03 0.89 0.34 0.70 0.00 0.00 175.22 175.36 1abb s ASP 564 N 6.96 6.48 -0.01 1.36 -1.08 0.34 -1.68 116.67 129.04 1abb s ASP 564 Ca 0.60 0.06 0.05 0.00 -0.52 0.00 0.00 52.55 52.74 1abb s ASP 564 Cb -0.08 -2.43 -0.01 0.00 -1.46 0.00 0.00 42.92 38.93 1abb s ASP 564 CO 0.08 -1.01 -0.15 0.68 0.52 0.00 0.00 175.17 175.29 1abb s VAL 565 N 3.63 1.17 -0.40 1.11 -7.23 -0.01 -1.31 120.40 117.36 1abb s VAL 565 Ca 0.35 -0.68 0.03 0.00 -1.81 0.00 0.00 61.98 59.87 1abb s VAL 565 Cb -0.11 -0.99 0.11 0.00 0.56 0.00 0.00 36.38 35.96 1abb s VAL 565 CO 0.25 0.30 0.15 -1.58 -0.31 0.00 0.00 175.10 173.91 1abb s GLN 566 N -0.44 1.38 -0.81 4.82 0.74 -0.84 -1.81 119.66 122.71 1abb s GLN 566 Ca 0.05 -1.90 -0.08 0.00 0.05 0.00 0.00 55.36 53.49 1abb s GLN 566 Cb -0.06 -2.77 0.21 0.00 1.10 0.00 0.00 33.01 31.49 1abb s GLN 566 CO -0.00 -1.04 0.71 0.14 -0.55 0.00 0.00 175.29 174.55 1abb s VAL 567 N 0.67 4.84 0.01 1.34 -7.23 -1.26 -1.41 120.40 117.36 1abb s VAL 567 Ca 0.14 -3.00 -0.04 0.00 -1.81 0.00 0.00 61.98 57.27 1abb s VAL 567 Cb -0.21 -4.02 -0.01 0.00 0.56 0.00 0.00 36.38 32.70 1abb s VAL 567 CO -0.08 -1.01 0.06 -0.54 -0.31 0.00 0.00 175.10 173.22 1abb s LYS 568 N -0.36 0.36 -0.06 4.82 -0.14 -0.43 -4.93 119.74 119.00 1abb s LYS 568 Ca 0.21 -0.43 -0.36 0.00 -1.36 0.00 0.00 55.97 54.03 1abb s LYS 568 Cb -0.13 0.14 -0.14 0.00 -1.68 0.00 0.00 37.83 36.02 1abb s LYS 568 CO -0.08 -0.07 1.68 -2.13 -0.76 0.00 0.00 175.35 173.99 1abb n ARG 569 N 1.71 1.69 -0.88 1.68 0.63 -1.26 -4.30 116.66 115.93 1abb n ARG 569 Ca -0.22 0.62 -0.41 0.00 -0.92 0.00 0.00 57.85 56.92 1abb n ARG 569 Cb 0.56 -2.36 -0.07 0.00 0.45 0.00 0.00 32.46 31.03 1abb n ARG 569 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 1abb n ILE 570 N 4.13 1.21 -4.25 5.15 2.08 -1.23 -4.79 119.36 121.67 1abb n ILE 570 Ca 0.22 -1.02 -0.30 0.00 0.56 0.00 0.00 62.75 62.21 1abb n ILE 570 Cb 0.23 -2.18 -0.10 0.00 -0.75 0.00 0.00 39.64 36.84 1abb n ILE 570 CO 0.00 0.00 0.00 -2.28 0.56 0.00 0.00 176.55 174.83 1abb s HIS 571 N 5.53 2.77 0.32 1.39 2.46 -1.26 -4.51 115.29 121.98 1abb s HIS 571 Ca 0.58 -0.14 0.06 0.00 0.47 0.00 0.00 55.06 56.03 1abb s HIS 571 Cb 0.14 -1.46 0.87 0.00 -0.13 0.00 0.00 32.58 32.00 1abb s HIS 571 CO 0.18 0.42 1.59 0.93 -2.47 0.00 0.00 174.74 175.39 1abb h GLU 572 N 3.68 0.04 0.00 2.88 5.08 -1.95 -1.96 114.58 122.35 1abb h GLU 572 Ca -0.49 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 57.83 1abb h GLU 572 Cb 1.17 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 1abb h GLU 572 CO 0.53 0.03 -0.17 0.10 -1.00 0.00 0.00 179.01 178.49 1abb h TYR 573 N 0.04 0.00 0.00 4.33 -0.00 -1.95 -3.14 116.97 116.24 1abb h TYR 573 Ca 0.64 0.00 -0.01 0.00 -0.00 0.00 0.00 58.73 59.37 1abb h TYR 573 Cb 1.42 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 38.15 1abb h TYR 573 CO -0.36 0.17 -0.03 -0.22 -0.00 0.00 0.00 178.16 177.72 1abb h LYS 574 N 0.00 0.00 0.00 0.10 1.63 -1.66 -3.27 116.57 113.37 1abb h LYS 574 Ca -0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1abb h LYS 574 Cb 0.88 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.51 1abb h LYS 574 CO 0.02 0.03 0.00 0.54 -3.45 0.00 0.00 179.45 176.60 1abb n ARG 575 N -3.17 -0.56 0.04 1.90 1.74 -1.19 -4.14 116.66 111.29 1abb n ARG 575 Ca -0.00 0.14 0.05 0.00 -0.77 0.00 0.00 57.85 57.26 1abb n ARG 575 Cb 0.28 -3.70 0.07 0.00 -1.02 0.00 0.00 32.46 28.09 1abb n ARG 575 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1abb n GLN 576 N -1.51 0.01 0.16 5.56 0.00 -1.26 0.09 117.38 120.42 1abb n GLN 576 Ca 0.00 0.39 0.01 0.00 0.00 0.00 0.00 57.00 57.41 1abb n GLN 576 Cb 0.14 -1.03 0.32 0.00 0.00 0.00 0.00 30.24 29.67 1abb n GLN 576 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 1abb h LEU 577 N 0.00 0.06 0.39 2.61 3.38 -1.95 -0.17 115.31 119.63 1abb h LEU 577 Ca 0.08 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1abb h LEU 577 Cb 0.97 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.70 1abb h LEU 577 CO -0.00 0.44 -0.19 0.25 0.09 0.00 0.00 178.44 179.04 1abb h LEU 578 N 0.05 -0.44 -1.80 1.67 5.85 -0.76 -2.89 115.31 116.99 1abb h LEU 578 Ca 0.00 0.02 0.28 0.00 0.84 0.00 0.00 57.88 59.02 1abb h LEU 578 Cb 0.71 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.81 1abb h LEU 578 CO 0.05 -0.29 0.85 -1.13 -0.34 0.00 0.00 178.44 177.57 1abb h ASN 579 N -0.56 0.00 0.40 1.25 -0.00 -1.57 0.11 115.58 115.21 1abb h ASN 579 Ca -0.05 0.00 -0.24 0.00 -0.00 0.00 0.00 56.30 56.01 1abb h ASN 579 Cb 0.40 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.72 1abb h ASN 579 CO 0.09 0.00 -1.03 0.00 -0.00 0.00 0.00 177.43 176.49 1abb h LEU 581 N 0.19 0.89 -2.49 0.00 3.38 -0.59 0.39 115.31 117.07 1abb h LEU 581 Ca -0.10 -0.49 -0.00 0.00 0.09 0.00 0.00 57.88 57.38 1abb h LEU 581 Cb 1.68 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 42.18 1abb h LEU 581 CO 0.18 1.19 -0.02 -0.74 0.09 0.00 0.00 178.44 179.14 1abb h HIS 582 N 0.60 0.00 0.14 1.13 2.76 -1.23 0.22 115.15 118.77 1abb h HIS 582 Ca 0.04 0.00 -0.20 0.00 -2.20 0.00 0.00 60.37 58.02 1abb h HIS 582 Cb 0.97 0.00 0.02 0.00 1.55 0.00 0.00 27.41 29.95 1abb h HIS 582 CO 0.07 0.02 -0.88 0.28 -1.30 0.00 0.00 177.93 176.12 1abb h VAL 583 N 0.00 1.47 0.00 5.26 2.07 -0.42 -2.51 116.25 122.12 1abb h VAL 583 Ca -0.00 -2.53 0.00 0.00 0.82 0.00 0.00 66.70 64.99 1abb h VAL 583 Cb 0.15 3.16 0.00 0.00 -1.52 0.00 0.00 31.29 33.08 1abb h VAL 583 CO 0.00 0.72 0.00 -0.38 0.02 0.00 0.00 177.57 177.93 1abb n ILE 584 N -4.10 0.70 -0.04 4.57 5.41 0.05 -0.97 119.36 124.98 1abb n ILE 584 Ca -0.15 0.15 -0.12 0.00 1.00 0.00 0.00 62.75 63.64 1abb n ILE 584 Cb 0.84 -0.87 -0.10 0.00 -0.71 0.00 0.00 39.64 38.80 1abb n ILE 584 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 176.55 177.29 1abb h THR 585 N 0.00 1.39 -0.11 1.39 2.02 -0.49 -2.97 112.91 114.14 1abb h THR 585 Ca 0.00 -1.81 0.04 0.00 0.77 0.00 0.00 66.41 65.41 1abb h THR 585 Cb 0.36 2.52 -0.06 0.00 -1.74 0.00 0.00 68.15 69.23 1abb h THR 585 CO 0.00 0.43 -0.26 -0.07 0.37 0.00 0.00 175.52 175.99 1abb h LEU 586 N -0.89 -0.81 -0.74 2.58 4.07 -0.93 -0.49 115.31 118.10 1abb h LEU 586 Ca -0.00 0.12 0.17 0.00 0.08 0.00 0.00 57.88 58.24 1abb h LEU 586 Cb 0.73 0.35 -0.13 0.00 1.08 0.00 0.00 40.66 42.69 1abb h LEU 586 CO 0.01 -0.31 0.01 0.22 -1.08 0.00 0.00 178.44 177.28 1abb h TYR 587 N -0.34 -0.05 -0.19 1.13 3.20 -1.21 -0.40 116.97 119.12 1abb h TYR 587 Ca 0.09 0.05 -0.02 0.00 3.14 0.00 0.00 58.73 61.99 1abb h TYR 587 Cb 0.48 0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.88 1abb h TYR 587 CO -0.35 -0.23 0.03 -0.91 -1.64 0.00 0.00 178.16 175.07 1abb h ASN 588 N 0.11 0.30 0.00 -2.11 2.35 -1.25 -2.15 115.58 112.83 1abb h ASN 588 Ca 0.40 -0.26 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 1abb h ASN 588 Cb 0.69 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.98 1abb h ASN 588 CO -0.64 0.48 0.00 0.54 -1.65 0.00 0.00 177.43 176.16 1abb n ARG 589 N -4.76 0.00 -0.29 0.81 1.74 -0.24 -1.00 116.66 112.92 1abb n ARG 589 Ca -0.04 0.46 0.25 0.00 -0.77 0.00 0.00 57.85 57.74 1abb n ARG 589 Cb 0.19 -1.35 0.43 0.00 -1.02 0.00 0.00 32.46 30.71 1abb n ARG 589 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1abb n ILE 590 N -1.72 -0.19 0.04 0.55 5.41 -0.22 0.85 119.36 124.08 1abb n ILE 590 Ca 0.00 1.22 -0.07 0.00 1.00 0.00 0.00 62.75 64.89 1abb n ILE 590 Cb 0.00 -1.99 -0.12 0.00 -0.71 0.00 0.00 39.64 36.82 1abb n ILE 590 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 1abb h LYS 591 N 0.00 0.00 -0.11 0.38 1.57 -0.94 -2.79 116.57 114.68 1abb h LYS 591 Ca 0.57 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 59.23 1abb h LYS 591 Cb 1.78 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.08 1abb h LYS 591 CO -0.35 0.85 -0.50 -0.22 -0.57 0.00 0.00 179.45 178.67 1abb h LYS 592 N 0.00 0.29 -2.52 3.15 3.64 0.22 -3.37 116.57 117.98 1abb h LYS 592 Ca -0.08 -0.16 -0.60 0.00 -1.27 0.00 0.00 60.65 58.54 1abb h LYS 592 Cb 1.82 0.01 -0.39 0.00 -0.41 0.00 0.00 32.23 33.27 1abb h LYS 592 CO 0.12 0.72 -0.89 -1.21 -2.27 0.00 0.00 179.45 175.92 1abb s GLU 593 N -3.98 1.19 0.00 1.90 2.02 -1.00 -5.01 118.70 113.81 1abb s GLU 593 Ca -0.05 -2.31 0.06 0.00 0.02 0.00 0.00 54.97 52.69 1abb s GLU 593 Cb 0.13 -1.80 0.33 0.00 0.10 0.00 0.00 34.13 32.88 1abb s GLU 593 CO 0.79 -1.36 0.73 -2.30 0.02 0.00 0.00 175.26 173.14 1abb n PRO 594 N 2.74 0.24 -0.88 0.39 -0.02 -1.05 -1.86 135.00 134.56 1abb n PRO 594 Ca 0.27 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.80 1abb n PRO 594 Cb 0.45 -1.37 0.12 0.00 -0.02 0.00 0.00 33.50 32.68 1abb n PRO 594 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1abb n ASN 595 N -0.87 1.39 -4.88 2.55 3.02 -1.26 -5.02 115.26 110.19 1abb n ASN 595 Ca 0.04 -3.01 -0.33 0.00 -0.03 0.00 0.00 54.58 51.26 1abb n ASN 595 Cb 0.02 -0.41 -0.05 0.00 -0.61 0.00 0.00 39.78 38.72 1abb n ASN 595 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1abb s LYS 596 N -1.80 3.70 -0.20 3.52 2.36 -0.78 -5.04 119.74 121.50 1abb s LYS 596 Ca 0.33 0.07 -0.25 0.00 -2.55 0.00 0.00 55.97 53.57 1abb s LYS 596 Cb 0.34 -2.87 -0.01 0.00 -1.05 0.00 0.00 37.83 34.25 1abb s LYS 596 CO -0.09 0.47 0.84 0.12 1.55 0.00 0.00 175.35 178.24 1abb s PHE 597 N -1.59 3.38 -0.10 4.03 5.36 -1.26 -4.99 117.98 122.80 1abb s PHE 597 Ca 0.39 1.22 0.00 0.00 -0.96 0.00 0.00 56.93 57.58 1abb s PHE 597 Cb -0.13 -3.04 0.02 0.00 -0.34 0.00 0.00 43.02 39.54 1abb s PHE 597 CO 0.22 -0.31 -0.08 0.54 -1.46 0.00 0.00 175.22 174.12 1abb s VAL 598 N 2.45 1.03 -0.03 3.12 0.11 -1.26 -5.10 120.40 120.72 1abb s VAL 598 Ca 0.37 -0.32 -0.30 0.00 -2.93 0.00 0.00 61.98 58.80 1abb s VAL 598 Cb -0.16 -1.03 -0.09 0.00 -1.53 0.00 0.00 36.38 33.57 1abb s VAL 598 CO 0.10 0.36 2.01 0.52 -3.33 0.00 0.00 175.10 174.76 1abb n VAL 599 N 4.72 0.67 -2.24 2.04 0.31 -1.26 -4.95 118.33 117.62 1abb n VAL 599 Ca -0.15 -0.19 -0.36 0.00 -0.01 0.00 0.00 64.34 63.63 1abb n VAL 599 Cb 0.50 -2.28 -0.00 0.00 -0.91 0.00 0.00 33.84 31.15 1abb n VAL 599 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1abb s PRO 600 N 4.76 3.49 0.04 5.55 0.04 -1.26 -4.89 135.00 142.73 1abb s PRO 600 Ca 0.92 1.70 0.04 0.00 0.04 0.00 0.00 61.00 63.70 1abb s PRO 600 Cb -0.47 -2.16 -0.02 0.00 0.04 0.00 0.00 34.50 31.89 1abb s PRO 600 CO 0.43 -0.76 -0.13 1.03 0.04 0.00 0.00 177.00 177.61 1abb s ARG 601 N -3.05 0.84 -0.31 4.56 0.52 -1.01 -0.85 118.95 119.65 1abb s ARG 601 Ca 0.69 -0.74 -0.05 0.00 -0.52 0.00 0.00 55.73 55.12 1abb s ARG 601 Cb -0.26 -0.82 0.03 0.00 0.52 0.00 0.00 34.95 34.42 1abb s ARG 601 CO 0.31 0.20 0.05 0.99 0.02 0.00 0.00 175.30 176.86 1abb s THR 602 N -0.90 3.47 -0.34 0.02 2.01 0.08 -2.98 115.64 117.00 1abb s THR 602 Ca -0.00 -1.11 -0.21 0.00 0.31 0.00 0.00 61.69 60.68 1abb s THR 602 Cb -0.08 -2.91 0.00 0.00 0.01 0.00 0.00 72.50 69.52 1abb s THR 602 CO 0.01 -0.06 0.68 -0.69 -0.69 0.00 0.00 174.62 173.87 1abb s VAL 603 N 1.37 4.86 -0.16 3.82 1.01 0.73 -0.51 120.40 131.52 1abb s VAL 603 Ca -0.02 0.76 0.00 0.00 0.00 0.00 0.00 61.98 62.73 1abb s VAL 603 Cb -0.19 -4.10 0.00 0.00 0.00 0.00 0.00 36.38 32.10 1abb s VAL 603 CO 0.01 -0.30 -0.17 -0.04 0.00 0.00 0.00 175.10 174.60 1abb s MET 604 N 2.80 3.14 0.08 2.72 -1.94 -0.43 -0.80 119.30 124.87 1abb s MET 604 Ca 0.27 -0.78 0.10 0.00 -1.71 0.00 0.00 55.69 53.57 1abb s MET 604 Cb -0.14 -2.61 -0.03 0.00 2.01 0.00 0.00 34.83 34.05 1abb s MET 604 CO 0.14 -0.06 -0.26 0.42 -0.01 0.00 0.00 175.02 175.25 1abb s ILE 605 N 0.98 2.17 0.05 2.53 1.01 -0.20 -1.98 121.20 125.76 1abb s ILE 605 Ca -0.02 -1.54 -0.19 0.00 0.00 0.00 0.00 60.65 58.90 1abb s ILE 605 Cb -0.15 -1.88 0.04 0.00 0.01 0.00 0.00 42.46 40.48 1abb s ILE 605 CO -0.04 0.24 0.45 -0.83 0.00 0.00 0.00 174.94 174.77 1abb s GLY 606 N -1.58 -0.33 0.00 6.18 0.00 -0.50 -0.62 107.32 110.47 1abb s GLY 606 Ca 0.12 0.38 0.00 0.00 0.00 0.00 0.00 44.72 45.22 1abb s GLY 606 CO 0.04 0.10 0.00 0.61 0.00 0.00 0.00 173.10 173.85 1abb n GLY 607 N 0.39 2.30 3.49 0.20 0.00 -1.26 -1.32 105.19 108.99 1abb n GLY 607 Ca -0.18 -1.63 -0.34 0.00 0.00 0.00 0.00 46.02 43.87 1abb n GLY 607 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1abb s LYS 608 N -1.81 3.66 0.06 1.61 1.02 -1.26 -4.70 119.74 118.32 1abb s LYS 608 Ca 0.00 -0.52 -0.18 0.00 0.02 0.00 0.00 55.97 55.29 1abb s LYS 608 Cb 0.00 -2.94 -0.07 0.00 -0.52 0.00 0.00 37.83 34.30 1abb s LYS 608 CO 0.00 0.20 1.28 0.00 -0.92 0.00 0.00 175.35 175.92 1abb h ALA 609 N 6.83 -0.72 0.00 5.17 0.00 -1.87 -3.26 119.26 125.41 1abb h ALA 609 Ca -0.32 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1abb h ALA 609 Cb 1.19 0.75 0.00 0.00 0.00 0.00 0.00 17.79 19.73 1abb h ALA 609 CO 0.62 -0.81 0.00 0.00 0.00 0.00 0.00 179.25 179.07 1abb n ALA 610 N -2.75 0.00 -1.65 0.00 0.00 -1.26 -4.57 120.51 110.28 1abb n ALA 610 Ca -0.04 0.00 -0.47 0.00 0.00 0.00 0.00 53.44 52.93 1abb n ALA 610 Cb 0.20 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.61 1abb n ALA 610 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1abb n PRO 611 N 0.00 1.87 0.00 0.00 -0.02 -1.26 -0.93 135.00 134.66 1abb n PRO 611 Ca 0.00 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 1abb n PRO 611 Cb 0.00 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.11 1abb n PRO 611 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1abb n GLY 612 N 2.81 2.82 3.59 -1.23 0.00 -1.26 -4.93 105.19 106.99 1abb n GLY 612 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1abb n GLY 612 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1abb s TYR 613 N -2.82 2.56 -0.26 1.61 6.14 -0.11 -4.85 117.35 119.62 1abb s TYR 613 Ca 0.00 0.51 0.19 0.00 0.64 0.00 0.00 57.07 58.41 1abb s TYR 613 Cb 0.00 -4.46 0.26 0.00 0.42 0.00 0.00 41.96 38.17 1abb s TYR 613 CO 0.00 -1.64 1.55 1.25 0.64 0.00 0.00 175.55 177.34 1abb h HIS 614 N 9.90 0.00 0.11 4.97 -0.00 -1.92 -2.40 115.15 125.82 1abb h HIS 614 Ca -0.25 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.11 1abb h HIS 614 Cb 1.07 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.48 1abb h HIS 614 CO 1.02 0.26 -0.05 1.98 -0.00 0.00 0.00 177.93 181.13 1abb h MET 615 N 0.00 -0.15 -1.00 5.26 -1.53 -1.98 -1.34 114.93 114.19 1abb h MET 615 Ca -0.00 0.01 0.20 0.00 -3.44 0.00 0.00 59.70 56.47 1abb h MET 615 Cb 1.17 0.03 -0.11 0.00 -0.55 0.00 0.00 31.60 32.14 1abb h MET 615 CO 0.03 0.07 0.60 0.00 0.14 0.00 0.00 176.91 177.76 1abb h ALA 616 N 0.51 1.69 -0.10 0.39 0.00 -1.79 0.18 119.26 120.14 1abb h ALA 616 Ca -0.02 0.09 -0.15 0.00 0.00 0.00 0.00 54.91 54.84 1abb h ALA 616 Cb 0.29 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1abb h ALA 616 CO 0.03 -0.10 -0.59 0.87 0.00 0.00 0.00 179.25 179.46 1abb h LYS 617 N 0.72 0.34 -0.06 0.00 1.57 -1.19 -2.69 116.57 115.26 1abb h LYS 617 Ca 0.59 -0.23 -0.12 0.00 -1.87 0.00 0.00 60.65 59.02 1abb h LYS 617 Cb 0.97 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.30 1abb h LYS 617 CO -0.41 0.83 -0.53 0.52 -0.57 0.00 0.00 179.45 179.29 1abb h MET 618 N 0.26 0.17 -0.36 3.15 2.86 0.46 -2.30 114.93 119.17 1abb h MET 618 Ca -0.00 -0.10 -0.02 0.00 -2.06 0.00 0.00 59.70 57.51 1abb h MET 618 Cb 1.10 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.75 1abb h MET 618 CO 0.10 0.66 0.13 0.82 1.06 0.00 0.00 176.91 179.67 1abb h ILE 619 N 0.13 1.20 -0.84 -1.22 2.04 -1.14 0.28 117.51 117.96 1abb h ILE 619 Ca 0.00 -0.64 0.01 0.00 1.00 0.00 0.00 64.86 65.24 1abb h ILE 619 Cb 0.98 0.94 -0.04 0.00 -0.74 0.00 0.00 36.82 37.95 1abb h ILE 619 CO 0.08 0.22 0.56 0.40 0.00 0.00 0.00 178.15 179.41 1abb h ILE 620 N 0.44 1.21 0.00 -0.67 2.04 -1.31 -1.55 117.51 117.66 1abb h ILE 620 Ca 0.12 -0.39 -0.04 0.00 1.00 0.00 0.00 64.86 65.55 1abb h ILE 620 Cb 0.22 -0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.27 1abb h ILE 620 CO -0.01 0.21 -0.21 0.50 0.00 0.00 0.00 178.15 178.64 1abb h LYS 621 N 1.13 0.00 0.31 2.37 1.63 -0.70 -2.69 116.57 118.62 1abb h LYS 621 Ca 0.31 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 60.10 1abb h LYS 621 Cb -0.12 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.51 1abb h LYS 621 CO -0.07 0.21 -0.15 -0.07 -3.45 0.00 0.00 179.45 175.92 1abb h LEU 622 N 0.00 -0.35 -1.13 5.20 3.38 0.02 -2.42 115.31 120.00 1abb h LEU 622 Ca -0.00 0.01 0.34 0.00 0.09 0.00 0.00 57.88 58.32 1abb h LEU 622 Cb 0.63 0.09 -0.14 0.00 0.09 0.00 0.00 40.66 41.33 1abb h LEU 622 CO 0.03 0.05 0.64 0.40 0.09 0.00 0.00 178.44 179.65 1abb h ILE 623 N -1.03 0.28 -0.04 1.22 2.04 -1.19 0.41 117.51 119.21 1abb h ILE 623 Ca -0.04 -0.09 -0.14 0.00 1.00 0.00 0.00 64.86 65.58 1abb h ILE 623 Cb 0.32 -0.02 0.01 0.00 -0.74 0.00 0.00 36.82 36.39 1abb h ILE 623 CO 0.07 0.05 -0.53 0.71 0.00 0.00 0.00 178.15 178.45 1abb h THR 624 N 0.28 1.41 -0.28 -0.27 1.35 -1.50 -2.04 112.91 111.86 1abb h THR 624 Ca 0.74 -1.96 -0.04 0.00 -0.55 0.00 0.00 66.41 64.59 1abb h THR 624 Cb 1.85 2.46 -0.02 0.00 -1.73 0.00 0.00 68.15 70.72 1abb h THR 624 CO -0.53 0.57 -0.02 0.00 -0.25 0.00 0.00 175.52 175.29 1abb h ALA 625 N 0.37 1.44 0.50 6.62 0.00 0.32 0.08 119.26 128.60 1abb h ALA 625 Ca -0.06 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 1abb h ALA 625 Cb 1.21 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1abb h ALA 625 CO 0.11 0.39 -0.24 0.82 0.00 0.00 0.00 179.25 180.33 1abb h ILE 626 N 0.42 0.51 -0.84 0.00 2.04 -1.37 -1.76 117.51 116.51 1abb h ILE 626 Ca 0.09 -0.02 0.21 0.00 1.00 0.00 0.00 64.86 66.14 1abb h ILE 626 Cb 0.31 0.52 -0.15 0.00 -0.74 0.00 0.00 36.82 36.76 1abb h ILE 626 CO 0.01 0.00 0.05 1.23 0.00 0.00 0.00 178.15 179.44 1abb h GLY 627 N -0.68 1.03 1.51 5.37 0.00 -0.41 -0.09 103.07 109.80 1abb h GLY 627 Ca -0.07 0.10 -0.12 0.00 0.00 0.00 0.00 47.33 47.24 1abb h GLY 627 CO 0.11 -0.36 -0.35 -0.55 0.00 0.00 0.00 176.54 175.39 1abb h ASP 628 N 0.10 0.58 0.13 0.19 3.32 -0.73 -1.60 116.42 118.40 1abb h ASP 628 Ca 0.48 -0.24 -0.01 0.00 0.02 0.00 0.00 57.03 57.29 1abb h ASP 628 Cb 0.91 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.30 1abb h ASP 628 CO -0.73 0.88 -0.06 0.58 -1.72 0.00 0.00 179.24 178.19 1abb h VAL 629 N 0.47 0.00 -0.92 -1.35 2.07 -0.21 -3.22 116.25 113.08 1abb h VAL 629 Ca 0.05 -0.24 0.04 0.00 0.82 0.00 0.00 66.70 67.37 1abb h VAL 629 Cb 0.84 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.55 1abb h VAL 629 CO 0.07 0.00 0.61 -0.37 0.02 0.00 0.00 177.57 177.90 1abb h VAL 630 N -0.42 1.14 0.00 2.57 -1.51 -1.19 -0.73 116.25 116.12 1abb h VAL 630 Ca -0.02 -0.39 -0.03 0.00 -1.23 0.00 0.00 66.70 65.03 1abb h VAL 630 Cb 0.13 -0.10 -0.00 0.00 -2.13 0.00 0.00 31.29 29.19 1abb h VAL 630 CO 0.03 0.21 -0.15 0.78 -1.23 0.00 0.00 177.57 177.21 1abb h ASN 631 N 1.15 0.00 -0.28 4.19 2.35 -1.46 -3.02 115.58 118.51 1abb h ASN 631 Ca 0.37 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.12 1abb h ASN 631 Cb 0.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.41 1abb h ASN 631 CO -0.12 0.15 0.00 1.41 -1.65 0.00 0.00 177.43 177.22 1abb n HIS 632 N -3.50 0.37 -3.42 1.19 8.25 -0.36 -4.98 115.22 112.76 1abb n HIS 632 Ca -0.01 -0.40 -0.37 0.00 -0.26 0.00 0.00 57.72 56.67 1abb n HIS 632 Cb 0.31 -0.02 -0.06 0.00 1.12 0.00 0.00 29.99 31.34 1abb n HIS 632 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1abb s ASP 633 N -0.98 6.86 0.15 0.41 2.15 -0.72 -5.01 116.67 119.53 1abb s ASP 633 Ca 0.21 1.04 0.14 0.00 0.43 0.00 0.00 52.55 54.37 1abb s ASP 633 Cb 0.11 -2.28 -0.08 0.00 -0.30 0.00 0.00 42.92 40.38 1abb s ASP 633 CO 0.15 0.25 1.15 -0.65 -0.17 0.00 0.00 175.17 175.90 1abb h PRO 634 N 4.31 0.00 -0.66 4.34 0.11 -1.92 -3.33 132.00 134.85 1abb h PRO 634 Ca -0.50 0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.66 1abb h PRO 634 Cb 1.21 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.27 1abb h PRO 634 CO 0.63 0.52 0.38 0.28 -0.21 0.00 0.00 178.00 179.60 1abb h VAL 635 N 0.00 0.99 0.00 3.15 2.07 -1.96 -1.40 116.25 119.11 1abb h VAL 635 Ca -0.08 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.20 1abb h VAL 635 Cb 1.57 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.57 1abb h VAL 635 CO 0.07 0.13 0.00 0.58 0.02 0.00 0.00 177.57 178.37 1abb h VAL 636 N 0.71 0.00 0.00 2.57 2.07 -1.90 -3.47 116.25 116.23 1abb h VAL 636 Ca 0.29 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.66 1abb h VAL 636 Cb 0.15 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 30.75 1abb h VAL 636 CO -0.16 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.04 1abb n GLY 637 N -0.59 3.40 0.17 2.17 0.00 -0.53 -0.70 105.19 109.13 1abb n GLY 637 Ca 0.00 0.25 0.07 0.00 0.00 0.00 0.00 46.02 46.34 1abb n GLY 637 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1abb n ASP 638 N 8.34 1.67 0.24 1.61 5.68 -1.26 -4.74 116.55 128.09 1abb n ASP 638 Ca 0.00 -2.68 0.15 0.00 -0.50 0.00 0.00 54.79 51.76 1abb n ASP 638 Cb 0.00 -0.33 0.54 0.00 -1.14 0.00 0.00 41.12 40.19 1abb n ASP 638 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 1abb h ARG 639 N 0.00 0.00 -2.22 0.11 3.08 -1.27 -3.44 114.38 110.64 1abb h ARG 639 Ca 0.00 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 1abb h ARG 639 Cb 1.07 0.00 -0.22 0.00 0.08 0.00 0.00 29.97 30.90 1abb h ARG 639 CO 0.00 0.00 -0.03 -1.17 -1.07 0.00 0.00 179.97 177.70 1abb s LEU 640 N -5.91 -0.51 -0.07 3.04 0.20 -1.26 -2.41 118.68 111.76 1abb s LEU 640 Ca 0.03 1.28 -0.11 0.00 0.69 0.00 0.00 54.13 56.03 1abb s LEU 640 Cb 0.08 2.10 0.02 0.00 -0.43 0.00 0.00 46.19 47.97 1abb s LEU 640 CO 0.55 -0.22 0.27 -0.13 -0.29 0.00 0.00 176.35 176.54 1abb s ARG 641 N 0.85 0.42 -0.41 1.98 0.52 -1.16 -4.60 118.95 116.55 1abb s ARG 641 Ca -0.04 0.17 0.04 0.00 -0.52 0.00 0.00 55.73 55.38 1abb s ARG 641 Cb -0.05 0.20 0.11 0.00 0.52 0.00 0.00 34.95 35.73 1abb s ARG 641 CO -0.07 -0.08 0.14 0.08 0.02 0.00 0.00 175.30 175.39 1abb s VAL 642 N -0.35 2.46 -0.11 3.52 1.01 -1.26 -0.19 120.40 125.48 1abb s VAL 642 Ca -0.05 -2.71 -0.04 0.00 0.00 0.00 0.00 61.98 59.19 1abb s VAL 642 Cb -0.03 -2.77 -0.03 0.00 0.00 0.00 0.00 36.38 33.55 1abb s VAL 642 CO 0.01 -0.68 0.02 -0.63 0.00 0.00 0.00 175.10 173.82 1abb s ILE 643 N 0.45 4.49 -0.60 2.22 1.01 0.02 -4.35 121.20 124.44 1abb s ILE 643 Ca 0.13 -0.17 -0.21 0.00 0.00 0.00 0.00 60.65 60.40 1abb s ILE 643 Cb -0.22 -2.93 0.07 0.00 0.01 0.00 0.00 42.46 39.40 1abb s ILE 643 CO -0.05 0.57 0.84 0.12 0.00 0.00 0.00 174.94 176.42 1abb s PHE 644 N -0.58 2.84 -0.31 3.97 5.36 -1.26 -1.03 117.98 126.96 1abb s PHE 644 Ca 0.10 -0.57 -0.28 0.00 -0.96 0.00 0.00 56.93 55.22 1abb s PHE 644 Cb -0.12 -4.06 -0.04 0.00 -0.34 0.00 0.00 43.02 38.46 1abb s PHE 644 CO 0.02 -1.41 2.09 -0.51 -1.46 0.00 0.00 175.22 173.95 1abb s LEU 645 N 3.46 3.44 0.23 6.12 1.43 0.21 -4.92 118.68 128.66 1abb s LEU 645 Ca 0.19 1.50 -0.30 0.00 -1.03 0.00 0.00 54.13 54.49 1abb s LEU 645 Cb -0.18 -3.32 -0.09 0.00 0.03 0.00 0.00 46.19 42.63 1abb s LEU 645 CO 0.11 -2.03 0.95 -0.70 0.23 0.00 0.00 176.35 174.91 1abb s GLU 646 N 6.43 4.84 -0.67 1.70 2.12 -1.26 -4.17 118.70 127.68 1abb s GLU 646 Ca 0.91 1.50 -0.01 0.00 0.36 0.00 0.00 54.97 57.74 1abb s GLU 646 Cb -0.26 -3.29 -0.01 0.00 0.26 0.00 0.00 34.13 30.83 1abb s GLU 646 CO 0.33 0.48 0.57 -1.71 -0.54 0.00 0.00 175.26 174.38 1abb n ASN 647 N 1.60 -2.59 -4.77 -1.70 5.15 -1.26 -4.90 115.26 106.78 1abb n ASN 647 Ca -0.02 -0.37 -0.41 0.00 -0.60 0.00 0.00 54.58 53.19 1abb n ASN 647 Cb 0.47 -3.19 -0.01 0.00 -0.53 0.00 0.00 39.78 36.53 1abb n ASN 647 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 1abb s TYR 648 N -3.21 2.72 0.10 1.20 5.04 -1.26 -4.91 117.35 117.03 1abb s TYR 648 Ca 0.06 1.17 -0.26 0.00 -2.44 0.00 0.00 57.07 55.59 1abb s TYR 648 Cb -0.01 -3.95 0.08 0.00 0.35 0.00 0.00 41.96 38.43 1abb s TYR 648 CO 0.42 -2.81 0.99 -0.98 -1.34 0.00 0.00 175.55 171.83 1abb s ARG 649 N -1.78 1.04 0.36 4.97 1.70 -1.26 -4.88 118.95 119.10 1abb s ARG 649 Ca 0.53 -0.55 0.15 0.00 -0.47 0.00 0.00 55.73 55.40 1abb s ARG 649 Cb -0.45 0.37 1.04 0.00 -0.57 0.00 0.00 34.95 35.34 1abb s ARG 649 CO 0.58 -0.47 1.73 0.28 -1.08 0.00 0.00 175.30 176.35 1abb h VAL 650 N 2.00 0.48 -0.00 4.99 2.07 -1.95 0.10 116.25 123.94 1abb h VAL 650 Ca -0.24 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.13 1abb h VAL 650 Cb 1.23 -0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 1abb h VAL 650 CO 0.27 0.08 -0.06 -1.54 0.02 0.00 0.00 177.57 176.33 1abb n SER 651 N -4.78 0.12 -0.05 0.57 3.41 -1.26 -1.88 113.62 109.75 1abb n SER 651 Ca 0.27 0.07 -0.22 0.00 -0.26 0.00 0.00 58.87 58.73 1abb n SER 651 Cb 0.87 -0.30 -0.13 0.00 -0.26 0.00 0.00 64.21 64.40 1abb n SER 651 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1abb n LEU 652 N -1.35 2.29 -0.05 1.04 0.00 0.29 -4.09 117.00 115.13 1abb n LEU 652 Ca 0.10 0.30 -0.09 0.00 0.00 0.00 0.00 56.01 56.33 1abb n LEU 652 Cb 0.30 -1.05 -0.02 0.00 0.00 0.00 0.00 43.42 42.65 1abb n LEU 652 CO 0.26 0.60 0.67 0.00 0.00 0.00 0.00 177.39 178.92 1abb h ALA 653 N -0.20 -0.20 0.00 1.96 0.00 -1.26 0.87 119.26 120.42 1abb h ALA 653 Ca -0.40 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1abb h ALA 653 Cb 1.71 0.57 0.00 0.00 0.00 0.00 0.00 17.79 20.06 1abb h ALA 653 CO -0.06 -0.71 0.00 -0.85 0.00 0.00 0.00 179.25 177.63 1abb n GLU 654 N -5.39 0.34 -0.12 0.00 0.28 -0.79 -1.95 120.64 113.01 1abb n GLU 654 Ca -0.01 0.06 -0.25 0.00 -0.16 0.00 0.00 57.16 56.80 1abb n GLU 654 Cb 0.31 -1.50 -0.11 0.00 1.43 0.00 0.00 31.44 31.57 1abb n GLU 654 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1abb n LYS 655 N -1.11 0.57 -0.03 3.44 5.02 0.16 -4.42 118.16 121.79 1abb n LYS 655 Ca 0.09 0.44 -0.15 0.00 -2.02 0.00 0.00 58.31 56.66 1abb n LYS 655 Cb 0.07 -1.63 -0.13 0.00 -0.02 0.00 0.00 35.03 33.32 1abb n LYS 655 CO 0.00 0.00 0.00 -0.24 -0.52 0.00 0.00 177.40 176.64 1abb h VAL 656 N -1.00 1.64 -0.49 -0.18 3.04 -0.96 -3.33 116.25 114.97 1abb h VAL 656 Ca -0.50 -2.17 0.10 0.00 -1.01 0.00 0.00 66.70 63.12 1abb h VAL 656 Cb 1.43 3.07 -0.09 0.00 -2.01 0.00 0.00 31.29 33.69 1abb h VAL 656 CO -0.30 0.58 -0.12 0.40 -1.01 0.00 0.00 177.57 177.12 1abb h ILE 657 N -0.69 0.52 -1.12 3.17 2.04 -1.62 0.45 117.51 120.26 1abb h ILE 657 Ca -0.03 -0.00 0.31 0.00 1.00 0.00 0.00 64.86 66.14 1abb h ILE 657 Cb 1.08 0.51 -0.10 0.00 -0.74 0.00 0.00 36.82 37.57 1abb h ILE 657 CO 0.04 0.00 0.73 -0.65 0.00 0.00 0.00 178.15 178.27 1abb h PRO 658 N 0.00 0.28 0.00 2.37 0.11 -1.77 -2.93 132.00 130.07 1abb h PRO 658 Ca 0.23 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.33 1abb h PRO 658 Cb 0.36 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.40 1abb h PRO 658 CO -0.50 0.19 0.00 0.00 -0.21 0.00 0.00 178.00 177.48 1abb h ALA 659 N 1.60 1.00 -2.41 -0.75 0.00 -1.02 -3.45 119.26 114.23 1abb h ALA 659 Ca 0.65 0.00 -0.51 0.00 0.00 0.00 0.00 54.91 55.04 1abb h ALA 659 Cb 1.82 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.58 1abb h ALA 659 CO -0.30 0.00 0.01 0.00 0.00 0.00 0.00 179.25 178.95 1abb s ALA 660 N -3.28 3.43 -0.06 0.00 0.00 -1.05 -4.59 121.76 116.22 1abb s ALA 660 Ca 0.06 -0.08 0.00 0.00 0.00 0.00 0.00 51.96 51.94 1abb s ALA 660 Cb 0.07 -2.63 -0.04 0.00 0.00 0.00 0.00 23.12 20.52 1abb s ALA 660 CO 0.63 0.41 -0.05 -0.25 0.00 0.00 0.00 175.76 176.50 1abb n ASP 661 N -0.19 3.45 -4.38 0.00 8.00 -0.68 -4.44 116.55 118.31 1abb n ASP 661 Ca 0.02 -0.03 -0.33 0.00 0.71 0.00 0.00 54.79 55.16 1abb n ASP 661 Cb 0.53 -0.09 -0.14 0.00 -0.02 0.00 0.00 41.12 41.40 1abb n ASP 661 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1abb s LEU 662 N -5.37 2.82 -0.59 0.64 0.20 -0.92 0.92 118.68 116.37 1abb s LEU 662 Ca -0.08 -0.31 -0.07 0.00 0.69 0.00 0.00 54.13 54.36 1abb s LEU 662 Cb 0.02 -1.65 0.15 0.00 -0.43 0.00 0.00 46.19 44.28 1abb s LEU 662 CO 0.13 0.14 0.45 -0.55 -0.29 0.00 0.00 176.35 176.23 1abb s SER 663 N 0.50 5.70 -0.91 3.68 0.15 -0.41 -0.83 113.70 121.58 1abb s SER 663 Ca -0.08 -2.43 -0.26 0.00 0.70 0.00 0.00 55.95 53.89 1abb s SER 663 Cb -0.15 -1.98 -0.18 0.00 -1.71 0.00 0.00 66.02 62.00 1abb s SER 663 CO 0.04 -0.54 2.27 -0.62 1.20 0.00 0.00 173.24 175.60 1abb n GLU 664 N 4.17 0.35 -0.84 5.44 -0.58 -0.75 -3.33 120.64 125.10 1abb n GLU 664 Ca 0.03 -1.18 -0.08 0.00 -0.42 0.00 0.00 57.16 55.50 1abb n GLU 664 Cb 0.41 -3.73 -0.11 0.00 -0.57 0.00 0.00 31.44 27.44 1abb n GLU 664 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1abb n GLN 665 N 8.43 1.67 -1.52 3.49 3.00 -0.80 -4.77 117.38 126.88 1abb n GLN 665 Ca 0.44 -0.71 -0.30 0.00 -0.01 0.00 0.00 57.00 56.43 1abb n GLN 665 Cb 0.44 -1.66 -0.01 0.00 0.00 0.00 0.00 30.24 29.01 1abb n GLN 665 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.06 177.50 1abb n ILE 666 N 2.09 3.35 -2.15 5.09 -5.35 -1.26 -3.58 119.36 117.55 1abb n ILE 666 Ca 0.28 -3.16 -0.40 0.00 -0.27 0.00 0.00 62.75 59.20 1abb n ILE 666 Cb 0.76 -1.44 -0.02 0.00 -1.74 0.00 0.00 39.64 37.20 1abb n ILE 666 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 1abb s SER 667 N -0.19 6.67 -0.03 7.28 0.01 -1.26 -4.69 113.70 121.50 1abb s SER 667 Ca 0.54 2.60 -0.40 0.00 1.31 0.00 0.00 55.95 60.01 1abb s SER 667 Cb 0.39 -2.64 -0.19 0.00 0.21 0.00 0.00 66.02 63.79 1abb s SER 667 CO -0.23 -0.59 1.23 0.41 0.41 0.00 0.00 173.24 174.47 1abb n THR 668 N 0.58 0.01 -1.94 1.44 -1.04 -1.24 -4.54 114.28 107.55 1abb n THR 668 Ca 0.01 -0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.68 1abb n THR 668 Cb 0.43 -0.35 0.03 0.00 -1.82 0.00 0.00 70.33 68.62 1abb n THR 668 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1abb s ALA 669 N 0.57 2.53 0.00 2.41 0.00 -1.26 -3.37 121.76 122.63 1abb s ALA 669 Ca 0.90 0.73 0.00 0.00 0.00 0.00 0.00 51.96 53.59 1abb s ALA 669 Cb -1.18 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 18.58 1abb s ALA 669 CO 0.56 -1.13 0.00 0.41 0.00 0.00 0.00 175.76 175.61 1abb n GLY 670 N -0.09 2.44 0.10 0.00 0.00 -1.26 -4.69 105.19 101.70 1abb n GLY 670 Ca 0.11 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.95 1abb n GLY 670 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1abb h THR 671 N 0.00 1.59 -4.11 2.61 1.35 -1.92 -3.47 112.91 108.97 1abb h THR 671 Ca 0.00 -2.44 -0.47 0.00 -0.55 0.00 0.00 66.41 62.95 1abb h THR 671 Cb 0.00 3.22 0.02 0.00 -1.73 0.00 0.00 68.15 69.66 1abb h THR 671 CO 0.00 0.68 0.37 -1.61 -0.25 0.00 0.00 175.52 174.71 1abb s GLU 672 N -2.43 3.82 -0.20 4.72 0.41 -1.26 -4.87 118.70 118.88 1abb s GLU 672 Ca -0.15 1.23 -0.14 0.00 -0.41 0.00 0.00 54.97 55.50 1abb s GLU 672 Cb -0.00 -2.11 -0.19 0.00 -1.78 0.00 0.00 34.13 30.05 1abb s GLU 672 CO 0.79 -0.40 0.10 0.00 -0.49 0.00 0.00 175.26 175.27 1abb n ALA 673 N -1.17 0.95 -2.22 5.21 0.00 -1.26 -3.90 120.51 118.12 1abb n ALA 673 Ca 0.08 -0.69 0.00 0.00 0.00 0.00 0.00 53.44 52.83 1abb n ALA 673 Cb 0.53 -0.42 0.00 0.00 0.00 0.00 0.00 19.45 19.56 1abb n ALA 673 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1abb n SER 674 N -4.03 0.86 0.00 0.00 2.88 -1.26 -4.14 113.62 107.93 1abb n SER 674 Ca -0.38 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.16 1abb n SER 674 Cb 0.85 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.31 1abb n SER 674 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1abb n GLY 675 N 0.00 -1.56 0.26 0.46 0.00 -1.26 -2.17 105.19 100.91 1abb n GLY 675 Ca 0.00 0.69 0.08 0.00 0.00 0.00 0.00 46.02 46.79 1abb n GLY 675 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1abb h THR 676 N 0.00 1.01 -0.00 2.61 2.02 -1.96 -1.09 112.91 115.50 1abb h THR 676 Ca 0.00 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.12 1abb h THR 676 Cb 0.00 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.44 1abb h THR 676 CO 0.00 0.02 -0.11 0.61 0.37 0.00 0.00 175.52 176.41 1abb n GLY 677 N -1.49 -1.37 0.23 2.16 0.00 -1.26 -2.63 105.19 100.83 1abb n GLY 677 Ca -0.03 -0.17 -0.10 0.00 0.00 0.00 0.00 46.02 45.72 1abb n GLY 677 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1abb h ASN 678 N 0.06 0.76 0.78 1.61 4.21 -1.60 -1.90 115.58 119.50 1abb h ASN 678 Ca 0.00 -0.31 0.00 0.00 1.21 0.00 0.00 56.30 57.20 1abb h ASN 678 Cb 0.46 -0.20 0.00 0.00 -1.12 0.00 0.00 38.32 37.46 1abb h ASN 678 CO 0.00 0.88 0.00 0.23 -1.29 0.00 0.00 177.43 177.25 1abb n MET 679 N -4.40 0.17 0.06 0.81 2.81 -1.08 -2.06 117.12 113.43 1abb n MET 679 Ca -0.00 0.36 -0.13 0.00 -1.81 0.00 0.00 57.70 56.12 1abb n MET 679 Cb 0.30 -1.80 -0.14 0.00 -0.71 0.00 0.00 33.22 30.88 1abb n MET 679 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 1abb h LYS 680 N 0.00 0.17 -0.06 0.03 1.57 -1.28 -2.64 116.57 114.36 1abb h LYS 680 Ca 0.00 -0.29 -0.10 0.00 -1.87 0.00 0.00 60.65 58.39 1abb h LYS 680 Cb 0.39 0.11 0.01 0.00 0.08 0.00 0.00 32.23 32.81 1abb h LYS 680 CO 0.00 1.05 -0.36 0.74 -0.57 0.00 0.00 179.45 180.30 1abb h PHE 681 N 0.05 0.48 0.25 -1.35 0.04 -1.15 -3.14 116.94 112.10 1abb h PHE 681 Ca -0.17 -0.22 0.01 0.00 2.80 0.00 0.00 57.97 60.39 1abb h PHE 681 Cb 1.95 -0.07 -0.03 0.00 2.20 0.00 0.00 35.95 40.00 1abb h PHE 681 CO 0.04 0.97 -0.31 1.98 -0.60 0.00 0.00 178.31 180.40 1abb h MET 682 N -0.16 -0.59 0.00 1.51 4.05 -1.44 0.07 114.93 118.37 1abb h MET 682 Ca -0.03 0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.43 1abb h MET 682 Cb 1.03 0.13 0.00 0.00 -0.80 0.00 0.00 31.60 31.96 1abb h MET 682 CO 0.07 -0.39 0.00 -0.11 0.23 0.00 0.00 176.91 176.71 1abb n LEU 683 N -5.42 0.33 -1.15 3.39 0.00 -1.00 -1.80 117.00 111.36 1abb n LEU 683 Ca -0.08 0.63 -0.05 0.00 0.00 0.00 0.00 56.01 56.51 1abb n LEU 683 Cb 0.33 -0.64 0.18 0.00 0.00 0.00 0.00 43.42 43.30 1abb n LEU 683 CO 0.27 -0.64 0.60 0.59 0.00 0.00 0.00 177.39 178.20 1abb n ASN 684 N -1.91 2.62 -3.37 1.96 3.02 -0.01 -4.94 115.26 112.64 1abb n ASN 684 Ca 0.00 -3.82 -0.18 0.00 -0.03 0.00 0.00 54.58 50.55 1abb n ASN 684 Cb 0.08 -0.60 0.08 0.00 -0.61 0.00 0.00 39.78 38.73 1abb n ASN 684 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1abb n GLY 685 N -1.09 -0.38 3.63 7.41 0.00 -0.74 -4.75 105.19 109.27 1abb n GLY 685 Ca 0.32 0.12 -0.24 0.00 0.00 0.00 0.00 46.02 46.23 1abb n GLY 685 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1abb s ALA 686 N -3.33 3.17 -0.13 4.61 0.00 -1.16 -4.80 121.76 120.12 1abb s ALA 686 Ca 0.19 -1.79 -0.04 0.00 0.00 0.00 0.00 51.96 50.32 1abb s ALA 686 Cb -0.08 -0.60 -0.04 0.00 0.00 0.00 0.00 23.12 22.40 1abb s ALA 686 CO 0.70 0.18 0.03 -0.51 0.00 0.00 0.00 175.76 176.16 1abb s LEU 687 N -3.69 3.68 -0.09 0.00 1.43 0.26 -4.63 118.68 115.64 1abb s LEU 687 Ca 0.33 0.12 -0.17 0.00 -1.03 0.00 0.00 54.13 53.38 1abb s LEU 687 Cb -0.04 -1.88 -0.05 0.00 0.03 0.00 0.00 46.19 44.25 1abb s LEU 687 CO 0.20 0.30 0.46 -0.89 0.23 0.00 0.00 176.35 176.64 1abb s THR 688 N -0.38 5.14 0.02 5.49 2.01 -1.26 -1.28 115.64 125.37 1abb s THR 688 Ca 0.08 0.92 0.03 0.00 0.31 0.00 0.00 61.69 63.03 1abb s THR 688 Cb -0.12 -3.79 -0.04 0.00 0.01 0.00 0.00 72.50 68.56 1abb s THR 688 CO 0.02 0.39 -0.01 -0.51 -0.69 0.00 0.00 174.62 173.82 1abb s ILE 689 N 0.18 4.04 -0.22 1.82 2.07 -1.21 -2.08 121.20 125.79 1abb s ILE 689 Ca 0.25 -0.72 -0.33 0.00 -1.41 0.00 0.00 60.65 58.44 1abb s ILE 689 Cb -0.16 -2.82 0.15 0.00 0.13 0.00 0.00 42.46 39.77 1abb s ILE 689 CO 0.11 0.32 1.24 -0.83 -1.91 0.00 0.00 174.94 173.87 1abb s GLY 690 N -1.71 -0.18 0.84 1.50 0.00 -1.20 -1.90 107.32 104.68 1abb s GLY 690 Ca 0.21 2.00 -0.09 0.00 0.00 0.00 0.00 44.72 46.83 1abb s GLY 690 CO 0.12 0.75 1.16 -0.51 0.00 0.00 0.00 173.10 174.61 1abb s THR 691 N -1.88 2.08 -0.63 0.90 -4.23 -1.23 -2.41 115.64 108.24 1abb s THR 691 Ca 0.08 -0.25 -0.22 0.00 -1.18 0.00 0.00 61.69 60.12 1abb s THR 691 Cb -0.01 -2.83 0.07 0.00 1.34 0.00 0.00 72.50 71.07 1abb s THR 691 CO -0.05 0.00 0.93 -0.32 -0.54 0.00 0.00 174.62 174.64 1abb s MET 692 N -5.53 3.15 0.14 3.99 1.75 -1.25 -4.84 119.30 116.70 1abb s MET 692 Ca 0.69 -0.76 -0.25 0.00 -1.25 0.00 0.00 55.69 54.12 1abb s MET 692 Cb -0.05 -4.19 0.07 0.00 2.84 0.00 0.00 34.83 33.50 1abb s MET 692 CO 0.49 -1.71 1.01 0.34 -0.65 0.00 0.00 175.02 174.50 1abb s ASP 693 N 3.47 -0.13 0.73 1.11 2.15 -1.26 -4.62 116.67 118.13 1abb s ASP 693 Ca 0.23 -0.42 0.00 0.00 0.43 0.00 0.00 52.55 52.79 1abb s ASP 693 Cb -0.17 0.45 0.00 0.00 -0.30 0.00 0.00 42.92 42.91 1abb s ASP 693 CO 0.12 -0.85 0.00 0.61 -0.17 0.00 0.00 175.17 174.88 1abb n GLY 694 N -0.51 2.95 0.77 2.66 0.00 -1.25 -1.05 105.19 108.76 1abb n GLY 694 Ca -0.06 0.19 0.12 0.00 0.00 0.00 0.00 46.02 46.27 1abb n GLY 694 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1abb n ALA 695 N 10.46 2.50 -0.09 4.61 0.00 -0.92 -3.79 120.51 133.28 1abb n ALA 695 Ca 0.00 -0.65 -0.09 0.00 0.00 0.00 0.00 53.44 52.70 1abb n ALA 695 Cb 0.00 -0.99 -0.01 0.00 0.00 0.00 0.00 19.45 18.45 1abb n ALA 695 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1abb h ASN 696 N 3.38 0.36 0.00 0.00 2.35 -1.38 -2.70 115.58 117.58 1abb h ASN 696 Ca 0.00 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1abb h ASN 696 Cb 0.73 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.01 1abb h ASN 696 CO 0.00 0.26 0.00 0.52 -1.65 0.00 0.00 177.43 176.56 1abb n VAL 697 N -4.87 0.00 0.00 2.81 0.31 -1.23 0.76 118.33 116.11 1abb n VAL 697 Ca -0.01 0.81 0.00 0.00 -0.01 0.00 0.00 64.34 65.14 1abb n VAL 697 Cb 0.03 -1.56 0.00 0.00 -0.91 0.00 0.00 33.84 31.40 1abb n VAL 697 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1abb n GLU 698 N -0.48 0.00 -0.07 5.55 1.02 -1.25 -0.23 120.64 125.19 1abb n GLU 698 Ca 0.00 0.31 -0.07 0.00 -0.02 0.00 0.00 57.16 57.38 1abb n GLU 698 Cb 0.00 -1.61 -0.04 0.00 -0.02 0.00 0.00 31.44 29.76 1abb n GLU 698 CO 0.00 0.00 0.00 0.52 1.18 0.00 0.00 177.13 178.83 1abb h MET 699 N 0.00 0.00 0.14 3.49 2.86 -1.03 -3.08 114.93 117.30 1abb h MET 699 Ca 0.00 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.65 1abb h MET 699 Cb 0.22 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.86 1abb h MET 699 CO 0.00 0.33 -0.24 0.00 1.06 0.00 0.00 176.91 178.06 1abb h ALA 700 N -0.74 -0.42 -0.90 6.32 0.00 0.36 0.78 119.26 124.67 1abb h ALA 700 Ca -0.05 -0.04 0.25 0.00 0.00 0.00 0.00 54.91 55.07 1abb h ALA 700 Cb 0.51 0.37 -0.15 0.00 0.00 0.00 0.00 17.79 18.52 1abb h ALA 700 CO -0.03 -0.78 0.22 1.49 0.00 0.00 0.00 179.25 180.16 1abb h GLU 701 N -0.45 0.16 -0.09 0.00 4.81 -1.44 0.53 114.58 118.09 1abb h GLU 701 Ca 0.02 -0.01 -0.18 0.00 -0.13 0.00 0.00 59.36 59.06 1abb h GLU 701 Cb 0.46 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.80 1abb h GLU 701 CO -0.12 0.10 -0.71 0.93 -0.73 0.00 0.00 179.01 178.48 1abb h GLU 702 N 0.16 0.43 0.00 1.92 4.39 0.60 -3.27 114.58 118.81 1abb h GLU 702 Ca 0.58 -0.34 -0.01 0.00 0.34 0.00 0.00 59.36 59.93 1abb h GLU 702 Cb 1.21 0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 29.93 1abb h GLU 702 CO -0.71 0.97 -0.39 0.00 -1.16 0.00 0.00 179.01 177.73 1abb h ALA 703 N 0.93 0.81 -0.21 3.43 0.00 0.70 -3.47 119.26 121.46 1abb h ALA 703 Ca -0.03 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1abb h ALA 703 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1abb h ALA 703 CO 0.12 0.08 0.00 0.41 0.00 0.00 0.00 179.25 179.86 1abb n GLY 704 N 1.14 -0.63 0.27 0.00 0.00 0.16 -4.55 105.19 101.59 1abb n GLY 704 Ca 0.02 -1.12 0.06 0.00 0.00 0.00 0.00 46.02 44.98 1abb n GLY 704 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1abb h GLU 705 N 0.00 0.25 0.00 1.61 4.22 -1.86 -1.71 114.58 117.09 1abb h GLU 705 Ca 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.42 1abb h GLU 705 Cb 0.00 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.19 1abb h GLU 705 CO 0.00 0.17 0.00 0.39 -2.18 0.00 0.00 179.01 177.39 1abb n GLU 706 N -5.17 0.08 0.00 1.92 4.71 -1.26 0.26 120.64 121.18 1abb n GLU 706 Ca 0.14 0.56 0.14 0.00 -0.01 0.00 0.00 57.16 57.99 1abb n GLU 706 Cb 0.47 -1.75 0.53 0.00 -1.01 0.00 0.00 31.44 29.68 1abb n GLU 706 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1abb n ASN 707 N -1.92 0.56 -4.40 1.62 3.02 -0.64 -4.94 115.26 108.56 1abb n ASN 707 Ca -0.00 -0.54 -0.32 0.00 -0.03 0.00 0.00 54.58 53.68 1abb n ASN 707 Cb 0.04 -0.03 -0.14 0.00 -0.61 0.00 0.00 39.78 39.03 1abb n ASN 707 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1abb s PHE 708 N -2.56 2.57 -0.78 3.10 0.08 0.14 -4.90 117.98 115.62 1abb s PHE 708 Ca 0.25 -0.34 -0.05 0.00 0.12 0.00 0.00 56.93 56.92 1abb s PHE 708 Cb 0.20 -1.60 0.05 0.00 -0.57 0.00 0.00 43.02 41.09 1abb s PHE 708 CO 0.51 0.05 2.71 1.19 -0.10 0.00 0.00 175.22 179.57 1abb n PHE 709 N 2.50 1.87 -2.09 0.36 3.72 -0.89 -4.94 117.46 118.00 1abb n PHE 709 Ca -0.17 -2.28 -0.41 0.00 -0.05 0.00 0.00 57.45 54.54 1abb n PHE 709 Cb 0.52 -1.61 -0.02 0.00 -0.94 0.00 0.00 39.48 37.42 1abb n PHE 709 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1abb s ILE 710 N -1.42 2.81 0.22 4.37 -1.09 -1.26 -3.20 121.20 121.62 1abb s ILE 710 Ca 0.58 0.71 -0.00 0.00 -2.23 0.00 0.00 60.65 59.71 1abb s ILE 710 Cb 0.30 -3.45 0.00 0.00 -1.58 0.00 0.00 42.46 37.73 1abb s ILE 710 CO -0.15 0.12 0.28 2.22 -1.23 0.00 0.00 174.94 176.19 1abb n PHE 711 N 2.04 -0.98 -0.58 3.97 -1.74 -1.01 -4.96 117.46 114.21 1abb n PHE 711 Ca 0.05 -1.50 0.07 0.00 -0.56 0.00 0.00 57.45 55.51 1abb n PHE 711 Cb 0.41 0.32 -0.03 0.00 1.52 0.00 0.00 39.48 41.70 1abb n PHE 711 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1abb n GLY 712 N -0.36 -2.21 3.44 4.97 0.00 -1.26 -3.77 105.19 106.00 1abb n GLY 712 Ca 0.01 -1.34 -0.38 0.00 0.00 0.00 0.00 46.02 44.31 1abb n GLY 712 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1abb n MET 713 N -3.20 0.45 -3.21 1.61 2.81 -1.26 -4.77 117.12 109.56 1abb n MET 713 Ca -0.02 0.18 -0.21 0.00 -1.81 0.00 0.00 57.70 55.84 1abb n MET 713 Cb 0.27 -1.62 0.04 0.00 -0.71 0.00 0.00 33.22 31.20 1abb n MET 713 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1abb n ARG 714 N 0.14 0.65 -0.05 0.03 1.74 -1.26 -4.52 116.66 113.39 1abb n ARG 714 Ca 0.11 -3.13 -0.08 0.00 -0.77 0.00 0.00 57.85 53.99 1abb n ARG 714 Cb 0.47 -0.02 -0.02 0.00 -1.02 0.00 0.00 32.46 31.87 1abb n ARG 714 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1abb h VAL 715 N 0.30 0.66 -0.85 1.55 2.07 -1.83 -1.04 116.25 117.10 1abb h VAL 715 Ca -0.29 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.39 1abb h VAL 715 Cb 1.21 0.66 -0.06 0.00 -1.52 0.00 0.00 31.29 31.58 1abb h VAL 715 CO 0.43 0.00 0.55 -0.08 0.02 0.00 0.00 177.57 178.49 1abb h GLU 716 N -0.08 0.54 0.00 1.57 4.22 -1.95 0.11 114.58 118.99 1abb h GLU 716 Ca 0.12 -0.03 -0.17 0.00 0.08 0.00 0.00 59.36 59.36 1abb h GLU 716 Cb 0.26 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 1abb h GLU 716 CO -0.28 0.36 -0.80 -0.44 -2.18 0.00 0.00 179.01 175.67 1abb h ASP 717 N 0.55 0.01 0.78 1.04 5.19 -1.61 -0.84 116.42 121.54 1abb h ASP 717 Ca 0.43 -0.01 -0.04 0.00 -0.62 0.00 0.00 57.03 56.79 1abb h ASP 717 Cb 0.84 -0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.35 1abb h ASP 717 CO -0.17 0.80 -0.37 0.58 -3.12 0.00 0.00 179.24 176.96 1abb h VAL 718 N 0.00 0.15 -0.91 -1.35 2.07 0.17 -2.64 116.25 113.74 1abb h VAL 718 Ca -0.01 -0.14 0.17 0.00 0.82 0.00 0.00 66.70 67.55 1abb h VAL 718 Cb 1.41 0.18 -0.10 0.00 -1.52 0.00 0.00 31.29 31.26 1abb h VAL 718 CO 0.10 0.01 0.49 0.44 0.02 0.00 0.00 177.57 178.64 1abb h ASP 719 N -1.16 0.59 -0.58 0.57 3.32 -0.97 0.29 116.42 118.49 1abb h ASP 719 Ca -0.11 0.10 -0.07 0.00 0.02 0.00 0.00 57.03 56.97 1abb h ASP 719 Cb 0.81 0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.35 1abb h ASP 719 CO 0.17 0.20 0.07 0.03 -1.72 0.00 0.00 179.24 178.00 1abb h ARG 720 N 0.64 0.97 -0.51 3.56 2.47 -1.20 0.23 114.38 120.54 1abb h ARG 720 Ca 0.52 -0.27 -0.04 0.00 -1.26 0.00 0.00 59.98 58.92 1abb h ARG 720 Cb 0.81 -0.11 -0.02 0.00 -1.65 0.00 0.00 29.97 29.00 1abb h ARG 720 CO -0.40 0.94 0.14 1.25 0.56 0.00 0.00 179.97 182.46 1abb h LEU 721 N 0.87 0.70 0.09 3.04 5.85 -0.08 0.13 115.31 125.91 1abb h LEU 721 Ca 0.17 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 1abb h LEU 721 Cb 0.45 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.30 1abb h LEU 721 CO 0.02 0.68 -0.04 0.44 -0.34 0.00 0.00 178.44 179.20 1abb h ASP 722 N 0.74 -0.10 -0.34 1.25 3.32 -1.10 1.21 116.42 121.40 1abb h ASP 722 Ca 0.17 -0.29 0.07 0.00 0.02 0.00 0.00 57.03 56.99 1abb h ASP 722 Cb 0.25 0.03 -0.07 0.00 0.22 0.00 0.00 39.33 39.76 1abb h ASP 722 CO -0.01 0.25 -0.10 -0.61 -1.72 0.00 0.00 179.24 177.05 1abb h GLN 723 N -0.45 -0.02 -0.02 3.56 4.15 -0.32 0.28 115.11 122.29 1abb h GLN 723 Ca -0.01 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1abb h GLN 723 Cb 0.38 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.08 1abb h GLN 723 CO 0.02 -0.01 -0.02 2.89 -1.93 0.00 0.00 178.83 179.77 1abb n ARG 724 N -5.29 1.69 -0.54 1.69 -4.01 0.41 -5.02 116.66 105.59 1abb n ARG 724 Ca 0.01 -1.05 0.00 0.00 -1.04 0.00 0.00 57.85 55.76 1abb n ARG 724 Cb 0.20 -1.48 0.00 0.00 -3.04 0.00 0.00 32.46 28.14 1abb n ARG 724 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1abb n GLY 725 N 1.21 -3.65 3.65 2.89 0.00 0.41 -4.96 105.19 104.74 1abb n GLY 725 Ca 0.18 -0.77 -0.43 0.00 0.00 0.00 0.00 46.02 45.01 1abb n GLY 725 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1abb s TYR 726 N -0.01 2.31 -0.84 1.61 5.04 -0.81 -4.89 117.35 119.77 1abb s TYR 726 Ca 0.00 0.55 0.01 0.00 -2.44 0.00 0.00 57.07 55.19 1abb s TYR 726 Cb 0.00 -3.80 0.21 0.00 0.35 0.00 0.00 41.96 38.72 1abb s TYR 726 CO 0.00 -2.89 0.74 -1.71 -1.34 0.00 0.00 175.55 170.35 1abb n ASN 727 N 7.27 3.96 0.02 4.32 4.05 -1.26 -4.99 115.26 128.63 1abb n ASN 727 Ca 0.16 -3.19 0.12 0.00 0.45 0.00 0.00 54.58 52.12 1abb n ASN 727 Cb 0.44 -0.96 0.18 0.00 1.23 0.00 0.00 39.78 40.67 1abb n ASN 727 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1abb n ALA 728 N 2.06 0.41 0.11 5.20 0.00 -1.26 -1.27 120.51 125.76 1abb n ALA 728 Ca 0.22 0.14 -0.01 0.00 0.00 0.00 0.00 53.44 53.79 1abb n ALA 728 Cb 0.37 -0.25 0.24 0.00 0.00 0.00 0.00 19.45 19.81 1abb n ALA 728 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1abb h GLN 729 N 0.00 0.19 -0.12 0.00 5.75 -1.94 -2.61 115.11 116.38 1abb h GLN 729 Ca 0.20 -0.09 -0.00 0.00 -0.15 0.00 0.00 58.65 58.61 1abb h GLN 729 Cb 1.88 -0.00 -0.01 0.00 1.07 0.00 0.00 27.48 30.42 1abb h GLN 729 CO -0.00 0.58 0.06 1.05 -2.65 0.00 0.00 178.83 177.87 1abb h GLU 730 N 0.16 0.16 -0.12 1.69 4.11 -1.60 0.66 114.58 119.65 1abb h GLU 730 Ca 0.01 -0.02 0.03 0.00 0.07 0.00 0.00 59.36 59.45 1abb h GLU 730 Cb 0.81 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.01 1abb h GLU 730 CO 0.06 0.22 -0.04 1.88 0.07 0.00 0.00 179.01 181.20 1abb h TYR 731 N 0.07 -0.08 -0.27 2.06 0.05 -1.77 0.26 116.97 117.30 1abb h TYR 731 Ca 0.04 0.01 0.08 0.00 0.05 0.00 0.00 58.73 58.91 1abb h TYR 731 Cb 0.10 0.05 -0.01 0.00 1.01 0.00 0.00 36.73 37.89 1abb h TYR 731 CO -0.03 -0.06 0.22 -0.92 -1.05 0.00 0.00 178.16 176.31 1abb h TYR 732 N -0.01 0.00 0.00 4.88 3.20 -0.96 0.18 116.97 124.25 1abb h TYR 732 Ca 0.06 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.93 1abb h TYR 732 Cb 0.10 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.37 1abb h TYR 732 CO -0.17 0.00 -0.95 -0.25 -1.64 0.00 0.00 178.16 175.16 1abb n ASP 733 N -4.19 0.64 -0.05 -2.11 8.00 0.23 -4.22 116.55 114.84 1abb n ASP 733 Ca 0.03 -0.30 -0.03 0.00 0.71 0.00 0.00 54.79 55.20 1abb n ASP 733 Cb 0.37 0.74 -0.02 0.00 -0.02 0.00 0.00 41.12 42.18 1abb n ASP 733 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1abb h ARG 734 N 0.00 0.00 -6.41 -1.24 3.08 0.24 -3.46 114.38 106.59 1abb h ARG 734 Ca 0.00 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.51 1abb h ARG 734 Cb 0.67 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.65 1abb h ARG 734 CO 0.00 0.17 1.07 0.42 -1.07 0.00 0.00 179.97 180.57 1abb s ILE 735 N -1.70 3.79 0.41 2.04 1.01 -0.56 -4.93 121.20 121.26 1abb s ILE 735 Ca -0.04 0.62 0.15 0.00 0.00 0.00 0.00 60.65 61.38 1abb s ILE 735 Cb -0.00 -4.63 0.16 0.00 0.01 0.00 0.00 42.46 38.00 1abb s ILE 735 CO 0.13 -1.41 1.93 -0.65 0.00 0.00 0.00 174.94 174.94 1abb h PRO 736 N 10.62 0.00 0.77 2.79 0.11 -1.89 -2.37 132.00 142.02 1abb h PRO 736 Ca -0.27 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.81 1abb h PRO 736 Cb 1.07 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.19 1abb h PRO 736 CO 1.21 0.26 -0.37 0.93 -0.21 0.00 0.00 178.00 179.82 1abb h GLU 737 N 0.00 -0.99 -0.77 1.05 3.07 -1.97 -2.85 114.58 112.12 1abb h GLU 737 Ca -0.00 0.07 0.11 0.00 -0.50 0.00 0.00 59.36 59.04 1abb h GLU 737 Cb 0.47 0.23 -0.13 0.00 -0.84 0.00 0.00 28.75 28.48 1abb h GLU 737 CO 0.03 -0.66 -0.43 1.25 -1.40 0.00 0.00 179.01 177.81 1abb h LEU 738 N -1.28 -1.51 -0.83 1.33 5.85 -1.90 0.16 115.31 117.14 1abb h LEU 738 Ca -0.11 0.27 0.19 0.00 0.84 0.00 0.00 57.88 59.08 1abb h LEU 738 Cb 0.79 0.72 -0.15 0.00 0.37 0.00 0.00 40.66 42.40 1abb h LEU 738 CO 0.17 -0.30 -0.03 -0.09 -0.34 0.00 0.00 178.44 177.85 1abb h ARG 739 N -0.12 0.06 -0.06 1.25 2.43 -1.47 -0.89 114.38 115.59 1abb h ARG 739 Ca 0.24 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.40 1abb h ARG 739 Cb 0.55 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.09 1abb h ARG 739 CO -0.81 0.04 0.01 0.37 -1.51 0.00 0.00 179.97 178.07 1abb h GLN 740 N 0.06 0.09 -0.23 0.20 4.15 -0.47 -2.59 115.11 116.32 1abb h GLN 740 Ca 0.45 -0.02 -0.09 0.00 0.77 0.00 0.00 58.65 59.76 1abb h GLN 740 Cb 0.81 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.48 1abb h GLN 740 CO -0.76 0.31 -0.24 -0.84 -1.93 0.00 0.00 178.83 175.36 1abb h ILE 741 N -0.14 1.26 -0.86 2.39 3.07 -0.06 -0.43 117.51 122.73 1abb h ILE 741 Ca 0.02 -1.22 -0.03 0.00 1.55 0.00 0.00 64.86 65.18 1abb h ILE 741 Cb 0.26 1.35 -0.04 0.00 -0.27 0.00 0.00 36.82 38.12 1abb h ILE 741 CO 0.00 0.38 0.43 0.40 -1.05 0.00 0.00 178.15 178.31 1abb h ILE 742 N 0.38 1.26 0.00 0.16 1.08 -1.21 -1.58 117.51 117.60 1abb h ILE 742 Ca 0.06 -0.70 0.00 0.00 -0.39 0.00 0.00 64.86 63.83 1abb h ILE 742 Cb 0.63 0.14 0.00 0.00 -3.07 0.00 0.00 36.82 34.53 1abb h ILE 742 CO 0.05 0.31 0.00 -0.33 -0.69 0.00 0.00 178.15 177.48 1abb h GLU 743 N 1.22 0.00 -0.01 2.37 4.39 -0.73 -2.48 114.58 119.34 1abb h GLU 743 Ca 0.30 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.81 1abb h GLU 743 Cb 0.09 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.76 1abb h GLU 743 CO -0.04 0.00 -0.74 1.96 -1.16 0.00 0.00 179.01 179.03 1abb h GLN 744 N 0.00 0.52 0.15 2.33 4.20 -0.27 -0.91 115.11 121.13 1abb h GLN 744 Ca 0.00 -0.54 0.02 0.00 0.06 0.00 0.00 58.65 58.18 1abb h GLN 744 Cb 0.77 0.15 -0.04 0.00 0.30 0.00 0.00 27.48 28.67 1abb h GLN 744 CO 0.00 1.18 -0.32 -0.07 -0.67 0.00 0.00 178.83 178.95 1abb h LEU 745 N 0.08 -0.91 0.33 1.46 3.38 -1.13 0.88 115.31 119.40 1abb h LEU 745 Ca -0.09 0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1abb h LEU 745 Cb 1.43 0.34 -0.01 0.00 0.09 0.00 0.00 40.66 42.51 1abb h LEU 745 CO 0.15 -0.41 -0.26 0.28 0.09 0.00 0.00 178.44 178.28 1abb h SER 746 N -0.56 -0.68 0.00 -0.43 0.02 -1.49 -1.96 113.55 108.45 1abb h SER 746 Ca 0.02 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 1abb h SER 746 Cb 0.58 0.22 0.00 0.00 0.14 0.00 0.00 62.40 63.34 1abb h SER 746 CO -0.17 -0.39 0.00 -1.54 -1.14 0.00 0.00 176.83 173.59 1abb n SER 747 N -5.39 0.00 -1.12 3.07 3.41 -0.35 -4.50 113.62 108.75 1abb n SER 747 Ca -0.10 -0.70 -0.11 0.00 -0.26 0.00 0.00 58.87 57.71 1abb n SER 747 Cb 0.29 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.23 1abb n SER 747 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1abb n GLY 748 N -0.01 0.20 0.33 5.00 0.00 -0.74 -4.79 105.19 105.18 1abb n GLY 748 Ca 0.07 -0.46 0.12 0.00 0.00 0.00 0.00 46.02 45.75 1abb n GLY 748 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1abb h PHE 749 N 0.00 0.88 -0.00 1.61 3.57 -1.04 -0.57 116.94 121.39 1abb h PHE 749 Ca -0.24 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.29 1abb h PHE 749 Cb 1.08 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 39.58 1abb h PHE 749 CO 0.28 0.12 -0.14 1.19 -2.23 0.00 0.00 178.31 177.53 1abb n PHE 750 N -4.88 0.00 -2.99 0.41 3.72 -1.25 -4.25 117.46 108.21 1abb n PHE 750 Ca 0.22 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.48 1abb n PHE 750 Cb 0.59 -0.20 0.01 0.00 -0.94 0.00 0.00 39.48 38.93 1abb n PHE 750 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1abb n SER 751 N -1.00 0.31 -0.30 4.37 3.41 -0.28 -4.75 113.62 115.37 1abb n SER 751 Ca 0.13 -3.04 0.12 0.00 -0.26 0.00 0.00 58.87 55.83 1abb n SER 751 Cb 0.29 -0.12 0.27 0.00 -0.26 0.00 0.00 64.21 64.40 1abb n SER 751 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1abb h PRO 752 N 2.95 0.13 -0.61 4.33 0.13 -1.56 -0.13 132.00 137.23 1abb h PRO 752 Ca 0.01 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 65.08 1abb h PRO 752 Cb 1.05 -0.03 -0.03 0.00 0.13 0.00 0.00 31.00 32.12 1abb h PRO 752 CO 0.41 0.09 0.17 0.87 -0.23 0.00 0.00 178.00 179.31 1abb h LYS 753 N 0.14 0.94 -3.09 0.86 6.56 -1.96 -3.30 116.57 116.72 1abb h LYS 753 Ca 0.55 -0.20 -0.62 0.00 -1.06 0.00 0.00 60.65 59.32 1abb h LYS 753 Cb 1.10 -0.14 -0.41 0.00 -0.57 0.00 0.00 32.23 32.22 1abb h LYS 753 CO -0.72 0.83 -0.69 -0.65 -2.06 0.00 0.00 179.45 176.16 1abb s GLN 754 N -5.28 1.71 0.06 3.15 -0.21 -0.08 -4.99 119.66 114.03 1abb s GLN 754 Ca -0.11 -2.47 -0.14 0.00 0.02 0.00 0.00 55.36 52.67 1abb s GLN 754 Cb 0.15 -2.79 -0.04 0.00 1.00 0.00 0.00 33.01 31.33 1abb s GLN 754 CO 0.82 -1.18 1.24 -1.35 -2.12 0.00 0.00 175.29 172.69 1abb h PRO 755 N 6.33 -0.08 0.00 2.91 0.11 -1.61 -2.15 132.00 137.51 1abb h PRO 755 Ca 0.02 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.13 1abb h PRO 755 Cb 0.88 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.01 1abb h PRO 755 CO 0.59 -0.05 0.00 -0.40 -0.21 0.00 0.00 178.00 177.92 1abb n ASP 756 N -3.94 0.00 -0.13 -2.05 5.68 -1.26 -3.85 116.55 111.00 1abb n ASP 756 Ca -0.00 0.23 -0.04 0.00 -0.50 0.00 0.00 54.79 54.47 1abb n ASP 756 Cb 0.13 -0.24 0.04 0.00 -1.14 0.00 0.00 41.12 39.91 1abb n ASP 756 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 1abb h LEU 757 N 0.00 -0.02 -2.58 -2.12 5.85 -1.72 -0.91 115.31 113.81 1abb h LEU 757 Ca 0.00 0.07 -0.15 0.00 0.84 0.00 0.00 57.88 58.64 1abb h LEU 757 Cb 0.00 0.11 -0.09 0.00 0.37 0.00 0.00 40.66 41.05 1abb h LEU 757 CO 0.00 0.03 0.20 0.49 -0.34 0.00 0.00 178.44 178.81 1abb n PHE 758 N -5.11 1.07 -0.34 1.25 3.72 -1.25 -4.53 117.46 112.26 1abb n PHE 758 Ca 0.03 -0.86 0.07 0.00 -0.05 0.00 0.00 57.45 56.65 1abb n PHE 758 Cb 0.20 -0.46 0.26 0.00 -0.94 0.00 0.00 39.48 38.53 1abb n PHE 758 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 1abb h LYS 759 N 0.59 0.94 0.00 -1.08 1.79 -1.45 -0.23 116.57 117.13 1abb h LYS 759 Ca 0.19 -0.06 -0.09 0.00 -2.18 0.00 0.00 60.65 58.51 1abb h LYS 759 Cb 1.57 -0.21 -0.01 0.00 -1.58 0.00 0.00 32.23 31.99 1abb h LYS 759 CO 0.37 0.62 -0.43 0.38 -1.08 0.00 0.00 179.45 179.31 1abb h ASP 760 N 0.97 0.00 1.00 0.86 3.04 -1.83 -1.11 116.42 119.34 1abb h ASP 760 Ca 0.47 0.00 -0.21 0.00 -3.24 0.00 0.00 57.03 54.06 1abb h ASP 760 Cb 0.46 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 38.72 1abb h ASP 760 CO -0.23 0.43 -0.98 0.40 -2.04 0.00 0.00 179.24 176.82 1abb h ILE 761 N 0.00 1.70 0.21 4.15 2.04 -1.41 -0.12 117.51 124.08 1abb h ILE 761 Ca -0.00 -3.37 -0.01 0.00 1.00 0.00 0.00 64.86 62.48 1abb h ILE 761 Cb 1.06 2.82 0.00 0.00 -0.74 0.00 0.00 36.82 39.96 1abb h ILE 761 CO 0.06 0.96 -0.10 0.58 0.00 0.00 0.00 178.15 179.65 1abb h VAL 762 N 0.00 0.00 -0.74 1.67 2.07 -0.83 -3.09 116.25 115.33 1abb h VAL 762 Ca -0.01 -0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.67 1abb h VAL 762 Cb 1.74 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 31.47 1abb h VAL 762 CO 0.13 0.00 0.50 0.78 0.02 0.00 0.00 177.57 179.00 1abb h ASN 763 N -0.28 0.29 -0.05 0.57 4.21 -1.18 0.12 115.58 119.26 1abb h ASN 763 Ca -0.03 0.02 0.04 0.00 1.21 0.00 0.00 56.30 57.54 1abb h ASN 763 Cb 0.21 -0.04 -0.05 0.00 -1.12 0.00 0.00 38.32 37.32 1abb h ASN 763 CO 0.05 0.14 -0.27 -0.03 -1.29 0.00 0.00 177.43 176.03 1abb h MET 764 N 0.30 -0.37 0.00 0.81 4.05 -1.04 -0.21 114.93 118.46 1abb h MET 764 Ca 0.36 0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.81 1abb h MET 764 Cb 0.98 0.08 0.00 0.00 -0.80 0.00 0.00 31.60 31.86 1abb h MET 764 CO -0.10 -0.25 0.00 1.28 0.23 0.00 0.00 176.91 178.08 1abb n LEU 765 N -5.38 0.00 -0.27 3.39 4.32 0.04 -0.47 117.00 118.62 1abb n LEU 765 Ca -0.04 0.76 0.33 0.00 -0.02 0.00 0.00 56.01 57.05 1abb n LEU 765 Cb 0.30 -0.26 0.73 0.00 -1.62 0.00 0.00 43.42 42.56 1abb n LEU 765 CO 0.20 -0.26 1.31 0.24 -1.22 0.00 0.00 177.39 177.65 1abb h MET 766 N 0.00 0.00 0.00 3.23 2.86 -0.79 -3.27 114.93 116.96 1abb h MET 766 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1abb h MET 766 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 1abb h MET 766 CO 0.00 0.00 0.00 0.72 1.06 0.00 0.00 176.91 178.69 1abb n HIS 767 N -4.04 0.00 -2.65 -0.22 8.25 -0.10 -4.46 115.22 112.00 1abb n HIS 767 Ca 0.24 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.66 1abb n HIS 767 Cb 1.22 0.01 0.09 0.00 1.12 0.00 0.00 29.99 32.42 1abb n HIS 767 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 1abb n HIS 768 N 0.00 -1.64 -1.89 4.41 -0.00 0.38 -5.00 115.22 111.47 1abb n HIS 768 Ca 0.00 -1.37 -0.39 0.00 -0.00 0.00 0.00 57.72 55.96 1abb n HIS 768 Cb 0.32 1.37 -0.03 0.00 -0.00 0.00 0.00 29.99 31.65 1abb n HIS 768 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 1abb s ASP 769 N -0.85 5.19 0.57 4.39 -1.08 -0.51 -4.80 116.67 119.58 1abb s ASP 769 Ca 0.10 0.80 0.37 0.00 -0.52 0.00 0.00 52.55 53.31 1abb s ASP 769 Cb 0.32 -2.52 1.77 0.00 -1.46 0.00 0.00 42.92 41.03 1abb s ASP 769 CO -0.08 -2.35 2.11 -0.09 0.52 0.00 0.00 175.17 175.27 1abb h ARG 770 N 15.74 0.00 -0.11 4.34 2.43 -1.96 -3.36 114.38 131.46 1abb h ARG 770 Ca -0.28 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 1abb h ARG 770 Cb 1.19 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 1abb h ARG 770 CO 1.15 0.00 0.00 1.19 -1.51 0.00 0.00 179.97 180.80 1abb n PHE 771 N -2.99 0.15 -3.11 2.20 3.72 -1.26 -5.05 117.46 111.11 1abb n PHE 771 Ca -0.01 -0.41 -0.10 0.00 -0.05 0.00 0.00 57.45 56.89 1abb n PHE 771 Cb 0.19 -0.03 0.05 0.00 -0.94 0.00 0.00 39.48 38.74 1abb n PHE 771 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1abb n LYS 772 N -0.03 -1.88 0.00 -1.08 5.02 -1.26 -4.65 118.16 114.29 1abb n LYS 772 Ca 0.04 1.02 0.00 0.00 -2.02 0.00 0.00 58.31 57.35 1abb n LYS 772 Cb 0.28 -5.62 0.00 0.00 -0.02 0.00 0.00 35.03 29.67 1abb n LYS 772 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1abb n VAL 773 N -2.72 0.00 -0.22 -0.18 0.31 -1.26 -2.92 118.33 111.34 1abb n VAL 773 Ca -0.05 0.14 0.13 0.00 -0.01 0.00 0.00 64.34 64.55 1abb n VAL 773 Cb 0.58 -0.29 0.24 0.00 -0.91 0.00 0.00 33.84 33.46 1abb n VAL 773 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1abb n PHE 774 N -0.55 0.50 0.08 3.52 3.01 -1.26 -0.45 117.46 122.31 1abb n PHE 774 Ca 0.00 0.78 -0.12 0.00 1.01 0.00 0.00 57.45 59.12 1abb n PHE 774 Cb 0.00 -1.04 -0.06 0.00 -0.01 0.00 0.00 39.48 38.36 1abb n PHE 774 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1abb h ALA 775 N 1.30 -0.13 -0.03 4.37 0.00 -1.96 -1.84 119.26 120.96 1abb h ALA 775 Ca 0.43 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.32 1abb h ALA 775 Cb 0.98 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 1abb h ALA 775 CO -0.58 -0.59 0.01 -0.25 0.00 0.00 0.00 179.25 177.84 1abb n ASP 776 N -5.18 1.83 0.06 0.00 8.00 0.40 -4.32 116.55 117.34 1abb n ASP 776 Ca -0.07 -2.06 -0.03 0.00 0.71 0.00 0.00 54.79 53.35 1abb n ASP 776 Cb 0.11 -0.51 -0.01 0.00 -0.02 0.00 0.00 41.12 40.68 1abb n ASP 776 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1abb h TYR 777 N 0.14 -0.17 -0.08 1.24 3.20 -1.25 -2.95 116.97 117.11 1abb h TYR 777 Ca 0.01 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.90 1abb h TYR 777 Cb 0.74 0.05 -0.06 0.00 1.54 0.00 0.00 36.73 39.01 1abb h TYR 777 CO 0.06 -0.10 -0.50 1.49 -1.64 0.00 0.00 178.16 177.47 1abb h GLU 778 N -0.49 -0.55 0.00 1.82 4.57 -1.77 -0.08 114.58 118.08 1abb h GLU 778 Ca -0.02 0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.19 1abb h GLU 778 Cb 0.14 0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 28.85 1abb h GLU 778 CO 0.03 -0.37 -0.02 1.49 -1.18 0.00 0.00 179.01 178.96 1abb h GLU 779 N -0.57 0.00 -0.03 1.92 4.81 -1.83 -2.90 114.58 115.98 1abb h GLU 779 Ca 0.02 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.20 1abb h GLU 779 Cb 0.65 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.03 1abb h GLU 779 CO -0.38 0.02 -0.17 -0.92 -0.73 0.00 0.00 179.01 176.84 1abb h TYR 780 N 0.00 0.23 -0.63 0.92 3.20 -0.84 -2.37 116.97 117.48 1abb h TYR 780 Ca -0.00 -0.10 -0.09 0.00 3.14 0.00 0.00 58.73 61.68 1abb h TYR 780 Cb 0.14 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.35 1abb h TYR 780 CO 0.00 0.82 0.06 -0.39 -1.64 0.00 0.00 178.16 177.01 1abb h VAL 781 N -0.42 1.26 -0.90 1.81 -1.51 -1.32 -2.15 116.25 113.03 1abb h VAL 781 Ca -0.01 -1.08 0.02 0.00 -1.23 0.00 0.00 66.70 64.39 1abb h VAL 781 Cb 0.84 0.72 -0.05 0.00 -2.13 0.00 0.00 31.29 30.68 1abb h VAL 781 CO 0.04 0.40 0.59 0.11 -1.23 0.00 0.00 177.57 177.48 1abb h LYS 782 N 0.99 1.16 0.00 5.19 1.79 -1.47 0.11 116.57 124.34 1abb h LYS 782 Ca 0.19 -0.07 -0.06 0.00 -2.18 0.00 0.00 60.65 58.53 1abb h LYS 782 Cb 0.49 -0.26 -0.01 0.00 -1.58 0.00 0.00 32.23 30.87 1abb h LYS 782 CO 0.02 0.77 -0.28 0.00 -1.08 0.00 0.00 179.45 178.87 1abb h GLN 784 N 0.00 0.49 -0.72 0.00 1.08 -0.42 0.15 115.11 115.68 1abb h GLN 784 Ca -0.00 -0.12 0.13 0.00 -1.45 0.00 0.00 58.65 57.21 1abb h GLN 784 Cb 0.56 -0.06 -0.09 0.00 -0.05 0.00 0.00 27.48 27.83 1abb h GLN 784 CO 0.04 0.56 0.28 0.93 -0.95 0.00 0.00 178.83 179.68 1abb h GLU 785 N 0.33 0.42 -0.44 1.46 5.08 0.06 0.36 114.58 121.85 1abb h GLU 785 Ca 0.10 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.36 1abb h GLU 785 Cb 0.29 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 1abb h GLU 785 CO 0.00 0.28 -0.03 0.00 -1.00 0.00 0.00 179.01 178.26 1abb h ARG 786 N 0.43 0.74 0.03 2.33 3.08 -0.73 -0.99 114.38 119.28 1abb h ARG 786 Ca 0.38 -0.21 -0.00 0.00 0.07 0.00 0.00 59.98 60.23 1abb h ARG 786 Cb 0.55 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.52 1abb h ARG 786 CO -0.38 0.78 -0.01 0.28 -1.07 0.00 0.00 179.97 179.56 1abb h VAL 787 N 0.69 1.09 -0.58 2.04 2.07 0.24 -2.74 116.25 119.05 1abb h VAL 787 Ca 0.13 -0.36 0.10 0.00 0.82 0.00 0.00 66.70 67.40 1abb h VAL 787 Cb 0.47 1.33 -0.08 0.00 -1.52 0.00 0.00 31.29 31.49 1abb h VAL 787 CO 0.02 0.09 0.15 0.28 0.02 0.00 0.00 177.57 178.14 1abb h SER 788 N -0.19 0.07 -0.44 0.57 0.02 -0.12 -2.05 113.55 111.41 1abb h SER 788 Ca -0.00 0.10 -0.07 0.00 -0.84 0.00 0.00 61.79 60.97 1abb h SER 788 Cb 0.18 0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.81 1abb h SER 788 CO 0.01 0.05 0.03 0.00 -1.14 0.00 0.00 176.83 175.77 1abb h ALA 789 N 1.44 1.09 -0.04 3.77 0.00 -1.19 0.17 119.26 124.50 1abb h ALA 789 Ca 0.30 -0.26 -0.16 0.00 0.00 0.00 0.00 54.91 54.79 1abb h ALA 789 Cb 0.42 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1abb h ALA 789 CO -0.36 0.58 -0.68 1.25 0.00 0.00 0.00 179.25 180.04 1abb h LEU 790 N 0.79 0.24 -1.55 0.00 5.85 -1.13 -3.22 115.31 116.28 1abb h LEU 790 Ca 0.16 -0.15 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 1abb h LEU 790 Cb 0.43 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 1abb h LEU 790 CO 0.02 0.84 -0.24 0.22 -0.34 0.00 0.00 178.44 178.94 1abb h TYR 791 N 0.14 0.00 0.00 1.25 3.20 -0.27 -2.21 116.97 119.08 1abb h TYR 791 Ca -0.02 0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.81 1abb h TYR 791 Cb 1.21 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.46 1abb h TYR 791 CO 0.02 0.24 -0.07 1.17 -1.64 0.00 0.00 178.16 177.88 1abb n LYS 792 N -4.00 1.06 -2.69 1.82 4.81 -1.01 -3.59 118.16 114.55 1abb n LYS 792 Ca -0.02 -0.25 -0.05 0.00 -0.87 0.00 0.00 58.31 57.12 1abb n LYS 792 Cb 0.31 -1.35 0.05 0.00 0.02 0.00 0.00 35.03 34.06 1abb n LYS 792 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1abb n ASN 793 N 1.91 -1.93 -0.36 3.14 2.85 -0.83 -5.04 115.26 115.00 1abb n ASN 793 Ca 0.11 -1.97 0.27 0.00 -0.11 0.00 0.00 54.58 52.88 1abb n ASN 793 Cb 0.51 1.06 0.53 0.00 1.24 0.00 0.00 39.78 43.12 1abb n ASN 793 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1abb h PRO 794 N 3.85 0.26 -0.33 1.20 0.11 -1.78 -2.82 132.00 132.50 1abb h PRO 794 Ca -0.11 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.98 1abb h PRO 794 Cb 1.15 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 1abb h PRO 794 CO -0.04 0.18 0.18 -0.09 -0.21 0.00 0.00 178.00 178.01 1abb h ARG 795 N 0.27 0.45 0.01 1.05 2.43 -1.94 -1.72 114.38 114.94 1abb h ARG 795 Ca 0.73 -0.05 -0.20 0.00 -0.81 0.00 0.00 59.98 59.65 1abb h ARG 795 Cb 1.88 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 31.33 1abb h ARG 795 CO -0.50 0.37 -0.91 0.93 -1.51 0.00 0.00 179.97 178.35 1abb h GLU 796 N 0.41 0.20 0.47 0.20 4.39 -1.86 -2.08 114.58 116.31 1abb h GLU 796 Ca 0.12 -0.23 -0.02 0.00 0.34 0.00 0.00 59.36 59.56 1abb h GLU 796 Cb 0.05 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 1abb h GLU 796 CO -0.02 0.98 -0.22 2.35 -1.16 0.00 0.00 179.01 180.93 1abb h TRP 797 N 0.11 -0.58 -0.52 4.33 7.01 -1.53 0.11 115.95 124.88 1abb h TRP 797 Ca -0.05 -0.01 0.15 0.00 2.11 0.00 0.00 58.89 61.09 1abb h TRP 797 Cb 1.55 0.19 -0.02 0.00 -2.10 0.00 0.00 29.16 28.78 1abb h TRP 797 CO 0.03 -0.27 0.48 1.15 -2.79 0.00 0.00 178.44 177.05 1abb h THR 798 N -0.86 0.44 0.07 2.65 2.02 -1.32 -0.96 112.91 114.94 1abb h THR 798 Ca -0.06 0.00 -0.30 0.00 0.77 0.00 0.00 66.41 66.81 1abb h THR 798 Cb 0.57 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 1abb h THR 798 CO 0.10 0.00 -1.61 0.03 0.37 0.00 0.00 175.52 174.41 1abb h ARG 799 N 0.00 0.15 -1.01 6.66 3.08 -0.44 -2.61 114.38 120.21 1abb h ARG 799 Ca 0.25 -0.25 0.08 0.00 0.07 0.00 0.00 59.98 60.13 1abb h ARG 799 Cb 1.21 0.09 -0.07 0.00 0.08 0.00 0.00 29.97 31.28 1abb h ARG 799 CO -0.00 0.92 0.65 1.98 -1.07 0.00 0.00 179.97 182.44 1abb h MET 800 N 0.04 1.09 -0.95 0.04 4.05 0.48 -1.22 114.93 118.47 1abb h MET 800 Ca -0.26 -0.07 0.02 0.00 -0.28 0.00 0.00 59.70 59.11 1abb h MET 800 Cb 1.99 -0.25 -0.05 0.00 -0.80 0.00 0.00 31.60 32.50 1abb h MET 800 CO 0.12 0.72 0.63 0.28 0.23 0.00 0.00 176.91 178.89 1abb h VAL 801 N 1.13 1.20 -0.29 -5.77 2.07 -1.39 -0.70 116.25 112.50 1abb h VAL 801 Ca 0.45 -0.43 -0.07 0.00 0.82 0.00 0.00 66.70 67.48 1abb h VAL 801 Cb 0.26 -0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 29.86 1abb h VAL 801 CO -0.20 0.23 -0.11 0.40 0.02 0.00 0.00 177.57 177.91 1abb h ILE 802 N 1.24 1.22 -0.22 4.57 2.04 -0.84 -1.86 117.51 123.66 1abb h ILE 802 Ca 0.37 -0.97 -0.12 0.00 1.00 0.00 0.00 64.86 65.13 1abb h ILE 802 Cb -0.06 1.12 -0.00 0.00 -0.74 0.00 0.00 36.82 37.14 1abb h ILE 802 CO -0.10 0.32 -0.34 0.03 0.00 0.00 0.00 178.15 178.06 1abb h ARG 803 N 0.45 0.62 -0.87 2.37 3.08 -0.61 -0.01 114.38 119.40 1abb h ARG 803 Ca 0.09 -0.37 -0.02 0.00 0.07 0.00 0.00 59.98 59.74 1abb h ARG 803 Cb 0.46 0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.51 1abb h ARG 803 CO 0.03 0.98 0.47 -0.91 -1.07 0.00 0.00 179.97 179.47 1abb h ASN 804 N 0.32 1.10 0.14 7.04 2.35 -0.76 -3.03 115.58 122.73 1abb h ASN 804 Ca 0.02 -0.10 -0.01 0.00 -0.55 0.00 0.00 56.30 55.66 1abb h ASN 804 Cb 0.93 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 39.02 1abb h ASN 804 CO 0.08 0.89 -0.07 0.40 -1.65 0.00 0.00 177.43 177.08 1abb h ILE 805 N 1.23 1.03 0.00 2.81 2.04 -1.32 -3.20 117.51 120.10 1abb h ILE 805 Ca 0.31 -0.93 0.00 0.00 1.00 0.00 0.00 64.86 65.23 1abb h ILE 805 Cb 0.05 1.59 0.00 0.00 -0.74 0.00 0.00 36.82 37.72 1abb h ILE 805 CO -0.05 0.21 0.00 0.00 0.00 0.00 0.00 178.15 178.32 1abb n ALA 806 N -2.43 1.13 1.06 1.87 0.00 -0.02 -1.99 120.51 120.13 1abb n ALA 806 Ca -0.09 0.17 0.12 0.00 0.00 0.00 0.00 53.44 53.64 1abb n ALA 806 Cb 0.25 -1.30 0.17 0.00 0.00 0.00 0.00 19.45 18.56 1abb n ALA 806 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1abb n THR 807 N -2.20 0.00 -0.30 0.00 -1.04 -1.17 -0.40 114.28 109.16 1abb n THR 807 Ca -0.01 -0.06 0.05 0.00 -2.04 0.00 0.00 64.05 61.99 1abb n THR 807 Cb 0.06 0.58 0.11 0.00 -1.82 0.00 0.00 70.33 69.26 1abb n THR 807 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1abb n SER 808 N -1.11 -0.32 0.00 8.00 7.64 -0.84 -3.65 113.62 123.34 1abb n SER 808 Ca 0.07 1.45 0.00 0.00 1.01 0.00 0.00 58.87 61.40 1abb n SER 808 Cb 0.35 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 63.12 1abb n SER 808 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1abb n GLY 809 N -1.52 0.00 0.12 0.23 0.00 -1.18 -0.59 105.19 102.25 1abb n GLY 809 Ca 0.13 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.21 1abb n GLY 809 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1abb n LYS 810 N -3.36 0.07 -0.09 1.61 0.00 -1.24 -2.12 118.16 113.02 1abb n LYS 810 Ca 0.00 0.51 0.03 0.00 0.00 0.00 0.00 58.31 58.85 1abb n LYS 810 Cb 0.00 -1.98 0.08 0.00 0.00 0.00 0.00 35.03 33.13 1abb n LYS 810 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 1abb n PHE 811 N -1.89 0.24 -2.31 5.64 3.72 0.24 -4.90 117.46 118.21 1abb n PHE 811 Ca -0.01 -0.47 -0.40 0.00 -0.05 0.00 0.00 57.45 56.52 1abb n PHE 811 Cb 0.27 -0.04 -0.03 0.00 -0.94 0.00 0.00 39.48 38.74 1abb n PHE 811 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1abb s SER 812 N -0.97 6.92 0.12 4.37 0.15 -0.90 -1.49 113.70 121.89 1abb s SER 812 Ca 0.13 2.43 0.22 0.00 0.70 0.00 0.00 55.95 59.43 1abb s SER 812 Cb 0.07 -2.63 0.87 0.00 -1.71 0.00 0.00 66.02 62.61 1abb s SER 812 CO 0.09 -0.40 1.67 -1.54 1.20 0.00 0.00 173.24 174.25 1abb n SER 813 N 0.79 0.35 -0.05 5.45 3.41 0.31 -2.43 113.62 121.44 1abb n SER 813 Ca 0.01 0.57 0.00 0.00 -0.26 0.00 0.00 58.87 59.19 1abb n SER 813 Cb 0.44 -0.65 0.30 0.00 -0.26 0.00 0.00 64.21 64.05 1abb n SER 813 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1abb h ASP 814 N 0.00 0.59 0.07 4.04 3.32 -1.91 -0.88 116.42 121.64 1abb h ASP 814 Ca 0.00 -0.07 -0.00 0.00 0.02 0.00 0.00 57.03 56.97 1abb h ASP 814 Cb 0.40 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1abb h ASP 814 CO 0.00 0.55 -0.03 -0.09 -1.72 0.00 0.00 179.24 177.95 1abb h ARG 815 N 0.64 -0.09 -1.12 3.56 1.12 -1.85 -2.29 114.38 114.35 1abb h ARG 815 Ca 0.15 0.01 0.37 0.00 -1.11 0.00 0.00 59.98 59.40 1abb h ARG 815 Cb 0.17 0.02 -0.14 0.00 -0.01 0.00 0.00 29.97 30.01 1abb h ARG 815 CO -0.01 -0.06 0.68 1.15 -3.11 0.00 0.00 179.97 178.62 1abb h THR 816 N -0.17 0.21 0.48 0.20 2.02 -1.53 0.88 112.91 114.99 1abb h THR 816 Ca -0.01 -0.07 -0.02 0.00 0.77 0.00 0.00 66.41 67.08 1abb h THR 816 Cb 0.07 -0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.48 1abb h THR 816 CO 0.01 0.04 -0.23 0.40 0.37 0.00 0.00 175.52 176.11 1abb h ILE 817 N 0.19 0.47 -0.91 3.11 1.08 -1.25 -2.71 117.51 117.49 1abb h ILE 817 Ca 0.77 -0.35 0.25 0.00 -0.39 0.00 0.00 64.86 65.14 1abb h ILE 817 Cb 2.08 0.61 -0.14 0.00 -3.07 0.00 0.00 36.82 36.30 1abb h ILE 817 CO -0.53 0.05 0.37 0.00 -0.69 0.00 0.00 178.15 177.35 1abb h ALA 818 N -0.47 1.49 0.00 1.87 0.00 0.14 1.50 119.26 123.78 1abb h ALA 818 Ca -0.07 0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1abb h ALA 818 Cb 0.58 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1abb h ALA 818 CO 0.11 -0.44 -0.01 1.96 0.00 0.00 0.00 179.25 180.86 1abb h GLN 819 N 0.31 0.00 0.02 0.00 4.20 -1.32 0.57 115.11 118.88 1abb h GLN 819 Ca 0.60 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.31 1abb h GLN 819 Cb 1.22 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.00 1abb h GLN 819 CO -0.60 0.01 -0.01 1.88 -0.67 0.00 0.00 178.83 179.44 1abb h TYR 820 N 0.00 -0.02 -0.28 2.96 0.05 0.23 -3.26 116.97 116.66 1abb h TYR 820 Ca -0.00 -0.00 0.06 0.00 0.05 0.00 0.00 58.73 58.84 1abb h TYR 820 Cb 0.09 0.01 -0.08 0.00 1.01 0.00 0.00 36.73 37.76 1abb h TYR 820 CO 0.00 0.70 -0.37 0.00 -1.05 0.00 0.00 178.16 177.43 1abb h ALA 821 N -0.19 -0.38 -3.00 3.88 0.00 0.28 0.00 119.26 119.85 1abb h ALA 821 Ca -0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1abb h ALA 821 Cb 0.73 0.75 0.00 0.00 0.00 0.00 0.00 17.79 19.27 1abb h ALA 821 CO 0.00 -0.82 0.00 0.54 0.00 0.00 0.00 179.25 178.97 1abb n ARG 822 N -5.42 0.00 0.06 0.00 1.74 0.06 0.77 116.66 113.88 1abb n ARG 822 Ca -0.01 0.00 0.02 0.00 -0.77 0.00 0.00 57.85 57.09 1abb n ARG 822 Cb 0.35 -0.27 0.12 0.00 -1.02 0.00 0.00 32.46 31.63 1abb n ARG 822 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1abb n GLU 823 N -0.20 0.03 0.05 5.56 1.02 -1.23 -3.21 120.64 122.65 1abb n GLU 823 Ca 0.00 0.37 0.00 0.00 -0.02 0.00 0.00 57.16 57.51 1abb n GLU 823 Cb 0.00 -1.89 0.00 0.00 -0.02 0.00 0.00 31.44 29.53 1abb n GLU 823 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1abb n ILE 824 N -1.54 0.16 0.19 -3.67 5.41 -0.16 -4.82 119.36 114.93 1abb n ILE 824 Ca -0.00 0.05 0.08 0.00 1.00 0.00 0.00 62.75 63.88 1abb n ILE 824 Cb 0.30 -0.83 0.16 0.00 -0.71 0.00 0.00 39.64 38.55 1abb n ILE 824 CO 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 176.55 176.05 1abb h TRP 825 N 0.00 0.00 -4.04 1.39 6.55 -1.10 -3.48 115.95 115.28 1abb h TRP 825 Ca 0.00 0.00 -0.18 0.00 0.95 0.00 0.00 58.89 59.66 1abb h TRP 825 Cb 0.19 0.00 0.10 0.00 -0.86 0.00 0.00 29.16 28.58 1abb h TRP 825 CO 0.00 0.23 -0.43 0.41 -1.05 0.00 0.00 178.44 177.60 1abb n GLY 826 N 1.03 -0.03 3.15 1.49 0.00 0.23 -4.98 105.19 106.08 1abb n GLY 826 Ca 0.03 -0.12 -0.14 0.00 0.00 0.00 0.00 46.02 45.79 1abb n GLY 826 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1abb s VAL 827 N -3.20 0.83 -0.30 1.61 -7.23 0.21 -4.94 120.40 107.38 1abb s VAL 827 Ca 0.03 -1.56 -0.15 0.00 -1.81 0.00 0.00 61.98 58.49 1abb s VAL 827 Cb -0.00 -1.25 -0.03 0.00 0.56 0.00 0.00 36.38 35.66 1abb s VAL 827 CO 0.40 -0.56 0.37 -1.61 -0.31 0.00 0.00 175.10 173.39 1abb s GLU 828 N -2.67 3.84 1.12 4.82 0.41 -1.26 -3.26 118.70 121.69 1abb s GLU 828 Ca 0.03 -0.14 -0.17 0.00 -0.41 0.00 0.00 54.97 54.28 1abb s GLU 828 Cb -0.03 -3.72 0.14 0.00 -1.78 0.00 0.00 34.13 28.74 1abb s GLU 828 CO -0.01 -0.38 0.24 -0.35 -0.49 0.00 0.00 175.26 174.27 1abb n PRO 829 N 5.37 -1.69 -3.59 0.39 -0.05 -1.26 -4.86 135.00 129.32 1abb n PRO 829 Ca -0.09 -0.47 -0.01 0.00 -0.05 0.00 0.00 63.50 62.88 1abb n PRO 829 Cb 0.50 -1.81 -0.06 0.00 -0.05 0.00 0.00 33.50 32.09 1abb n PRO 829 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 175.50 175.90 1abb s SER 830 N -1.97 -0.50 -0.38 3.54 0.15 -1.02 -4.94 113.70 108.60 1abb s SER 830 Ca 0.59 0.76 0.02 0.00 0.70 0.00 0.00 55.95 58.02 1abb s SER 830 Cb -0.15 1.30 0.50 0.00 -1.71 0.00 0.00 66.02 65.96 1abb s SER 830 CO 0.66 -0.12 1.76 0.54 1.20 0.00 0.00 173.24 177.29 1abb n ARG 831 N 3.97 2.03 -2.38 5.44 1.74 -1.26 -0.87 116.66 125.33 1abb n ARG 831 Ca -0.16 -2.39 -0.41 0.00 -0.77 0.00 0.00 57.85 54.13 1abb n ARG 831 Cb 0.56 -1.94 -0.04 0.00 -1.02 0.00 0.00 32.46 30.03 1abb n ARG 831 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1abb s GLN 832 N -2.64 4.54 0.26 5.56 0.74 -1.26 -4.98 119.66 121.87 1abb s GLN 832 Ca 0.45 1.89 -0.30 0.00 0.05 0.00 0.00 55.36 57.46 1abb s GLN 832 Cb 0.38 -3.19 -0.09 0.00 1.10 0.00 0.00 33.01 31.20 1abb s GLN 832 CO 0.07 0.03 1.18 1.03 -0.55 0.00 0.00 175.29 177.06 1abb s ARG 833 N -1.00 4.52 0.10 1.67 3.00 -1.26 -4.80 118.95 121.18 1abb s ARG 833 Ca 0.48 1.92 -0.08 0.00 0.00 0.00 0.00 55.73 58.06 1abb s ARG 833 Cb -0.33 -3.18 -0.06 0.00 0.00 0.00 0.00 34.95 31.38 1abb s ARG 833 CO 0.41 0.01 0.39 -1.17 0.00 0.00 0.00 175.30 174.94 1abb s LEU 834 N -1.06 4.31 0.00 2.53 2.96 -1.22 -5.02 118.68 121.19 1abb s LEU 834 Ca 0.49 0.71 0.00 0.00 -0.22 0.00 0.00 54.13 55.11 1abb s LEU 834 Cb -0.34 -3.09 0.00 0.00 0.50 0.00 0.00 46.19 43.26 1abb s LEU 834 CO 0.42 0.13 0.61 -0.81 -1.32 0.00 0.00 176.35 175.38 1abb n PRO 835 N 0.61 0.00 0.00 0.98 -0.04 -1.26 -4.48 135.00 130.80 1abb n PRO 835 Ca -0.06 0.15 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 1abb n PRO 835 Cb 0.52 -1.12 0.00 0.00 -0.04 0.00 0.00 33.50 32.86 1abb n PRO 835 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1abb n ALA 836 N -0.95 0.00 0.00 0.55 0.00 -1.26 -4.93 120.51 113.92 1abb n ALA 836 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1abb n ALA 836 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1abb n ALA 836 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15